smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccccc1-c1ncc(CN[C@@H](CO)Cc2ccc(C)c(C)c2)cn1 ZINC000453620740 1126093183 /nfs/dbraw/zinc/09/31/83/1126093183.db2.gz IKYNWGZCSUEAHM-HXUWFJFHSA-N 0 3 377.488 3.462 10 0 GGAEHN CCN(CC)c1ncc(CN[C@]2(CO)CCCN(Cc3ccccc3)C2)s1 ZINC000604769093 1126100501 /nfs/dbraw/zinc/10/05/01/1126100501.db2.gz HCJNNSOCJAGMNK-OAQYLSRUSA-N 0 3 388.581 3.106 10 0 GGAEHN Cc1nn(C)c(Cl)c1CN[C@]1(CO)CCc2cc(Br)ccc2C1 ZINC000859574732 1126112919 /nfs/dbraw/zinc/11/29/19/1126112919.db2.gz PQWCJABKUYKFBU-QGZVFWFLSA-N 0 3 398.732 3.154 10 0 GGAEHN C[C@@](CO)(Cc1ccc(Br)cc1)NCc1cccc2c1OCCO2 ZINC001176587665 1126149652 /nfs/dbraw/zinc/14/96/52/1126149652.db2.gz NMCOFYODRIYOKR-IBGZPJMESA-N 0 3 392.293 3.304 10 0 GGAEHN CCOc1ccc(CN[C@@](C)(CO)Cc2ccc(Br)cc2)nc1 ZINC001198219683 1126154984 /nfs/dbraw/zinc/15/49/84/1126154984.db2.gz RFIXBVMACKUDNO-GOSISDBHSA-N 0 3 379.298 3.326 10 0 GGAEHN C[C@](CO)(Cc1ccccc1F)NCc1cccc(C(=O)NCc2ccco2)c1 ZINC001560183320 1126209025 /nfs/dbraw/zinc/20/90/25/1126209025.db2.gz MHNFZOWJQVGIOT-HSZRJFAPSA-N 0 3 396.462 3.432 10 0 GGAEHN COC(=O)c1cc(CN[C@@](C)(CO)Cc2ccc(Br)cc2)c(C)o1 ZINC001660389541 1126264477 /nfs/dbraw/zinc/26/44/77/1126264477.db2.gz OYGOEBHEADKIKP-GOSISDBHSA-N 0 3 396.281 3.220 10 0 GGAEHN CN1C(=O)[C@H](c2ccccc2)CC12CCN(Cc1ccc3c(c1)OCO3)CC2 ZINC000426381770 530046298 /nfs/dbraw/zinc/04/62/98/530046298.db2.gz SDTLAAHBZSQDAX-IBGZPJMESA-N 0 3 378.472 3.396 10 0 GGAEHN O[C@H](CNCCNc1ncccc1C(F)(F)F)Cn1ccc2ccccc21 ZINC000004299482 204036649 /nfs/dbraw/zinc/03/66/49/204036649.db2.gz UFMTVOCZUJUSKF-OAHLLOKOSA-N 0 3 378.398 3.118 10 0 GGAEHN CCCc1cnc(NCCNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)nc1 ZINC000004299545 204036834 /nfs/dbraw/zinc/03/68/34/204036834.db2.gz KYRVIANWYTYSDU-CQSZACIVSA-N 0 3 399.322 3.177 10 0 GGAEHN COC(=O)c1ccc(OC[C@H](O)CNCc2cccc(C(F)(F)F)c2)cc1 ZINC000003353484 204000258 /nfs/dbraw/zinc/00/02/58/204000258.db2.gz YWEGFHLMPLEAPO-MRXNPFEDSA-N 0 3 383.366 3.022 10 0 GGAEHN CC[C@H]1CCCCN1CCCNC(=O)CCS(=O)(=O)Cc1ccc(C)cc1 ZINC000004711130 204068682 /nfs/dbraw/zinc/06/86/82/204068682.db2.gz IQHOSLHQFUBLKP-FQEVSTJZSA-N 0 3 394.581 3.071 10 0 GGAEHN C[C@H](OC[C@H](O)CNC[C@@H]1COc2ccccc2O1)c1ccc(Cl)cc1 ZINC000006865262 204216180 /nfs/dbraw/zinc/21/61/80/204216180.db2.gz PDLJMIAOCAFJQW-BMGDILEWSA-N 0 3 377.868 3.208 10 0 GGAEHN O=C(COc1ccc2ccccc2c1CN1CCCCC1)NC[C@H]1CCCO1 ZINC000006859678 204216780 /nfs/dbraw/zinc/21/67/80/204216780.db2.gz DGZORGKKIDMWGN-LJQANCHMSA-N 0 3 382.504 3.500 10 0 GGAEHN Cc1ccc2c(c1)-c1onc(C(=O)N(CCN(C)C)Cc3ccco3)c1CO2 ZINC000006893195 204221521 /nfs/dbraw/zinc/22/15/21/204221521.db2.gz FGNOKBOTCFGTSM-UHFFFAOYSA-N 0 3 381.432 3.339 10 0 GGAEHN COCCN(CCOC)C[C@@H](O)CO[C@@H](c1ccccc1)c1ccccc1C ZINC000006940292 204226708 /nfs/dbraw/zinc/22/67/08/204226708.db2.gz CNHBVPIBRBYILG-GGAORHGYSA-N 0 3 387.520 3.057 10 0 GGAEHN Cc1ccc(-c2nnc(CCC(=O)N[C@H](CN(C)C)c3ccccc3)o2)cc1 ZINC000007818476 204252362 /nfs/dbraw/zinc/25/23/62/204252362.db2.gz SANHMAXOIQPJIB-LJQANCHMSA-N 0 3 378.476 3.397 10 0 GGAEHN CN(C)C[C@@H](NC(=O)C1CCN(C(=O)c2cccs2)CC1)c1ccccc1 ZINC000007818152 204252848 /nfs/dbraw/zinc/25/28/48/204252848.db2.gz NDRJJWMREYLRDL-GOSISDBHSA-N 0 3 385.533 3.019 10 0 GGAEHN Cc1ccc(N2C[C@H](C(=O)NC3CCN(Cc4ccccc4)CC3)CC2=O)cc1 ZINC000008392025 204276064 /nfs/dbraw/zinc/27/60/64/204276064.db2.gz OQOUYPWMZBQJRA-HXUWFJFHSA-N 0 3 391.515 3.129 10 0 GGAEHN COc1ccc(CCN(C)[C@H]2CCCN(C(=O)NC(C)(C)C)C2)cc1OC ZINC000012050819 204368514 /nfs/dbraw/zinc/36/85/14/204368514.db2.gz RGLZNFGEIDPESY-KRWDZBQOSA-N 0 3 377.529 3.151 10 0 GGAEHN CCC(=O)N[C@@H]1c2ccccc2C2(CCN(Cc3ccccn3)CC2)[C@H]1OC ZINC000012031843 204368720 /nfs/dbraw/zinc/36/87/20/204368720.db2.gz UPTYMKHEEANCKO-YADHBBJMSA-N 0 3 379.504 3.211 10 0 GGAEHN Cc1ncc(C(=O)N2CC[C@@H](C3CCN(Cc4cccc(F)c4F)CC3)C2)[nH]1 ZINC000012299902 204391585 /nfs/dbraw/zinc/39/15/85/204391585.db2.gz ZEBSTYDNMIDXSY-MRXNPFEDSA-N 0 3 388.462 3.371 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)c1cnn(-c2cccc(C)c2)c1-n1cccc1 ZINC000020979982 204747468 /nfs/dbraw/zinc/74/74/68/204747468.db2.gz MBKACXMGEORAKE-IBGZPJMESA-N 0 3 377.492 3.186 10 0 GGAEHN C[C@@H](NCC1(N2CCOCC2)CCCCC1)C(=O)Nc1ccc2c(c1)CCC2 ZINC000022913979 204792496 /nfs/dbraw/zinc/79/24/96/204792496.db2.gz KNKCJHLFEDYVEY-GOSISDBHSA-N 0 3 385.552 3.127 10 0 GGAEHN C[C@@H](NC(=O)CC[NH+]1CCC(C(=O)Nc2ccccc2[O-])CC1)c1ccccc1 ZINC000028901771 204883151 /nfs/dbraw/zinc/88/31/51/204883151.db2.gz NAYDARZCGGAITQ-QGZVFWFLSA-N 0 3 395.503 3.310 10 0 GGAEHN CC(C)N1CCN(c2nnc(C(=O)NCc3ccccc3)c3ccccc32)CC1 ZINC000034838890 204976412 /nfs/dbraw/zinc/97/64/12/204976412.db2.gz NHVFLVDKEPXTGC-UHFFFAOYSA-N 0 3 389.503 3.090 10 0 GGAEHN COc1ccc(CN(C[C@H](O)COCc2ccccc2)C[C@@H]2CCCO2)cc1 ZINC000036095262 205005202 /nfs/dbraw/zinc/00/52/02/205005202.db2.gz DNBYZIGABNUDHN-GMAHTHKFSA-N 0 3 385.504 3.254 10 0 GGAEHN COc1cccc(CN(C[C@H](O)COCc2ccccc2)C[C@H]2CCCO2)c1 ZINC000036100267 205005633 /nfs/dbraw/zinc/00/56/33/205005633.db2.gz CCSFFZXXRJDHTL-JTHBVZDNSA-N 0 3 385.504 3.254 10 0 GGAEHN COc1ccc(CN(C[C@H](O)Cc2ccccc2)C[C@H]2CCCO2)cc1OC ZINC000036096068 205005956 /nfs/dbraw/zinc/00/59/56/205005956.db2.gz WKOIPQHLGKCXDR-NHCUHLMSSA-N 0 3 385.504 3.288 10 0 GGAEHN COCCN(Cc1cccc(OC)c1)C[C@@H](O)COc1ccc(Cl)cc1 ZINC000036100162 205006260 /nfs/dbraw/zinc/00/62/60/205006260.db2.gz QFTCHWCYRJHIEZ-GOSISDBHSA-N 0 3 379.884 3.237 10 0 GGAEHN CN(C)CCN(Cc1c(-c2ccccc2)noc1N1CCCC1)C(=O)C1CC1 ZINC000036312431 205010959 /nfs/dbraw/zinc/01/09/59/205010959.db2.gz DDYRPIOKXATXSA-UHFFFAOYSA-N 0 3 382.508 3.242 10 0 GGAEHN CN(Cc1ccon1)C(=O)C1(N(C)Cc2ccccc2)Cc2ccccc2C1 ZINC000039354663 205040335 /nfs/dbraw/zinc/04/03/35/205040335.db2.gz KJZONBKJNXUBEK-UHFFFAOYSA-N 0 3 375.472 3.303 10 0 GGAEHN O[C@@H](COCCOc1ccc(Cl)cc1)CN1CCC[C@H](C(F)(F)F)C1 ZINC000036391727 205016174 /nfs/dbraw/zinc/01/61/74/205016174.db2.gz UEVFWOBSABNDMR-DZGCQCFKSA-N 0 3 381.822 3.371 10 0 GGAEHN O[C@H](CN[C@H]1CCSc2ccc(F)cc21)COCc1ccc2c(c1)OCO2 ZINC000036396210 205016639 /nfs/dbraw/zinc/01/66/39/205016639.db2.gz QWMUNGGWXKVVCI-WBVHZDCISA-N 0 3 391.464 3.259 10 0 GGAEHN CO[C@@H]1CCCN(C(=O)C2(N(C)Cc3ccccc3)Cc3ccccc3C2)C1 ZINC000039421449 205041898 /nfs/dbraw/zinc/04/18/98/205041898.db2.gz DYVHSASNZJAWCH-JOCHJYFZSA-N 0 3 378.516 3.293 10 0 GGAEHN Cc1cccc([C@H]2CC[C@@H](C(=O)NCCN(C)C)CN2C(=O)C2CCCC2)c1 ZINC000037545815 205028864 /nfs/dbraw/zinc/02/88/64/205028864.db2.gz LIVKSFWUGVRFFF-NHCUHLMSSA-N 0 3 385.552 3.143 10 0 GGAEHN CN(Cc1ccccc1)C1(C(=O)NCCc2cscn2)Cc2ccccc2C1 ZINC000039412704 205042808 /nfs/dbraw/zinc/04/28/08/205042808.db2.gz PFECDCSOULWBDF-UHFFFAOYSA-N 0 3 391.540 3.471 10 0 GGAEHN COc1ccc([C@H](CNC(=O)Nc2cccc(-n3cccn3)c2)N(C)C)cc1 ZINC000040121835 205055979 /nfs/dbraw/zinc/05/59/79/205055979.db2.gz AWJVFBDRDBVXLC-FQEVSTJZSA-N 0 3 379.464 3.305 10 0 GGAEHN CCCOc1c(Br)cc(Br)cc1CNC[C@H](C)O ZINC000040743864 205071164 /nfs/dbraw/zinc/07/11/64/205071164.db2.gz DDIVXVBOYCFEPZ-VIFPVBQESA-N 0 3 381.108 3.471 10 0 GGAEHN CC(C)[C@H](NC(=O)c1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000048089494 205112101 /nfs/dbraw/zinc/11/21/01/205112101.db2.gz QITLVFLGFZLIDH-QFIPXVFZSA-N 0 3 393.531 3.222 10 0 GGAEHN Cc1c(F)cc(C(N)=O)cc1NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000048309739 205117538 /nfs/dbraw/zinc/11/75/38/205117538.db2.gz ULOUIPUSUODGSS-OAHLLOKOSA-N 0 3 387.430 3.223 10 0 GGAEHN CC[C@@H](NCC(=O)NC(=O)NCc1ccco1)c1ccc(Br)cc1 ZINC000057290228 205154974 /nfs/dbraw/zinc/15/49/74/205154974.db2.gz SXMBPFDFPRIUJX-OAHLLOKOSA-N 0 3 394.269 3.109 10 0 GGAEHN CC[C@H](NCC(=O)NC(=O)NCc1ccco1)c1ccc(Br)cc1 ZINC000057290225 205155252 /nfs/dbraw/zinc/15/52/52/205155252.db2.gz SXMBPFDFPRIUJX-HNNXBMFYSA-N 0 3 394.269 3.109 10 0 GGAEHN Cc1cc(C)n(CCCNC(=O)N(CCCc2ccccc2)CCN(C)C)n1 ZINC000058209344 205169434 /nfs/dbraw/zinc/16/94/34/205169434.db2.gz JQAXUMRTURLABA-UHFFFAOYSA-N 0 3 385.556 3.096 10 0 GGAEHN CC(C)S(=O)(=O)C(C)C(=O)NCc1ccccc1OCc1ccccc1 ZINC000058264571 205171535 /nfs/dbraw/zinc/17/15/35/205171535.db2.gz JWLFUTNNFXYXFC-MRXNPFEDSA-N 0 3 375.490 3.094 10 0 GGAEHN CN1CCCN(c2ccc(CNC(=O)CCCSc3ccccc3)cn2)CC1 ZINC000058441327 205176887 /nfs/dbraw/zinc/17/68/87/205176887.db2.gz IZGKYHQQXUFXNC-UHFFFAOYSA-N 0 3 398.576 3.412 10 0 GGAEHN COc1ccc([C@@H](CNC(=O)Nc2ccc(C(=O)NC3CC3)cc2)N(C)C)cc1 ZINC000058883271 205178636 /nfs/dbraw/zinc/17/86/36/205178636.db2.gz MWCCYHWDQSEZRU-HXUWFJFHSA-N 0 3 396.491 3.012 10 0 GGAEHN COCCN1CC[C@@H](CNC(=O)Nc2ccc(SC(F)(F)F)cc2)C1 ZINC000062394478 205185665 /nfs/dbraw/zinc/18/56/65/205185665.db2.gz KVJJWSOQINDKJK-LBPRGKRZSA-N 0 3 377.432 3.388 10 0 GGAEHN O=C(CC1CCN(C(=O)NC2CCCCC2)CC1)NCCN1CCCCCC1 ZINC000064847040 205198653 /nfs/dbraw/zinc/19/86/53/205198653.db2.gz MDEHTHCCIXURKQ-UHFFFAOYSA-N 0 3 392.588 3.123 10 0 GGAEHN CC(=O)N1CCc2cc(-c3ccc(C(=O)NCCN4CCCCC4)cc3)ccc21 ZINC000065026967 205207118 /nfs/dbraw/zinc/20/71/18/205207118.db2.gz LLWOIDLFJODIKC-UHFFFAOYSA-N 0 3 391.515 3.478 10 0 GGAEHN O=C(NCCN1CCCCCC1)c1csc(-c2ccnc(N3CCCC3)c2)n1 ZINC000065062501 205208540 /nfs/dbraw/zinc/20/85/40/205208540.db2.gz WWIXHZSQVXPXDX-UHFFFAOYSA-N 0 3 399.564 3.411 10 0 GGAEHN Cc1ccc(NC(=O)N2CCC[C@@H](CCC(=O)NCCN3CCCC3)C2)cc1 ZINC000065136304 205213418 /nfs/dbraw/zinc/21/34/18/205213418.db2.gz GXWSDFAWGUBVCU-IBGZPJMESA-N 0 3 386.540 3.231 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1csc(-c2ccc(N3CCCC3)nc2)n1 ZINC000065165319 205215074 /nfs/dbraw/zinc/21/50/74/205215074.db2.gz GZMJOUKDHWIJQK-MRXNPFEDSA-N 0 3 399.564 3.410 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)c1nc(-c2ccc(N3CCCCCC3)cc2)no1 ZINC000064746554 205193733 /nfs/dbraw/zinc/19/37/33/205193733.db2.gz RANQJOVPMJHYBE-IBGZPJMESA-N 0 3 397.523 3.331 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1ccn2c(c1)nnc2-c1ccc(F)cc1 ZINC000065296318 205228284 /nfs/dbraw/zinc/22/82/84/205228284.db2.gz REKYJIDOGAAKAT-HNNXBMFYSA-N 0 3 381.455 3.140 10 0 GGAEHN CCn1ccc2oc(C)c(C(=O)NC3CCN(Cc4ccccc4)CC3)c2c1=O ZINC000065230320 205221454 /nfs/dbraw/zinc/22/14/54/205221454.db2.gz FQMGGZFCZVVSFM-UHFFFAOYSA-N 0 3 393.487 3.317 10 0 GGAEHN Cc1cc2ncn(Cc3nc(C4CC[NH+](C(C)C)CC4)cc(=O)[n-]3)c2cc1C ZINC000067820131 205262437 /nfs/dbraw/zinc/26/24/37/205262437.db2.gz USKQPKMVFFYCQT-UHFFFAOYSA-N 0 3 379.508 3.373 10 0 GGAEHN C[C@@H](NC[C@H](O)Cc1ccc2ccccc2c1)c1ccc2c(c1)NC(=O)CO2 ZINC000225396611 206046064 /nfs/dbraw/zinc/04/60/64/206046064.db2.gz JRINESWTMRLYRQ-FOIQADDNSA-N 0 3 376.456 3.425 10 0 GGAEHN CC(C)OCCOCc1cccc(NC(=O)N(C)[C@@H]2CCN(C)C[C@@H]2C)c1 ZINC000229444649 206105321 /nfs/dbraw/zinc/10/53/21/206105321.db2.gz OKZKMDVBTRPHKS-FXAWDEMLSA-N 0 3 377.529 3.432 10 0 GGAEHN CCn1ccnc1[C@H]1OCCC[C@@H]1NCc1cc(Cl)c2c(c1)OCCO2 ZINC000190431009 206210218 /nfs/dbraw/zinc/21/02/18/206210218.db2.gz FGKANYIGJSBQEN-YJBOKZPZSA-N 0 3 377.872 3.338 10 0 GGAEHN O=C(Nc1ccccc1)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000058227650 136155164 /nfs/dbraw/zinc/15/51/64/136155164.db2.gz XBKMHVDUXCSKCA-IBGZPJMESA-N 0 3 379.508 3.148 10 0 GGAEHN O=C(Nc1ccccc1)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 ZINC000058227648 136155166 /nfs/dbraw/zinc/15/51/66/136155166.db2.gz XBKMHVDUXCSKCA-LJQANCHMSA-N 0 3 379.508 3.148 10 0 GGAEHN Cc1cccc(CN2CCCN(c3cccc(C(=O)NCCN(C)C)c3)C2=O)c1 ZINC000064743406 136157512 /nfs/dbraw/zinc/15/75/12/136157512.db2.gz CWCDCDKVPVLUAT-UHFFFAOYSA-N 0 3 394.519 3.119 10 0 GGAEHN CN(C)CCNC(=O)C[C@@H]1COc2ccc(Cl)cc2N1Cc1ccccc1 ZINC000096323057 136186572 /nfs/dbraw/zinc/18/65/72/136186572.db2.gz MBNXYFOCJMRJPP-GOSISDBHSA-N 0 3 387.911 3.176 10 0 GGAEHN O=C(NCCN1CCCCCC1)c1ccc2ncnc(N3CCCCC3)c2c1 ZINC000096399976 136187106 /nfs/dbraw/zinc/18/71/06/136187106.db2.gz CBNYYBWYRPRZJV-UHFFFAOYSA-N 0 3 381.524 3.226 10 0 GGAEHN CC(=O)c1ccc(N2C(=O)C[C@@H](NCCc3c[nH]c4ccc(C)cc34)C2=O)cc1 ZINC000025183338 518342618 /nfs/dbraw/zinc/34/26/18/518342618.db2.gz YXXKBRRIDRRJRJ-OAQYLSRUSA-N 0 3 389.455 3.143 10 0 GGAEHN CCc1cc(N2CCC(N(C)Cc3ccccn3)CC2)nc(N2CCCC2)n1 ZINC000095528885 536144677 /nfs/dbraw/zinc/14/46/77/536144677.db2.gz XIYUZMUFDQEDNH-UHFFFAOYSA-N 0 3 380.540 3.135 10 0 GGAEHN C[C@@]1(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1(Cl)Cl ZINC000115158293 564186962 /nfs/dbraw/zinc/18/69/62/564186962.db2.gz XVEWZKYVCMZUGY-AEFFLSMTSA-N 0 3 385.335 3.132 10 0 GGAEHN CN(C[C@H]1CCCN(C)C1)C(=O)N[C@@H]1CCc2cc(Br)ccc21 ZINC000115808887 564199107 /nfs/dbraw/zinc/19/91/07/564199107.db2.gz OKELBUWMRGTACX-SUMWQHHRSA-N 0 3 380.330 3.420 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)N(C)C[C@H]1CCCN(C)C1 ZINC000115803382 564199293 /nfs/dbraw/zinc/19/92/93/564199293.db2.gz NBGWOLLJMXYGEZ-HOCLYGCPSA-N 0 3 382.346 3.363 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)N(C)C[C@@H]1CCCN(C)C1 ZINC000115803375 564199537 /nfs/dbraw/zinc/19/95/37/564199537.db2.gz NBGWOLLJMXYGEZ-GOEBONIOSA-N 0 3 382.346 3.363 10 0 GGAEHN Cn1cc([C@@H]2CCN(CCC(=O)Nc3ccc(Br)cc3)C2)cn1 ZINC000116315791 564207518 /nfs/dbraw/zinc/20/75/18/564207518.db2.gz WNZMGJBXXNZVEG-CYBMUJFWSA-N 0 3 377.286 3.001 10 0 GGAEHN CN(C[C@@H]1CCN(C)C1)C(=O)c1cc(Br)sc1Br ZINC000116752109 564216117 /nfs/dbraw/zinc/21/61/17/564216117.db2.gz WROSVQKDYGTIKA-MRVPVSSYSA-N 0 3 396.148 3.297 10 0 GGAEHN CN(C)C[C@@H]1CN(C(=O)C2(c3cccc(Br)c3)CCCC2)CCO1 ZINC000116791665 564216965 /nfs/dbraw/zinc/21/69/65/564216965.db2.gz BIQCAYLDCDRSRC-QGZVFWFLSA-N 0 3 395.341 3.050 10 0 GGAEHN Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N1CCO[C@H](CN(C)C)C1 ZINC000116797217 564217072 /nfs/dbraw/zinc/21/70/72/564217072.db2.gz LMZALDAOWXVNBD-LLVKDONJSA-N 0 3 385.942 3.236 10 0 GGAEHN CN(C)C[C@H]1CN(C(=O)C2(c3ccc(Br)cc3)CCCC2)CCO1 ZINC000116797478 564217109 /nfs/dbraw/zinc/21/71/09/564217109.db2.gz OYVFKWOYIXLKOX-KRWDZBQOSA-N 0 3 395.341 3.050 10 0 GGAEHN C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)N1CCO[C@@H](CN(C)C)C1 ZINC000116783715 564217207 /nfs/dbraw/zinc/21/72/07/564217207.db2.gz JPZIWJLVYQQNFW-AAEUAGOBSA-N 0 3 377.337 3.263 10 0 GGAEHN CCCn1cc(CNCCC(=O)N(C)Cc2ccccc2Br)cn1 ZINC000116917290 564219772 /nfs/dbraw/zinc/21/97/72/564219772.db2.gz KUQWZJVMPCCXJP-UHFFFAOYSA-N 0 3 393.329 3.194 10 0 GGAEHN C[C@H](NC(=O)N1CCO[C@H](CN(C)C)C1)c1c(Cl)ccc(F)c1Cl ZINC000117036683 564221457 /nfs/dbraw/zinc/22/14/57/564221457.db2.gz BPFCHJPZRDXDHU-WDEREUQCSA-N 0 3 378.275 3.166 10 0 GGAEHN CC[C@H](Cc1cccc(Br)c1)C(=O)Nc1cnn(CCN(C)C)c1 ZINC000117140884 564222479 /nfs/dbraw/zinc/22/24/79/564222479.db2.gz QFRMDDLMCUVYIR-OAHLLOKOSA-N 0 3 393.329 3.415 10 0 GGAEHN CN(C)C[C@H](NC(=O)c1cccc(I)c1)c1ccccc1 ZINC000007816560 564241900 /nfs/dbraw/zinc/24/19/00/564241900.db2.gz RGGCSHDNQSSMJX-INIZCTEOSA-N 0 3 394.256 3.324 10 0 GGAEHN COCCN1CCC(NC(=O)C[C@H](C)c2ccc(Br)cc2)CC1 ZINC000119074957 564253120 /nfs/dbraw/zinc/25/31/20/564253120.db2.gz PCBZNIJQARZNGT-AWEZNQCLSA-N 0 3 383.330 3.170 10 0 GGAEHN COCCN1CCC(NC(=O)C[C@@H](C)c2ccc(Br)cc2)CC1 ZINC000119075082 564253340 /nfs/dbraw/zinc/25/33/40/564253340.db2.gz PCBZNIJQARZNGT-CQSZACIVSA-N 0 3 383.330 3.170 10 0 GGAEHN O=C(CC1(N2CCOCC2)CCCC1)NCc1cc(F)cc(Br)c1 ZINC000119137494 564255948 /nfs/dbraw/zinc/25/59/48/564255948.db2.gz HXSKAZGFFKBJCL-UHFFFAOYSA-N 0 3 399.304 3.240 10 0 GGAEHN Cc1c(I)cccc1C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000119132747 564256061 /nfs/dbraw/zinc/25/60/61/564256061.db2.gz YCIYQKUIGUQZRD-DGCLKSJQSA-N 0 3 386.277 3.154 10 0 GGAEHN C[C@@H]1C[C@@H](NCc2ccc(S(=O)(=O)N3CCOCC3)s2)CC(C)(C)C1 ZINC000119355353 564267227 /nfs/dbraw/zinc/26/72/27/564267227.db2.gz CCIXLWHWPWAQKO-HUUCEWRRSA-N 0 3 386.583 3.073 10 0 GGAEHN C[C@H]1C[C@H](C)CN(CC(=O)N(C)CC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000013056188 564273477 /nfs/dbraw/zinc/27/34/77/564273477.db2.gz QJVKAERWPJKSHR-STQMWFEESA-N 0 3 386.323 3.368 10 0 GGAEHN CC(C)N(CC(=O)N(C)Cc1cc(Br)cs1)C1CCOCC1 ZINC000119657290 564282062 /nfs/dbraw/zinc/28/20/62/564282062.db2.gz FCNONTQMLIZWSL-UHFFFAOYSA-N 0 3 389.359 3.358 10 0 GGAEHN CN(CC1(c2ccc(Br)cc2)CC1)C(=O)NC[C@@H]1CCCN1C ZINC000119859224 564291759 /nfs/dbraw/zinc/29/17/59/564291759.db2.gz WJCMZYNLBAAOJG-INIZCTEOSA-N 0 3 380.330 3.216 10 0 GGAEHN C/C(=C/c1ccc(Cl)cc1)CNC[C@@H](O)CS(=O)(=O)c1cccs1 ZINC000119875607 564293040 /nfs/dbraw/zinc/29/30/40/564293040.db2.gz TXTFFEAESUFVGX-RCBBPTIPSA-N 0 3 385.938 3.229 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)c1nnc(Cc2ccc(Cl)cc2Cl)o1 ZINC000020851784 564307474 /nfs/dbraw/zinc/30/74/74/564307474.db2.gz QWLOCGKNHDCRRE-ZDUSSCGKSA-N 0 3 383.279 3.181 10 0 GGAEHN C[C@@H](CC(=O)Nc1ccn(CCN(C)C)n1)c1ccc(Br)cc1 ZINC000120323395 564315837 /nfs/dbraw/zinc/31/58/37/564315837.db2.gz JNVXHAAUOWRDLZ-ZDUSSCGKSA-N 0 3 379.302 3.340 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)CSCc1cc(-c2cccs2)on1 ZINC000120952400 564345294 /nfs/dbraw/zinc/34/52/94/564345294.db2.gz YWSOKRPIQPMVBB-HIFRSBDPSA-N 0 3 379.551 3.435 10 0 GGAEHN O=C(NCC1(N2CCSCC2)CCCC1)[C@H]1Cc2cc(Cl)ccc2O1 ZINC000029368723 564369760 /nfs/dbraw/zinc/36/97/60/564369760.db2.gz HGDXBYVVXPGPBQ-QGZVFWFLSA-N 0 3 380.941 3.121 10 0 GGAEHN Cc1cc(S(=O)(=O)N2CC[C@H]3[C@H](CCCN3C3CC3)C2)c(Cl)cc1F ZINC000121681122 564381842 /nfs/dbraw/zinc/38/18/42/564381842.db2.gz FVMKKDVETITROC-DYVFJYSZSA-N 0 3 386.920 3.425 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)c1cccc(I)c1C ZINC000121800959 564387395 /nfs/dbraw/zinc/38/73/95/564387395.db2.gz BVSZJCIJTLEFKQ-ZDUSSCGKSA-N 0 3 386.277 3.156 10 0 GGAEHN C[C@@H](O)CN1CCN(CCSc2ccnc3cc(Cl)ccc32)C[C@H]1C ZINC000121998780 564396477 /nfs/dbraw/zinc/39/64/77/564396477.db2.gz FLDYVWYDMKUIDA-HUUCEWRRSA-N 0 3 379.957 3.367 10 0 GGAEHN CCN(CC)CCNS(=O)(=O)c1cc(-c2nc(C)c(C)s2)sc1C ZINC000033290065 564413290 /nfs/dbraw/zinc/41/32/90/564413290.db2.gz MUPBBMGHAVRNQK-UHFFFAOYSA-N 0 3 387.596 3.417 10 0 GGAEHN CNS(=O)(=O)c1cccc([C@@H](C)NCCc2ccc(OC)cc2Cl)c1 ZINC000122894733 564431576 /nfs/dbraw/zinc/43/15/76/564431576.db2.gz OYZDFFBFRBUIPO-CYBMUJFWSA-N 0 3 382.913 3.150 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)c2cnn(-c3ccc(Br)cc3)c2)CCN1C ZINC000123034251 564436342 /nfs/dbraw/zinc/43/63/42/564436342.db2.gz YGJFZZMXPPDKJN-GUYCJALGSA-N 0 3 391.313 3.190 10 0 GGAEHN C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000123142663 564440014 /nfs/dbraw/zinc/44/00/14/564440014.db2.gz VXPKBQHUMKTQLA-UKRRQHHQSA-N 0 3 396.304 3.175 10 0 GGAEHN COc1cc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc(OC)c1Br ZINC000123603501 564454509 /nfs/dbraw/zinc/45/45/09/564454509.db2.gz JZZWPAACFYCSMW-AAEUAGOBSA-N 0 3 385.302 3.021 10 0 GGAEHN CCN1CCO[C@H](CNCc2ccc(Br)c(Br)c2)C1 ZINC000124561420 564485519 /nfs/dbraw/zinc/48/55/19/564485519.db2.gz IRSKBMYCQACNPS-GFCCVEGCSA-N 0 3 392.135 3.022 10 0 GGAEHN Cn1cc([C@@H]2CCN(CCC(=O)Nc3cccc(Br)c3)C2)cn1 ZINC000125033297 564500892 /nfs/dbraw/zinc/50/08/92/564500892.db2.gz GMRRGWHVYFLTPM-CYBMUJFWSA-N 0 3 377.286 3.001 10 0 GGAEHN CN1CCN(CCCNC(=O)[C@]2(C)CC2(Cl)Cl)[C@@H](c2ccccc2)C1 ZINC000046388195 564501306 /nfs/dbraw/zinc/50/13/06/564501306.db2.gz XYXIFIPMTXBTSZ-AEFFLSMTSA-N 0 3 384.351 3.065 10 0 GGAEHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)Cc1cccc(O)c1 ZINC000125389609 564512865 /nfs/dbraw/zinc/51/28/65/564512865.db2.gz IDGHIAOLOCBLGV-UHFFFAOYSA-N 0 3 391.309 3.288 10 0 GGAEHN CN(C)C[C@H](NC(=O)[C@H]1COc2ccc(Br)cc21)c1ccccc1 ZINC000125388220 564512890 /nfs/dbraw/zinc/51/28/90/564512890.db2.gz CICYRVGQZUGFIE-IRXDYDNUSA-N 0 3 389.293 3.344 10 0 GGAEHN CN(C)C[C@H](NC(=O)[C@@H]1COc2ccc(Br)cc21)c1ccccc1 ZINC000125387798 564513131 /nfs/dbraw/zinc/51/31/31/564513131.db2.gz CICYRVGQZUGFIE-SJORKVTESA-N 0 3 389.293 3.344 10 0 GGAEHN O=C(NCc1ccc([O-])c(Br)c1)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000126168276 564538648 /nfs/dbraw/zinc/53/86/48/564538648.db2.gz NQIOWWNHUPHUFQ-HNNXBMFYSA-N 0 3 396.329 3.315 10 0 GGAEHN CCCN(C)[C@@H](CNC(=O)Nc1nnc(OC)s1)c1ccc(Cl)cc1 ZINC000482444640 564542912 /nfs/dbraw/zinc/54/29/12/564542912.db2.gz HGBRCUQLIRAXOC-ZDUSSCGKSA-N 0 3 383.905 3.405 10 0 GGAEHN CCOCCN1CCN(CCOc2ccccc2Br)C[C@H]1CC ZINC000126642035 564556479 /nfs/dbraw/zinc/55/64/79/564556479.db2.gz YRTBKDUFRDVSAO-MRXNPFEDSA-N 0 3 385.346 3.261 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)Nc1cncc(Br)c1 ZINC000126719975 564559142 /nfs/dbraw/zinc/55/91/42/564559142.db2.gz PEYCFSAXWKGTEK-INIZCTEOSA-N 0 3 377.286 3.139 10 0 GGAEHN CCN1CCC(NC(=O)CSCc2ccc(Br)cc2F)CC1 ZINC000051341962 564564253 /nfs/dbraw/zinc/56/42/53/564564253.db2.gz XFEIKCLYZYZYHW-UHFFFAOYSA-N 0 3 389.334 3.422 10 0 GGAEHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)NCc1cscn1 ZINC000051751519 564566957 /nfs/dbraw/zinc/56/69/57/564566957.db2.gz XCZRIAJLIJZKEP-UHFFFAOYSA-N 0 3 397.342 3.179 10 0 GGAEHN COc1ccc(Br)c(C(=O)N[C@H](CN(C)C)c2ccccc2)c1 ZINC000052555117 564574062 /nfs/dbraw/zinc/57/40/62/564574062.db2.gz VNQWBBQBIRODID-QGZVFWFLSA-N 0 3 377.282 3.490 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)NC(c1cccs1)c1cccs1 ZINC000127133928 564574476 /nfs/dbraw/zinc/57/44/76/564574476.db2.gz FKZQWBQAOUEZFY-AWEZNQCLSA-N 0 3 379.551 3.309 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(C)ccc2Br)[C@H](C)C1 ZINC000127812430 564597314 /nfs/dbraw/zinc/59/73/14/564597314.db2.gz QPIOSYBCDGKIQJ-HIFRSBDPSA-N 0 3 389.359 3.108 10 0 GGAEHN CC(C)COC1CCN(C[C@H](O)COc2ccc(Br)cc2)CC1 ZINC000054325162 564603513 /nfs/dbraw/zinc/60/35/13/564603513.db2.gz NOLNAPXHZAIZQW-INIZCTEOSA-N 0 3 386.330 3.326 10 0 GGAEHN CC(C(=O)NCC1CCCCC1)S(=O)(=O)Cc1nc(C(C)(C)C)cs1 ZINC000127984894 564603601 /nfs/dbraw/zinc/60/36/01/564603601.db2.gz AHXXBDYLWQCVIT-CYBMUJFWSA-N 0 3 386.583 3.440 10 0 GGAEHN CC(C(=O)NCc1cccs1)S(=O)(=O)Cc1nc(C(C)(C)C)cs1 ZINC000128031886 564604413 /nfs/dbraw/zinc/60/44/13/564604413.db2.gz AWWZXVNVGGSHSK-LLVKDONJSA-N 0 3 386.564 3.122 10 0 GGAEHN CC(C(=O)N[C@H]1CCCC[C@H]1C)S(=O)(=O)Cc1nc(C(C)(C)C)cs1 ZINC000128050852 564605895 /nfs/dbraw/zinc/60/58/95/564605895.db2.gz HJUJOFWJKCLMNR-MCIONIFRSA-N 0 3 386.583 3.439 10 0 GGAEHN CN(C)C[C@@H]1CN(Cc2csc(COc3ccc(Cl)cc3)n2)CCO1 ZINC000128087407 564606111 /nfs/dbraw/zinc/60/61/11/564606111.db2.gz UEOCZSQNACWYKC-QGZVFWFLSA-N 0 3 381.929 3.138 10 0 GGAEHN O=C(NCCN1CCCCC1)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000054816659 564610287 /nfs/dbraw/zinc/61/02/87/564610287.db2.gz ZBIJLWUQGVVIEM-OAHLLOKOSA-N 0 3 382.302 3.058 10 0 GGAEHN C[C@H](NCc1cc(F)cc(Br)c1)c1cccc(-n2cnnn2)c1 ZINC000129135722 564640001 /nfs/dbraw/zinc/64/00/01/564640001.db2.gz UDQFUFXAGVIZJZ-NSHDSACASA-N 0 3 376.233 3.415 10 0 GGAEHN C[C@H](CCNCc1ccc(Br)c(Br)c1)[S@](C)=O ZINC000129405453 564647060 /nfs/dbraw/zinc/64/70/60/564647060.db2.gz HGORVVZKAVAOHG-VVVCHXIZSA-N 0 3 383.149 3.458 10 0 GGAEHN CCOc1c(Br)cc(CNCC[C@@H](C)[S@](C)=O)cc1OC ZINC000129433634 564648350 /nfs/dbraw/zinc/64/83/50/564648350.db2.gz ASDSJBXOKZWSDB-WSVYEEACSA-N 0 3 378.332 3.103 10 0 GGAEHN CSc1ccc(NC(=O)C(=O)NC[C@H]2CCCN2CC(C)C)cc1Cl ZINC000129509527 564651590 /nfs/dbraw/zinc/65/15/90/564651590.db2.gz WTYAMWBPKZPFIC-CQSZACIVSA-N 0 3 383.945 3.237 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)N(C)Cc1ccc(Br)o1 ZINC000057203975 564663537 /nfs/dbraw/zinc/66/35/37/564663537.db2.gz AZPMCLVJHHFBIW-OAHLLOKOSA-N 0 3 394.313 3.356 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)NCc1cc(Br)cs1 ZINC000057202600 564663548 /nfs/dbraw/zinc/66/35/48/564663548.db2.gz JBAPNNPKRFLRPD-HNNXBMFYSA-N 0 3 396.354 3.483 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)NCc1ccc(Br)s1 ZINC000057202761 564663716 /nfs/dbraw/zinc/66/37/16/564663716.db2.gz YOBAVEJAVPLQPK-CQSZACIVSA-N 0 3 396.354 3.483 10 0 GGAEHN CN1CCC[C@@H](NC(=O)NCC2(c3cccc(Br)c3)CCC2)C1 ZINC000057859809 564675986 /nfs/dbraw/zinc/67/59/86/564675986.db2.gz IYXVMWOIIOIHPQ-MRXNPFEDSA-N 0 3 380.330 3.264 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)Nc2nnc(-c3cccc(Br)c3)s2)C1 ZINC000130424730 564681375 /nfs/dbraw/zinc/68/13/75/564681375.db2.gz MQOOWUUTFJGPCD-LBPRGKRZSA-N 0 3 396.314 3.135 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)c2cc(COc3c(Cl)cccc3Cl)on2)C1 ZINC000130454028 564682162 /nfs/dbraw/zinc/68/21/62/564682162.db2.gz RGYMRIQZYVEETG-LLVKDONJSA-N 0 3 384.263 3.337 10 0 GGAEHN CC(C)N(C(=O)C(C)S(=O)(=O)Cc1csc(Br)c1)C(C)C ZINC000062640265 564712480 /nfs/dbraw/zinc/71/24/80/564712480.db2.gz HSPBKXYZQOGFNZ-NSHDSACASA-N 0 3 396.372 3.459 10 0 GGAEHN O[C@H](COC[C@@H]1CCCO1)CN1CCC[C@@H]1c1ccccc1Br ZINC000131613979 564718375 /nfs/dbraw/zinc/71/83/75/564718375.db2.gz SLLQXEGZVAELDV-RLFYNMQTSA-N 0 3 384.314 3.143 10 0 GGAEHN CC(C)c1csc([C@@H]2CCCN(C[C@@H]3CCCN(S(C)(=O)=O)C3)C2)n1 ZINC000131944796 564729083 /nfs/dbraw/zinc/72/90/83/564729083.db2.gz WNVVYLREUXWOSO-JKSUJKDBSA-N 0 3 385.599 3.118 10 0 GGAEHN COC[C@@](C)(CCO)NCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000132562706 564746814 /nfs/dbraw/zinc/74/68/14/564746814.db2.gz WWYFKYQHAHDLHF-FUHWJXTLSA-N 0 3 389.323 3.034 10 0 GGAEHN CCc1c(C)sc2nc(SCCN(C)C)n(C[C@H]3CCCO3)c(=O)c12 ZINC000066315207 564762537 /nfs/dbraw/zinc/76/25/37/564762537.db2.gz DKUUIWSAQHLMQW-CYBMUJFWSA-N 0 3 381.567 3.162 10 0 GGAEHN CCS(=O)(=O)C[C@H](C)N[C@H]1CCN(C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000133175723 564765709 /nfs/dbraw/zinc/76/57/09/564765709.db2.gz XACHKBMQPXZJEN-DOPJRALCSA-N 0 3 390.952 3.416 10 0 GGAEHN C[C@H]1CN(C2CCN(CC(=O)Nc3cc(Cl)ccc3Cl)CC2)CCO1 ZINC000066561861 564769402 /nfs/dbraw/zinc/76/94/02/564769402.db2.gz QWORNBPUFRQDLW-ZDUSSCGKSA-N 0 3 386.323 3.117 10 0 GGAEHN CN(CCc1nccs1)C(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1 ZINC000133303290 564769590 /nfs/dbraw/zinc/76/95/90/564769590.db2.gz MGLZXULPPIHMSM-WMLDXEAASA-N 0 3 378.567 3.472 10 0 GGAEHN CC(C(=O)N[C@@H](C)c1ccccc1)S(=O)(=O)Cc1csc(C2CC2)n1 ZINC000134654309 564810984 /nfs/dbraw/zinc/81/09/84/564810984.db2.gz UNWZXTFWBNTXNN-QWHCGFSZSA-N 0 3 378.519 3.201 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)[C@@H](C)NC(=O)c1cccc(Cl)c1Cl ZINC000068224103 564811559 /nfs/dbraw/zinc/81/15/59/564811559.db2.gz GDUYUZMJFSDDAG-OLZOCXBDSA-N 0 3 388.339 3.204 10 0 GGAEHN CN1CCC(NC(=O)NCc2ccc(Br)cc2C(F)(F)F)CC1 ZINC000134814155 564816327 /nfs/dbraw/zinc/81/63/27/564816327.db2.gz UVXGJIPOLXWIDC-UHFFFAOYSA-N 0 3 394.235 3.361 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CCCN(C(C)C)CC2)c1 ZINC000068776915 564826620 /nfs/dbraw/zinc/82/66/20/564826620.db2.gz LEKJQKBUZFJGTF-UHFFFAOYSA-N 0 3 386.277 3.156 10 0 GGAEHN CCC[C@H](C(=O)N1CCN(C(=O)c2ccc(Cl)cc2Cl)CC1)N(C)C ZINC000135860155 564842010 /nfs/dbraw/zinc/84/20/10/564842010.db2.gz ABDJRCSCXFTGHP-MRXNPFEDSA-N 0 3 386.323 3.008 10 0 GGAEHN CCC[C@H](C(=O)N1CCN(C(=O)c2cccc(Cl)c2Cl)CC1)N(C)C ZINC000136430459 564850686 /nfs/dbraw/zinc/85/06/86/564850686.db2.gz UXCYLWPZEXZVRQ-OAHLLOKOSA-N 0 3 386.323 3.008 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N1CCc2[nH]c3c(cccc3Br)c2C1 ZINC000139798374 564870265 /nfs/dbraw/zinc/87/02/65/564870265.db2.gz SEOUEYSELWVJDZ-LBPRGKRZSA-N 0 3 391.313 3.092 10 0 GGAEHN COc1c(Br)cc(Br)cc1CNC[C@H]1CCC[C@@H]1O ZINC000091316086 564870632 /nfs/dbraw/zinc/87/06/32/564870632.db2.gz HODWTLUAIQAROF-RNCFNFMXSA-N 0 3 393.119 3.471 10 0 GGAEHN CC1CCN(CCNC(=O)CSCc2cc(-c3cccs3)on2)CC1 ZINC000140264971 564871169 /nfs/dbraw/zinc/87/11/69/564871169.db2.gz XGXWPPRPEZOODY-UHFFFAOYSA-N 0 3 379.551 3.484 10 0 GGAEHN COc1sc(CN2CCC(N3CCO[C@H](C)C3)CC2)cc1Br ZINC000092079098 564873532 /nfs/dbraw/zinc/87/35/32/564873532.db2.gz QGHQHLYJBSYDSD-GFCCVEGCSA-N 0 3 389.359 3.204 10 0 GGAEHN COc1sc(CN2CCC(N3CCO[C@@H](C)C3)CC2)cc1Br ZINC000092079099 564874217 /nfs/dbraw/zinc/87/42/17/564874217.db2.gz QGHQHLYJBSYDSD-LBPRGKRZSA-N 0 3 389.359 3.204 10 0 GGAEHN COc1c(Br)cc(CN[C@H]2CCO[C@H]2C)cc1Br ZINC000149454624 564885823 /nfs/dbraw/zinc/88/58/23/564885823.db2.gz PRHJNXPAXQZFHE-UFBFGSQYSA-N 0 3 379.092 3.487 10 0 GGAEHN CN(CCNc1cc(Br)cc(F)c1C(N)=O)Cc1ccccc1 ZINC000094149606 564897026 /nfs/dbraw/zinc/89/70/26/564897026.db2.gz WJQRHFDGPWSVOX-UHFFFAOYSA-N 0 3 380.261 3.231 10 0 GGAEHN Cc1ccc(NC(=O)c2cnn3cc(Br)cnc23)c(CN(C)C)c1 ZINC000094149229 564897077 /nfs/dbraw/zinc/89/70/77/564897077.db2.gz YLEIFQACGYKAEQ-UHFFFAOYSA-N 0 3 388.269 3.114 10 0 GGAEHN C[C@@H](NCC(C)(C)C(N)=O)c1ccc(Br)cc1Br ZINC000095462746 564899350 /nfs/dbraw/zinc/89/93/50/564899350.db2.gz ZXNDYPQWCVBVTD-MRVPVSSYSA-N 0 3 378.108 3.374 10 0 GGAEHN CCOc1c(Br)cc(Br)cc1CNCC[C@@H](C)O ZINC000096593361 564903310 /nfs/dbraw/zinc/90/33/10/564903310.db2.gz VBYQVGCIFPJSPZ-SECBINFHSA-N 0 3 381.108 3.471 10 0 GGAEHN CCCN1CCC(CNS(=O)(=O)c2cc3c(c(Cl)c2)O[C@H](C)C3)CC1 ZINC000097590801 564909503 /nfs/dbraw/zinc/90/95/03/564909503.db2.gz QODDNYLCSJRPEL-CYBMUJFWSA-N 0 3 386.945 3.064 10 0 GGAEHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1)[C@@H]1CCCO1 ZINC000098027049 564911095 /nfs/dbraw/zinc/91/10/95/564911095.db2.gz FZGJZWRIGVSICN-YOEHRIQHSA-N 0 3 398.345 3.090 10 0 GGAEHN COCc1ccc(C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)o1 ZINC000098036355 564911701 /nfs/dbraw/zinc/91/17/01/564911701.db2.gz ISIYRINTTBFGGI-UHFFFAOYSA-N 0 3 395.297 3.393 10 0 GGAEHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1)[C@H]1CCCO1 ZINC000098027051 564911765 /nfs/dbraw/zinc/91/17/65/564911765.db2.gz FZGJZWRIGVSICN-WMLDXEAASA-N 0 3 398.345 3.090 10 0 GGAEHN CCN1CCN(CCC(=O)N[C@@H](C)c2c(Cl)ccc(F)c2Cl)CC1 ZINC000101649232 564919460 /nfs/dbraw/zinc/91/94/60/564919460.db2.gz RAFCJUVZEBXYMG-LBPRGKRZSA-N 0 3 376.303 3.337 10 0 GGAEHN CCOc1cc(Br)ccc1NC(=O)Nc1cnn(CCN(C)C)c1 ZINC000151488485 564922581 /nfs/dbraw/zinc/92/25/81/564922581.db2.gz JHDSVUWFADAZRZ-UHFFFAOYSA-N 0 3 396.289 3.250 10 0 GGAEHN CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)Nc1ccc(Cl)cc1Cl ZINC000102052196 564925078 /nfs/dbraw/zinc/92/50/78/564925078.db2.gz CCVKNFAMKCRGBS-OAHLLOKOSA-N 0 3 387.311 3.058 10 0 GGAEHN CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)Nc1ccc(Cl)cc1Cl ZINC000102052193 564925223 /nfs/dbraw/zinc/92/52/23/564925223.db2.gz CCVKNFAMKCRGBS-HNNXBMFYSA-N 0 3 387.311 3.058 10 0 GGAEHN C[NH+](C)CCOc1ccccc1C(=O)NCc1ccc([O-])c(Br)c1 ZINC000151590408 564928150 /nfs/dbraw/zinc/92/81/50/564928150.db2.gz JARFOISZVXZXIH-UHFFFAOYSA-N 0 3 393.281 3.025 10 0 GGAEHN O=C(NC[C@H](O)CN1CCCCC1)Nc1ccc(Cl)c(Br)c1 ZINC000151721810 564934486 /nfs/dbraw/zinc/93/44/86/564934486.db2.gz NLCDQKYFBDGPJI-LBPRGKRZSA-N 0 3 390.709 3.071 10 0 GGAEHN CCC[NH+]1CCC(C[N-]S(=O)(=O)c2ccc(F)cc2C(F)(F)F)CC1 ZINC000103158949 564943836 /nfs/dbraw/zinc/94/38/36/564943836.db2.gz QWQOWOZJTYMYNS-UHFFFAOYSA-N 0 3 382.423 3.245 10 0 GGAEHN Cc1cc(S(=O)(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)c(C)s1 ZINC000103163933 564944979 /nfs/dbraw/zinc/94/49/79/564944979.db2.gz ZNOIFTMSSAOUPC-SFHVURJKSA-N 0 3 378.563 3.208 10 0 GGAEHN CN(C)CCN(C)C(=O)NCc1ccc(Br)cc1C(F)(F)F ZINC000152294375 564953748 /nfs/dbraw/zinc/95/37/48/564953748.db2.gz AQYKUGVVNCXJMT-UHFFFAOYSA-N 0 3 382.224 3.171 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)NCc2ccc(Br)cc2C(F)(F)F)C1 ZINC000152311310 564954046 /nfs/dbraw/zinc/95/40/46/564954046.db2.gz URTZKCFDPPXPIB-GFCCVEGCSA-N 0 3 394.235 3.313 10 0 GGAEHN CN(C)[C@@H]1CCCN(C(=O)CSCc2ccc(Br)cc2F)C1 ZINC000105327896 564964232 /nfs/dbraw/zinc/96/42/32/564964232.db2.gz YVULPCDPBNMUBD-CQSZACIVSA-N 0 3 389.334 3.374 10 0 GGAEHN Cc1nc(CS(=O)(=O)C(C)C(=O)N[C@@H](C)c2ccc(Cl)cc2)cs1 ZINC000105523170 564967879 /nfs/dbraw/zinc/96/78/79/564967879.db2.gz DKZCLUIZTGIZNJ-QWRGUYRKSA-N 0 3 386.926 3.286 10 0 GGAEHN O[C@H](CNCc1cc(Br)c2c(c1)OCCCO2)Cc1ccccc1 ZINC000105493081 564967961 /nfs/dbraw/zinc/96/79/61/564967961.db2.gz LQZUJKYMVNFTGW-INIZCTEOSA-N 0 3 392.293 3.304 10 0 GGAEHN CN(Cc1ccc(F)c(Br)c1)[C@@H]1CCCN(c2cccnn2)C1 ZINC000106075266 564976965 /nfs/dbraw/zinc/97/69/65/564976965.db2.gz KHFVNFHGLSKERI-CQSZACIVSA-N 0 3 379.277 3.479 10 0 GGAEHN CN(Cc1ccc(F)c(Br)c1)[C@H]1CCCN(c2cccnn2)C1 ZINC000106075270 564977299 /nfs/dbraw/zinc/97/72/99/564977299.db2.gz KHFVNFHGLSKERI-AWEZNQCLSA-N 0 3 379.277 3.479 10 0 GGAEHN COc1ccc(Br)cc1CN(C)[C@@H]1CCCN(c2cccnn2)C1 ZINC000106077969 564977337 /nfs/dbraw/zinc/97/73/37/564977337.db2.gz TVUMQSSZCUACPF-MRXNPFEDSA-N 0 3 391.313 3.349 10 0 GGAEHN CN(Cc1cc(F)ccc1Br)C1CCN(CCn2cccn2)CC1 ZINC000106128582 564979434 /nfs/dbraw/zinc/97/94/34/564979434.db2.gz PESUBHSIJRJGOU-UHFFFAOYSA-N 0 3 395.320 3.381 10 0 GGAEHN O[C@@H](COc1c(Cl)cccc1Cl)CN1CCC(Cn2cccn2)CC1 ZINC000106184187 564980429 /nfs/dbraw/zinc/98/04/29/564980429.db2.gz MXRSTJJZTLPHAC-OAHLLOKOSA-N 0 3 384.307 3.342 10 0 GGAEHN COCCCN(C)CCNC(=O)N[C@@H](c1ccc(Cl)cc1)C(F)(F)F ZINC000153461403 564996077 /nfs/dbraw/zinc/99/60/77/564996077.db2.gz XRTOPFGPJGZVKM-AWEZNQCLSA-N 0 3 381.826 3.211 10 0 GGAEHN C[C@@H](Oc1ccc(F)cc1Br)C(=O)NCCN1CCCC[C@H]1C ZINC000107628620 565000718 /nfs/dbraw/zinc/00/07/18/565000718.db2.gz CHMGZRWXUDBWFG-CHWSQXEVSA-N 0 3 387.293 3.346 10 0 GGAEHN O=S(=O)(c1ccccc1C(F)(F)F)N1CCCC[C@H](N2CCCC2)C1 ZINC000107708009 565002565 /nfs/dbraw/zinc/00/25/65/565002565.db2.gz UKNDCYCNMYKOIR-AWEZNQCLSA-N 0 3 376.444 3.344 10 0 GGAEHN CN(C)CCOc1ccccc1C(=O)NCc1cc(Br)cs1 ZINC000108592130 565014230 /nfs/dbraw/zinc/01/42/30/565014230.db2.gz CQBXKQFPVXIIRI-UHFFFAOYSA-N 0 3 383.311 3.381 10 0 GGAEHN CN(C(=O)c1ccc(Cl)cc1Cl)C1CCN(CCn2cccn2)CC1 ZINC000109291587 565023756 /nfs/dbraw/zinc/02/37/56/565023756.db2.gz VNSSKUGKMKRCLQ-UHFFFAOYSA-N 0 3 381.307 3.427 10 0 GGAEHN CN(C(=O)c1cc(Cl)cc(Cl)c1)C1CCN(CCn2cccn2)CC1 ZINC000109293413 565023768 /nfs/dbraw/zinc/02/37/68/565023768.db2.gz UHWUOXUUKBMQLO-UHFFFAOYSA-N 0 3 381.307 3.427 10 0 GGAEHN CN(C(=O)c1cc(Cl)ccc1Cl)C1CCN(CCn2cccn2)CC1 ZINC000109293188 565024111 /nfs/dbraw/zinc/02/41/11/565024111.db2.gz HQAVMEBPXUTCSD-UHFFFAOYSA-N 0 3 381.307 3.427 10 0 GGAEHN C[C@@H](CNC(=O)N1CC[C@@H](N(C)C)C1)Sc1ccc(Br)cc1 ZINC000109404860 565025360 /nfs/dbraw/zinc/02/53/60/565025360.db2.gz MGFSJEOPFHMOSG-GXTWGEPZSA-N 0 3 386.359 3.275 10 0 GGAEHN C[C@H](O)C1CCN(Cc2ccnc(-c3ccc(Br)cc3)n2)CC1 ZINC000154224754 565030225 /nfs/dbraw/zinc/03/02/25/565030225.db2.gz HAIHFKSMOPOWGH-ZDUSSCGKSA-N 0 3 376.298 3.499 10 0 GGAEHN CCCN1CCC(CNS(=O)(=O)c2ccc(Br)c(C)c2)CC1 ZINC000109856103 565033012 /nfs/dbraw/zinc/03/30/12/565033012.db2.gz TXCDPAVTCRWFER-UHFFFAOYSA-N 0 3 389.359 3.158 10 0 GGAEHN Clc1ccc2c(c1)[C@H](NC[C@]1(N3CCOCC3)CCSC1)CCCO2 ZINC000154392174 565036936 /nfs/dbraw/zinc/03/69/36/565036936.db2.gz AYKKUMSQMCPREJ-IEBWSBKVSA-N 0 3 382.957 3.351 10 0 GGAEHN Clc1ccc2c(c1)[C@H](NC[C@@]1(N3CCOCC3)CCSC1)CCCO2 ZINC000154392384 565037092 /nfs/dbraw/zinc/03/70/92/565037092.db2.gz AYKKUMSQMCPREJ-MJGOQNOKSA-N 0 3 382.957 3.351 10 0 GGAEHN C[C@H](CC(=O)Nc1cccc(Br)c1)NCc1cccnc1N(C)C ZINC000154717710 565050287 /nfs/dbraw/zinc/05/02/87/565050287.db2.gz RMOPJTRKRUGYML-CYBMUJFWSA-N 0 3 391.313 3.417 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)N(C)[C@@H](C)c1ccccc1Br ZINC000111864415 565058458 /nfs/dbraw/zinc/05/84/58/565058458.db2.gz BUFLZNYUBBEWFA-GJZGRUSLSA-N 0 3 398.345 3.262 10 0 GGAEHN CN(C)CCN(CCN(C)C)C(=O)N[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000155081832 565061531 /nfs/dbraw/zinc/06/15/31/565061531.db2.gz YXILIQRQXQCYTD-INIZCTEOSA-N 0 3 387.355 3.116 10 0 GGAEHN CCc1nc2n(n1)C[C@@H](N[C@H](C)C(=O)Nc1cc(Cl)ccc1Cl)CC2 ZINC000112550794 565064386 /nfs/dbraw/zinc/06/43/86/565064386.db2.gz BJYQWOBJUKIVDQ-PWSUYJOCSA-N 0 3 382.295 3.079 10 0 GGAEHN CCc1nc2n(n1)C[C@@H](N[C@H](C)C(=O)Nc1cccc(Cl)c1Cl)CC2 ZINC000112550599 565064414 /nfs/dbraw/zinc/06/44/14/565064414.db2.gz VSTOLIUKPCVLRV-MNOVXSKESA-N 0 3 382.295 3.079 10 0 GGAEHN CCc1nc2n(n1)C[C@H](N[C@H](C)C(=O)Nc1cc(Cl)ccc1Cl)CC2 ZINC000112550792 565064446 /nfs/dbraw/zinc/06/44/46/565064446.db2.gz BJYQWOBJUKIVDQ-ZYHUDNBSSA-N 0 3 382.295 3.079 10 0 GGAEHN CCc1nc2n(n1)C[C@@H](N[C@H](C)C(=O)Nc1ccc(Cl)cc1Cl)CC2 ZINC000112550698 565064454 /nfs/dbraw/zinc/06/44/54/565064454.db2.gz ADXHKRBGVFCCQD-PWSUYJOCSA-N 0 3 382.295 3.079 10 0 GGAEHN CCc1nc2n(n1)C[C@@H](N[C@@H](C)C(=O)Nc1ccc(Cl)cc1Cl)CC2 ZINC000112550694 565064459 /nfs/dbraw/zinc/06/44/59/565064459.db2.gz ADXHKRBGVFCCQD-JQWIXIFHSA-N 0 3 382.295 3.079 10 0 GGAEHN CCc1nc2n(n1)C[C@@H](N[C@@H](C)C(=O)Nc1cc(Cl)ccc1Cl)CC2 ZINC000112550790 565064483 /nfs/dbraw/zinc/06/44/83/565064483.db2.gz BJYQWOBJUKIVDQ-JQWIXIFHSA-N 0 3 382.295 3.079 10 0 GGAEHN Cc1cccc(S(=O)(=O)N2CCC(N3CCCC3)CC2)c1Br ZINC000155369017 565066716 /nfs/dbraw/zinc/06/67/16/565066716.db2.gz POJKBEQOVNANFM-UHFFFAOYSA-N 0 3 387.343 3.006 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)cc1OC ZINC000155386236 565067075 /nfs/dbraw/zinc/06/70/75/565067075.db2.gz WHGIKQSJRLJAPK-SWLSCSKDSA-N 0 3 399.329 3.315 10 0 GGAEHN CC(C)[C@@H](CNc1ncnc2ccc(Br)cc21)N1CCN(C)CC1 ZINC000112964052 565067304 /nfs/dbraw/zinc/06/73/04/565067304.db2.gz OJTJXECOPPMBTA-QGZVFWFLSA-N 0 3 392.345 3.076 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cc1OC ZINC000113224769 565068396 /nfs/dbraw/zinc/06/83/96/565068396.db2.gz RYNLRVLATSQIOL-JSGCOSHPSA-N 0 3 397.313 3.165 10 0 GGAEHN C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(-c2ccc(Br)cc2)n[nH]1 ZINC000113223258 565068570 /nfs/dbraw/zinc/06/85/70/565068570.db2.gz XIWREZOFVRXUNL-SWLSCSKDSA-N 0 3 389.297 3.148 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)Cc1ccc(Br)s1 ZINC000114319410 565073875 /nfs/dbraw/zinc/07/38/75/565073875.db2.gz NRYXCHLWEIBGEZ-AWEZNQCLSA-N 0 3 381.339 3.342 10 0 GGAEHN C[C@H](NCCCN(C)CC(F)(F)F)c1ccc(-n2cncn2)cc1Cl ZINC000156393799 565084318 /nfs/dbraw/zinc/08/43/18/565084318.db2.gz UAZUSDDOGIKOSP-LBPRGKRZSA-N 0 3 375.826 3.456 10 0 GGAEHN CCC[C@@H](C)NC(=O)C(C)S(=O)(=O)Cc1sc(C)nc1C(F)(F)F ZINC000183711639 565090218 /nfs/dbraw/zinc/09/02/18/565090218.db2.gz OYYFEKRRWBICME-RKDXNWHRSA-N 0 3 386.461 3.078 10 0 GGAEHN O=C(c1ccccc1)N1CCC(CNCc2cncc(Br)c2)CC1 ZINC000183716008 565090713 /nfs/dbraw/zinc/09/07/13/565090713.db2.gz OGBSCTVKOXOGSM-UHFFFAOYSA-N 0 3 388.309 3.486 10 0 GGAEHN CC(C)(C)OC[C@H](O)CN1CCC(Oc2cccc(Br)c2)CC1 ZINC000183824014 565096897 /nfs/dbraw/zinc/09/68/97/565096897.db2.gz OHLOUQSHEBQEKS-OAHLLOKOSA-N 0 3 386.330 3.468 10 0 GGAEHN CC(C)OCCN1CCC(NC(=O)Nc2nc(C(F)(F)F)cs2)CC1 ZINC000266982513 565099627 /nfs/dbraw/zinc/09/96/27/565099627.db2.gz NSTVMEQEIZKEAU-UHFFFAOYSA-N 0 3 380.436 3.173 10 0 GGAEHN CN(Cc1cc(Br)ccc1F)C1CCN(c2cnccn2)CC1 ZINC000369881125 565116778 /nfs/dbraw/zinc/11/67/78/565116778.db2.gz BIERCJCPQVREQY-UHFFFAOYSA-N 0 3 379.277 3.479 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNCCCn1ccnn1 ZINC000184244791 565122798 /nfs/dbraw/zinc/12/27/98/565122798.db2.gz CTAHDBFYXGKILL-UHFFFAOYSA-N 0 3 389.301 3.023 10 0 GGAEHN CN(C[C@H](O)c1ccc(Cl)cc1Cl)C1CCN(c2cnccn2)CC1 ZINC000370049326 565125242 /nfs/dbraw/zinc/12/52/42/565125242.db2.gz HYHBALFONCATBQ-KRWDZBQOSA-N 0 3 381.307 3.418 10 0 GGAEHN CN(C[C@@H](O)c1ccc(Cl)cc1Cl)C1CCN(c2cnccn2)CC1 ZINC000370049327 565125534 /nfs/dbraw/zinc/12/55/34/565125534.db2.gz HYHBALFONCATBQ-QGZVFWFLSA-N 0 3 381.307 3.418 10 0 GGAEHN CN1CCC(CC(=O)NCCc2c[nH]c3cccc(Br)c23)CC1 ZINC000292638651 565126046 /nfs/dbraw/zinc/12/60/46/565126046.db2.gz KEJFVKDEAKADNP-UHFFFAOYSA-N 0 3 378.314 3.321 10 0 GGAEHN Cc1noc([C@@H]2CCCN(C[C@@](C)(O)c3ccc(Br)cc3F)C2)n1 ZINC000292689004 565129505 /nfs/dbraw/zinc/12/95/05/565129505.db2.gz AHZYSMZYMYNEFF-SJKOYZFVSA-N 0 3 398.276 3.367 10 0 GGAEHN CN1CC[C@]2(CCN(C(=O)N[C@H]3CCOc4c(Br)cccc43)C2)C1 ZINC000292742982 565131741 /nfs/dbraw/zinc/13/17/41/565131741.db2.gz TXEDWNILDYFDIJ-YJBOKZPZSA-N 0 3 394.313 3.010 10 0 GGAEHN CN1CC[C@@]2(CCN(C(=O)N[C@H]3CCOc4c(Br)cccc43)C2)C1 ZINC000292740823 565131832 /nfs/dbraw/zinc/13/18/32/565131832.db2.gz TXEDWNILDYFDIJ-MAUKXSAKSA-N 0 3 394.313 3.010 10 0 GGAEHN CN(CCCN1CCN(C)CC1)C(=O)N[C@H]1CCCc2sc(Cl)cc21 ZINC000292834157 565137036 /nfs/dbraw/zinc/13/70/36/565137036.db2.gz BQRMCHXVBWAQSJ-HNNXBMFYSA-N 0 3 384.977 3.058 10 0 GGAEHN CCC[C@@H](C(=O)N1CCO[C@H](c2ccc(F)c(Br)c2)C1)N(C)C ZINC000184493544 565139193 /nfs/dbraw/zinc/13/91/93/565139193.db2.gz OWIFTSXIQANQIQ-HOTGVXAUSA-N 0 3 387.293 3.218 10 0 GGAEHN Cn1ncc(Br)c1CNC1(Cc2cccc(F)c2)CCOCC1 ZINC000292957066 565143185 /nfs/dbraw/zinc/14/31/85/565143185.db2.gz JDRAKNFAORFQIF-UHFFFAOYSA-N 0 3 382.277 3.203 10 0 GGAEHN CC(C)N(CCN(C)C)C(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000157965502 565150223 /nfs/dbraw/zinc/15/02/23/565150223.db2.gz YQGLVUIMZNZKGT-OAHLLOKOSA-N 0 3 384.318 3.254 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1cc(F)c(Br)cc1C ZINC000184836292 565159811 /nfs/dbraw/zinc/15/98/11/565159811.db2.gz LADNGLGUXAPBFY-LBPRGKRZSA-N 0 3 388.281 3.129 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)Cc2c[nH]c3cc(Br)ccc23)CCN1C ZINC000158450038 565170134 /nfs/dbraw/zinc/17/01/34/565170134.db2.gz ZDOQPQKSGQWRIG-SWLSCSKDSA-N 0 3 378.314 3.414 10 0 GGAEHN Cc1cnn([C@H]2CCN(C[C@](C)(O)c3ccc(Br)cc3F)C2)c1 ZINC000293533497 565173405 /nfs/dbraw/zinc/17/34/05/565173405.db2.gz JPHXTEPBZBHEJR-YOEHRIQHSA-N 0 3 382.277 3.248 10 0 GGAEHN C[C@H](CCN1CCN(C)CC1)NC(=O)N[C@@H]1CCCc2sc(Cl)cc21 ZINC000293596980 565176310 /nfs/dbraw/zinc/17/63/10/565176310.db2.gz ZLZRPRDKQMSRKK-UKRRQHHQSA-N 0 3 384.977 3.104 10 0 GGAEHN CN1CC[C@@H](NCc2ccc(S(C)(=O)=O)cc2)[C@@H]1c1ccc(Cl)cc1 ZINC000371205898 565182117 /nfs/dbraw/zinc/18/21/17/565182117.db2.gz CECDGMBMLSSIKY-MOPGFXCFSA-N 0 3 378.925 3.279 10 0 GGAEHN CN1CC[C@@H](NCc2ccc(S(C)(=O)=O)cc2)[C@H]1c1ccc(Cl)cc1 ZINC000371205902 565182497 /nfs/dbraw/zinc/18/24/97/565182497.db2.gz CECDGMBMLSSIKY-RTBURBONSA-N 0 3 378.925 3.279 10 0 GGAEHN Cc1ccc(I)c(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1 ZINC000158950678 565188034 /nfs/dbraw/zinc/18/80/34/565188034.db2.gz JJCHVKNNXYBQII-SWLSCSKDSA-N 0 3 386.277 3.058 10 0 GGAEHN Cc1ccc(I)c(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1 ZINC000158950807 565188101 /nfs/dbraw/zinc/18/81/01/565188101.db2.gz JJCHVKNNXYBQII-WFASDCNBSA-N 0 3 386.277 3.058 10 0 GGAEHN Cc1cccc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1I ZINC000158988756 565190393 /nfs/dbraw/zinc/19/03/93/565190393.db2.gz VVHUTANILOAXBV-JSGCOSHPSA-N 0 3 386.277 3.058 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 ZINC000159124552 565195290 /nfs/dbraw/zinc/19/52/90/565195290.db2.gz LPEVADKHEAZHCN-RYUDHWBXSA-N 0 3 376.448 3.145 10 0 GGAEHN COCC1=CCN(CCCOc2cccc(I)c2)CC1 ZINC000185834197 565223397 /nfs/dbraw/zinc/22/33/97/565223397.db2.gz DDDFFHWXMLLTOI-UHFFFAOYSA-N 0 3 387.261 3.339 10 0 GGAEHN COCCCN(C(=O)Cc1cscc1Br)C1CCN(C)CC1 ZINC000294712319 565225076 /nfs/dbraw/zinc/22/50/76/565225076.db2.gz NQLKAKNDKSHOFJ-UHFFFAOYSA-N 0 3 389.359 3.012 10 0 GGAEHN O=C1Nc2ccccc2[C@@]12CCN(Cc1nc3ccc(Br)cc3[nH]1)C2 ZINC000372302483 565229592 /nfs/dbraw/zinc/22/95/92/565229592.db2.gz RYTUAUBUZFWRKO-IBGZPJMESA-N 0 3 397.276 3.421 10 0 GGAEHN O=C1Nc2ccccc2[C@]12CCN(Cc1nc3ccc(Br)cc3[nH]1)C2 ZINC000372302484 565229744 /nfs/dbraw/zinc/22/97/44/565229744.db2.gz RYTUAUBUZFWRKO-LJQANCHMSA-N 0 3 397.276 3.421 10 0 GGAEHN O=C1C[C@H]([C@@H]2CCCCN2Cc2cc(Br)cc3cccnc32)CN1 ZINC000372334641 565232985 /nfs/dbraw/zinc/23/29/85/565232985.db2.gz RVMYZUBVPZCXJI-YOEHRIQHSA-N 0 3 388.309 3.488 10 0 GGAEHN COc1cc(CNC2(C(=O)N(C)C)CCCCC2)cc(Br)c1O ZINC000294970891 565238201 /nfs/dbraw/zinc/23/82/01/565238201.db2.gz JAKSYXYVPDQLIY-UHFFFAOYSA-N 0 3 385.302 3.044 10 0 GGAEHN Brc1ccc([C@@H](NCCN2CCCCC2)c2cncnc2)cc1 ZINC000186099526 565239714 /nfs/dbraw/zinc/23/97/14/565239714.db2.gz YZDWQKZQQIYDEB-GOSISDBHSA-N 0 3 375.314 3.404 10 0 GGAEHN CCN(Cc1cccc(Br)c1)C(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C ZINC000372570448 565244605 /nfs/dbraw/zinc/24/46/05/565244605.db2.gz LFCSDGFIXVJUTH-GPMSIDNRSA-N 0 3 395.341 3.330 10 0 GGAEHN CCN(Cc1cccc(Br)c1)C(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C ZINC000372570453 565245092 /nfs/dbraw/zinc/24/50/92/565245092.db2.gz LFCSDGFIXVJUTH-TXPKVOOTSA-N 0 3 395.341 3.330 10 0 GGAEHN COc1ccc(Cl)cc1C[C@@H]1CCCN(CC2CCS(=O)(=O)CC2)C1 ZINC000271295416 565247552 /nfs/dbraw/zinc/24/75/52/565247552.db2.gz NNWWKJJBANSOLG-INIZCTEOSA-N 0 3 385.957 3.428 10 0 GGAEHN COc1nccnc1CNCC1(c2ccc(Br)cc2)CCOCC1 ZINC000295228185 565252534 /nfs/dbraw/zinc/25/25/34/565252534.db2.gz ROVJCPBVLLHVNU-UHFFFAOYSA-N 0 3 392.297 3.086 10 0 GGAEHN CCOC(=O)c1nn(C)cc1CN[C@@H](C)Cc1ccc(Br)cc1 ZINC000186310230 565254776 /nfs/dbraw/zinc/25/47/76/565254776.db2.gz BRMFKBWWGLBMHX-LBPRGKRZSA-N 0 3 380.286 3.080 10 0 GGAEHN C[C@H](N[C@@H]1CCOC2(CCSCC2)C1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000271542405 565258028 /nfs/dbraw/zinc/25/80/28/565258028.db2.gz SUNMVNZJMBGKSB-DZGCQCFKSA-N 0 3 387.542 3.325 10 0 GGAEHN C[C@H](N[C@H]1CCOC2(CCSCC2)C1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000271542417 565258348 /nfs/dbraw/zinc/25/83/48/565258348.db2.gz SUNMVNZJMBGKSB-ZFWWWQNUSA-N 0 3 387.542 3.325 10 0 GGAEHN CCOC(=O)c1nn(C)cc1CN[C@@H](C)Cc1ccccc1Br ZINC000186381336 565258592 /nfs/dbraw/zinc/25/85/92/565258592.db2.gz DFLRWLCGCMMXFQ-LBPRGKRZSA-N 0 3 380.286 3.080 10 0 GGAEHN CCO[C@@H]1C[C@H](N[C@@H](CO)c2cccc(Br)c2)C12CCOCC2 ZINC000186422312 565260751 /nfs/dbraw/zinc/26/07/51/565260751.db2.gz XQCYTWRIYNCULO-YESZJQIVSA-N 0 3 384.314 3.046 10 0 GGAEHN CCO[C@@H]1C[C@@H](NCc2cc(Br)cc3c2OCC3)C12CCOCC2 ZINC000186508037 565264091 /nfs/dbraw/zinc/26/40/91/565264091.db2.gz BMFKOHYMRZEBCR-IAGOWNOFSA-N 0 3 396.325 3.448 10 0 GGAEHN CN(C)C(=O)N1CCC(N[C@@H]2CCOc3ccc(Br)cc32)CC1 ZINC000271759877 565266980 /nfs/dbraw/zinc/26/69/80/565266980.db2.gz ZLNKZGXMFSZJSD-OAHLLOKOSA-N 0 3 382.302 3.008 10 0 GGAEHN CN(C)C(=O)N1CCC(N[C@H]2CCOc3ccc(Br)cc32)CC1 ZINC000271759876 565267070 /nfs/dbraw/zinc/26/70/70/565267070.db2.gz ZLNKZGXMFSZJSD-HNNXBMFYSA-N 0 3 382.302 3.008 10 0 GGAEHN Fc1ccc2c(c1Br)CC[C@@H]2NC[C@@H]1COC2(CCOCC2)O1 ZINC000295551382 565272585 /nfs/dbraw/zinc/27/25/85/565272585.db2.gz YIVDDLKNYKIAKI-ABAIWWIYSA-N 0 3 386.261 3.087 10 0 GGAEHN Fc1ccc2c(c1Br)CC[C@@H]2NC[C@H]1COC2(CCOCC2)O1 ZINC000295551409 565272622 /nfs/dbraw/zinc/27/26/22/565272622.db2.gz YIVDDLKNYKIAKI-NHYWBVRUSA-N 0 3 386.261 3.087 10 0 GGAEHN CN(C)CCn1cc(NC(=O)c2cccc(Br)c2Cl)ccc1=O ZINC000272365782 565285288 /nfs/dbraw/zinc/28/52/88/565285288.db2.gz CVHKLYGGYIUNCC-UHFFFAOYSA-N 0 3 398.688 3.078 10 0 GGAEHN CC(C)(C)C(=O)N1CCC(CN[C@@H](CO)c2cccc(Br)c2)CC1 ZINC000161715214 565291680 /nfs/dbraw/zinc/29/16/80/565291680.db2.gz HOCIFOWESIAPHT-KRWDZBQOSA-N 0 3 397.357 3.357 10 0 GGAEHN O=C1[C@H](N[C@@H]2CCCc3cc(Br)ccc32)CCN1C1CCOCC1 ZINC000373565277 565292264 /nfs/dbraw/zinc/29/22/64/565292264.db2.gz ZOKZSGIJUOTIRB-QZTJIDSGSA-N 0 3 393.325 3.196 10 0 GGAEHN O=C(NCc1ccccc1CN1CC[C@H](O)C1)c1csc(Br)c1 ZINC000272739684 565295447 /nfs/dbraw/zinc/29/54/47/565295447.db2.gz BYDDXTBUNJRCII-HNNXBMFYSA-N 0 3 395.322 3.007 10 0 GGAEHN CCS(=O)(=O)CCCCCN1CCC(c2ncc(C(F)(F)F)[nH]2)CC1 ZINC000373712344 565299378 /nfs/dbraw/zinc/29/93/78/565299378.db2.gz OBPKJGCZMDZNAV-UHFFFAOYSA-N 0 3 381.464 3.213 10 0 GGAEHN CCN1CCN([C@@H](C)CNC(=O)C[C@H](C)c2ccc(Br)cc2)CC1 ZINC000162101346 565304951 /nfs/dbraw/zinc/30/49/51/565304951.db2.gz FVCOSYIUANJSRU-HOTGVXAUSA-N 0 3 396.373 3.085 10 0 GGAEHN C[C@@H]1CCN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCS1 ZINC000373841179 565305013 /nfs/dbraw/zinc/30/50/13/565305013.db2.gz KIFZCISIGLWOFM-LRVUVFPRSA-N 0 3 379.492 3.329 10 0 GGAEHN CCN1CCN([C@H](C)CNC(=O)C[C@H](C)c2ccc(Br)cc2)CC1 ZINC000162101467 565305210 /nfs/dbraw/zinc/30/52/10/565305210.db2.gz FVCOSYIUANJSRU-JKSUJKDBSA-N 0 3 396.373 3.085 10 0 GGAEHN C[C@H]1CCN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCS1 ZINC000373841178 565305136 /nfs/dbraw/zinc/30/51/36/565305136.db2.gz KIFZCISIGLWOFM-GRTSSRMGSA-N 0 3 379.492 3.329 10 0 GGAEHN COc1nccnc1CNCC1(c2cccc(Br)c2)CCOCC1 ZINC000296223216 565307397 /nfs/dbraw/zinc/30/73/97/565307397.db2.gz CAMWZOMJRYWEIB-UHFFFAOYSA-N 0 3 392.297 3.086 10 0 GGAEHN COc1c(Br)cccc1CN[C@@H]1CCCN(c2ncccn2)C1 ZINC000187130592 565310888 /nfs/dbraw/zinc/31/08/88/565310888.db2.gz QLYXESKTWKAAQE-CQSZACIVSA-N 0 3 377.286 3.006 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1C[C@H](O)c1ccc(F)c(Br)c1 ZINC000187125815 565311349 /nfs/dbraw/zinc/31/13/49/565311349.db2.gz ORKLMHRUCKREHF-PBHICJAKSA-N 0 3 382.277 3.291 10 0 GGAEHN COc1c(Br)cccc1CN[C@H]1CCCN(c2ncccn2)C1 ZINC000187130611 565311538 /nfs/dbraw/zinc/31/15/38/565311538.db2.gz QLYXESKTWKAAQE-AWEZNQCLSA-N 0 3 377.286 3.006 10 0 GGAEHN CN1CCC(CC(=O)NCc2cc(Br)ccc2OC(F)F)CC1 ZINC000273209134 565311997 /nfs/dbraw/zinc/31/19/97/565311997.db2.gz LFJDCDRPJLBHHT-UHFFFAOYSA-N 0 3 391.256 3.399 10 0 GGAEHN Nc1c(Br)cc(Br)cc1CNC[C@@H]1CCCC[C@@H]1O ZINC000187400563 565329914 /nfs/dbraw/zinc/32/99/14/565329914.db2.gz MFWXJZAZEOTNIY-ZANVPECISA-N 0 3 392.135 3.435 10 0 GGAEHN C[C@@H](N[C@H]1CCCN(c2ncccn2)C1)c1cc(Br)ncc1F ZINC000273915770 565345877 /nfs/dbraw/zinc/34/58/77/565345877.db2.gz YNRUGEUNLHSVKG-NEPJUHHUSA-N 0 3 380.265 3.093 10 0 GGAEHN C[C@H](N[C@@H]1CCCN(c2ncccn2)C1)c1cc(Br)ncc1F ZINC000273915772 565346163 /nfs/dbraw/zinc/34/61/63/565346163.db2.gz YNRUGEUNLHSVKG-NWDGAFQWSA-N 0 3 380.265 3.093 10 0 GGAEHN CS[C@@H]1CN(CC(=O)Nc2c(Cl)cccc2Cl)C[C@@H]1N1CCCC1 ZINC000273934078 565347007 /nfs/dbraw/zinc/34/70/07/565347007.db2.gz CLGNONGHVYFEMX-LSDHHAIUSA-N 0 3 388.364 3.444 10 0 GGAEHN CS[C@H]1CN(CC(=O)Nc2c(Cl)cccc2Cl)C[C@@H]1N1CCCC1 ZINC000273934071 565347543 /nfs/dbraw/zinc/34/75/43/565347543.db2.gz CLGNONGHVYFEMX-GJZGRUSLSA-N 0 3 388.364 3.444 10 0 GGAEHN CS[C@H]1CN(CC(=O)Nc2cccc(Cl)c2Cl)C[C@H]1N1CCCC1 ZINC000273966783 565349481 /nfs/dbraw/zinc/34/94/81/565349481.db2.gz GHKFNIPYIUAQQR-CABCVRRESA-N 0 3 388.364 3.444 10 0 GGAEHN O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1csc(Cl)c1 ZINC000187923043 565363943 /nfs/dbraw/zinc/36/39/43/565363943.db2.gz WCUBDUAQULRCNT-UHFFFAOYSA-N 0 3 377.897 3.479 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)Nc2cnc(Cl)c(Br)c2)CCN1C ZINC000274327933 565367452 /nfs/dbraw/zinc/36/74/52/565367452.db2.gz DKEKPAASJVRWIP-KOLCDFICSA-N 0 3 375.698 3.444 10 0 GGAEHN CCOc1cc(CN[C@H]2COc3ccccc3[C@H]2O)cc(Br)c1O ZINC000297405828 565370972 /nfs/dbraw/zinc/37/09/72/565370972.db2.gz KVBQDVSSOYKBGW-WMLDXEAASA-N 0 3 394.265 3.138 10 0 GGAEHN Cc1csc(=O)n1CCNC1(c2ccc(Br)cc2)CCOCC1 ZINC000165675112 565371087 /nfs/dbraw/zinc/37/10/87/565371087.db2.gz AHSGSWDCPPLEHH-UHFFFAOYSA-N 0 3 397.338 3.276 10 0 GGAEHN O=C(Nc1cccc2c1CNCC2)c1ccccc1I ZINC000167378119 565378253 /nfs/dbraw/zinc/37/82/53/565378253.db2.gz GFKSQNQJPFWUJT-UHFFFAOYSA-N 0 3 378.213 3.189 10 0 GGAEHN O=S1(=O)CCC[C@@H](CN2CCC[C@@H]2Cc2ccc(Br)cc2)C1 ZINC000375360432 565383091 /nfs/dbraw/zinc/38/30/91/565383091.db2.gz HWJZGGHJMOCHQV-DOTOQJQBSA-N 0 3 386.355 3.281 10 0 GGAEHN O=C1CCCN1C[C@@H](O)CN[C@H](CC1CC1)c1cc(F)cc(Br)c1 ZINC000188188406 565387569 /nfs/dbraw/zinc/38/75/69/565387569.db2.gz VDBGNLZQBCUNJM-DLBZAZTESA-N 0 3 399.304 3.002 10 0 GGAEHN COCc1nc2n(n1)CCC[C@@H]2N[C@@H](C)Cc1ccc(Br)cc1 ZINC000188248756 565390290 /nfs/dbraw/zinc/39/02/90/565390290.db2.gz OIYRTSWQKJAHJT-WFASDCNBSA-N 0 3 379.302 3.243 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)c2ccc(Oc3cccc(Br)c3)nc2)C1 ZINC000170866159 565395783 /nfs/dbraw/zinc/39/57/83/565395783.db2.gz RUGXZRAJAQECBQ-OAHLLOKOSA-N 0 3 390.281 3.413 10 0 GGAEHN Cc1nn(-c2ccc(C(=O)N3CC[C@@H](N(C)C)C3)cc2)c(C)c1Br ZINC000170866969 565396710 /nfs/dbraw/zinc/39/67/10/565396710.db2.gz LWARZUKVHPWPME-MRXNPFEDSA-N 0 3 391.313 3.028 10 0 GGAEHN COc1c(Br)cc(Br)cc1CNC[C@@H]1[C@H]2COC[C@H]21 ZINC000375804611 565406820 /nfs/dbraw/zinc/40/68/20/565406820.db2.gz IXMFTISOHUAIOO-CNDDSTCGSA-N 0 3 391.103 3.202 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)NC1CCN(C2CC2)CC1 ZINC000188546163 565407539 /nfs/dbraw/zinc/40/75/39/565407539.db2.gz YGHMDMPYKJRLMF-GFCCVEGCSA-N 0 3 396.329 3.445 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)NC1CCN(C2CC2)CC1 ZINC000188546143 565408099 /nfs/dbraw/zinc/40/80/99/565408099.db2.gz YGHMDMPYKJRLMF-LBPRGKRZSA-N 0 3 396.329 3.445 10 0 GGAEHN COc1ccc(-c2n[nH]c(SCCc3cncn3C)n2)cc1Br ZINC000298358417 565410485 /nfs/dbraw/zinc/41/04/85/565410485.db2.gz TVZOMNOOFJUHAR-UHFFFAOYSA-N 0 3 394.298 3.311 10 0 GGAEHN CCOc1cc(C[NH2+]C[C@H](O)c2cccc(OC)c2)cc(Br)c1[O-] ZINC000298547429 565419709 /nfs/dbraw/zinc/41/97/09/565419709.db2.gz UHBPCFAWIDYIJK-INIZCTEOSA-N 0 3 396.281 3.385 10 0 GGAEHN O=C(C1CCN(CCOc2cc(F)cc(Br)c2)CC1)N1CCCC1 ZINC000188767390 565423176 /nfs/dbraw/zinc/42/31/76/565423176.db2.gz KAEVZSUTSBNTGV-UHFFFAOYSA-N 0 3 399.304 3.301 10 0 GGAEHN CCN1CCC[C@H](NC(=O)N(CCCO)Cc2ccc(Cl)c(Cl)c2)C1 ZINC000171316847 565426001 /nfs/dbraw/zinc/42/60/01/565426001.db2.gz VIFNAKAZNYQLOV-HNNXBMFYSA-N 0 3 388.339 3.372 10 0 GGAEHN CCN1CCC[C@H](NC(=O)N[C@@H](C)c2ccc(Br)cc2OC)C1 ZINC000188893017 565430878 /nfs/dbraw/zinc/43/08/78/565430878.db2.gz ITSPCJSLUGIALD-JSGCOSHPSA-N 0 3 384.318 3.302 10 0 GGAEHN CCn1cnnc1[C@@H]1CCCN(CCOc2cc(F)cc(Br)c2)C1 ZINC000188927514 565432747 /nfs/dbraw/zinc/43/27/47/565432747.db2.gz NLJPFMRXZQJQDR-CYBMUJFWSA-N 0 3 397.292 3.458 10 0 GGAEHN COc1cccc(NC(=O)CCN[C@H](CO)c2cccc(Br)c2)c1 ZINC000298888915 565433138 /nfs/dbraw/zinc/43/31/38/565433138.db2.gz KXTNMYDBWFPTIE-QGZVFWFLSA-N 0 3 393.281 3.110 10 0 GGAEHN COc1cc(C[NH2+][C@H](CO)Cc2ccccc2C)cc(Br)c1[O-] ZINC000188940774 565434332 /nfs/dbraw/zinc/43/43/32/565434332.db2.gz XHTUCULOWFEOKX-HNNXBMFYSA-N 0 3 380.282 3.165 10 0 GGAEHN CN1CC[C@H]2[C@H](CCCN2C(=O)C2(c3ccccc3Br)CC2)C1 ZINC000189034041 565439034 /nfs/dbraw/zinc/43/90/34/565439034.db2.gz HUACGBKGYZOPNM-PBHICJAKSA-N 0 3 377.326 3.423 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2csc(Br)c2)n1 ZINC000276244421 565441563 /nfs/dbraw/zinc/44/15/63/565441563.db2.gz QUADOAKVMKDWHU-UHFFFAOYSA-N 0 3 375.313 3.476 10 0 GGAEHN CN1CC[C@@H](NC(=O)Nc2ccncc2Br)[C@H]1c1ccccc1 ZINC000276386382 565447486 /nfs/dbraw/zinc/44/74/86/565447486.db2.gz MJBLYMNPTALLKZ-HZPDHXFCSA-N 0 3 375.270 3.411 10 0 GGAEHN CN1CC[C@@H](NC(=O)Nc2ccncc2Br)[C@@H]1c1ccccc1 ZINC000276386370 565447591 /nfs/dbraw/zinc/44/75/91/565447591.db2.gz MJBLYMNPTALLKZ-CVEARBPZSA-N 0 3 375.270 3.411 10 0 GGAEHN O[C@@H](COc1cccc(Br)c1)CN1CCC([C@H]2CCCO2)CC1 ZINC000189170248 565448979 /nfs/dbraw/zinc/44/89/79/565448979.db2.gz MBTFWIDDFWOXDT-SJLPKXTDSA-N 0 3 384.314 3.080 10 0 GGAEHN O=C(NC[C@H]1CN2CCC[C@@H]2CO1)Nc1cc(Cl)ccc1C(F)(F)F ZINC000376742814 565452147 /nfs/dbraw/zinc/45/21/47/565452147.db2.gz JFLHKZFRDQCVLZ-NEPJUHHUSA-N 0 3 377.794 3.344 10 0 GGAEHN Cc1nc(-c2ccc(CCNC(=O)N3CCN4CCC[C@@H]4C3)s2)cs1 ZINC000171899518 565456292 /nfs/dbraw/zinc/45/62/92/565456292.db2.gz BHRRGEBNKHIHEP-CQSZACIVSA-N 0 3 376.551 3.212 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(OC(F)F)c(Cl)c1 ZINC000171908274 565456361 /nfs/dbraw/zinc/45/63/61/565456361.db2.gz YSGXRSWVLCRYHG-GFCCVEGCSA-N 0 3 377.819 3.174 10 0 GGAEHN O=C(Nc1ccc(N2CCSCC2)c(Cl)c1)N1CCN2CCC[C@@H]2C1 ZINC000171892288 565456914 /nfs/dbraw/zinc/45/69/14/565456914.db2.gz XQNZWMBUOKBFES-OAHLLOKOSA-N 0 3 380.945 3.205 10 0 GGAEHN C[C@H](NC[C@]1(O)CCO[C@H]1C)c1ccc(Br)cc1Br ZINC000300423534 565461811 /nfs/dbraw/zinc/46/18/11/565461811.db2.gz GSWYOPIIHMTTJZ-PKFCDNJMSA-N 0 3 393.119 3.402 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)NC[C@@H]1CCCN(C)C1 ZINC000189489913 565468596 /nfs/dbraw/zinc/46/85/96/565468596.db2.gz MPXBTBGQUBWEAB-STQMWFEESA-N 0 3 384.318 3.160 10 0 GGAEHN O=S(=O)(c1ccc(N2CCCC[C@@H](N3CCCC3)C2)cc1)C(F)(F)F ZINC000301183999 565470763 /nfs/dbraw/zinc/47/07/63/565470763.db2.gz JAYQEBWVUUSCKW-OAHLLOKOSA-N 0 3 376.444 3.435 10 0 GGAEHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)[C@H]1CCCOCC1 ZINC000377463180 565481483 /nfs/dbraw/zinc/48/14/83/565481483.db2.gz HWCPINJWFXXYTA-INIZCTEOSA-N 0 3 383.330 3.156 10 0 GGAEHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)[C@@H]1CCCOCC1 ZINC000377463181 565481633 /nfs/dbraw/zinc/48/16/33/565481633.db2.gz HWCPINJWFXXYTA-MRXNPFEDSA-N 0 3 383.330 3.156 10 0 GGAEHN CN1CCC[C@@H](CNc2cnn(C)c(=O)c2Br)[C@H]1c1cccs1 ZINC000301403118 565483623 /nfs/dbraw/zinc/48/36/23/565483623.db2.gz DORNWIBWOYNBJL-NHYWBVRUSA-N 0 3 397.342 3.099 10 0 GGAEHN CN1CC[C@H](NC(=O)Nc2cncc(Br)c2)[C@@H]1c1ccccc1 ZINC000189749789 565486400 /nfs/dbraw/zinc/48/64/00/565486400.db2.gz LMFGAUDEJWUNAR-HOTGVXAUSA-N 0 3 375.270 3.411 10 0 GGAEHN CN1CC[C@@H](NC(=O)Nc2cncc(Br)c2)[C@@H]1c1ccccc1 ZINC000189749807 565486476 /nfs/dbraw/zinc/48/64/76/565486476.db2.gz LMFGAUDEJWUNAR-CVEARBPZSA-N 0 3 375.270 3.411 10 0 GGAEHN CCCN1CCC(CNS(=O)(=O)c2ccc(CC(F)(F)F)cc2)CC1 ZINC000189925143 565496793 /nfs/dbraw/zinc/49/67/93/565496793.db2.gz XDGYYQUBAQLSBC-UHFFFAOYSA-N 0 3 378.460 3.192 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N[C@H](CN(C)C)c1ccccc1 ZINC000172703465 565500141 /nfs/dbraw/zinc/50/01/41/565500141.db2.gz GUTZDXBWPYBCQV-QGZVFWFLSA-N 0 3 391.309 3.419 10 0 GGAEHN Cc1nc2ccc(Br)cc2c(N2C[C@@H]3[C@H](C2)OCCN3C)c1C ZINC000301687362 565504883 /nfs/dbraw/zinc/50/48/83/565504883.db2.gz XHUVYFQNNIASBI-SJORKVTESA-N 0 3 376.298 3.133 10 0 GGAEHN Brc1ccc2ncnc(NC3CCN([C@H]4CCOC4)CC3)c2c1 ZINC000301726618 565506574 /nfs/dbraw/zinc/50/65/74/565506574.db2.gz QIUBBQMZFAEJTO-AWEZNQCLSA-N 0 3 377.286 3.058 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NCc1ccccc1CN(C)C ZINC000172968775 565517208 /nfs/dbraw/zinc/51/72/08/565517208.db2.gz CTJHMWNOOYNEEA-UHFFFAOYSA-N 0 3 391.309 3.378 10 0 GGAEHN NC(=O)c1c(F)cc(Br)cc1N1CCN(CC2CCCCC2)CC1 ZINC000301922394 565518793 /nfs/dbraw/zinc/51/87/93/565518793.db2.gz DXRPWRVCEGZIFE-UHFFFAOYSA-N 0 3 398.320 3.389 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)CCc2nc3cc(Br)ccc3s2)C1 ZINC000173045697 565522171 /nfs/dbraw/zinc/52/21/71/565522171.db2.gz RUQKDANARRWLBE-LBPRGKRZSA-N 0 3 382.327 3.154 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2cc(Cl)c(OC)c(OC)c2)n1 ZINC000190342712 565524291 /nfs/dbraw/zinc/52/42/91/565524291.db2.gz JJAVUROAZNKGSL-UHFFFAOYSA-N 0 3 384.885 3.323 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2ccc(Br)cc2OC)n1 ZINC000190347238 565524382 /nfs/dbraw/zinc/52/43/82/565524382.db2.gz WAAWCKLEXHCVMO-UHFFFAOYSA-N 0 3 399.310 3.423 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2cc(Br)cs2)n1 ZINC000190350810 565524623 /nfs/dbraw/zinc/52/46/23/565524623.db2.gz OGYJSABILSNBCP-UHFFFAOYSA-N 0 3 375.313 3.476 10 0 GGAEHN CC[C@@H](CN(C)C[C@H](O)CN1CCCC1=O)Oc1ccc(Cl)c(Cl)c1 ZINC000190385016 565527494 /nfs/dbraw/zinc/52/74/94/565527494.db2.gz LINMJVSKQWFXLO-KBPBESRZSA-N 0 3 389.323 3.066 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC[C@H](O)COCc1ccco1 ZINC000190438481 565532039 /nfs/dbraw/zinc/53/20/39/565532039.db2.gz TWOBLEZJRWFXFX-JSGCOSHPSA-N 0 3 384.270 3.279 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC[C@@H](O)COCc1ccco1 ZINC000190438515 565532393 /nfs/dbraw/zinc/53/23/93/565532393.db2.gz TWOBLEZJRWFXFX-GXTWGEPZSA-N 0 3 384.270 3.279 10 0 GGAEHN C[C@@H]1OCCC[C@H]1C(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000190479589 565535375 /nfs/dbraw/zinc/53/53/75/565535375.db2.gz GXERSQCNNCHJKG-WMLDXEAASA-N 0 3 383.330 3.154 10 0 GGAEHN CCc1cnc(NC(=O)N2CC[C@H](CN(C)Cc3scnc3C)C2)s1 ZINC000190504393 565536456 /nfs/dbraw/zinc/53/64/56/565536456.db2.gz BTCWNLGOBMSRRE-CYBMUJFWSA-N 0 3 379.555 3.456 10 0 GGAEHN COc1cc(C)sc1C(=O)N1CC[C@H](CN(C)Cc2scnc2C)C1 ZINC000190515428 565537689 /nfs/dbraw/zinc/53/76/89/565537689.db2.gz DTOXLECAXVNIJB-CQSZACIVSA-N 0 3 379.551 3.424 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)c2coc(Br)c2)C1 ZINC000190521691 565539252 /nfs/dbraw/zinc/53/92/52/565539252.db2.gz NHZAXJLJIUXRDZ-LBPRGKRZSA-N 0 3 398.326 3.401 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)c2ccc(Br)o2)C1 ZINC000190534942 565539702 /nfs/dbraw/zinc/53/97/02/565539702.db2.gz SQUDYLMVUTUFCJ-LBPRGKRZSA-N 0 3 398.326 3.401 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)c2cc(Br)c[nH]2)C1 ZINC000190544420 565541641 /nfs/dbraw/zinc/54/16/41/565541641.db2.gz AXXIYOPWEQCNHN-LBPRGKRZSA-N 0 3 397.342 3.136 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(Cl)c(OC)cc2Cl)[C@H](C)C1 ZINC000173261028 565541918 /nfs/dbraw/zinc/54/19/18/565541918.db2.gz ZZGSLPTWRFYGCO-RISCZKNCSA-N 0 3 395.352 3.353 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(C)cc2Br)[C@H](C)C1 ZINC000173259433 565542126 /nfs/dbraw/zinc/54/21/26/565542126.db2.gz JWLTUQQSKAVLQR-UKRRQHHQSA-N 0 3 389.359 3.108 10 0 GGAEHN C[C@H]1CN(c2ccc3cccc(Br)c3n2)CCN1CC(C)(C)O ZINC000302465516 565542337 /nfs/dbraw/zinc/54/23/37/565542337.db2.gz BHADXWGVBOHAER-ZDUSSCGKSA-N 0 3 378.314 3.279 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)c2occc2Br)C1 ZINC000190571451 565542426 /nfs/dbraw/zinc/54/24/26/565542426.db2.gz HHXGFSDXRSEILV-LBPRGKRZSA-N 0 3 398.326 3.401 10 0 GGAEHN Cc1nc2ccc(Br)cc2c(N2CCN(CCO)[C@@H](C)C2)c1C ZINC000302443737 565542600 /nfs/dbraw/zinc/54/26/00/565542600.db2.gz QZKYJRQRSOJKGY-LBPRGKRZSA-N 0 3 378.314 3.117 10 0 GGAEHN CSc1ccc(Cl)c(C(=O)N2CCCC[C@@H](N3CCN(C)CC3)C2)c1 ZINC000173279594 565543449 /nfs/dbraw/zinc/54/34/49/565543449.db2.gz WMYBHKVBWTXZLO-OAHLLOKOSA-N 0 3 381.973 3.304 10 0 GGAEHN COCC[C@H](COC)NCc1ccc(Br)c(Br)c1 ZINC000385738112 565545792 /nfs/dbraw/zinc/54/57/92/565545792.db2.gz PRKLCTCTSSPSOY-LLVKDONJSA-N 0 3 381.108 3.353 10 0 GGAEHN CN1CCN([C@H]2CCCCN(C(=O)Cc3c(Cl)cccc3Cl)C2)CC1 ZINC000173295160 565545924 /nfs/dbraw/zinc/54/59/24/565545924.db2.gz SEKQCSMKVOXUBX-HNNXBMFYSA-N 0 3 384.351 3.164 10 0 GGAEHN O=S(=O)([N-][C@H]1CC[N@@H+]2CCCC[C@H]12)c1c(Cl)cccc1Br ZINC000385913425 565546774 /nfs/dbraw/zinc/54/67/74/565546774.db2.gz HUYUCAXKQWYJDF-QWHCGFSZSA-N 0 3 393.734 3.008 10 0 GGAEHN O=S(=O)([N-][C@H]1CC[N@H+]2CCCC[C@H]12)c1c(Cl)cccc1Br ZINC000385913425 565546775 /nfs/dbraw/zinc/54/67/75/565546775.db2.gz HUYUCAXKQWYJDF-QWHCGFSZSA-N 0 3 393.734 3.008 10 0 GGAEHN CC(C)[NH+](CC[N-]S(=O)(=O)c1c(Cl)cccc1Br)C(C)C ZINC000385821429 565546918 /nfs/dbraw/zinc/54/69/18/565546918.db2.gz XRFYYPYTJIRZMA-UHFFFAOYSA-N 0 3 397.766 3.500 10 0 GGAEHN CN(Cc1cccnc1)C[C@H]1CCN(C(=O)c2cccc(Br)c2)C1 ZINC000190637687 565548062 /nfs/dbraw/zinc/54/80/62/565548062.db2.gz QCUBHDWLZKTRBA-MRXNPFEDSA-N 0 3 388.309 3.438 10 0 GGAEHN O=C(N[C@H]1CCOc2ccc(Br)cc21)C1CCN(C2CC2)CC1 ZINC000278279501 565548558 /nfs/dbraw/zinc/54/85/58/565548558.db2.gz PWDAYVJKSSEGES-INIZCTEOSA-N 0 3 379.298 3.263 10 0 GGAEHN CN(C)C[C@H]1CN(c2ccnc3c(Cl)cc(Br)cc23)CCO1 ZINC000302725354 565551786 /nfs/dbraw/zinc/55/17/86/565551786.db2.gz JMKJJXPLJBFEIP-LBPRGKRZSA-N 0 3 384.705 3.418 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)NCCc2ccsc2)C1 ZINC000190693511 565552514 /nfs/dbraw/zinc/55/25/14/565552514.db2.gz HQKRXJVBZWSGKQ-MRXNPFEDSA-N 0 3 378.567 3.219 10 0 GGAEHN CCN1CC[C@@H](NC(=O)c2cc(Br)ccc2Br)C1 ZINC000390010967 565554871 /nfs/dbraw/zinc/55/48/71/565554871.db2.gz SNZMTIVSXQIYGI-SNVBAGLBSA-N 0 3 376.092 3.036 10 0 GGAEHN CCN1CC[C@H](NC(=O)c2cc(Br)ccc2Br)C1 ZINC000390010963 565555081 /nfs/dbraw/zinc/55/50/81/565555081.db2.gz SNZMTIVSXQIYGI-JTQLQIEISA-N 0 3 376.092 3.036 10 0 GGAEHN CN1CCC(C(=O)N2CCC[C@@H]2c2ccc(I)cc2)CC1 ZINC000173456357 565558792 /nfs/dbraw/zinc/55/87/92/565558792.db2.gz VBOGNGWTVIWVDJ-MRXNPFEDSA-N 0 3 398.288 3.297 10 0 GGAEHN Cc1cc(N2CCC[C@H](N[C@@H](C)c3cccc(Br)c3)C2=O)n(C)n1 ZINC000173455195 565558895 /nfs/dbraw/zinc/55/88/95/565558895.db2.gz WZEDGSHEIDCLHM-BBRMVZONSA-N 0 3 391.313 3.337 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)C(=O)Nc2cc(Cl)c(F)c(Cl)c2)CCN1C ZINC000190836760 565563166 /nfs/dbraw/zinc/56/31/66/565563166.db2.gz HRJNPZIRLMXTKJ-ONGXEEELSA-N 0 3 376.259 3.012 10 0 GGAEHN C[C@H](CCNCc1cc(Br)cc(Br)c1)[S@](C)=O ZINC000394524216 565571182 /nfs/dbraw/zinc/57/11/82/565571182.db2.gz JQBIRCNDXYVXDT-XLFHBGCDSA-N 0 3 383.149 3.458 10 0 GGAEHN CCN1CCC[C@H](NC(=O)CCNc2ncc(C(F)(F)F)cc2Cl)C1 ZINC000173562386 565567627 /nfs/dbraw/zinc/56/76/27/565567627.db2.gz PIPDOAKDVYPAPJ-LBPRGKRZSA-N 0 3 378.826 3.156 10 0 GGAEHN CCc1nc2n(n1)C[C@H](NCc1cc(Br)c(Cl)s1)CC2 ZINC000190973603 565573812 /nfs/dbraw/zinc/57/38/12/565573812.db2.gz KJAWQEDOAWRNAC-MRVPVSSYSA-N 0 3 375.723 3.423 10 0 GGAEHN Cc1nc(NCC2(O)CCN(Cc3ccccc3)CC2)ccc1Br ZINC000397529336 565575517 /nfs/dbraw/zinc/57/55/17/565575517.db2.gz KEULBIWNVYJSDU-UHFFFAOYSA-N 0 3 390.325 3.013 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NCC(C)(C)N1CCCCC1 ZINC000303971541 565576141 /nfs/dbraw/zinc/57/61/41/565576141.db2.gz STPQPYYOUPANCJ-UHFFFAOYSA-N 0 3 383.330 3.381 10 0 GGAEHN NC[C@@H](NC(=O)c1ccc(Br)c(C(F)(F)F)c1)C(F)(F)F ZINC000401748636 565581926 /nfs/dbraw/zinc/58/19/26/565581926.db2.gz MBYQTNZDJSYCOY-MRVPVSSYSA-N 0 3 379.098 3.087 10 0 GGAEHN CC[NH+](CC)CCC[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000312888131 565583250 /nfs/dbraw/zinc/58/32/50/565583250.db2.gz QNQHRERUPAOEDP-UHFFFAOYSA-N 0 3 383.739 3.113 10 0 GGAEHN CCC[N@H+](CC)CC[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000312936944 565583269 /nfs/dbraw/zinc/58/32/69/565583269.db2.gz ZBDCRFNCZURCEW-UHFFFAOYSA-N 0 3 383.739 3.113 10 0 GGAEHN CCC[N@@H+](CC)CC[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000312936944 565583272 /nfs/dbraw/zinc/58/32/72/565583272.db2.gz ZBDCRFNCZURCEW-UHFFFAOYSA-N 0 3 383.739 3.113 10 0 GGAEHN CN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)c1nscc1Br ZINC000404820066 565583896 /nfs/dbraw/zinc/58/38/96/565583896.db2.gz MGLRSXRJELHRLJ-CQSZACIVSA-N 0 3 394.338 3.500 10 0 GGAEHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1nscc1Br ZINC000404858449 565584225 /nfs/dbraw/zinc/58/42/25/565584225.db2.gz TUICZOCZHRPXMJ-SMDDNHRTSA-N 0 3 380.311 3.156 10 0 GGAEHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1nscc1Br ZINC000404858443 565584365 /nfs/dbraw/zinc/58/43/65/565584365.db2.gz TUICZOCZHRPXMJ-BXUZGUMPSA-N 0 3 380.311 3.156 10 0 GGAEHN O=S(=O)([N-][C@@H]1CC[NH2+]C2(CCC2)C1)c1c(Cl)cccc1Br ZINC000314434081 565586119 /nfs/dbraw/zinc/58/61/19/565586119.db2.gz FXOBFHXIPXONPE-SNVBAGLBSA-N 0 3 393.734 3.056 10 0 GGAEHN C[C@@H]1C[C@@H](NC(=O)N[C@H]2CCOc3c(Br)cccc32)CN1C1CC1 ZINC000407954835 565586991 /nfs/dbraw/zinc/58/69/91/565586991.db2.gz FNYRGRZATBURLX-HSMVNMDESA-N 0 3 394.313 3.197 10 0 GGAEHN CS(=O)(=O)N1CCC[C@H](CN(CCC(F)(F)F)Cc2ccccc2)C1 ZINC000191241827 565590047 /nfs/dbraw/zinc/59/00/47/565590047.db2.gz ZHJUUXDNAFPAKF-MRXNPFEDSA-N 0 3 378.460 3.113 10 0 GGAEHN COc1cccc(N2CC[C@H](CNCc3c(Br)c(C)nn3C)C2)c1 ZINC000279056877 565593585 /nfs/dbraw/zinc/59/35/85/565593585.db2.gz DWQBMBBSOXSSAS-CQSZACIVSA-N 0 3 393.329 3.116 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1S(=O)(=O)c1cc(Cl)sc1Cl ZINC000317511717 565594527 /nfs/dbraw/zinc/59/45/27/565594527.db2.gz NHGPWBQIMHCCOW-NSHDSACASA-N 0 3 377.318 3.302 10 0 GGAEHN O=C(c1n[nH]c2ccc(Br)cc21)N1CCC[C@@H](N2CCCC2)C1 ZINC000408127571 565595339 /nfs/dbraw/zinc/59/53/39/565595339.db2.gz WYOYAKMBVWHXCE-CYBMUJFWSA-N 0 3 377.286 3.026 10 0 GGAEHN C[C@@H](N[C@H]1CCCN(c2cnn(C)c2)C1=O)c1cccc(Br)c1 ZINC000173890667 565596781 /nfs/dbraw/zinc/59/67/81/565596781.db2.gz NAADSGOECBMZOD-WBMJQRKESA-N 0 3 377.286 3.029 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CC[C@H](N2CCCC2)C1 ZINC000191432795 565603760 /nfs/dbraw/zinc/60/37/60/565603760.db2.gz CQMFNHKOFFHLQZ-ZFWWWQNUSA-N 0 3 396.329 3.398 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CCN2CCC[C@@H]2C1 ZINC000191444664 565604716 /nfs/dbraw/zinc/60/47/16/565604716.db2.gz LYWFAOVMUXHARM-GXTWGEPZSA-N 0 3 382.302 3.008 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C ZINC000191441071 565604967 /nfs/dbraw/zinc/60/49/67/565604967.db2.gz LUTRQSMWGYUFJH-YUELXQCFSA-N 0 3 396.329 3.397 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CCC[C@H](N(C)C)C1 ZINC000191439833 565605001 /nfs/dbraw/zinc/60/50/01/565605001.db2.gz VOMQHWVFVBYFSH-OCCSQVGLSA-N 0 3 384.318 3.254 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000191446688 565605261 /nfs/dbraw/zinc/60/52/61/565605261.db2.gz BUYFDBOTJZZZRE-ZFWWWQNUSA-N 0 3 394.313 3.174 10 0 GGAEHN CCOc1cc(CN2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)cc(Br)c1[O-] ZINC000321827369 565606558 /nfs/dbraw/zinc/60/65/58/565606558.db2.gz BQKYAKRTTIIXMK-GDBMZVCRSA-N 0 3 383.330 3.470 10 0 GGAEHN CCOc1cc(CN2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc(Br)c1[O-] ZINC000321827369 565606563 /nfs/dbraw/zinc/60/65/63/565606563.db2.gz BQKYAKRTTIIXMK-GDBMZVCRSA-N 0 3 383.330 3.470 10 0 GGAEHN COc1ccc(Br)c(C(=O)N2CCc3ccccc3[C@H]2CN)c1 ZINC000321838942 565606952 /nfs/dbraw/zinc/60/69/52/565606952.db2.gz HERUXGHRRDKXEA-QGZVFWFLSA-N 0 3 375.266 3.156 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000174075750 565611589 /nfs/dbraw/zinc/61/15/89/565611589.db2.gz PJOSKPFZWMAURW-RHSMWYFYSA-N 0 3 378.314 3.036 10 0 GGAEHN O[C@H](COc1cccc(Br)c1)CN1CCC(c2ccncc2)CC1 ZINC000191677551 565620198 /nfs/dbraw/zinc/62/01/98/565620198.db2.gz WTSHRMSUMCFGBK-SFHVURJKSA-N 0 3 391.309 3.463 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1cccc(Cl)c1Br ZINC000191719083 565624322 /nfs/dbraw/zinc/62/43/22/565624322.db2.gz VDWUTZSHYZGDSJ-LLVKDONJSA-N 0 3 390.709 3.335 10 0 GGAEHN C[C@@H](CCc1ccc(Br)cc1)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000174255873 565625001 /nfs/dbraw/zinc/62/50/01/565625001.db2.gz RVHHWWWEFCITCD-MAUKXSAKSA-N 0 3 392.341 3.426 10 0 GGAEHN O=C(NC[C@@H](O)CN1CCCCC1)Nc1cccc(Cl)c1Br ZINC000191725514 565625747 /nfs/dbraw/zinc/62/57/47/565625747.db2.gz YNHGAGFCUDMVOT-LLVKDONJSA-N 0 3 390.709 3.071 10 0 GGAEHN Cc1cc(N2CCC[C@@H](N[C@H](C)c3ccc(Br)cc3)C2=O)n(C)n1 ZINC000174344441 565630782 /nfs/dbraw/zinc/63/07/82/565630782.db2.gz AGHSOHKOGSPROC-CZUORRHYSA-N 0 3 391.313 3.337 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)NCCc2cc(Br)ccc2F)CCN1C ZINC000174362923 565631011 /nfs/dbraw/zinc/63/10/11/565631011.db2.gz HAGOJXPLKYSYHE-WFASDCNBSA-N 0 3 386.309 3.255 10 0 GGAEHN Cc1cc(N2CCC[C@H](N[C@H](C)c3ccc(Br)cc3)C2=O)n(C)n1 ZINC000174344426 565631184 /nfs/dbraw/zinc/63/11/84/565631184.db2.gz AGHSOHKOGSPROC-CJNGLKHVSA-N 0 3 391.313 3.337 10 0 GGAEHN C[C@H](Cc1cccc(Br)c1)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000174349127 565631314 /nfs/dbraw/zinc/63/13/14/565631314.db2.gz FPWUBQTUXQWVCO-RHSMWYFYSA-N 0 3 378.314 3.036 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)C1(c2cncc(Br)c2)CC1 ZINC000409673779 565632769 /nfs/dbraw/zinc/63/27/69/565632769.db2.gz VINJXWRWGZVBFA-OKILXGFUSA-N 0 3 380.330 3.255 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)C1(c2cncc(Br)c2)CC1 ZINC000409673780 565632826 /nfs/dbraw/zinc/63/28/26/565632826.db2.gz VINJXWRWGZVBFA-ZIAGYGMSSA-N 0 3 380.330 3.255 10 0 GGAEHN C[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCOc3c(Br)cccc32)CCN1C ZINC000409697763 565633493 /nfs/dbraw/zinc/63/34/93/565633493.db2.gz NKQZWEVDNCZURU-TYNCELHUSA-N 0 3 382.302 3.055 10 0 GGAEHN CN(C)C1(CNC(=O)N[C@H]2CCOc3c(Br)cccc32)CCC1 ZINC000409701247 565634562 /nfs/dbraw/zinc/63/45/62/565634562.db2.gz OUGRXRUOKHSADW-AWEZNQCLSA-N 0 3 382.302 3.056 10 0 GGAEHN O=C(NCCCOc1ccc(Cl)cc1Cl)N1CC[C@@H](N2CC=CC2)C1 ZINC000174425093 565634981 /nfs/dbraw/zinc/63/49/81/565634981.db2.gz ZHTCLLKZMHOYNM-OAHLLOKOSA-N 0 3 384.307 3.418 10 0 GGAEHN CCN(CCNC(=O)N[C@@H]1CCOc2c(Br)cccc21)C1CC1 ZINC000409703572 565635023 /nfs/dbraw/zinc/63/50/23/565635023.db2.gz AYGXTIYMXNKVHI-OAHLLOKOSA-N 0 3 382.302 3.056 10 0 GGAEHN C[C@@H](CN1CCCCC1)NC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000409748680 565639133 /nfs/dbraw/zinc/63/91/33/565639133.db2.gz QNKMCKCPDGMPEI-BBRMVZONSA-N 0 3 396.329 3.446 10 0 GGAEHN COc1cc(Cl)c(Cl)cc1NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C ZINC000191963703 565646479 /nfs/dbraw/zinc/64/64/79/565646479.db2.gz VFTDPIDLMASBEY-LLVKDONJSA-N 0 3 390.311 3.033 10 0 GGAEHN C[C@H](NCCC(=O)Nc1cccc(Cl)c1)c1ccc(S(C)(=O)=O)cc1 ZINC000174697489 565652547 /nfs/dbraw/zinc/65/25/47/565652547.db2.gz GMXSBPBADSTCSE-ZDUSSCGKSA-N 0 3 380.897 3.423 10 0 GGAEHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000409979141 565654923 /nfs/dbraw/zinc/65/49/23/565654923.db2.gz JYSQRCQIFKDYFW-XHDPSFHLSA-N 0 3 387.268 3.213 10 0 GGAEHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)Cc1c(F)ccc(Br)c1F ZINC000410004749 565657351 /nfs/dbraw/zinc/65/73/51/565657351.db2.gz SJYYWVFCHNIJMG-NSHDSACASA-N 0 3 389.284 3.459 10 0 GGAEHN C[C@@H](NCCCc1ccccn1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000280208033 565658559 /nfs/dbraw/zinc/65/85/59/565658559.db2.gz TYKMHMWGMABGER-LLVKDONJSA-N 0 3 388.320 3.319 10 0 GGAEHN O=C1[C@H](N2CCC[C@H](c3nc[nH]n3)C2)CCN1c1ccc(Cl)c(Cl)c1 ZINC000329235706 565659794 /nfs/dbraw/zinc/65/97/94/565659794.db2.gz IUCQIJGWKMRBJU-XHDPSFHLSA-N 0 3 380.279 3.096 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000410053153 565661363 /nfs/dbraw/zinc/66/13/63/565661363.db2.gz RREAMVUIQODEDI-BBRMVZONSA-N 0 3 396.329 3.446 10 0 GGAEHN Cn1nc(Br)cc1C(=O)NC[C@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000192136522 565661965 /nfs/dbraw/zinc/66/19/65/565661965.db2.gz RHRZJZSPLGWJTI-ABAIWWIYSA-N 0 3 397.342 3.057 10 0 GGAEHN Cn1nc(Br)cc1C(=O)NC[C@@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000192136516 565662729 /nfs/dbraw/zinc/66/27/29/565662729.db2.gz RHRZJZSPLGWJTI-NHYWBVRUSA-N 0 3 397.342 3.057 10 0 GGAEHN CN1C(=O)C[C@H](NCCOCC(F)(F)C(F)F)[C@@H]1c1ccc(Cl)cc1 ZINC000192158846 565664226 /nfs/dbraw/zinc/66/42/26/565664226.db2.gz XPWSEXPZBZGGAQ-JSGCOSHPSA-N 0 3 382.785 3.118 10 0 GGAEHN CN1C(=O)C[C@@H](NCCOCC(F)(F)C(F)F)[C@H]1c1ccc(Cl)cc1 ZINC000192158830 565664276 /nfs/dbraw/zinc/66/42/76/565664276.db2.gz XPWSEXPZBZGGAQ-TZMCWYRMSA-N 0 3 382.785 3.118 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)N[C@@H]1C[C@H]1c1ccccc1Br ZINC000280418641 565671055 /nfs/dbraw/zinc/67/10/55/565671055.db2.gz AHORFLJXQKNOIE-UOJCXKCYSA-N 0 3 380.330 3.287 10 0 GGAEHN C[C@H](NC[C@]1(C)CCCS1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280556879 565680288 /nfs/dbraw/zinc/68/02/88/565680288.db2.gz JHMIJUGECSJRHM-HZMBPMFUSA-N 0 3 393.372 3.033 10 0 GGAEHN CCSCC[C@@H](C)N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280564312 565681084 /nfs/dbraw/zinc/68/10/84/565681084.db2.gz JULGOJFOESRXHA-GHMZBOCLSA-N 0 3 395.388 3.279 10 0 GGAEHN CCSCC[C@@H](C)N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280564316 565681220 /nfs/dbraw/zinc/68/12/20/565681220.db2.gz JULGOJFOESRXHA-MNOVXSKESA-N 0 3 395.388 3.279 10 0 GGAEHN CCSCC[C@H](C)N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280564321 565681502 /nfs/dbraw/zinc/68/15/02/565681502.db2.gz JULGOJFOESRXHA-QWRGUYRKSA-N 0 3 395.388 3.279 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)Nc1cccc(C(=O)OC)c1Br ZINC000192424779 565689851 /nfs/dbraw/zinc/68/98/51/565689851.db2.gz NWIJEBLIUAMAJH-LBPRGKRZSA-N 0 3 398.301 3.184 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2C)[C@H](C)C1 ZINC000175305548 565692330 /nfs/dbraw/zinc/69/23/30/565692330.db2.gz CCKGUALUAAGPSW-UKRRQHHQSA-N 0 3 378.460 3.365 10 0 GGAEHN CC(C)N1CCC[C@@H](NC2(c3ccc(Br)cc3)CCOCC2)C1=O ZINC000192638018 565703288 /nfs/dbraw/zinc/70/32/88/565703288.db2.gz DBTAHRTZCWOZLW-QGZVFWFLSA-N 0 3 395.341 3.444 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)N[C@H]1CCC[C@@H](S(C)(=O)=O)C1 ZINC000330493503 565708660 /nfs/dbraw/zinc/70/86/60/565708660.db2.gz MUCHPNQTLCAXSI-FPMFFAJLSA-N 0 3 390.343 3.464 10 0 GGAEHN CNC(=O)CN1CCC(N[C@@H](C)c2cc3cc(Br)ccc3o2)CC1 ZINC000192753459 565708951 /nfs/dbraw/zinc/70/89/51/565708951.db2.gz KVXQGAAUKFZCBD-LBPRGKRZSA-N 0 3 394.313 3.056 10 0 GGAEHN CC(C)C(=O)N1CCC(N[C@@H](C)C(=O)Nc2ccc(Br)cc2)CC1 ZINC000192884020 565716661 /nfs/dbraw/zinc/71/66/61/565716661.db2.gz ILJJNDJJLQAFAO-ZDUSSCGKSA-N 0 3 396.329 3.013 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)N[C@@H]2C[C@H]2c2ccc(Br)cc2)CCN1C ZINC000281181738 565717024 /nfs/dbraw/zinc/71/70/24/565717024.db2.gz FFHQSJJEFWANSG-NKKGCODLSA-N 0 3 380.330 3.429 10 0 GGAEHN CC(C)C(=O)N1CCC(N[C@@H](C)C(=O)Nc2ccccc2Br)CC1 ZINC000192887570 565717709 /nfs/dbraw/zinc/71/77/09/565717709.db2.gz JUMGLNNODPPQPF-ZDUSSCGKSA-N 0 3 396.329 3.013 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(S(=O)(=O)c2ccc(Cl)cc2)C1 ZINC000192932825 565719537 /nfs/dbraw/zinc/71/95/37/565719537.db2.gz KGPBUZOHQSZPSN-CQSZACIVSA-N 0 3 399.969 3.248 10 0 GGAEHN O=C(CCNC1(CO)Cc2ccccc2C1)Nc1cc(Cl)ccc1Cl ZINC000411285656 565722897 /nfs/dbraw/zinc/72/28/97/565722897.db2.gz VLQJAEJRVSGIID-UHFFFAOYSA-N 0 3 379.287 3.442 10 0 GGAEHN Cc1nc(C(=O)N[C@H](Cc2ccccc2)CN(C)C)c(Br)s1 ZINC000411550049 565735720 /nfs/dbraw/zinc/73/57/20/565735720.db2.gz IZZPHNHINCERIN-CYBMUJFWSA-N 0 3 382.327 3.117 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)C(=O)Nc2cc(Cl)c(Cl)cc2F)CCN1C ZINC000281528048 565735940 /nfs/dbraw/zinc/73/59/40/565735940.db2.gz SUXKCCYZUCWJNX-NXEZZACHSA-N 0 3 376.259 3.012 10 0 GGAEHN Cc1ccsc1[C@@H](CO)NCCC(=O)Nc1ccccc1Br ZINC000411572448 565737035 /nfs/dbraw/zinc/73/70/35/565737035.db2.gz QVWQSVZIBWSNIY-CQSZACIVSA-N 0 3 383.311 3.471 10 0 GGAEHN C[C@H](CNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1)Oc1ccccc1Br ZINC000175975790 565737897 /nfs/dbraw/zinc/73/78/97/565737897.db2.gz NWFJYSOMKJAKIX-ZNMIVQPWSA-N 0 3 398.345 3.341 10 0 GGAEHN O=C(CNC1(c2ccc(Br)cc2)CCOCC1)N1CCCCC1 ZINC000193352089 565747424 /nfs/dbraw/zinc/74/74/24/565747424.db2.gz RPQMBMVZKFYFST-UHFFFAOYSA-N 0 3 381.314 3.057 10 0 GGAEHN C[C@@](CO)(NCCC(=O)Nc1ccccc1F)c1ccc(Br)cc1 ZINC000411723122 565748536 /nfs/dbraw/zinc/74/85/36/565748536.db2.gz WNYIFDKYVRJMOG-SFHVURJKSA-N 0 3 395.272 3.414 10 0 GGAEHN Cc1nc([C@@H](C)N2CC[C@H](Cc3cccc(I)c3)C2)n[nH]1 ZINC000411776818 565751967 /nfs/dbraw/zinc/75/19/67/565751967.db2.gz XYZXHZJYVLVXSY-BXUZGUMPSA-N 0 3 396.276 3.343 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)Nc1ccccc1I ZINC000176251801 565759514 /nfs/dbraw/zinc/75/95/14/565759514.db2.gz XKCMPPHRMRQRHZ-LBPRGKRZSA-N 0 3 387.265 3.239 10 0 GGAEHN CCN1CCC(NC(=O)N[C@H]2CCOc3c(Br)cccc32)CC1 ZINC000281992548 565759525 /nfs/dbraw/zinc/75/95/25/565759525.db2.gz SXAAPJBJILXPFV-HNNXBMFYSA-N 0 3 382.302 3.056 10 0 GGAEHN C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccccc1CSC1=NCCS1 ZINC000176307865 565763476 /nfs/dbraw/zinc/76/34/76/565763476.db2.gz AANAABMXVAPOPY-GDBMZVCRSA-N 0 3 375.563 3.331 10 0 GGAEHN CC(C)N(Cc1cc(Br)cc2cccnc21)C[C@@H]1CCC(=O)N1 ZINC000412071835 565768917 /nfs/dbraw/zinc/76/89/17/565768917.db2.gz IHHGHHCGEONALZ-INIZCTEOSA-N 0 3 376.298 3.486 10 0 GGAEHN CC(C)N(Cc1cc(Br)cc2cccnc21)C[C@H]1CCC(=O)N1 ZINC000412071836 565769753 /nfs/dbraw/zinc/76/97/53/565769753.db2.gz IHHGHHCGEONALZ-MRXNPFEDSA-N 0 3 376.298 3.486 10 0 GGAEHN COC(=O)[C@]1(C)CCCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000412111387 565771159 /nfs/dbraw/zinc/77/11/59/565771159.db2.gz VWPLUUQCIIWJQS-SJKOYZFVSA-N 0 3 376.280 3.008 10 0 GGAEHN CC(C)(C)CCN1CCN(C[C@@H](O)COc2cccc(Br)c2)CC1 ZINC000193825679 565778167 /nfs/dbraw/zinc/77/81/67/565778167.db2.gz CDOLONXWJZBQNE-QGZVFWFLSA-N 0 3 399.373 3.243 10 0 GGAEHN CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)CSCC(=O)c1ccc(Cl)cc1 ZINC000176517047 565779487 /nfs/dbraw/zinc/77/94/87/565779487.db2.gz PIOGZNGZDSCQQV-IAGOWNOFSA-N 0 3 380.941 3.341 10 0 GGAEHN COc1c(Br)cccc1CNC[C@H]1CCC2(CCOCC2)[C@H]1O ZINC000282580184 565787153 /nfs/dbraw/zinc/78/71/53/565787153.db2.gz BIMQSRYKWRGRJQ-PBHICJAKSA-N 0 3 384.314 3.115 10 0 GGAEHN C[C@H](NCC1(OCCO)CCOCC1)c1cc2cc(Br)ccc2o1 ZINC000282737412 565794563 /nfs/dbraw/zinc/79/45/63/565794563.db2.gz MYGOKDDCFYDPMG-ZDUSSCGKSA-N 0 3 398.297 3.404 10 0 GGAEHN COc1ccc(Br)cc1CNC[C@H]1CCC2(CCOCC2)[C@H]1O ZINC000282903116 565802147 /nfs/dbraw/zinc/80/21/47/565802147.db2.gz UKHBHFRHKHFXOK-DYVFJYSZSA-N 0 3 384.314 3.115 10 0 GGAEHN C[C@H]1CN(C)CC[C@@H]1N(C)S(=O)(=O)c1c(Cl)cccc1Br ZINC000282936390 565804159 /nfs/dbraw/zinc/80/41/59/565804159.db2.gz IJELOEHSJZOHJP-GWCFXTLKSA-N 0 3 395.750 3.063 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)Nc2nnc(SCc3ccccc3)s2)C1 ZINC000194320542 565808102 /nfs/dbraw/zinc/80/81/02/565808102.db2.gz USBDIEBKEFZFNR-CQSZACIVSA-N 0 3 377.539 3.436 10 0 GGAEHN CCN1CCC[C@H](NC(=O)Nc2nnc(SCc3ccccc3)s2)C1 ZINC000194320527 565808330 /nfs/dbraw/zinc/80/83/30/565808330.db2.gz USBDIEBKEFZFNR-AWEZNQCLSA-N 0 3 377.539 3.436 10 0 GGAEHN C[C@@H]1COCC[C@H]1C(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000194353703 565810106 /nfs/dbraw/zinc/81/01/06/565810106.db2.gz LESGAHKAMAFXGI-RHSMWYFYSA-N 0 3 383.330 3.012 10 0 GGAEHN C[C@@H]1COCC[C@@H]1C(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000194353682 565810682 /nfs/dbraw/zinc/81/06/82/565810682.db2.gz LESGAHKAMAFXGI-PBHICJAKSA-N 0 3 383.330 3.012 10 0 GGAEHN C[C@H](NC[C@@H]1CCC2(CCOCC2)[C@H]1O)c1cc(Br)ncc1F ZINC000283197417 565812322 /nfs/dbraw/zinc/81/23/22/565812322.db2.gz LDECZJGTUADQOC-MKBNYLNASA-N 0 3 387.293 3.202 10 0 GGAEHN C[C@H](NC[C@@H]1CCC2(CCOCC2)[C@@H]1O)c1cc(Br)ncc1F ZINC000283197420 565812828 /nfs/dbraw/zinc/81/28/28/565812828.db2.gz LDECZJGTUADQOC-MQIPJXDCSA-N 0 3 387.293 3.202 10 0 GGAEHN CCN(CC)C(=O)[C@H]1CCCN1CCC(=O)Nc1ccc(Br)cc1 ZINC000194403298 565813230 /nfs/dbraw/zinc/81/32/30/565813230.db2.gz GJJKREBYUOJQTM-MRXNPFEDSA-N 0 3 396.329 3.111 10 0 GGAEHN C[C@H](NC[C@H]1CCC2(CCOCC2)[C@@H]1O)c1cc(Br)ncc1F ZINC000283197414 565813336 /nfs/dbraw/zinc/81/33/36/565813336.db2.gz LDECZJGTUADQOC-HWWQOWPSSA-N 0 3 387.293 3.202 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)c1ccn(-c2cccc(Br)c2)n1 ZINC000176971842 565819815 /nfs/dbraw/zinc/81/98/15/565819815.db2.gz GHNVSIGFACGYEP-INIZCTEOSA-N 0 3 391.313 3.191 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)c1cnn(-c2cccc(Br)c2)c1 ZINC000177003638 565821630 /nfs/dbraw/zinc/82/16/30/565821630.db2.gz AJXFRRPCSXMMEQ-QGZVFWFLSA-N 0 3 391.313 3.191 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N(C)C[C@H]2CCCN2CC)cc1OC ZINC000177006728 565821847 /nfs/dbraw/zinc/82/18/47/565821847.db2.gz UXBJMSXONZHYNN-CQSZACIVSA-N 0 3 399.329 3.413 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)c1cc(OC)c(Br)c(OC)c1 ZINC000176995747 565821877 /nfs/dbraw/zinc/82/18/77/565821877.db2.gz OOGPBFSGWLDHHX-ZDUSSCGKSA-N 0 3 385.302 3.023 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)CCc1ccc(OC)c(Br)c1 ZINC000177019886 565823058 /nfs/dbraw/zinc/82/30/58/565823058.db2.gz VCLFHPVYISWWBK-HNNXBMFYSA-N 0 3 383.330 3.333 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)c1[nH]nc(-c2ccccc2)c1Br ZINC000177032221 565824113 /nfs/dbraw/zinc/82/41/13/565824113.db2.gz HVAXZAOVFNGSAX-CQSZACIVSA-N 0 3 391.313 3.396 10 0 GGAEHN Cc1cc(N2CCC[C@H](NCc3ccc(Br)cc3C)C2=O)n(C)n1 ZINC000177112342 565829386 /nfs/dbraw/zinc/82/93/86/565829386.db2.gz GQEJBQOLBVLZOG-INIZCTEOSA-N 0 3 391.313 3.085 10 0 GGAEHN Cc1cc(N2CCC[C@@H](NCc3ccc(Br)cc3C)C2=O)n(C)n1 ZINC000177112322 565829838 /nfs/dbraw/zinc/82/98/38/565829838.db2.gz GQEJBQOLBVLZOG-MRXNPFEDSA-N 0 3 391.313 3.085 10 0 GGAEHN CC(C)(C)[C@@H](O)C[C@@H](CO)NCc1ccc(Br)c2cccnc12 ZINC000283826793 565832346 /nfs/dbraw/zinc/83/23/46/565832346.db2.gz DRQGTUGAEPMHSV-BBRMVZONSA-N 0 3 381.314 3.245 10 0 GGAEHN CC(C)(C)[C@@H](O)C[C@H](CO)NCc1ccc(Br)c2cccnc12 ZINC000283826794 565832499 /nfs/dbraw/zinc/83/24/99/565832499.db2.gz DRQGTUGAEPMHSV-CJNGLKHVSA-N 0 3 381.314 3.245 10 0 GGAEHN CC(C)(C)[C@H](O)C[C@@H](CO)NCc1ccc(Br)c2cccnc12 ZINC000283826796 565832739 /nfs/dbraw/zinc/83/27/39/565832739.db2.gz DRQGTUGAEPMHSV-XJKSGUPXSA-N 0 3 381.314 3.245 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)Nc2ccc(F)cc2I)C1 ZINC000177279263 565841078 /nfs/dbraw/zinc/84/10/78/565841078.db2.gz DBZMSNVMNCZKMP-LLVKDONJSA-N 0 3 391.228 3.036 10 0 GGAEHN CN(CC1CCN(C[C@H](O)c2ccccc2)CC1)C(=O)[C@H]1CC1(Cl)Cl ZINC000177467555 565852433 /nfs/dbraw/zinc/85/24/33/565852433.db2.gz IWBMGUBZZQIDDT-SJORKVTESA-N 0 3 385.335 3.084 10 0 GGAEHN CC[C@H](C(=O)N1CCC[C@@H]1c1ccccc1I)N(C)C ZINC000413450406 565852634 /nfs/dbraw/zinc/85/26/34/565852634.db2.gz FYRUYEZPVFBSKX-HUUCEWRRSA-N 0 3 386.277 3.295 10 0 GGAEHN CN(CC1CCN(C[C@H](O)c2ccccc2)CC1)C(=O)[C@@H]1CC1(Cl)Cl ZINC000177467519 565852837 /nfs/dbraw/zinc/85/28/37/565852837.db2.gz IWBMGUBZZQIDDT-IRXDYDNUSA-N 0 3 385.335 3.084 10 0 GGAEHN C[C@@H]1CCN(C(=O)c2[nH]nc3ccc(Br)cc32)C[C@@H]1n1ccnc1 ZINC000177486323 565854978 /nfs/dbraw/zinc/85/49/78/565854978.db2.gz LHYIOEHRZVSJKX-ABAIWWIYSA-N 0 3 388.269 3.245 10 0 GGAEHN CC[C@@H](C(=O)N1CCC[C@H]1c1ccc(I)cc1)N(C)C ZINC000413528047 565858269 /nfs/dbraw/zinc/85/82/69/565858269.db2.gz CXAVNXAAMLLJSG-GJZGRUSLSA-N 0 3 386.277 3.295 10 0 GGAEHN OC1(CNc2cc(Br)ccn2)CCN(Cc2ccccc2)CC1 ZINC000413582309 565861964 /nfs/dbraw/zinc/86/19/64/565861964.db2.gz MPEMJWRJNDUGGR-UHFFFAOYSA-N 0 3 376.298 3.283 10 0 GGAEHN O=C(NCc1cc(Cl)cc(Br)c1)N1CC[C@@H](N2CC=CC2)C1 ZINC000413697490 565867657 /nfs/dbraw/zinc/86/76/57/565867657.db2.gz GJDRINIERMXGDJ-OAHLLOKOSA-N 0 3 384.705 3.258 10 0 GGAEHN CCN1CCC[C@H]1CN(C)CC(=O)Nc1c(F)cc(F)cc1Br ZINC000177709435 565869328 /nfs/dbraw/zinc/86/93/28/565869328.db2.gz YSARGMFWQSIBBD-LBPRGKRZSA-N 0 3 390.272 3.082 10 0 GGAEHN COC(=O)c1sccc1CN1CC[C@H](CN(C)Cc2scnc2C)C1 ZINC000195260954 565870729 /nfs/dbraw/zinc/87/07/29/565870729.db2.gz JAXFNNFWWXYUEF-CQSZACIVSA-N 0 3 379.551 3.254 10 0 GGAEHN C[C@H](Cn1cc(Br)cn1)N[C@H](C)c1ccc(N2CCOC2=O)cc1 ZINC000177754119 565871261 /nfs/dbraw/zinc/87/12/61/565871261.db2.gz QMNCMHUIVQMSOX-CHWSQXEVSA-N 0 3 393.285 3.342 10 0 GGAEHN Brc1cccc(Cc2noc(CN3CCN4CCCC[C@@H]4C3)n2)c1 ZINC000177755906 565871285 /nfs/dbraw/zinc/87/12/85/565871285.db2.gz UANAIVGLMFHAOG-MRXNPFEDSA-N 0 3 391.313 3.093 10 0 GGAEHN O=C(COc1ccc(C2SCCCS2)cc1)N1CCN2CCC[C@@H]2C1 ZINC000195318976 565875561 /nfs/dbraw/zinc/87/55/61/565875561.db2.gz RBIKPKUZYIWIIP-MRXNPFEDSA-N 0 3 378.563 3.241 10 0 GGAEHN C[C@@H](N[C@@H](CO)c1cccc(Br)c1)C1CN(C(=O)OC(C)(C)C)C1 ZINC000284912390 565876552 /nfs/dbraw/zinc/87/65/52/565876552.db2.gz CQOXEEFNWKRILC-WBMJQRKESA-N 0 3 399.329 3.328 10 0 GGAEHN C[C@@H](NC(=O)CN1CCC(c2ccn[nH]2)CC1)c1ccc(Br)cc1 ZINC000195506187 565888886 /nfs/dbraw/zinc/88/88/86/565888886.db2.gz ZDZJVKNOJNXXLP-CYBMUJFWSA-N 0 3 391.313 3.229 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1ccc(Br)c(F)c1 ZINC000195717283 565892167 /nfs/dbraw/zinc/89/21/67/565892167.db2.gz RHJCOFOHEIAESM-OAHLLOKOSA-N 0 3 379.273 3.491 10 0 GGAEHN CC(=O)Nc1cccc([C@@H](C)N[C@H](C)Cn2cc(Br)ccc2=O)c1 ZINC000414063086 565892294 /nfs/dbraw/zinc/89/22/94/565892294.db2.gz MEYSSVHIZDBOGK-CHWSQXEVSA-N 0 3 392.297 3.309 10 0 GGAEHN COc1ccc([C@H](C)NCc2cccnc2-n2cncn2)cc1Br ZINC000178047997 565892473 /nfs/dbraw/zinc/89/24/73/565892473.db2.gz RDULFIOSRYECFE-LBPRGKRZSA-N 0 3 388.269 3.284 10 0 GGAEHN Cc1ccc2c(c1C)OC[C@@H]2N[C@H](C)Cn1cc(Br)ccc1=O ZINC000414068564 565892665 /nfs/dbraw/zinc/89/26/65/565892665.db2.gz BFZOPLZFIBHALN-WBMJQRKESA-N 0 3 377.282 3.339 10 0 GGAEHN Cc1ccc2c(c1C)OC[C@H]2N[C@H](C)Cn1cc(Br)ccc1=O ZINC000414068563 565892796 /nfs/dbraw/zinc/89/27/96/565892796.db2.gz BFZOPLZFIBHALN-MLGOLLRUSA-N 0 3 377.282 3.339 10 0 GGAEHN CCCCCn1cc(CN[C@H](C)Cn2cc(Br)ccc2=O)c(C)n1 ZINC000414087839 565893338 /nfs/dbraw/zinc/89/33/38/565893338.db2.gz ALAVHIADLDMICF-CQSZACIVSA-N 0 3 395.345 3.484 10 0 GGAEHN CCCCCn1cc(CN[C@@H](C)Cn2cc(Br)ccc2=O)c(C)n1 ZINC000414087837 565893388 /nfs/dbraw/zinc/89/33/88/565893388.db2.gz ALAVHIADLDMICF-AWEZNQCLSA-N 0 3 395.345 3.484 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000414092021 565894158 /nfs/dbraw/zinc/89/41/58/565894158.db2.gz DSGYUKXXQIHOMC-HEWAKGLMSA-N 0 3 397.338 3.088 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NCCOCc1ccc(Cl)cc1 ZINC000414094814 565894606 /nfs/dbraw/zinc/89/46/06/565894606.db2.gz HCJVFZQSWWILCS-ZDUSSCGKSA-N 0 3 399.716 3.459 10 0 GGAEHN COc1ccc(C2(N[C@H](C)Cn3cc(Br)ccc3=O)CC2)cc1 ZINC000414096689 565894637 /nfs/dbraw/zinc/89/46/37/565894637.db2.gz MHUQWZYMYXIACD-CYBMUJFWSA-N 0 3 377.282 3.287 10 0 GGAEHN CCCCn1cc(CN[C@@H](C)Cn2cc(Br)ccc2=O)c(C)n1 ZINC000414093160 565894871 /nfs/dbraw/zinc/89/48/71/565894871.db2.gz FONVJACJDZNHHX-ZDUSSCGKSA-N 0 3 381.318 3.094 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)Nc1cccc(OCCN(C)C)c1 ZINC000414106831 565895263 /nfs/dbraw/zinc/89/52/63/565895263.db2.gz JAXGKFKJHNEOOC-CQSZACIVSA-N 0 3 394.313 3.052 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NCc1ccc(OC(C)(C)C)nc1 ZINC000414106259 565895339 /nfs/dbraw/zinc/89/53/39/565895339.db2.gz IJDZFEGOTLZIBH-CYBMUJFWSA-N 0 3 394.313 3.361 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NC[C@]1(C)OCCc2sccc21 ZINC000414140954 565897612 /nfs/dbraw/zinc/89/76/12/565897612.db2.gz HZRWRAJXMOIKQY-PXAZEXFGSA-N 0 3 397.338 3.139 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NC[C@@]1(C)OCCc2sccc21 ZINC000414140961 565899021 /nfs/dbraw/zinc/89/90/21/565899021.db2.gz HZRWRAJXMOIKQY-YVEFUNNKSA-N 0 3 397.338 3.139 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NCc1ccnc(C(F)(F)F)c1 ZINC000414155015 565899632 /nfs/dbraw/zinc/89/96/32/565899632.db2.gz UTVDIPVMMQQSEG-JTQLQIEISA-N 0 3 390.203 3.203 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000414162903 565900618 /nfs/dbraw/zinc/90/06/18/565900618.db2.gz MKUQNOVDZITWKO-DYVFJYSZSA-N 0 3 396.304 3.031 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000414162902 565900798 /nfs/dbraw/zinc/90/07/98/565900798.db2.gz MKUQNOVDZITWKO-CXAGYDPISA-N 0 3 396.304 3.031 10 0 GGAEHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC[C@H](O)Cn1ccnn1 ZINC000414172340 565900824 /nfs/dbraw/zinc/90/08/24/565900824.db2.gz DXCDJLZYYACKAB-ABAIWWIYSA-N 0 3 377.901 3.075 10 0 GGAEHN O=C(c1ccc(Br)cc1Br)N1CCN2CCC[C@@H]2C1 ZINC000218773978 565901026 /nfs/dbraw/zinc/90/10/26/565901026.db2.gz XGLKFOHBBVBHKH-LLVKDONJSA-N 0 3 388.103 3.132 10 0 GGAEHN Cc1cc([C@H](NC[C@@H](O)Cn2ccnn2)c2cccc(Cl)c2)c(C)s1 ZINC000414203539 565902665 /nfs/dbraw/zinc/90/26/65/565902665.db2.gz ZKEKXIJBIYTTLK-SJLPKXTDSA-N 0 3 376.913 3.350 10 0 GGAEHN O[C@@H](CN[C@@H](c1sccc1Br)C1CCCCC1)Cn1ccnn1 ZINC000414198106 565902964 /nfs/dbraw/zinc/90/29/64/565902964.db2.gz WBAPVBPQCFRCHL-DZGCQCFKSA-N 0 3 399.358 3.374 10 0 GGAEHN Cc1cc([C@H](NC[C@H](O)Cn2ccnn2)c2cccc(Cl)c2)c(C)s1 ZINC000414203537 565903129 /nfs/dbraw/zinc/90/31/29/565903129.db2.gz ZKEKXIJBIYTTLK-FUHWJXTLSA-N 0 3 376.913 3.350 10 0 GGAEHN C[C@@H](NC[C@@]1(O)CCOC1)c1ccc(Br)cc1Br ZINC000222427364 565904488 /nfs/dbraw/zinc/90/44/88/565904488.db2.gz ODGFYOWWHPGYML-RNCFNFMXSA-N 0 3 379.092 3.014 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NCc1cnccc1C(C)(C)C ZINC000414228466 565905366 /nfs/dbraw/zinc/90/53/66/565905366.db2.gz LYEJKPUTPBOXRS-ZDUSSCGKSA-N 0 3 378.314 3.482 10 0 GGAEHN COC[C@@H](O)CCN[C@@H](C)c1ccc(Br)cc1Br ZINC000222708969 565905978 /nfs/dbraw/zinc/90/59/78/565905978.db2.gz KWXHHCNWBBEOHZ-ONGXEEELSA-N 0 3 381.108 3.260 10 0 GGAEHN Cc1ccccc1[C@@H](C)NCc1ccc(S(N)(=O)=O)c(Br)c1 ZINC000414274882 565907427 /nfs/dbraw/zinc/90/74/27/565907427.db2.gz SLGSNZDQZCQGLH-GFCCVEGCSA-N 0 3 383.311 3.256 10 0 GGAEHN CC(C)(CCN[C@H]1CCCOc2ccc(Br)cc21)S(C)(=O)=O ZINC000414271130 565907476 /nfs/dbraw/zinc/90/74/76/565907476.db2.gz WATNCOMETBKESJ-AWEZNQCLSA-N 0 3 390.343 3.466 10 0 GGAEHN CS(=O)(=O)c1ccccc1CN[C@H]1CCc2cccc(Br)c2C1 ZINC000414271672 565907517 /nfs/dbraw/zinc/90/75/17/565907517.db2.gz ZXUVKKKILIJMFX-HNNXBMFYSA-N 0 3 394.334 3.500 10 0 GGAEHN C[C@H](c1cccc(Br)c1)N1CCC[C@H](C(=O)N2CCOCC2)C1 ZINC000178273965 565909750 /nfs/dbraw/zinc/90/97/50/565909750.db2.gz KUAVDWKLEVNGQI-ZBFHGGJFSA-N 0 3 381.314 3.081 10 0 GGAEHN C[C@@H](c1cccc(Br)c1)N1CCC[C@H](C(=O)N2CCOCC2)C1 ZINC000178273950 565909883 /nfs/dbraw/zinc/90/98/83/565909883.db2.gz KUAVDWKLEVNGQI-HOCLYGCPSA-N 0 3 381.314 3.081 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1Cc1cc2c(cc1Br)OCCO2 ZINC000178287340 565911114 /nfs/dbraw/zinc/91/11/14/565911114.db2.gz IJWNXNVKCGGLCF-HNNXBMFYSA-N 0 3 392.297 3.390 10 0 GGAEHN CS(=O)(=O)CC1(CN[C@@H]2CCc3c2ccc(F)c3Br)CCC1 ZINC000414338048 565912375 /nfs/dbraw/zinc/91/23/75/565912375.db2.gz YBDSHBTVKQJTNB-CQSZACIVSA-N 0 3 390.318 3.380 10 0 GGAEHN C[C@@H]1Cc2ccccc2[C@H]1NCc1ccc(S(N)(=O)=O)c(Br)c1 ZINC000414350575 565913938 /nfs/dbraw/zinc/91/39/38/565913938.db2.gz LTKBMBJYZYFMAY-DIFFPNOSSA-N 0 3 395.322 3.120 10 0 GGAEHN CN1CC[C@@H](NCc2ccc(S(C)(=O)=O)s2)[C@H]1c1ccc(Cl)cc1 ZINC000414362232 565916493 /nfs/dbraw/zinc/91/64/93/565916493.db2.gz DQFUROKBARIKHF-NVXWUHKLSA-N 0 3 384.954 3.340 10 0 GGAEHN Cc1nc2n(n1)C[C@@H](N[C@@H]1CCCOc3ccc(Br)cc31)CC2 ZINC000178506353 565922742 /nfs/dbraw/zinc/92/27/42/565922742.db2.gz ZDYSJIWSTQOAAB-DZGCQCFKSA-N 0 3 377.286 3.167 10 0 GGAEHN CC(C)(C)OC[C@H](O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000178513580 565922927 /nfs/dbraw/zinc/92/29/27/565922927.db2.gz XYAXVNBXZQATNE-MRXNPFEDSA-N 0 3 386.330 3.220 10 0 GGAEHN Cc1ccc(F)c(CS(=O)(=O)C(C)C(=O)NCc2ccc(Cl)cc2)c1 ZINC000414427138 565929792 /nfs/dbraw/zinc/92/97/92/565929792.db2.gz QUBNQTQSOAHSIA-ZDUSSCGKSA-N 0 3 383.872 3.407 10 0 GGAEHN COc1ccc(CNC[C@H]2CCC3(CCOCC3)[C@@H]2O)c(Br)c1 ZINC000285932121 565933638 /nfs/dbraw/zinc/93/36/38/565933638.db2.gz LUMZPICXBQVDRH-RHSMWYFYSA-N 0 3 384.314 3.115 10 0 GGAEHN CN(CCOCCN(C)Cc1ccc(Cl)nc1)Cc1ccc(Cl)nc1 ZINC000178710331 565934092 /nfs/dbraw/zinc/93/40/92/565934092.db2.gz PWXAITKAPVVYED-UHFFFAOYSA-N 0 3 383.323 3.364 10 0 GGAEHN Cc1ccc(CN2CC[C@@H](Cc3cccc(I)c3)C2)nn1 ZINC000414459123 565936620 /nfs/dbraw/zinc/93/66/20/565936620.db2.gz OEMCSERLXISGAU-HNNXBMFYSA-N 0 3 393.272 3.454 10 0 GGAEHN Cc1cc(C)n2c(CNCCOc3cccc(Br)c3)cnc2n1 ZINC000178880993 565944253 /nfs/dbraw/zinc/94/42/53/565944253.db2.gz WTTCKBADULTJRG-UHFFFAOYSA-N 0 3 375.270 3.277 10 0 GGAEHN COc1cc(C[NH2+]C[C@@H](CO)c2ccc(F)cc2)cc(Br)c1[O-] ZINC000414537780 565947237 /nfs/dbraw/zinc/94/72/37/565947237.db2.gz ZOJJVEHPNGHUEB-ZDUSSCGKSA-N 0 3 384.245 3.168 10 0 GGAEHN OC1CCN(CCCNc2ccc(Br)c(C(F)(F)F)n2)CC1 ZINC000286198348 565947410 /nfs/dbraw/zinc/94/74/10/565947410.db2.gz FPXNTOTVTZNDGF-UHFFFAOYSA-N 0 3 382.224 3.122 10 0 GGAEHN CCOc1c(Br)cc(CN(C[C@H]2CCC(=O)N2)C(C)C)cc1OC ZINC000414555496 565947852 /nfs/dbraw/zinc/94/78/52/565947852.db2.gz IKBLTTXHKJSARI-CQSZACIVSA-N 0 3 399.329 3.345 10 0 GGAEHN CCOc1cc(CNc2cnn(CCN(C)C)c2)cc(Br)c1OC ZINC000237048839 565949143 /nfs/dbraw/zinc/94/91/43/565949143.db2.gz WBNVGZCDTRMYOX-UHFFFAOYSA-N 0 3 397.317 3.227 10 0 GGAEHN CCOc1c(Br)cc(CNc2cnn(CCN(C)C)c2)cc1OC ZINC000237042331 565949495 /nfs/dbraw/zinc/94/94/95/565949495.db2.gz ZIUZXPSGDOKYBW-UHFFFAOYSA-N 0 3 397.317 3.227 10 0 GGAEHN CC(C)N(Cc1ccnc2c(Br)cccc12)C[C@H]1CCC(=O)N1 ZINC000414565667 565950097 /nfs/dbraw/zinc/95/00/97/565950097.db2.gz FCUHEJAOUMIKGE-CQSZACIVSA-N 0 3 376.298 3.486 10 0 GGAEHN OC[C@H]1CCC[C@@H](NCc2c(F)ccc(I)c2F)C1 ZINC000414579918 565951381 /nfs/dbraw/zinc/95/13/81/565951381.db2.gz QGTYKXCBOLEMKR-VHSXEESVSA-N 0 3 381.204 3.210 10 0 GGAEHN COc1cc(C[NH2+]CCN(C)Cc2ccccc2)cc(Br)c1[O-] ZINC000237167263 565952577 /nfs/dbraw/zinc/95/25/77/565952577.db2.gz ZALCYWZMBKMMNN-UHFFFAOYSA-N 0 3 379.298 3.385 10 0 GGAEHN Cc1cc(Br)ccc1NC(=O)NCCCNCc1cccnc1 ZINC000414725186 565956884 /nfs/dbraw/zinc/95/68/84/565956884.db2.gz VJLPLIPWPPZDDZ-UHFFFAOYSA-N 0 3 377.286 3.454 10 0 GGAEHN CN(C[C@H]1CCCN(C(=O)CN)C1)[C@H](c1ccc(Cl)cc1)C(F)(F)F ZINC000414742870 565957591 /nfs/dbraw/zinc/95/75/91/565957591.db2.gz GMKBNKRALAATRN-MLGOLLRUSA-N 0 3 377.838 3.073 10 0 GGAEHN CN(C[C@@H]1CCCN(C(=O)CN)C1)[C@H](c1ccc(Cl)cc1)C(F)(F)F ZINC000414742865 565957974 /nfs/dbraw/zinc/95/79/74/565957974.db2.gz GMKBNKRALAATRN-BLLLJJGKSA-N 0 3 377.838 3.073 10 0 GGAEHN C[C@H](C(=O)N1CCN(Cc2ccc(Cl)s2)CC1)[C@@H](N)c1ccccc1 ZINC000237416470 565959319 /nfs/dbraw/zinc/95/93/19/565959319.db2.gz ZCBGIWPAKDRPPG-KBXCAEBGSA-N 0 3 377.941 3.382 10 0 GGAEHN NC[C@H](NC(=O)c1ccccc1C(=O)c1ccc(Br)cc1)C1CC1 ZINC000237909528 565973984 /nfs/dbraw/zinc/97/39/84/565973984.db2.gz ZPTGWGUIGJFLIZ-KRWDZBQOSA-N 0 3 387.277 3.147 10 0 GGAEHN O=C(NCCCNCc1cccnc1)Nc1cc(Br)ccc1F ZINC000415165178 565977262 /nfs/dbraw/zinc/97/72/62/565977262.db2.gz QQRRZEUVGWSZGI-UHFFFAOYSA-N 0 3 381.249 3.285 10 0 GGAEHN O=C(NCCCNCc1cccnc1)Nc1ccc(F)c(Br)c1 ZINC000415229032 565979473 /nfs/dbraw/zinc/97/94/73/565979473.db2.gz NQMGAJBKSFWSKC-UHFFFAOYSA-N 0 3 381.249 3.285 10 0 GGAEHN Cc1cc(N2CCC[C@@H](NCc3ccc(C)c(Br)c3)C2=O)n(C)n1 ZINC000179426629 565979995 /nfs/dbraw/zinc/97/99/95/565979995.db2.gz QKALQHNSFQLODY-MRXNPFEDSA-N 0 3 391.313 3.085 10 0 GGAEHN NC[C@@H](NC(=O)c1ccccc1C(=O)c1ccc(Br)cc1)C1CC1 ZINC000238091746 565980704 /nfs/dbraw/zinc/98/07/04/565980704.db2.gz ZPTGWGUIGJFLIZ-QGZVFWFLSA-N 0 3 387.277 3.147 10 0 GGAEHN FC(F)Oc1ccc(Br)cc1CN[C@H]1CCO[C@@]2(CCOC2)C1 ZINC000362644081 565981076 /nfs/dbraw/zinc/98/10/76/565981076.db2.gz YJCOURVMWRCGHF-BBRMVZONSA-N 0 3 392.240 3.478 10 0 GGAEHN CNCc1ccccc1NC(=O)C(=O)N[C@@H]1CCCc2sc(Cl)cc21 ZINC000415262403 565982382 /nfs/dbraw/zinc/98/23/82/565982382.db2.gz IIDSWFGXONEMOB-CQSZACIVSA-N 0 3 377.897 3.253 10 0 GGAEHN O=C(NCCCNCc1cccnc1)Nc1cc(F)ccc1Br ZINC000415274673 565982521 /nfs/dbraw/zinc/98/25/21/565982521.db2.gz XHENWIUPYTYNHI-UHFFFAOYSA-N 0 3 381.249 3.285 10 0 GGAEHN COc1cc(NC(=O)NCCCNCc2cccnc2)ccc1Br ZINC000415265700 565982581 /nfs/dbraw/zinc/98/25/81/565982581.db2.gz LPXNLOKXJMROIR-UHFFFAOYSA-N 0 3 393.285 3.154 10 0 GGAEHN O=C(Nc1ccc2c(c1)CNC2)C(=O)N[C@H]1CCCc2sc(Cl)cc21 ZINC000415279274 565983497 /nfs/dbraw/zinc/98/34/97/565983497.db2.gz YQYPELLZYXMEKM-AWEZNQCLSA-N 0 3 375.881 3.137 10 0 GGAEHN O=C(CCN1CCC[C@H](c2ccncn2)C1)Nc1ccc(Br)cc1 ZINC000363015277 565986981 /nfs/dbraw/zinc/98/69/81/565986981.db2.gz XMRLJEPVQPFKTP-AWEZNQCLSA-N 0 3 389.297 3.447 10 0 GGAEHN C[C@H](NC[C@H]1CCCN(S(C)(=O)=O)C1)c1c(Cl)ccc(F)c1Cl ZINC000179540927 565987623 /nfs/dbraw/zinc/98/76/23/565987623.db2.gz HZJYGVCIPKVICH-WDEREUQCSA-N 0 3 383.316 3.455 10 0 GGAEHN C[C@@H](NC[C@H]1CCCN(S(C)(=O)=O)C1)c1c(Cl)ccc(F)c1Cl ZINC000179540939 565987899 /nfs/dbraw/zinc/98/78/99/565987899.db2.gz HZJYGVCIPKVICH-GHMZBOCLSA-N 0 3 383.316 3.455 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2C)[C@@H](C)C1 ZINC000245413776 565989252 /nfs/dbraw/zinc/98/92/52/565989252.db2.gz CCKGUALUAAGPSW-ZFWWWQNUSA-N 0 3 378.460 3.365 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cccc(Br)c2C)[C@@H](C)C1 ZINC000245426108 565989327 /nfs/dbraw/zinc/98/93/27/565989327.db2.gz UNWJOOVIYWPBBP-WFASDCNBSA-N 0 3 389.359 3.108 10 0 GGAEHN O[C@H](COc1cccc(Br)c1)CN1CCC[C@@H]1c1ccncc1 ZINC000179575859 565990385 /nfs/dbraw/zinc/99/03/85/565990385.db2.gz CPEQSXZHQVXBAW-FUHWJXTLSA-N 0 3 377.282 3.421 10 0 GGAEHN O[C@@H](COc1cccc(Br)c1)CN1CCC[C@@H]1c1ccncc1 ZINC000179575848 565990522 /nfs/dbraw/zinc/99/05/22/565990522.db2.gz CPEQSXZHQVXBAW-SJLPKXTDSA-N 0 3 377.282 3.421 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O ZINC000245435660 565990524 /nfs/dbraw/zinc/99/05/24/565990524.db2.gz SZEYSGOAMPIJFW-BBRMVZONSA-N 0 3 381.929 3.086 10 0 GGAEHN COCCOc1c(Cl)cc(NC(=O)N[C@@H]2CNCCC2(F)F)cc1Cl ZINC000415401519 565994192 /nfs/dbraw/zinc/99/41/92/565994192.db2.gz HNQHMZYVRARNRJ-GFCCVEGCSA-N 0 3 398.237 3.137 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1C[C@@H](C(N)=O)CC[C@H]1C ZINC000245549428 565995624 /nfs/dbraw/zinc/99/56/24/565995624.db2.gz ZBYXTUSANXAXOJ-OCCSQVGLSA-N 0 3 391.313 3.029 10 0 GGAEHN O[C@@H](COc1cccc(Br)c1)CN1CCC[C@H]1c1ccncc1 ZINC000245562377 565995649 /nfs/dbraw/zinc/99/56/49/565995649.db2.gz CPEQSXZHQVXBAW-AEFFLSMTSA-N 0 3 377.282 3.421 10 0 GGAEHN CC[C@@H]1CN(CC2=Cc3cc(Br)ccc3OC2)CCN1C[C@H](C)O ZINC000245707457 566001119 /nfs/dbraw/zinc/00/11/19/566001119.db2.gz FIONXEZLYHWOOH-KBXCAEBGSA-N 0 3 395.341 3.002 10 0 GGAEHN Cc1cc(Br)cc(NC(=O)NCCCNCc2cccnc2)c1 ZINC000415521869 566001940 /nfs/dbraw/zinc/00/19/40/566001940.db2.gz CPVSUOXHIXMLEC-UHFFFAOYSA-N 0 3 377.286 3.454 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)N1CCOC[C@H]1CC(F)F)c1ccsc1 ZINC000287280309 566008848 /nfs/dbraw/zinc/00/88/48/566008848.db2.gz VCWRVMRHWNXWHQ-CABCVRRESA-N 0 3 375.485 3.197 10 0 GGAEHN C[C@H](NC[C@@H]1CC[C@@H](C(=O)N(C)C)O1)c1cc2cc(Br)ccc2o1 ZINC000245936256 566011804 /nfs/dbraw/zinc/01/18/04/566011804.db2.gz TZSRWYZAVIHHKH-PJODQICGSA-N 0 3 395.297 3.482 10 0 GGAEHN C[C@@H]1CN(Cc2ccc(Br)c3cccnc23)C[C@H]1N1CCOCC1 ZINC000245963201 566011833 /nfs/dbraw/zinc/01/18/33/566011833.db2.gz MXHBDSCRJJZMSQ-RDTXWAMCSA-N 0 3 390.325 3.150 10 0 GGAEHN Cc1ccc(I)cc1C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000245965991 566012047 /nfs/dbraw/zinc/01/20/47/566012047.db2.gz DRDSIWUDAYPYTL-JSGCOSHPSA-N 0 3 386.277 3.154 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(OC(F)F)c(Cl)c2)[C@@H](C)C1 ZINC000246036397 566014807 /nfs/dbraw/zinc/01/48/07/566014807.db2.gz AVVVHIFLXUBLJO-FZMZJTMJSA-N 0 3 396.887 3.292 10 0 GGAEHN COC(=O)c1cc(NC(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)ccc1Br ZINC000246052412 566015277 /nfs/dbraw/zinc/01/52/77/566015277.db2.gz PXUXTBHAKDSGET-XHDPSFHLSA-N 0 3 398.301 3.086 10 0 GGAEHN CCN1CC[C@H](N[C@@H](C)CS(=O)(=O)CC)[C@H]1c1ccc(Cl)c(F)c1 ZINC000246087612 566016032 /nfs/dbraw/zinc/01/60/32/566016032.db2.gz WFNOHUOFPHLQCO-AFAVFJNCSA-N 0 3 376.925 3.027 10 0 GGAEHN CCOc1cc(Br)c(F)cc1NC(=O)N[C@@H]1CNCCC1(F)F ZINC000415743748 566016521 /nfs/dbraw/zinc/01/65/21/566016521.db2.gz KSAKIOFBXHCGFT-GFCCVEGCSA-N 0 3 396.207 3.106 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)Cc2c(Cl)cccc2Cl)[C@@H](C)C1 ZINC000246222984 566021186 /nfs/dbraw/zinc/02/11/86/566021186.db2.gz QDTRTSBQXAPPLJ-BLLLJJGKSA-N 0 3 379.353 3.485 10 0 GGAEHN CC(C)N1CC[C@H](N[C@@H]2CCCS(=O)(=O)C2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000179956472 566021962 /nfs/dbraw/zinc/02/19/62/566021962.db2.gz OMBGDBYPASADQM-JLSDUUJJSA-N 0 3 388.936 3.170 10 0 GGAEHN CNCc1cccc(NC(=O)N(CCO)Cc2cc(Br)cs2)c1 ZINC000415966081 566022607 /nfs/dbraw/zinc/02/26/07/566022607.db2.gz VMCBCTNYAXOAJB-UHFFFAOYSA-N 0 3 398.326 3.256 10 0 GGAEHN CN(Cc1ccc(Br)o1)C(=O)Nc1ccc2c(c1F)CCNC2 ZINC000415953066 566022855 /nfs/dbraw/zinc/02/28/55/566022855.db2.gz HYWUNKUXSGGFGI-UHFFFAOYSA-N 0 3 382.233 3.491 10 0 GGAEHN Brc1ccc([C@H](NC[C@H]2COC3(CCOCC3)O2)C2CC2)cc1 ZINC000179984416 566022976 /nfs/dbraw/zinc/02/29/76/566022976.db2.gz AEWVKGZKPIMPFG-DLBZAZTESA-N 0 3 382.298 3.412 10 0 GGAEHN C[C@H](C(=O)Nc1ccc(Cl)cc1C(F)(F)F)N1CCN2CCC[C@H]2C1 ZINC000246236820 566023155 /nfs/dbraw/zinc/02/31/55/566023155.db2.gz CTHZPUNCFMFULI-YPMHNXCESA-N 0 3 375.822 3.466 10 0 GGAEHN Brc1ccc2c(c1)[C@@H](NC[C@H]1COC3(CCOCC3)O1)CCCO2 ZINC000179979282 566023234 /nfs/dbraw/zinc/02/32/34/566023234.db2.gz ABBYXFDYDFKYOL-HOCLYGCPSA-N 0 3 398.297 3.175 10 0 GGAEHN O=C(Nc1ccc2c(c1)CNC2)N[C@@H](CCO)c1ccccc1Br ZINC000415984992 566023715 /nfs/dbraw/zinc/02/37/15/566023715.db2.gz ADJXCRXAKHYKNZ-KRWDZBQOSA-N 0 3 390.281 3.298 10 0 GGAEHN O[C@H](COC[C@H]1CCCO1)CN1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000246304507 566025483 /nfs/dbraw/zinc/02/54/83/566025483.db2.gz CFGGATKKCTZRGK-CWRNSKLLSA-N 0 3 390.307 3.003 10 0 GGAEHN CCN(CC)[C@H](CN[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccsc1 ZINC000180014891 566025575 /nfs/dbraw/zinc/02/55/75/566025575.db2.gz LRRINLOMSCYALP-KBXCAEBGSA-N 0 3 381.567 3.129 10 0 GGAEHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@]3(C)CC3(Cl)Cl)CC2)C[C@@H](C)O1 ZINC000246362974 566027406 /nfs/dbraw/zinc/02/74/06/566027406.db2.gz NFUFTEMLIXUFID-CKEIUWERSA-N 0 3 377.356 3.308 10 0 GGAEHN Cc1cc(Cl)ccc1OCCCN[C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000180048614 566028284 /nfs/dbraw/zinc/02/82/84/566028284.db2.gz LXJPVYSHRLYYIF-AWEZNQCLSA-N 0 3 382.913 3.416 10 0 GGAEHN CC[C@H]1CN(Cc2ccc(Br)c3cccnc23)CCN1C[C@@H](C)O ZINC000180099496 566032686 /nfs/dbraw/zinc/03/26/86/566032686.db2.gz LFWPUHKTRAUEIH-ZBFHGGJFSA-N 0 3 392.341 3.274 10 0 GGAEHN C[C@@H](NC[C@@H](O)c1cc(Cl)cc(Cl)c1)c1ccc(S(N)(=O)=O)cc1 ZINC000180123270 566034347 /nfs/dbraw/zinc/03/43/47/566034347.db2.gz JDRGJUNHDVRVFI-QLJPJBMISA-N 0 3 389.304 3.025 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1Cc1cc(Br)c2c(c1)OCCO2 ZINC000180124622 566035522 /nfs/dbraw/zinc/03/55/22/566035522.db2.gz ZDZRXOPCHSKHTI-OAHLLOKOSA-N 0 3 392.297 3.390 10 0 GGAEHN CC[C@@H](CN[C@@H](C)c1ccc(S(N)(=O)=O)cc1)Oc1ccccc1Cl ZINC000180142608 566036543 /nfs/dbraw/zinc/03/65/43/566036543.db2.gz CGLOIHTYAMVDFK-ZFWWWQNUSA-N 0 3 382.913 3.496 10 0 GGAEHN CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1csc(I)c1 ZINC000247001561 566049343 /nfs/dbraw/zinc/04/93/43/566049343.db2.gz QIDQPZCQUNXJDW-NEPJUHHUSA-N 0 3 390.290 3.052 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)N1CCc2cc(Cl)cc(Cl)c2C1 ZINC000364221983 566039562 /nfs/dbraw/zinc/03/95/62/566039562.db2.gz QKVRVQFGSBIDKD-ZSZQSSIHSA-N 0 3 383.319 3.411 10 0 GGAEHN C[C@H](N[C@@H]1CCc2c1cccc2Br)c1ccc(S(N)(=O)=O)cc1 ZINC000180165784 566040154 /nfs/dbraw/zinc/04/01/54/566040154.db2.gz KTGUJSXSFOUFOH-APPDUMDISA-N 0 3 395.322 3.435 10 0 GGAEHN C[C@H](NC[C@@H](O)c1c(Cl)cccc1Cl)c1ccc(S(N)(=O)=O)cc1 ZINC000180182938 566041668 /nfs/dbraw/zinc/04/16/68/566041668.db2.gz VQBVUJAFMNXRJV-ZUZCIYMTSA-N 0 3 389.304 3.025 10 0 GGAEHN CN(C)[C@H](CC(=O)N[C@@H](CO)c1cccc(Br)c1)c1ccccc1 ZINC000416189554 566043103 /nfs/dbraw/zinc/04/31/03/566043103.db2.gz KWBVGDQGUBNZBB-ZWKOTPCHSA-N 0 3 391.309 3.292 10 0 GGAEHN O=S(=O)(C[C@@H](O)CN[C@H](c1ccc(Cl)cc1)C1CC1)c1cccs1 ZINC000180201899 566044228 /nfs/dbraw/zinc/04/42/28/566044228.db2.gz YGDJDSKVFKYERK-RDJZCZTQSA-N 0 3 385.938 3.277 10 0 GGAEHN Brc1ccc(Cc2nc(CN3CCN4CCCC[C@H]4C3)no2)cc1 ZINC000246904050 566045680 /nfs/dbraw/zinc/04/56/80/566045680.db2.gz RPLBWUVLGOVAFJ-INIZCTEOSA-N 0 3 391.313 3.093 10 0 GGAEHN C[C@H](NC[C@@](C)(O)c1ccc(S(C)(=O)=O)cc1)c1ccc(F)c(Cl)c1 ZINC000180246139 566047486 /nfs/dbraw/zinc/04/74/86/566047486.db2.gz XNDKPJPUYZVNFF-KPZWWZAWSA-N 0 3 385.888 3.441 10 0 GGAEHN Cc1cnn([C@H]2CCCN(C[C@@H](O)COc3cccc(Br)c3)C2)c1 ZINC000246946213 566047532 /nfs/dbraw/zinc/04/75/32/566047532.db2.gz BEOQJFBOKBVMGO-DLBZAZTESA-N 0 3 394.313 3.031 10 0 GGAEHN C[C@H]1CN(Cc2ccc(Br)c3cccnc23)C[C@@H]1N1CCOCC1 ZINC000180248744 566047862 /nfs/dbraw/zinc/04/78/62/566047862.db2.gz MXHBDSCRJJZMSQ-KSSFIOAISA-N 0 3 390.325 3.150 10 0 GGAEHN C[C@@H](NC(=O)C[C@H](c1ccccc1)N(C)C)c1ncc(Br)cn1 ZINC000416240290 566048563 /nfs/dbraw/zinc/04/85/63/566048563.db2.gz NAFJBZKSKKTDIT-IUODEOHRSA-N 0 3 377.286 3.109 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)Nc2cccc(F)c2I)C1 ZINC000180279386 566050435 /nfs/dbraw/zinc/05/04/35/566050435.db2.gz KVJOSGJQXWVHTI-SNVBAGLBSA-N 0 3 391.228 3.036 10 0 GGAEHN FC(F)(F)c1nc(N2CCN(C3CCOCC3)CC2)ccc1Br ZINC000287982445 566050598 /nfs/dbraw/zinc/05/05/98/566050598.db2.gz APXOFGGBZJIOEK-UHFFFAOYSA-N 0 3 394.235 3.164 10 0 GGAEHN COC(=O)c1cc(Br)cc(NC(=O)CC2CCN(C)CC2)c1C ZINC000416273458 566050757 /nfs/dbraw/zinc/05/07/57/566050757.db2.gz GLRCNHDKBRCCFF-UHFFFAOYSA-N 0 3 383.286 3.215 10 0 GGAEHN Cc1cc(C(=O)N2CCN3CCC[C@H]3C2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000180285488 566051129 /nfs/dbraw/zinc/05/11/29/566051129.db2.gz BVDBOUFDHKZGLH-AWEZNQCLSA-N 0 3 379.291 3.408 10 0 GGAEHN C[C@H](Cc1ccc(F)c(Br)c1)C(=O)N1C[C@H]2CCCN2C[C@H]1C ZINC000247076088 566051854 /nfs/dbraw/zinc/05/18/54/566051854.db2.gz QNFXSBSCRADISP-UMVBOHGHSA-N 0 3 383.305 3.462 10 0 GGAEHN Cc1sc2ncnc(SCC(=O)N3C[C@@H]4CCCN4C[C@H]3C)c2c1C ZINC000247084600 566052097 /nfs/dbraw/zinc/05/20/97/566052097.db2.gz HXKWXWRQRVCOAV-RISCZKNCSA-N 0 3 376.551 3.095 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)NCc2cc(F)c(F)cc2Br)CCN1C ZINC000288010077 566052217 /nfs/dbraw/zinc/05/22/17/566052217.db2.gz BPXVUMWLTDFLHA-JQWIXIFHSA-N 0 3 390.272 3.351 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1C[C@@H](O)COc1cc(Cl)ccc1Cl ZINC000247137737 566053537 /nfs/dbraw/zinc/05/35/37/566053537.db2.gz SSWARQJNBDKYHL-JKSUJKDBSA-N 0 3 384.307 3.403 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000247150740 566053782 /nfs/dbraw/zinc/05/37/82/566053782.db2.gz UGSXXXSYJITOEJ-LSDHHAIUSA-N 0 3 384.307 3.403 10 0 GGAEHN C[C@H](Oc1ccc(F)cc1Br)C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1 ZINC000247342182 566059478 /nfs/dbraw/zinc/05/94/78/566059478.db2.gz JFNAYDGQBIJKOU-DYEKYZERSA-N 0 3 387.293 3.297 10 0 GGAEHN CC(C)(COc1ncccc1Br)NCC(=O)Nc1ccccc1F ZINC000180396255 566059975 /nfs/dbraw/zinc/05/99/75/566059975.db2.gz QAZPYKNISIBKLM-UHFFFAOYSA-N 0 3 396.260 3.369 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1OC ZINC000247392127 566060345 /nfs/dbraw/zinc/06/03/45/566060345.db2.gz MBDMBVRVLOKSRX-JSGCOSHPSA-N 0 3 399.329 3.411 10 0 GGAEHN Cc1ccc(I)c(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1 ZINC000247504169 566061267 /nfs/dbraw/zinc/06/12/67/566061267.db2.gz VEILBPBZOMXOOZ-QWHCGFSZSA-N 0 3 386.277 3.154 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)cc1OC ZINC000247482912 566061294 /nfs/dbraw/zinc/06/12/94/566061294.db2.gz WHGIKQSJRLJAPK-DOMZBBRYSA-N 0 3 399.329 3.315 10 0 GGAEHN C[C@H]1CN2CCC[C@H]2CN1Cc1nc(-c2cccc(Br)c2)no1 ZINC000247477877 566061381 /nfs/dbraw/zinc/06/13/81/566061381.db2.gz SJCBLYREPBXKDP-WFASDCNBSA-N 0 3 377.286 3.168 10 0 GGAEHN Cc1cccc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1I ZINC000247477583 566061800 /nfs/dbraw/zinc/06/18/00/566061800.db2.gz VVHUTANILOAXBV-OCCSQVGLSA-N 0 3 386.277 3.058 10 0 GGAEHN C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1 ZINC000247566024 566063849 /nfs/dbraw/zinc/06/38/49/566063849.db2.gz ZZJGXVAUTUJCQS-AGIUHOORSA-N 0 3 386.323 3.053 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(C)ccc2Br)[C@@H](C)C1 ZINC000247689891 566065386 /nfs/dbraw/zinc/06/53/86/566065386.db2.gz QPIOSYBCDGKIQJ-ZFWWWQNUSA-N 0 3 389.359 3.108 10 0 GGAEHN CC[C@H]1CN(CCC(=O)Nc2c(Cl)cccc2Cl)CCN1C[C@H](C)O ZINC000247806955 566066364 /nfs/dbraw/zinc/06/63/64/566066364.db2.gz SYDREPRJGHLYFJ-KBPBESRZSA-N 0 3 388.339 3.099 10 0 GGAEHN CN(Cc1ccc(Br)s1)C(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C ZINC000364728311 566066787 /nfs/dbraw/zinc/06/67/87/566066787.db2.gz AFSPOAAFXUHOSX-NORZTCDRSA-N 0 3 387.343 3.002 10 0 GGAEHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)c1cc(Br)cc2nc[nH]c21 ZINC000288302155 566067219 /nfs/dbraw/zinc/06/72/19/566067219.db2.gz IDUMSTBEQPYTPE-AAEUAGOBSA-N 0 3 377.286 3.024 10 0 GGAEHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cc(Br)cc2nc[nH]c21 ZINC000288302164 566067370 /nfs/dbraw/zinc/06/73/70/566067370.db2.gz IDUMSTBEQPYTPE-WCQYABFASA-N 0 3 377.286 3.024 10 0 GGAEHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1cc(Br)cc2nc[nH]c21 ZINC000288304379 566067617 /nfs/dbraw/zinc/06/76/17/566067617.db2.gz IDUMSTBEQPYTPE-YPMHNXCESA-N 0 3 377.286 3.024 10 0 GGAEHN C[C@H](NC(=O)N[C@@H](CCO)c1ccc(Cl)c(Cl)c1)C1=CCN(C)CC1 ZINC000288328338 566068703 /nfs/dbraw/zinc/06/87/03/566068703.db2.gz VENIYNZEBUGCPC-SJCJKPOMSA-N 0 3 386.323 3.367 10 0 GGAEHN CCc1nc2n(n1)C[C@@H](N[C@@H](C)c1ccc(OC)c(Br)c1)CC2 ZINC000180612622 566077195 /nfs/dbraw/zinc/07/71/95/566077195.db2.gz PEUQEPOJMIVLEU-AAEUAGOBSA-N 0 3 379.302 3.277 10 0 GGAEHN CCc1nc2n(n1)C[C@H](N[C@H](C)c1ccc(OC)c(Br)c1)CC2 ZINC000180612645 566077252 /nfs/dbraw/zinc/07/72/52/566077252.db2.gz PEUQEPOJMIVLEU-DGCLKSJQSA-N 0 3 379.302 3.277 10 0 GGAEHN C[N@H+](CCCC[N-]S(=O)(=O)c1cccc(Br)c1Cl)C1CC1 ZINC000416507352 566078593 /nfs/dbraw/zinc/07/85/93/566078593.db2.gz NBOQXEJNRBUHBP-UHFFFAOYSA-N 0 3 395.750 3.255 10 0 GGAEHN C[N@@H+](CCCC[N-]S(=O)(=O)c1cccc(Br)c1Cl)C1CC1 ZINC000416507352 566078597 /nfs/dbraw/zinc/07/85/97/566078597.db2.gz NBOQXEJNRBUHBP-UHFFFAOYSA-N 0 3 395.750 3.255 10 0 GGAEHN O[C@@H]1CCC[C@H](CN[C@H](c2ccc(Br)cc2)c2cncnc2)C1 ZINC000248565391 566081658 /nfs/dbraw/zinc/08/16/58/566081658.db2.gz ORLRUNNZKAGGMX-MORSLUCNSA-N 0 3 376.298 3.469 10 0 GGAEHN CCN1CCC[C@H]1CN[C@H](c1ccc(Br)cc1)c1cncnc1 ZINC000248589947 566082263 /nfs/dbraw/zinc/08/22/63/566082263.db2.gz ZAZNCEYABBINNF-ZWKOTPCHSA-N 0 3 375.314 3.402 10 0 GGAEHN CCN1CCC[C@@H]1CN[C@H](c1ccc(Br)cc1)c1cncnc1 ZINC000248589946 566082946 /nfs/dbraw/zinc/08/29/46/566082946.db2.gz ZAZNCEYABBINNF-QZTJIDSGSA-N 0 3 375.314 3.402 10 0 GGAEHN C[C@@H](c1nc2ccccc2s1)[C@H](C)NCCS(=O)(=O)NCC1CCC1 ZINC000180719754 566083929 /nfs/dbraw/zinc/08/39/29/566083929.db2.gz CWNXMVYJHGHBFS-KGLIPLIRSA-N 0 3 381.567 3.097 10 0 GGAEHN C[C@@H](NCCS(=O)(=O)NCC1CCC1)[C@H](C)c1nc2ccccc2s1 ZINC000180719736 566084524 /nfs/dbraw/zinc/08/45/24/566084524.db2.gz CWNXMVYJHGHBFS-UONOGXRCSA-N 0 3 381.567 3.097 10 0 GGAEHN C[C@H](NCCS(=O)(=O)NCC1CCC1)[C@H](C)c1nc2ccccc2s1 ZINC000180719771 566084777 /nfs/dbraw/zinc/08/47/77/566084777.db2.gz CWNXMVYJHGHBFS-KBPBESRZSA-N 0 3 381.567 3.097 10 0 GGAEHN O[C@@H](CN1CCCN(c2nnc(C(F)(F)F)s2)CC1)C1CCCCC1 ZINC000365274712 566092937 /nfs/dbraw/zinc/09/29/37/566092937.db2.gz BXMFXCLPBSAOJM-ZDUSSCGKSA-N 0 3 378.464 3.010 10 0 GGAEHN CN1CC[C@H](NC(=O)Nc2cncc(Br)c2)[C@H]1c1ccccc1 ZINC000249030037 566094108 /nfs/dbraw/zinc/09/41/08/566094108.db2.gz LMFGAUDEJWUNAR-JKSUJKDBSA-N 0 3 375.270 3.411 10 0 GGAEHN CCO[C@@H]1C[C@H](N[C@H](CO)c2cccc(Br)c2)C12CCOCC2 ZINC000249056260 566095304 /nfs/dbraw/zinc/09/53/04/566095304.db2.gz XQCYTWRIYNCULO-IXDOHACOSA-N 0 3 384.314 3.046 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(C)cc(Br)c2)[C@@H](C)C1 ZINC000249062366 566095980 /nfs/dbraw/zinc/09/59/80/566095980.db2.gz HIAGHSKINUYQMN-XJKSGUPXSA-N 0 3 389.359 3.108 10 0 GGAEHN CN1CC[C@H](NC(=O)Nc2cccnc2Br)[C@H]1c1ccccc1 ZINC000249089371 566096876 /nfs/dbraw/zinc/09/68/76/566096876.db2.gz UKIMKWHBIKRURQ-DZGCQCFKSA-N 0 3 375.270 3.411 10 0 GGAEHN C[C@H]1CN(C(=O)c2c(Cl)cc(F)cc2Cl)CC[C@H]1N1CCN(C)CC1 ZINC000365397272 566098755 /nfs/dbraw/zinc/09/87/55/566098755.db2.gz VGZXNDMAKUBEMD-BLLLJJGKSA-N 0 3 388.314 3.231 10 0 GGAEHN C[C@H](CN(C)C[C@@H](O)COC[C@H]1CCCO1)Oc1ccc(Cl)c(Cl)c1 ZINC000249281861 566100530 /nfs/dbraw/zinc/10/05/30/566100530.db2.gz LAIVCQIWEKIUHA-IIAWOOMASA-N 0 3 392.323 3.249 10 0 GGAEHN COCc1nc2n(n1)C[C@H](N[C@H](C)c1ccc(Br)c(C)c1)CC2 ZINC000180940087 566100862 /nfs/dbraw/zinc/10/08/62/566100862.db2.gz CGUNUODRRCZRGM-TZMCWYRMSA-N 0 3 379.302 3.161 10 0 GGAEHN COc1cc(Br)ccc1CN[C@@H]1CCCN(c2cccnn2)C1 ZINC000180934764 566100911 /nfs/dbraw/zinc/10/09/11/566100911.db2.gz CLAVMGVQMVIJGC-OAHLLOKOSA-N 0 3 377.286 3.006 10 0 GGAEHN CC[C@H](Cc1ccccc1Br)N(C)C[C@H](C)CS(C)(=O)=O ZINC000249443468 566102524 /nfs/dbraw/zinc/10/25/24/566102524.db2.gz MRMBECHRMDQNHJ-DZGCQCFKSA-N 0 3 376.360 3.383 10 0 GGAEHN OC[C@@H]1CN(C[C@H](O)c2cccc(Br)c2)C[C@H]1c1ccsc1 ZINC000249570006 566104752 /nfs/dbraw/zinc/10/47/52/566104752.db2.gz OALBQNAYRZKJMS-XIRDDKMYSA-N 0 3 382.323 3.252 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(CC(F)(F)F)cc2)[C@@H](C)C1 ZINC000249635260 566105623 /nfs/dbraw/zinc/10/56/23/566105623.db2.gz RRRBGXFLTXJICJ-XJKSGUPXSA-N 0 3 378.460 3.142 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)N2CCO[C@@H](c3cccc(Br)c3)C2)C1 ZINC000249725586 566107126 /nfs/dbraw/zinc/10/71/26/566107126.db2.gz LTOKFVNRXGYZDJ-IAGOWNOFSA-N 0 3 396.329 3.016 10 0 GGAEHN C[C@@H]1SCCN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)[C@H]1C ZINC000365547439 566107342 /nfs/dbraw/zinc/10/73/42/566107342.db2.gz OKLCNFXOCOGBDH-XOEAPDPESA-N 0 3 379.492 3.327 10 0 GGAEHN CN1CC[C@@H]2CCN(C(=O)CCCOc3ccccc3Br)[C@H]2C1 ZINC000252513173 566113907 /nfs/dbraw/zinc/11/39/07/566113907.db2.gz XUVWVRZVZAWBGP-ZBFHGGJFSA-N 0 3 381.314 3.161 10 0 GGAEHN CC(C)N1C[C@@H](C)[C@H](NC(=O)c2cc(=O)[nH]c3ccc(Br)cc32)C1 ZINC000253552291 566120026 /nfs/dbraw/zinc/12/00/26/566120026.db2.gz BHVJGQGSFKWGOP-BDJLRTHQSA-N 0 3 392.297 3.161 10 0 GGAEHN CN(Cc1ccccc1)C[C@H](O)CN(C)Cc1ccccc1Br ZINC000261406992 566124190 /nfs/dbraw/zinc/12/41/90/566124190.db2.gz LVQOROAVPPDHTL-SFHVURJKSA-N 0 3 377.326 3.374 10 0 GGAEHN O=C1[C@@H](NC2CC(c3ccc(Br)cc3)C2)CCN1C1CCOCC1 ZINC000365880263 566125049 /nfs/dbraw/zinc/12/50/49/566125049.db2.gz LGUQWMRGQXXUAR-PVARCSIZSA-N 0 3 393.325 3.065 10 0 GGAEHN CN(C)C[C@@H]1CN(C(=O)Nc2cccc(Cl)c2SCC(F)F)CCO1 ZINC000181213808 566125213 /nfs/dbraw/zinc/12/52/13/566125213.db2.gz KWSVFGWYRFBYKI-LLVKDONJSA-N 0 3 393.887 3.492 10 0 GGAEHN CN(C)C[C@@H]1CN(C(=O)Nc2cc(Br)c(F)cc2Cl)CCO1 ZINC000181228356 566126206 /nfs/dbraw/zinc/12/62/06/566126206.db2.gz XSRKGCWISBOLTO-SECBINFHSA-N 0 3 394.672 3.036 10 0 GGAEHN C[C@H](NC(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C)c1ccccc1Br ZINC000261644736 566128003 /nfs/dbraw/zinc/12/80/03/566128003.db2.gz FFIWZLGWGPELPR-HMECXNKFSA-N 0 3 381.314 3.159 10 0 GGAEHN CC(C)c1cc(Br)ccc1NC(=O)N1CCO[C@@H](CN(C)C)C1 ZINC000181285323 566130236 /nfs/dbraw/zinc/13/02/36/566130236.db2.gz XPLQTRWTYPQXJV-AWEZNQCLSA-N 0 3 384.318 3.367 10 0 GGAEHN CCNC(=O)N1CC[C@H](N[C@H](CCCOC)c2ccc(Br)cc2)C1 ZINC000181330947 566133872 /nfs/dbraw/zinc/13/38/72/566133872.db2.gz XMJRLJJGOCRDJP-DLBZAZTESA-N 0 3 398.345 3.310 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C ZINC000261786746 566135256 /nfs/dbraw/zinc/13/52/56/566135256.db2.gz YLMJXUOGQWKQMO-BMHLXIAXSA-N 0 3 395.341 3.029 10 0 GGAEHN C[C@@H](CCc1ccc(Br)cc1)NC(=O)N[C@@H]1CNCCC1(F)F ZINC000417221625 566138105 /nfs/dbraw/zinc/13/81/05/566138105.db2.gz DAYIWKKLMSDNPJ-SMDDNHRTSA-N 0 3 390.272 3.067 10 0 GGAEHN C[C@H](CCc1ccc(Br)cc1)NC(=O)N[C@H]1CNCCC1(F)F ZINC000417221624 566138298 /nfs/dbraw/zinc/13/82/98/566138298.db2.gz DAYIWKKLMSDNPJ-RISCZKNCSA-N 0 3 390.272 3.067 10 0 GGAEHN NC1(C(=O)N2CCC(COc3cc(Cl)cc(Cl)c3)CC2)CCOCC1 ZINC000261878775 566139557 /nfs/dbraw/zinc/13/95/57/566139557.db2.gz OZHQHRMJAHIHNS-UHFFFAOYSA-N 0 3 387.307 3.119 10 0 GGAEHN NC1(C(=O)Nc2nc(-c3cccc(Br)c3)cs2)CCOCC1 ZINC000261900541 566140032 /nfs/dbraw/zinc/14/00/32/566140032.db2.gz ROAYNKOEEJTNCG-UHFFFAOYSA-N 0 3 382.283 3.019 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NC1CCN([C@@H]2CCOC2)CC1 ZINC000366197337 566140231 /nfs/dbraw/zinc/14/02/31/566140231.db2.gz ATTPESKGIHXBLS-SWLSCSKDSA-N 0 3 387.307 3.130 10 0 GGAEHN CCC1(CC)CN(C(=O)C2(N)CCOCC2)c2ccc(Br)cc21 ZINC000261929982 566140935 /nfs/dbraw/zinc/14/09/35/566140935.db2.gz WDOVLAPAEVWVLW-UHFFFAOYSA-N 0 3 381.314 3.361 10 0 GGAEHN C[C@H](NC(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C)c1ccc(Br)cc1 ZINC000261970158 566143294 /nfs/dbraw/zinc/14/32/94/566143294.db2.gz YWPWHFDKUYMFFQ-ZJQCNOOHSA-N 0 3 381.314 3.159 10 0 GGAEHN CN(Cc1csc(Br)c1)C(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C ZINC000262451194 566153276 /nfs/dbraw/zinc/15/32/76/566153276.db2.gz HVYUUHWCVOJLOQ-DETPVDSQSA-N 0 3 387.343 3.002 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)Cc2ccc(Cl)cc2Cl)[C@H](C)C1 ZINC000181664707 566156459 /nfs/dbraw/zinc/15/64/59/566156459.db2.gz RQJQZDCGVPQCOO-MLGOLLRUSA-N 0 3 379.353 3.485 10 0 GGAEHN COC[C@H](NC[C@H](O)COc1ccc(Br)cc1)c1ccccc1 ZINC000181683137 566158447 /nfs/dbraw/zinc/15/84/47/566158447.db2.gz YTOMWUHFQLPLGY-WMZOPIPTSA-N 0 3 380.282 3.166 10 0 GGAEHN C[C@@H](NC[C@@H](C)N1CCN(C)CC1)c1cc2cc(Br)ccc2o1 ZINC000181702977 566159364 /nfs/dbraw/zinc/15/93/64/566159364.db2.gz SUAPOYCTEKDWAA-ZIAGYGMSSA-N 0 3 380.330 3.482 10 0 GGAEHN C[C@@H](CC(=O)NC1CCN([C@H]2CCOC2)CC1)c1ccc(Br)cc1 ZINC000366592727 566159465 /nfs/dbraw/zinc/15/94/65/566159465.db2.gz VXHYMQFBBKYVFS-KSSFIOAISA-N 0 3 395.341 3.312 10 0 GGAEHN CCSc1nccnc1C(=O)NC[C@@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000366579618 566159566 /nfs/dbraw/zinc/15/95/66/566159566.db2.gz KNMVSAOQLGMFAQ-BBRMVZONSA-N 0 3 376.551 3.463 10 0 GGAEHN COc1cc(Br)ccc1CCCN1CCC[C@H](n2cncn2)C1 ZINC000181853385 566170103 /nfs/dbraw/zinc/17/01/03/566170103.db2.gz IQKZSTAABDNAJH-INIZCTEOSA-N 0 3 379.302 3.319 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)c1coc(-c2ccc(Br)cc2F)n1 ZINC000181883668 566171423 /nfs/dbraw/zinc/17/14/23/566171423.db2.gz HZEICRLVFVZOHQ-NSHDSACASA-N 0 3 382.233 3.067 10 0 GGAEHN N[C@@H](CNC(=O)NCC1(c2ccccc2Br)CC1)c1ccccc1 ZINC000417723773 566172870 /nfs/dbraw/zinc/17/28/70/566172870.db2.gz CIGWBFSGZDPGLP-KRWDZBQOSA-N 0 3 388.309 3.480 10 0 GGAEHN CCc1csc(CC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)n1 ZINC000366904449 566175777 /nfs/dbraw/zinc/17/57/77/566175777.db2.gz AHOJPQHWQWIVEC-UHFFFAOYSA-N 0 3 375.460 3.170 10 0 GGAEHN C[C@@H](CNC(=O)NC[C@@H](N)c1ccccc1)Oc1ccccc1Br ZINC000417828937 566177398 /nfs/dbraw/zinc/17/73/98/566177398.db2.gz QRZUHXGJCQDBQI-XJKSGUPXSA-N 0 3 392.297 3.216 10 0 GGAEHN C[C@H](Cc1ccccc1Br)NC(=O)NC[C@H](N)c1ccccc1 ZINC000417895851 566179111 /nfs/dbraw/zinc/17/91/11/566179111.db2.gz QHFBSTQYLBQCGB-DYVFJYSZSA-N 0 3 376.298 3.379 10 0 GGAEHN C[C@H](Cc1ccccc1Br)NC(=O)NC[C@@H](N)c1ccccc1 ZINC000417895850 566179415 /nfs/dbraw/zinc/17/94/15/566179415.db2.gz QHFBSTQYLBQCGB-CXAGYDPISA-N 0 3 376.298 3.379 10 0 GGAEHN CCOC(=O)c1csc(CCN[C@H](C)c2ccc(Br)nc2)n1 ZINC000290851751 566192424 /nfs/dbraw/zinc/19/24/24/566192424.db2.gz ZNYVPWUYOFGXQN-SNVBAGLBSA-N 0 3 384.299 3.371 10 0 GGAEHN O=C(NCCCc1nccs1)NC[C@@H]1CCCN(Cc2cccs2)C1 ZINC000290862588 566193703 /nfs/dbraw/zinc/19/37/03/566193703.db2.gz QVENFRSGBVPZAG-HNNXBMFYSA-N 0 3 378.567 3.349 10 0 GGAEHN CCOc1cc(CN[C@H]2C[C@@](C)(O)C2)cc(Br)c1OC(F)F ZINC000418107859 566197938 /nfs/dbraw/zinc/19/79/38/566197938.db2.gz FGHBSLDXOJPLLB-AVCCJPFPSA-N 0 3 380.229 3.452 10 0 GGAEHN CC[C@H](NC(=O)N[C@@H]1CNCCC1(F)F)c1cc(F)cc(Br)c1 ZINC000418145573 566199583 /nfs/dbraw/zinc/19/95/83/566199583.db2.gz OKMKEFKFORTFIW-QWHCGFSZSA-N 0 3 394.235 3.336 10 0 GGAEHN C[C@@H](NC(=O)N1CC[C@H](N2CC=CC2)C1)c1ccc(Br)cc1F ZINC000291001041 566200731 /nfs/dbraw/zinc/20/07/31/566200731.db2.gz SVLSKRKAZZXTGM-OCCSQVGLSA-N 0 3 382.277 3.305 10 0 GGAEHN COCCCN(C(=O)Cc1ccc(Br)s1)C1CCN(C)CC1 ZINC000291139978 566206894 /nfs/dbraw/zinc/20/68/94/566206894.db2.gz IUILRIJCDUTJHD-UHFFFAOYSA-N 0 3 389.359 3.012 10 0 GGAEHN CN(Cc1cccc(Br)c1)C(=O)NCCCNCc1cccnc1 ZINC000418330790 566208796 /nfs/dbraw/zinc/20/87/96/566208796.db2.gz QOWLNLAFGXESLF-UHFFFAOYSA-N 0 3 391.313 3.165 10 0 GGAEHN OC[C@@H](NC1CCN(c2nccs2)CC1)c1cccc(Br)c1 ZINC000291245751 566211042 /nfs/dbraw/zinc/21/10/42/566211042.db2.gz VKELJMNHIAUJMS-OAHLLOKOSA-N 0 3 382.327 3.198 10 0 GGAEHN CN(CCOc1ccc(Br)cc1)C(=O)NC[C@H](N)c1ccccc1 ZINC000418427729 566213396 /nfs/dbraw/zinc/21/33/96/566213396.db2.gz LQNWGSRSWUNQFG-KRWDZBQOSA-N 0 3 392.297 3.169 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)Nc1ccc(Br)c(C(=O)OC)c1 ZINC000182640942 566218310 /nfs/dbraw/zinc/21/83/10/566218310.db2.gz DQJXAMDHGUJFEI-ZDUSSCGKSA-N 0 3 398.301 3.184 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)N1CCC[C@@H]1c1cccc(Br)c1 ZINC000418741402 566222075 /nfs/dbraw/zinc/22/20/75/566222075.db2.gz ATPLGCZOSAUPIN-KGLIPLIRSA-N 0 3 388.256 3.293 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)N1CCc2sccc2[C@H]1c1cccs1 ZINC000418749200 566222322 /nfs/dbraw/zinc/22/23/22/566222322.db2.gz LYKCWOLOKCEJIE-GJZGRUSLSA-N 0 3 383.489 3.464 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)N1CCc2sccc2[C@@H]1c1cccs1 ZINC000418749201 566222452 /nfs/dbraw/zinc/22/24/52/566222452.db2.gz LYKCWOLOKCEJIE-HUUCEWRRSA-N 0 3 383.489 3.464 10 0 GGAEHN OC[C@H](CN[C@H]1CCCOc2c(Br)cccc21)c1cccnc1 ZINC000367905530 566222606 /nfs/dbraw/zinc/22/26/06/566222606.db2.gz XJPHSWSSFHARKO-YOEHRIQHSA-N 0 3 377.282 3.424 10 0 GGAEHN OC[C@H](CN[C@H]1CCCOc2cc(Br)ccc21)c1cccnc1 ZINC000367896498 566222633 /nfs/dbraw/zinc/22/26/33/566222633.db2.gz AZSDUGNUHNEPCA-YOEHRIQHSA-N 0 3 377.282 3.424 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)N(Cc1ccc(F)cc1Cl)CC1CC1 ZINC000418777445 566222825 /nfs/dbraw/zinc/22/28/25/566222825.db2.gz YFOTWIIBQGLTIH-OAHLLOKOSA-N 0 3 375.822 3.398 10 0 GGAEHN C[C@H](NCc1ccc(Cl)c2cccnc12)c1ccc(S(N)(=O)=O)cc1 ZINC000182858609 566227171 /nfs/dbraw/zinc/22/71/71/566227171.db2.gz MQLZGSKVKUTCPE-LBPRGKRZSA-N 0 3 375.881 3.386 10 0 GGAEHN C[C@@H]1CN(CCSc2ccnc3cc(Cl)ccc32)[C@@H](C)CN1CCO ZINC000419327970 566232277 /nfs/dbraw/zinc/23/22/77/566232277.db2.gz DFSCVZIQVYWFSW-CABCVRRESA-N 0 3 379.957 3.367 10 0 GGAEHN NS(=O)(=O)c1ccc(CNCc2ccc(C3CC3)cc2)cc1Br ZINC000419702144 566242169 /nfs/dbraw/zinc/24/21/69/566242169.db2.gz ZYWFGCGHLHLOPN-UHFFFAOYSA-N 0 3 395.322 3.264 10 0 GGAEHN CCN1CC[C@H](N[C@@H](C)CS(=O)(=O)CC)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000183430149 566246619 /nfs/dbraw/zinc/24/66/19/566246619.db2.gz WFNOHUOFPHLQCO-ZLIFDBKOSA-N 0 3 376.925 3.027 10 0 GGAEHN CCC[C@H](O)[C@H](CO)NCc1cnc(-c2ccc(Br)cc2)s1 ZINC000419820962 566250641 /nfs/dbraw/zinc/25/06/41/566250641.db2.gz MZQCGQUHZLRYQN-GJZGRUSLSA-N 0 3 385.327 3.184 10 0 GGAEHN CCOC(=O)C[C@H](O)CN(C)[C@H]1CCSc2ccc(Br)cc21 ZINC000599287130 566252301 /nfs/dbraw/zinc/25/23/01/566252301.db2.gz QWMURSHKPIQKHL-JSGCOSHPSA-N 0 3 388.327 3.232 10 0 GGAEHN CCOC(=O)C[C@@H](O)CN(C)[C@@H]1CCSc2ccc(Br)cc21 ZINC000599287132 566252457 /nfs/dbraw/zinc/25/24/57/566252457.db2.gz QWMURSHKPIQKHL-TZMCWYRMSA-N 0 3 388.327 3.232 10 0 GGAEHN COc1cc(C(=O)NCCN2CCCC[C@@H]2C)cc(Br)c1OC ZINC000555816271 566252485 /nfs/dbraw/zinc/25/24/85/566252485.db2.gz FCZBMWPXVNXACL-LBPRGKRZSA-N 0 3 385.302 3.071 10 0 GGAEHN NC(C(=O)N1CCC(OCc2ccc(Cl)c(Cl)c2)CC1)C(F)(F)F ZINC000575121185 566253701 /nfs/dbraw/zinc/25/37/01/566253701.db2.gz CBSDPLIIEYSAFL-ZDUSSCGKSA-N 0 3 385.213 3.391 10 0 GGAEHN CN(C)[C@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)c1ccccc1 ZINC000599347360 566255034 /nfs/dbraw/zinc/25/50/34/566255034.db2.gz NUEPMXZIVVDXGR-MRXNPFEDSA-N 0 3 387.281 3.358 10 0 GGAEHN CN(C)CC[C@@](C)(O)CNC(=O)c1sc2ccccc2c1Br ZINC000419971555 566255538 /nfs/dbraw/zinc/25/55/38/566255538.db2.gz DYRLXBDQPUAGNC-MRXNPFEDSA-N 0 3 385.327 3.096 10 0 GGAEHN CCOc1cc(C[NH2+]C[C@@H]2CC(=O)N(C(C)(C)C)C2)cc(Br)c1[O-] ZINC000668692110 566255520 /nfs/dbraw/zinc/25/55/20/566255520.db2.gz YPVGGCDUFZGZGE-ZDUSSCGKSA-N 0 3 399.329 3.290 10 0 GGAEHN OCC1(CO)CCN(Cc2ccc(-c3cccc(Br)c3)s2)C1 ZINC000668666724 566256169 /nfs/dbraw/zinc/25/61/69/566256169.db2.gz QWTYMZBQOKWWHX-UHFFFAOYSA-N 0 3 382.323 3.354 10 0 GGAEHN CC[C@H](Cc1ccccc1Br)N(C)Cc1cnc(C(=O)OC)cn1 ZINC000599370637 566257003 /nfs/dbraw/zinc/25/70/03/566257003.db2.gz HJVIAUCBWXJXNO-OAHLLOKOSA-N 0 3 392.297 3.479 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CC[C@H]2COC[C@H]2C1 ZINC000668704054 566258401 /nfs/dbraw/zinc/25/84/01/566258401.db2.gz BORNWUMBMIPFPQ-GOEBONIOSA-N 0 3 376.298 3.412 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1CC[C@@H]2COC[C@@H]2C1 ZINC000668706576 566259067 /nfs/dbraw/zinc/25/90/67/566259067.db2.gz UZZQKBRALSNIPD-ZBFHGGJFSA-N 0 3 376.298 3.412 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1CC[C@H]2COC[C@H]2C1 ZINC000668705041 566259229 /nfs/dbraw/zinc/25/92/29/566259229.db2.gz FPJTTWSISWHAKR-GOEBONIOSA-N 0 3 376.298 3.412 10 0 GGAEHN Cc1nc2ccccn2c(=O)c1CCN1CCc2ccc(Br)cc2C1 ZINC000575220685 566262312 /nfs/dbraw/zinc/26/23/12/566262312.db2.gz SJCYOQVLIGLGHH-UHFFFAOYSA-N 0 3 398.304 3.366 10 0 GGAEHN O[C@@H](CN[C@@H](c1cccnc1)C1CC1)COc1cccc(Br)c1 ZINC000556019373 566267566 /nfs/dbraw/zinc/26/75/66/566267566.db2.gz JLYWCXVPYBEKSS-FUHWJXTLSA-N 0 3 377.282 3.325 10 0 GGAEHN CN(C[C@@H]1CCCN(C)C1)C(=O)c1c(F)c(F)c(Br)c(F)c1F ZINC000668800629 566269200 /nfs/dbraw/zinc/26/92/00/566269200.db2.gz WBNNIPFTDBROPC-MRVPVSSYSA-N 0 3 397.210 3.419 10 0 GGAEHN CCCN1CCC(CNS(=O)(=O)c2ccc(C)c(Br)c2)CC1 ZINC000462263436 566270192 /nfs/dbraw/zinc/27/01/92/566270192.db2.gz OXWIMTRGHJHTEW-UHFFFAOYSA-N 0 3 389.359 3.158 10 0 GGAEHN C[NH+](C)[C@H]1CCC[C@@H]([N-]S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000509168823 566270195 /nfs/dbraw/zinc/27/01/95/566270195.db2.gz WLMKBDXWMWGVIF-MNOVXSKESA-N 0 3 395.750 3.254 10 0 GGAEHN C[C@H](N[C@@H](CO)C[C@H](O)C(C)(C)C)c1ccc(I)cc1 ZINC000556605554 566318455 /nfs/dbraw/zinc/31/84/55/566318455.db2.gz ARDUHERCAKOYEH-GLQYFDAESA-N 0 3 391.293 3.100 10 0 GGAEHN CN(Cc1ncc(Br)cc1Br)[C@@H]1CCN(C2CC2)C1 ZINC000481999940 566275567 /nfs/dbraw/zinc/27/55/67/566275567.db2.gz IOKRQZJCFHZJLB-GFCCVEGCSA-N 0 3 389.135 3.275 10 0 GGAEHN CCN(CC)[C@@H](CN[C@@H](C)Cn1cc(Br)ccc1=O)c1ccco1 ZINC000556233884 566275667 /nfs/dbraw/zinc/27/56/67/566275667.db2.gz LTNRTGSZOGBJLU-HOCLYGCPSA-N 0 3 396.329 3.265 10 0 GGAEHN COc1cc(I)c(Cl)cc1CN[C@@H]1CCCOC1 ZINC000482001170 566275752 /nfs/dbraw/zinc/27/57/52/566275752.db2.gz MJAOCXQEHMNZIX-SNVBAGLBSA-N 0 3 381.641 3.222 10 0 GGAEHN O=C(CN1C[C@H]2CCC[C@@H](C1)N2)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000420402121 566276705 /nfs/dbraw/zinc/27/67/05/566276705.db2.gz QGDVSKSNRMXHKB-RVKKMQEKSA-N 0 3 382.335 3.483 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2csc(-c3ccccc3)n2)[C@@H](C)C1 ZINC000462300254 566278505 /nfs/dbraw/zinc/27/85/05/566278505.db2.gz ILVVVAUGTKHZPE-HOCLYGCPSA-N 0 3 379.551 3.161 10 0 GGAEHN Fc1ccc([C@H](NCCCCn2cc(Br)cn2)c2c[nH]nn2)cc1 ZINC000556243812 566278546 /nfs/dbraw/zinc/27/85/46/566278546.db2.gz NFRCAOCDYCNSNL-INIZCTEOSA-N 0 3 393.264 3.062 10 0 GGAEHN CC[N@@H+]1CCC[C@H](C[N-]S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000509221559 566279121 /nfs/dbraw/zinc/27/91/21/566279121.db2.gz BZFKVESHXOODQC-LLVKDONJSA-N 0 3 395.750 3.113 10 0 GGAEHN CC[N@H+]1CCC[C@H](C[N-]S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000509221559 566279124 /nfs/dbraw/zinc/27/91/24/566279124.db2.gz BZFKVESHXOODQC-LLVKDONJSA-N 0 3 395.750 3.113 10 0 GGAEHN CCN1CCC(N(C)C(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)CC1 ZINC000625131964 566279614 /nfs/dbraw/zinc/27/96/14/566279614.db2.gz DYTFYQFIZRAGIX-BPQIPLTHSA-N 0 3 377.326 3.278 10 0 GGAEHN COC(=O)c1cc(Cl)cc(Cl)c1NC(=O)CN[C@H]1[C@@H](C)[C@@H](C)O[C@H]1C ZINC000599625242 566280056 /nfs/dbraw/zinc/28/00/56/566280056.db2.gz HTDHGWANZUEGBQ-OFYUCFFLSA-N 0 3 389.279 3.120 10 0 GGAEHN COC(=O)c1cc(Cl)cc(Cl)c1NC(=O)CN[C@@H]1[C@H](C)O[C@@H](C)[C@H]1C ZINC000599625241 566280505 /nfs/dbraw/zinc/28/05/05/566280505.db2.gz HTDHGWANZUEGBQ-HTQGBYLWSA-N 0 3 389.279 3.120 10 0 GGAEHN O=C([C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)N1CC[C@@H](N2CCCC2)C1 ZINC000625135834 566280855 /nfs/dbraw/zinc/28/08/55/566280855.db2.gz GORVCBXZRGBWIE-ZYRRHWMLSA-N 0 3 375.310 3.032 10 0 GGAEHN Cc1cc(S(=O)(=O)N2C[C@@H](c3cccc(F)c3)[C@H](N)C2)c(Cl)cc1F ZINC000420473366 566282252 /nfs/dbraw/zinc/28/22/52/566282252.db2.gz VBMISJNIGMDSDA-XJKSGUPXSA-N 0 3 386.851 3.042 10 0 GGAEHN COC(=O)c1cnc(CN2C[C@H](c3ccc(Br)cc3)C[C@H]2C)cn1 ZINC000599651922 566282612 /nfs/dbraw/zinc/28/26/12/566282612.db2.gz IIGDQJCSVXXJGZ-TZMCWYRMSA-N 0 3 390.281 3.404 10 0 GGAEHN COc1nc(C)c(Br)cc1-c1noc([C@H]2CCN(C)[C@@H](C)C2)n1 ZINC000420506670 566285633 /nfs/dbraw/zinc/28/56/33/566285633.db2.gz UADZLLXULDEXHO-ONGXEEELSA-N 0 3 381.274 3.409 10 0 GGAEHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000669118320 566285960 /nfs/dbraw/zinc/28/59/60/566285960.db2.gz LJVAQTOUEAOZAM-RDTXWAMCSA-N 0 3 394.357 3.462 10 0 GGAEHN CN(C)[C@@]1(CNCc2cn(-c3ccc(Cl)cc3Cl)nn2)CCSC1 ZINC000535200107 566286793 /nfs/dbraw/zinc/28/67/93/566286793.db2.gz IDLMIBGCFWLLAI-MRXNPFEDSA-N 0 3 386.352 3.101 10 0 GGAEHN O[C@@H](CNC[C@@H](O)Cc1cccc(F)c1)COc1c(Cl)cccc1Cl ZINC000575803350 566287345 /nfs/dbraw/zinc/28/73/45/566287345.db2.gz KHPQLAFSWHVCOO-GJZGRUSLSA-N 0 3 388.266 3.065 10 0 GGAEHN COC(=O)[C@@H]1C[C@@H](C)N(CCC(=O)Nc2ccc(Br)cc2)[C@@H](C)C1 ZINC000599703485 566288553 /nfs/dbraw/zinc/28/85/53/566288553.db2.gz BNKILHCKJWVVAH-BTTYYORXSA-N 0 3 397.313 3.440 10 0 GGAEHN COC(=O)C1C[C@H](C)N(CCC(=O)Nc2cccc(Br)c2)[C@@H](C)C1 ZINC000599699718 566288743 /nfs/dbraw/zinc/28/87/43/566288743.db2.gz YMUXWDWHPZPYCT-STQMWFEESA-N 0 3 397.313 3.440 10 0 GGAEHN CN(C(=O)c1cc(Br)cc(N2CCCC2)c1)[C@@H]1CCCN(C)C1 ZINC000669179107 566288708 /nfs/dbraw/zinc/28/87/08/566288708.db2.gz RGLHPFSJSRYIOE-MRXNPFEDSA-N 0 3 380.330 3.216 10 0 GGAEHN COc1ccc(CCC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c(Br)c1 ZINC000669128362 566289131 /nfs/dbraw/zinc/28/91/31/566289131.db2.gz HFRSOOJOVQVNJZ-UKRRQHHQSA-N 0 3 383.330 3.331 10 0 GGAEHN COc1ccc(-c2nnc(N3C[C@@H](SC)[C@H](N4CCCC4)C3)s2)cc1 ZINC000420609080 566289139 /nfs/dbraw/zinc/28/91/39/566289139.db2.gz GKZAFBARKAEPKJ-HZPDHXFCSA-N 0 3 376.551 3.230 10 0 GGAEHN COC(=O)[C@@H]1C[C@@H](C)N(C[C@@H](O)COc2ccc(Cl)cc2Cl)[C@@H](C)C1 ZINC000599710362 566289557 /nfs/dbraw/zinc/28/95/57/566289557.db2.gz QTJWHXQYOWBYKM-QVHKTLOISA-N 0 3 390.307 3.395 10 0 GGAEHN CS[C@H]1CN(C(=O)c2csc(N(C)c3ccccc3)n2)C[C@@H]1N(C)C ZINC000599721738 566289916 /nfs/dbraw/zinc/28/99/16/566289916.db2.gz QZGLKHKEDKDRFA-HOTGVXAUSA-N 0 3 376.551 3.029 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cc(C)cc(Br)c2F)C[C@@H]1N(C)C ZINC000599721697 566289948 /nfs/dbraw/zinc/28/99/48/566289948.db2.gz PXPXFSWPHQZVRJ-STQMWFEESA-N 0 3 375.307 3.014 10 0 GGAEHN Cc1cc(I)cc(C(=O)N(C)[C@@H]2CN3CCC2CC3)c1C ZINC000482180492 566290471 /nfs/dbraw/zinc/29/04/71/566290471.db2.gz PNVAILTXXAXPCU-MRXNPFEDSA-N 0 3 398.288 3.074 10 0 GGAEHN O=C(CCCSc1ccc(Br)cc1)NCCNc1ccncc1 ZINC000535263370 566290608 /nfs/dbraw/zinc/29/06/08/566290608.db2.gz WIUPTPNXRITIOC-UHFFFAOYSA-N 0 3 394.338 3.367 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)c2c(F)c(F)c(Br)c(F)c2F)CCN1C ZINC000669182255 566290597 /nfs/dbraw/zinc/29/05/97/566290597.db2.gz KDPLTWDINATAHK-RNFRBKRXSA-N 0 3 383.183 3.218 10 0 GGAEHN CN(C(=O)Cc1c[nH]c2cc(Br)ccc12)[C@@H]1CN2CCC1CC2 ZINC000482178387 566290729 /nfs/dbraw/zinc/29/07/29/566290729.db2.gz MQBHJCKRTRPPGU-QGZVFWFLSA-N 0 3 376.298 3.026 10 0 GGAEHN Cc1cc(I)cc(C(=O)N(C)[C@H]2CN3CCC2CC3)c1C ZINC000482180491 566290862 /nfs/dbraw/zinc/29/08/62/566290862.db2.gz PNVAILTXXAXPCU-INIZCTEOSA-N 0 3 398.288 3.074 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)c2cc(Br)cc(N3CCCC3)c2)CCN1C ZINC000669184437 566291002 /nfs/dbraw/zinc/29/10/02/566291002.db2.gz ZFLQPRGJEOLIRK-CZUORRHYSA-N 0 3 380.330 3.262 10 0 GGAEHN CC(C)(C)CNC(=O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000625231223 566291937 /nfs/dbraw/zinc/29/19/37/566291937.db2.gz AZAOBMBHTRJTGS-UHFFFAOYSA-N 0 3 383.330 3.207 10 0 GGAEHN CN1CCC[C@@H]1C(=O)N1CCC[C@H]1c1ccc(I)cc1 ZINC000535283456 566292161 /nfs/dbraw/zinc/29/21/61/566292161.db2.gz KNQURHPLMPZPDA-LSDHHAIUSA-N 0 3 384.261 3.049 10 0 GGAEHN CN1Cc2ccccc2[C@H](NC(=O)c2n[nH]c3ccc(Br)cc32)C1 ZINC000535279493 566292232 /nfs/dbraw/zinc/29/22/32/566292232.db2.gz CKRGLKIICYINSF-MRXNPFEDSA-N 0 3 385.265 3.242 10 0 GGAEHN Brc1ccc(C2(NCCOC3CCOCC3)CCOCC2)cc1 ZINC000625233083 566292340 /nfs/dbraw/zinc/29/23/40/566292340.db2.gz MTWWFAMFUDNOGT-UHFFFAOYSA-N 0 3 384.314 3.240 10 0 GGAEHN CN1CCC[C@H]1C(=O)N1CCC[C@@H]1c1ccc(I)cc1 ZINC000535283448 566292505 /nfs/dbraw/zinc/29/25/05/566292505.db2.gz KNQURHPLMPZPDA-CABCVRRESA-N 0 3 384.261 3.049 10 0 GGAEHN CN1CCC[C@H]1C(=O)N1CCC[C@H]1c1ccc(I)cc1 ZINC000535283451 566292546 /nfs/dbraw/zinc/29/25/46/566292546.db2.gz KNQURHPLMPZPDA-GJZGRUSLSA-N 0 3 384.261 3.049 10 0 GGAEHN COc1cc(C(=O)N2C[C@@H](SC)[C@@H](N3CCCC3)C2)ccc1Br ZINC000599759824 566292998 /nfs/dbraw/zinc/29/29/98/566292998.db2.gz DNHOQYKQMNWORN-GOEBONIOSA-N 0 3 399.354 3.110 10 0 GGAEHN CS[C@@H]1CN(C(=O)[C@@H]2[C@@H]3Cc4c(cccc4Cl)[C@@H]32)C[C@H]1N1CCCC1 ZINC000599761924 566293328 /nfs/dbraw/zinc/29/33/28/566293328.db2.gz LKHFVSOHXPQTNU-RXABAKJHSA-N 0 3 376.953 3.264 10 0 GGAEHN COCCN1CCC[C@H]1CN[C@@H](C)c1ccccc1I ZINC000482241771 566295742 /nfs/dbraw/zinc/29/57/42/566295742.db2.gz JFVGFAURTGPOAA-KBPBESRZSA-N 0 3 388.293 3.053 10 0 GGAEHN COCCN1CCC[C@@H]1CN[C@@H]1CCCOc2c(Br)cccc21 ZINC000482256617 566298404 /nfs/dbraw/zinc/29/84/04/566298404.db2.gz MWEWWGRMZRSODU-RHSMWYFYSA-N 0 3 383.330 3.363 10 0 GGAEHN COCCN1CCC[C@H]1CN[C@H]1CCCOc2c(Br)cccc21 ZINC000482256619 566298484 /nfs/dbraw/zinc/29/84/84/566298484.db2.gz MWEWWGRMZRSODU-YOEHRIQHSA-N 0 3 383.330 3.363 10 0 GGAEHN C[NH+](C)CC1CCC([N-]S(=O)(=O)c2cc(Cl)ccc2OC(F)F)CC1 ZINC000420689885 566300607 /nfs/dbraw/zinc/30/06/07/566300607.db2.gz GSMUUVGQWHVECP-UHFFFAOYSA-N 0 3 396.887 3.340 10 0 GGAEHN Cc1cc(Br)c(F)c(C(=O)N(CCN(C)C)C[C@@H]2CCCO2)c1 ZINC000625280655 566301528 /nfs/dbraw/zinc/30/15/28/566301528.db2.gz NRHDFNRMGXVDNX-ZDUSSCGKSA-N 0 3 387.293 3.079 10 0 GGAEHN C[C@@H](CNC(=O)Nc1cc(F)c(Cl)cc1I)N(C)C ZINC000599927776 566302667 /nfs/dbraw/zinc/30/26/67/566302667.db2.gz GWTMBDNPHVCFRS-ZETCQYMHSA-N 0 3 399.635 3.155 10 0 GGAEHN O=C(COc1ccccc1)N1CC[C@H](NCc2cccc(Br)c2)C1 ZINC000509427891 566303429 /nfs/dbraw/zinc/30/34/29/566303429.db2.gz AGJFJHJAGNPEOV-KRWDZBQOSA-N 0 3 389.293 3.219 10 0 GGAEHN COc1cc(C)nc(CNCCOc2ccc(I)cc2)c1 ZINC000509431485 566303693 /nfs/dbraw/zinc/30/36/93/566303693.db2.gz VIFPUEOVVFSQQC-UHFFFAOYSA-N 0 3 398.244 3.172 10 0 GGAEHN Ic1ccc(OCCNCc2cnn3ccccc23)cc1 ZINC000509431092 566304030 /nfs/dbraw/zinc/30/40/30/566304030.db2.gz TZRWOYXFAORIFH-UHFFFAOYSA-N 0 3 393.228 3.108 10 0 GGAEHN C[C@@H](CN(C)C)NC(=O)Nc1cc(F)c(Cl)cc1I ZINC000599929154 566304335 /nfs/dbraw/zinc/30/43/35/566304335.db2.gz XUGSHQMTDZYINR-ZETCQYMHSA-N 0 3 399.635 3.155 10 0 GGAEHN CCCn1cc(CNCCOc2ccc(I)cc2)cn1 ZINC000509431822 566304874 /nfs/dbraw/zinc/30/48/74/566304874.db2.gz WGXYNFCWDIKHIO-UHFFFAOYSA-N 0 3 385.249 3.066 10 0 GGAEHN O=C(COc1ccccc1)N1CC[C@@H](NCc2ccc(Br)s2)C1 ZINC000509432833 566305998 /nfs/dbraw/zinc/30/59/98/566305998.db2.gz VEWNJSDHABWFJD-CYBMUJFWSA-N 0 3 395.322 3.280 10 0 GGAEHN C[C@@H]1CN(CCCOc2cccc(I)c2)[C@@H](C)CN1C ZINC000509462897 566307749 /nfs/dbraw/zinc/30/77/49/566307749.db2.gz KNJWDSPQEMGTAY-KGLIPLIRSA-N 0 3 388.293 3.085 10 0 GGAEHN C[C@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)N1CCCC[C@@H]1C ZINC000600005995 566309205 /nfs/dbraw/zinc/30/92/05/566309205.db2.gz NCQGWRGJQOLJQC-NWDGAFQWSA-N 0 3 379.302 3.318 10 0 GGAEHN C[C@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)N1CCCC[C@H]1C ZINC000600005998 566309240 /nfs/dbraw/zinc/30/92/40/566309240.db2.gz NCQGWRGJQOLJQC-VXGBXAGGSA-N 0 3 379.302 3.318 10 0 GGAEHN C[C@@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)N1CCCC[C@H]1C ZINC000600005991 566309558 /nfs/dbraw/zinc/30/95/58/566309558.db2.gz NCQGWRGJQOLJQC-NEPJUHHUSA-N 0 3 379.302 3.318 10 0 GGAEHN O=C(c1cc2c(cncc2Br)s1)N1CC[C@H](N2CCCC2)C1 ZINC000648763841 566309762 /nfs/dbraw/zinc/30/97/62/566309762.db2.gz LAMVIXOZFOPJFZ-NSHDSACASA-N 0 3 380.311 3.369 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)NCc1ccc2c(c1)CNC2 ZINC000669565662 566310826 /nfs/dbraw/zinc/31/08/26/566310826.db2.gz QGAKVONXJKCSDT-UHFFFAOYSA-N 0 3 390.281 3.060 10 0 GGAEHN O=C(N[C@@H]1CCN(CC2CC2)C1)c1cc2c(cncc2Br)s1 ZINC000648776735 566311030 /nfs/dbraw/zinc/31/10/30/566311030.db2.gz QGJRLFFQEOREHN-LLVKDONJSA-N 0 3 380.311 3.273 10 0 GGAEHN COc1c(Br)cc(CN[C@H]2C[C@@](C)(O)C2)cc1Br ZINC000669574140 566312236 /nfs/dbraw/zinc/31/22/36/566312236.db2.gz SIUIHCPFAIFRHW-SWZMTVOYSA-N 0 3 379.092 3.223 10 0 GGAEHN CN(C)C1(CNC(=O)N[C@@H]2CCOc3ccc(Br)cc32)CCC1 ZINC000445842330 566313815 /nfs/dbraw/zinc/31/38/15/566313815.db2.gz YTNWYIFTPLHPCA-CQSZACIVSA-N 0 3 382.302 3.056 10 0 GGAEHN CC1(C)COCCN1CCN[C@H]1CCCOc2ccc(Br)cc21 ZINC000482535991 566315480 /nfs/dbraw/zinc/31/54/80/566315480.db2.gz PSHZWXYDVCQTQK-INIZCTEOSA-N 0 3 383.330 3.363 10 0 GGAEHN Cc1cc(Br)c(S(=O)(=O)[N-]CC[N@@H+](C)C2CCCCC2)s1 ZINC000462529911 566316828 /nfs/dbraw/zinc/31/68/28/566316828.db2.gz RWBXWVJMNFGWAS-UHFFFAOYSA-N 0 3 395.388 3.362 10 0 GGAEHN Cc1cc(Br)c(S(=O)(=O)[N-]CC[N@H+](C)C2CCCCC2)s1 ZINC000462529911 566316833 /nfs/dbraw/zinc/31/68/33/566316833.db2.gz RWBXWVJMNFGWAS-UHFFFAOYSA-N 0 3 395.388 3.362 10 0 GGAEHN O=C1Nc2ccc(Br)cc2CC[C@H]1N1CC[C@@]2(C1)CCCOC2 ZINC000625402087 566318306 /nfs/dbraw/zinc/31/83/06/566318306.db2.gz DCYBAAIJLQVMLO-SJLPKXTDSA-N 0 3 379.298 3.205 10 0 GGAEHN C[C@H](N[C@@H](CO)C[C@@H](O)C(C)(C)C)c1ccc(I)cc1 ZINC000556605555 566318288 /nfs/dbraw/zinc/31/82/88/566318288.db2.gz ARDUHERCAKOYEH-NILFDRSVSA-N 0 3 391.293 3.100 10 0 GGAEHN C[C@]1(CNCC(=O)Nc2ccc(I)cc2)CCCS1 ZINC000600157225 566319698 /nfs/dbraw/zinc/31/96/98/566319698.db2.gz SZAJUPUGHBNMJP-CQSZACIVSA-N 0 3 390.290 3.105 10 0 GGAEHN COC(=O)[C@@H]1CN(Cc2cnc(C)o2)C[C@H]1c1ccc(Br)cc1 ZINC000600163854 566320408 /nfs/dbraw/zinc/32/04/08/566320408.db2.gz BXGSHGIDRNTXFY-JKSUJKDBSA-N 0 3 379.254 3.134 10 0 GGAEHN C[C@H](CC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)n1cc(Br)cn1 ZINC000648842547 566320877 /nfs/dbraw/zinc/32/08/77/566320877.db2.gz BYSIOZVSLFRDBQ-RPVQJOFSSA-N 0 3 391.313 3.158 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N(C)C[C@H]1CCCN1C ZINC000420832333 566322387 /nfs/dbraw/zinc/32/23/87/566322387.db2.gz KKIPSQYSHBUEHP-GXTWGEPZSA-N 0 3 384.318 3.254 10 0 GGAEHN C[C@@H](NC(C)(C)CNC(=O)c1cc[nH]c(=O)c1Br)c1ccccc1 ZINC000446076185 566327081 /nfs/dbraw/zinc/32/70/81/566327081.db2.gz FPDUAENOZPYVLL-GFCCVEGCSA-N 0 3 392.297 3.409 10 0 GGAEHN CCN1CCCC[C@@H]1CNC(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000625469565 566327101 /nfs/dbraw/zinc/32/71/01/566327101.db2.gz UYHNDMPSVPITKM-UOAMXJAYSA-N 0 3 377.326 3.325 10 0 GGAEHN COC[C@H]1CCCN([C@H]2CCc3cc(Br)ccc3NC2=O)CC1 ZINC000625466083 566327388 /nfs/dbraw/zinc/32/73/88/566327388.db2.gz WIYAEEFXCUKAME-GUYCJALGSA-N 0 3 381.314 3.451 10 0 GGAEHN CN(C(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)[C@@H]1CCN(C2CC2)C1 ZINC000625487527 566327448 /nfs/dbraw/zinc/32/74/48/566327448.db2.gz XNRGSCDOACUNCG-ZYRRHWMLSA-N 0 3 375.310 3.030 10 0 GGAEHN CN(C[C@@H]1CCCN1C)C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000420875536 566327504 /nfs/dbraw/zinc/32/75/04/566327504.db2.gz ZTFWBCXLDOYXAK-WFASDCNBSA-N 0 3 382.302 3.008 10 0 GGAEHN CN(C[C@H]1CCCN1C)C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000420875527 566327565 /nfs/dbraw/zinc/32/75/65/566327565.db2.gz ZTFWBCXLDOYXAK-DOMZBBRYSA-N 0 3 382.302 3.008 10 0 GGAEHN CNC(=O)CCOC1CCN(C[C@@H](C)c2cccc(Br)c2)CC1 ZINC000535801423 566328224 /nfs/dbraw/zinc/32/82/24/566328224.db2.gz MNASARXPXSECBI-CQSZACIVSA-N 0 3 383.330 3.170 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)CCCC(=O)c1ccc(Br)cc1 ZINC000446094844 566329409 /nfs/dbraw/zinc/32/94/09/566329409.db2.gz KPAHXLSIIBODNA-MRXNPFEDSA-N 0 3 381.314 3.355 10 0 GGAEHN CN1CCC[C@@H]1CNC(=O)c1c(F)ccc(C(F)(F)F)c1Br ZINC000625566431 566337213 /nfs/dbraw/zinc/33/72/13/566337213.db2.gz MKEVYUALWOUWFO-MRVPVSSYSA-N 0 3 383.183 3.431 10 0 GGAEHN CN(CCOc1ccc(S(N)(=O)=O)cc1)Cc1ccc(C(C)(C)C)s1 ZINC000556894656 566341870 /nfs/dbraw/zinc/34/18/70/566341870.db2.gz GNGCQGAOVGESSN-UHFFFAOYSA-N 0 3 382.551 3.204 10 0 GGAEHN O=C(N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)N1CCN2CCC1CC2 ZINC000576416410 566343680 /nfs/dbraw/zinc/34/36/80/566343680.db2.gz BHDOVVSLGUOKEZ-ZDUSSCGKSA-N 0 3 383.323 3.062 10 0 GGAEHN CN(C)Cc1ccc(S(=O)(=O)NCc2csc(C(F)(F)F)c2)cc1 ZINC000625617023 566343797 /nfs/dbraw/zinc/34/37/97/566343797.db2.gz YLAMINZCQJVHBV-UHFFFAOYSA-N 0 3 378.441 3.307 10 0 GGAEHN Cc1cc(Cl)c2c(c1)[C@@H](NC[C@@H]1CCCCN1S(C)(=O)=O)CCCO2 ZINC000556920593 566344448 /nfs/dbraw/zinc/34/44/48/566344448.db2.gz NHIJFHXCTPOAEB-YOEHRIQHSA-N 0 3 386.945 3.266 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1F)NCC1(S(C)(=O)=O)CCCC1 ZINC000556921871 566344761 /nfs/dbraw/zinc/34/47/61/566344761.db2.gz YKJFFHVXFXYNTQ-LBPRGKRZSA-N 0 3 392.334 3.466 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)N[C@@H](C)C1(S(C)(=O)=O)CC1 ZINC000556921446 566344861 /nfs/dbraw/zinc/34/48/61/566344861.db2.gz VZHNPHTWHFYLLU-MNOVXSKESA-N 0 3 378.307 3.075 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)N[C@H](C)C1(S(C)(=O)=O)CC1 ZINC000556921445 566345126 /nfs/dbraw/zinc/34/51/26/566345126.db2.gz VZHNPHTWHFYLLU-GHMZBOCLSA-N 0 3 378.307 3.075 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)C1(c3c(Cl)cccc3Cl)CC1)CCO2 ZINC000649131375 566347057 /nfs/dbraw/zinc/34/70/57/566347057.db2.gz IZICSAKEBHYDNY-UHFFFAOYSA-N 0 3 383.319 3.348 10 0 GGAEHN CN(C(=O)c1cc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1CCN(C2CC2)C1 ZINC000600570333 566347166 /nfs/dbraw/zinc/34/71/66/566347166.db2.gz AMADSZDFBALHHL-OAHLLOKOSA-N 0 3 389.297 3.148 10 0 GGAEHN Cc1cc(C)c(Br)c(C(=O)N2CCOC3(CCN(C)CC3)C2)c1 ZINC000649130689 566347295 /nfs/dbraw/zinc/34/72/95/566347295.db2.gz RKVAAORHWRYBJM-UHFFFAOYSA-N 0 3 381.314 3.003 10 0 GGAEHN C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CCOC2(CCN(C)CC2)C1 ZINC000649132594 566347643 /nfs/dbraw/zinc/34/76/43/566347643.db2.gz GSYVIXLVQWTROS-ZDUSSCGKSA-N 0 3 387.307 3.084 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)c1ccc(Br)cc1Cl)CCO2 ZINC000649134245 566347663 /nfs/dbraw/zinc/34/76/63/566347663.db2.gz SHWOATCSHKCNTK-UHFFFAOYSA-N 0 3 387.705 3.039 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)c1cc(Cl)ccc1Br)CCO2 ZINC000649135148 566347749 /nfs/dbraw/zinc/34/77/49/566347749.db2.gz NPAQZDVGBXWWMV-UHFFFAOYSA-N 0 3 387.705 3.039 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)c1ccc(Br)c(Cl)c1)CCO2 ZINC000649131492 566348074 /nfs/dbraw/zinc/34/80/74/566348074.db2.gz ONCCFDDORIRGCW-UHFFFAOYSA-N 0 3 387.705 3.039 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)CCCc1ccccc1Br)CCO2 ZINC000649131544 566348153 /nfs/dbraw/zinc/34/81/53/566348153.db2.gz QMEBEDQNFNTCOZ-UHFFFAOYSA-N 0 3 395.341 3.095 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)[C@@H]1COc2ccc(Br)cc21 ZINC000576467118 566348499 /nfs/dbraw/zinc/34/84/99/566348499.db2.gz ZVFFEBDGDITPAJ-IAGOWNOFSA-N 0 3 387.277 3.010 10 0 GGAEHN CC[C@H](CN1CCCC1)NC(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000625671436 566349320 /nfs/dbraw/zinc/34/93/20/566349320.db2.gz JGQKVTFVEDTRLL-ZYRRHWMLSA-N 0 3 377.326 3.325 10 0 GGAEHN O=C([C@H]1CN2CCN1CCC2)N1CCC(c2cccc(Cl)c2Cl)CC1 ZINC000462771556 566351214 /nfs/dbraw/zinc/35/12/14/566351214.db2.gz FWACELFVLFQEET-QGZVFWFLSA-N 0 3 382.335 3.089 10 0 GGAEHN CC(C)CC[C@@H](NCc1ccc(S(=O)(=O)N2CCOCC2)s1)C1CC1 ZINC000670153824 566352628 /nfs/dbraw/zinc/35/26/28/566352628.db2.gz CHQYBXRYYJEKGL-QGZVFWFLSA-N 0 3 386.583 3.073 10 0 GGAEHN CN(C)C[C@H]1CN(C(=O)Cc2sccc2Br)c2ccccc2O1 ZINC000649199074 566353300 /nfs/dbraw/zinc/35/33/00/566353300.db2.gz FQMWNBOAAZDRHB-LBPRGKRZSA-N 0 3 395.322 3.409 10 0 GGAEHN O=C(NC1CCN(CCOc2ccc(Br)cc2)CC1)C12CC(C1)C2 ZINC000625719574 566354418 /nfs/dbraw/zinc/35/44/18/566354418.db2.gz SOGIKFWGUPZKOJ-UHFFFAOYSA-N 0 3 393.325 3.209 10 0 GGAEHN O=C(COc1ccccc1)N1CC[C@H](NCc2cc(Br)cs2)C1 ZINC000510003843 566355355 /nfs/dbraw/zinc/35/53/55/566355355.db2.gz FNOOWKVYVNMVIJ-AWEZNQCLSA-N 0 3 395.322 3.280 10 0 GGAEHN CCCC[C@@](C)(NC[C@@H](O)CN1CCOCC1)c1cccc(Br)c1 ZINC000483064716 566356951 /nfs/dbraw/zinc/35/69/51/566356951.db2.gz YZILBTOIBIOGEP-RTBURBONSA-N 0 3 399.373 3.137 10 0 GGAEHN CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000510024569 566357120 /nfs/dbraw/zinc/35/71/20/566357120.db2.gz VZENNTJAZYNCAF-WOSRLPQWSA-N 0 3 385.961 3.097 10 0 GGAEHN CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000510024568 566357754 /nfs/dbraw/zinc/35/77/54/566357754.db2.gz VZENNTJAZYNCAF-HEHGZKQESA-N 0 3 385.961 3.097 10 0 GGAEHN OCc1ccc(F)c(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)c1 ZINC000625796234 566360542 /nfs/dbraw/zinc/36/05/42/566360542.db2.gz IPDIFIVKPQILBU-IBGZPJMESA-N 0 3 394.284 3.090 10 0 GGAEHN CN(Cc1nc(-c2cc(Br)cs2)no1)[C@H]1CCN(C2CC2)C1 ZINC000600728004 566360963 /nfs/dbraw/zinc/36/09/63/566360963.db2.gz PUTJQEPUQOCRPE-LBPRGKRZSA-N 0 3 383.315 3.229 10 0 GGAEHN O=C([C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)N1CCNC2(CCCCC2)C1 ZINC000625811824 566361144 /nfs/dbraw/zinc/36/11/44/566361144.db2.gz MUFPTPYDCQEOCJ-BPQIPLTHSA-N 0 3 389.337 3.470 10 0 GGAEHN CCc1ccc(CN[C@]2(CO)CCc3cc(Br)ccc3C2)nc1 ZINC000625797164 566361307 /nfs/dbraw/zinc/36/13/07/566361307.db2.gz RBZQATXADXSZKD-LJQANCHMSA-N 0 3 375.310 3.416 10 0 GGAEHN CC1(C)CCC[C@](CO)(NCC(=O)Nc2ccc(Br)cc2F)C1 ZINC000625833763 566362858 /nfs/dbraw/zinc/36/28/58/566362858.db2.gz ZNOZPNDEYDWHCY-KRWDZBQOSA-N 0 3 387.293 3.448 10 0 GGAEHN COc1cnccc1N1CCN(CCOc2ccccc2Br)CC1 ZINC000483210045 566363963 /nfs/dbraw/zinc/36/39/63/566363963.db2.gz LAZWGZNQJUOSDZ-UHFFFAOYSA-N 0 3 392.297 3.054 10 0 GGAEHN CN(CC(=O)N1CCC[C@H]1c1ccccc1I)C1CCC1 ZINC000600817783 566367661 /nfs/dbraw/zinc/36/76/61/566367661.db2.gz SXICDXBSODYJCB-INIZCTEOSA-N 0 3 398.288 3.439 10 0 GGAEHN CCc1nc(CN2CCC(CNCc3nn(C)c(C)c3Cl)CC2)cs1 ZINC000421363672 566367874 /nfs/dbraw/zinc/36/78/74/566367874.db2.gz LWOFKFFVIFIBLQ-UHFFFAOYSA-N 0 3 381.977 3.403 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)NC2CC(F)(c3cccc(Cl)c3)C2)CCSC1 ZINC000483247160 566368132 /nfs/dbraw/zinc/36/81/32/566368132.db2.gz WJXBLSJZHXJMAD-IIIMJFFVSA-N 0 3 385.936 3.404 10 0 GGAEHN CN(C)C[C@H](NC[C@H](O)COCc1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000625983124 566372625 /nfs/dbraw/zinc/37/26/25/566372625.db2.gz GLUPYNYFLRBEQU-KSSFIOAISA-N 0 3 387.307 3.356 10 0 GGAEHN C[C@@H](CN1CCC(CNS(C)(=O)=O)CC1)c1ccc(C(F)(F)F)cc1 ZINC000510262207 566372674 /nfs/dbraw/zinc/37/26/74/566372674.db2.gz ZQEFYCIIOORNCS-ZDUSSCGKSA-N 0 3 378.460 3.070 10 0 GGAEHN CN(C)C[C@H](NCC[C@@H]1CCS(=O)(=O)C1)c1ccc(Cl)c(Cl)c1 ZINC000625983601 566373231 /nfs/dbraw/zinc/37/32/31/566373231.db2.gz UWAHBHVIVOHHCT-WBMJQRKESA-N 0 3 379.353 3.011 10 0 GGAEHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1nscc1Br ZINC000649578060 566374744 /nfs/dbraw/zinc/37/47/44/566374744.db2.gz DVAKSTVOEAKUDN-CQSZACIVSA-N 0 3 380.311 3.473 10 0 GGAEHN CN(C)S(=O)(=O)c1ccc(CN[C@@H]2CCC[C@@H]2Cc2ccccc2)s1 ZINC000557257869 566375338 /nfs/dbraw/zinc/37/53/38/566375338.db2.gz GLUARRCLJKPYFT-SJLPKXTDSA-N 0 3 378.563 3.499 10 0 GGAEHN CN(C)S(=O)(=O)c1ccc(CN[C@@H]2CCC[C@H]2Cc2ccccc2)s1 ZINC000557257868 566376296 /nfs/dbraw/zinc/37/62/96/566376296.db2.gz GLUARRCLJKPYFT-FUHWJXTLSA-N 0 3 378.563 3.499 10 0 GGAEHN CS[C@H]1CN(C(=O)Cc2ccc(Br)cc2C)C[C@@H]1N1CCCC1 ZINC000483389011 566378964 /nfs/dbraw/zinc/37/89/64/566378964.db2.gz BTGFHLLNCJXFNT-IRXDYDNUSA-N 0 3 397.382 3.338 10 0 GGAEHN CS[C@H]1CN(C(=O)Cc2ccc(Br)cc2C)C[C@H]1N1CCCC1 ZINC000483389357 566379141 /nfs/dbraw/zinc/37/91/41/566379141.db2.gz BTGFHLLNCJXFNT-SJORKVTESA-N 0 3 397.382 3.338 10 0 GGAEHN CS[C@H]1CN(C(=O)c2ccc(F)cc2C(F)(F)F)C[C@H]1N1CCCC1 ZINC000483387590 566379542 /nfs/dbraw/zinc/37/95/42/566379542.db2.gz CBRCNOXIIJGBLF-CABCVRRESA-N 0 3 376.419 3.496 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cc(C)cc(Br)c2)C[C@H]1N1CCCC1 ZINC000483400704 566380779 /nfs/dbraw/zinc/38/07/79/566380779.db2.gz DISBMKIGIZZQJQ-CVEARBPZSA-N 0 3 383.355 3.409 10 0 GGAEHN Cc1cc(C(=O)Nc2cnn(CCN(C)C)c2)cc(Cl)c1Br ZINC000670779891 566381291 /nfs/dbraw/zinc/38/12/91/566381291.db2.gz SKCDQDSVGJGXCA-UHFFFAOYSA-N 0 3 385.693 3.421 10 0 GGAEHN OCC[C@@]1(NCc2cnc(-c3ccc(Br)cc3)s2)CCOC1 ZINC000447062575 566382471 /nfs/dbraw/zinc/38/24/71/566382471.db2.gz BNXHTMWEDGRQFX-MRXNPFEDSA-N 0 3 383.311 3.204 10 0 GGAEHN CCCN(CCN1CCCC1)C(=O)c1n[nH]c2ccc(Br)cc21 ZINC000557419192 566385020 /nfs/dbraw/zinc/38/50/20/566385020.db2.gz BYKOICWHYDTZMN-UHFFFAOYSA-N 0 3 379.302 3.273 10 0 GGAEHN C[C@@]1(Cc2cccc(Cl)c2)CCCN1C[C@@H]1CCCN(S(C)(=O)=O)C1 ZINC000649684189 566385936 /nfs/dbraw/zinc/38/59/36/566385936.db2.gz IKKAZYQGAAUEOJ-HKUYNNGSSA-N 0 3 384.973 3.409 10 0 GGAEHN C[C@H](NC(=O)C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1)c1cc(Cl)ccc1Cl ZINC000670925271 566388594 /nfs/dbraw/zinc/38/85/94/566388594.db2.gz NWJZYEZWEUTNCA-MBNYWOFBSA-N 0 3 386.323 3.112 10 0 GGAEHN C[C@H](NC(=O)C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1)c1cc(Cl)ccc1Cl ZINC000670925270 566388776 /nfs/dbraw/zinc/38/87/76/566388776.db2.gz NWJZYEZWEUTNCA-DYEKYZERSA-N 0 3 386.323 3.112 10 0 GGAEHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)c1cc[nH]c(=O)c1Br)N(C)C ZINC000510514545 566388928 /nfs/dbraw/zinc/38/89/28/566388928.db2.gz UYLRDWGCQUEZFR-WBMJQRKESA-N 0 3 392.297 3.279 10 0 GGAEHN CN(C(=O)[C@H]1CCOc2ccc(Br)cc21)[C@@H]1CCN(C2CC2)C1 ZINC000649723347 566388980 /nfs/dbraw/zinc/38/89/80/566388980.db2.gz IJBTXHANJIIMGA-CABCVRRESA-N 0 3 379.298 3.010 10 0 GGAEHN O=C([C@@H]1CCCN(CCOc2cccc(Br)c2)C1)N1CCCC1 ZINC000601073467 566389202 /nfs/dbraw/zinc/38/92/02/566389202.db2.gz HKNRKVOIWWVNSW-OAHLLOKOSA-N 0 3 381.314 3.162 10 0 GGAEHN CN(C(=O)[C@H]1CCOc2ccc(Br)cc21)[C@H]1CCN(C2CC2)C1 ZINC000649723348 566389614 /nfs/dbraw/zinc/38/96/14/566389614.db2.gz IJBTXHANJIIMGA-GJZGRUSLSA-N 0 3 379.298 3.010 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)[C@H]2CCOc3ccc(Br)cc32)CCN1C ZINC000649765568 566390826 /nfs/dbraw/zinc/39/08/26/566390826.db2.gz ZTGZDRLMPPVUIZ-YUELXQCFSA-N 0 3 381.314 3.256 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000649764438 566391109 /nfs/dbraw/zinc/39/11/09/566391109.db2.gz CHMXPOQJLUODDI-INWMFGNUSA-N 0 3 381.314 3.114 10 0 GGAEHN Nc1c(Br)cc(Br)cc1CNCC1(CCO)CCC1 ZINC000463228260 566393319 /nfs/dbraw/zinc/39/33/19/566393319.db2.gz BDLKYLXPRPPZCK-UHFFFAOYSA-N 0 3 392.135 3.436 10 0 GGAEHN CN1CC[C@@H]2[C@H](CCCN2C(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)C1 ZINC000626197104 566393502 /nfs/dbraw/zinc/39/35/02/566393502.db2.gz GCHYONNWBSCLBE-NOFZEOBUSA-N 0 3 389.337 3.278 10 0 GGAEHN C[C@@H](CCNCc1cc(Br)cc(Br)c1N)[S@](C)=O ZINC000463239084 566394780 /nfs/dbraw/zinc/39/47/80/566394780.db2.gz UIPLDKAGTXJSSZ-ASCAZGACSA-N 0 3 398.164 3.041 10 0 GGAEHN C[C@H](CCNCc1cc(Br)cc(Br)c1N)[S@](C)=O ZINC000463239085 566394783 /nfs/dbraw/zinc/39/47/83/566394783.db2.gz UIPLDKAGTXJSSZ-CVJBHZAOSA-N 0 3 398.164 3.041 10 0 GGAEHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000649816516 566397088 /nfs/dbraw/zinc/39/70/88/566397088.db2.gz OCPLVSLSHIAOLG-OWCLPIDISA-N 0 3 393.325 3.400 10 0 GGAEHN Fc1ccc2c(c1)C[C@@H](NCc1cnc3ccc(Br)cn13)CO2 ZINC000577022172 566398595 /nfs/dbraw/zinc/39/85/95/566398595.db2.gz PLOXJNJZXZSJCT-CQSZACIVSA-N 0 3 376.229 3.329 10 0 GGAEHN CN1CC[C@@H]2[C@H](CCCN2C(=O)[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000649849033 566399126 /nfs/dbraw/zinc/39/91/26/566399126.db2.gz KVFHDAPJKCFRQT-UKPHBRMFSA-N 0 3 393.325 3.258 10 0 GGAEHN COCCN1CCN(CCC(=O)Nc2c(Cl)cccc2Cl)C(C)(C)C1 ZINC000649850099 566399358 /nfs/dbraw/zinc/39/93/58/566399358.db2.gz YNXJUGFOQCSUKY-UHFFFAOYSA-N 0 3 388.339 3.365 10 0 GGAEHN COCCN1CCN(CCCc2ccc(Br)cc2OC)C(C)(C)C1 ZINC000649850623 566400380 /nfs/dbraw/zinc/40/03/80/566400380.db2.gz XSBLEHMARBABNB-UHFFFAOYSA-N 0 3 399.373 3.433 10 0 GGAEHN Cc1ccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cc1S(C)(=O)=O ZINC000649871271 566400830 /nfs/dbraw/zinc/40/08/30/566400830.db2.gz WRDRMHYAROTGBZ-OLZOCXBDSA-N 0 3 379.400 3.085 10 0 GGAEHN Cc1cc(Br)ccc1NC(=O)CN(C)C(=O)CN[C@H](C)C(C)(C)C ZINC000649861554 566401741 /nfs/dbraw/zinc/40/17/41/566401741.db2.gz KKUBCSMXXOBOLW-CYBMUJFWSA-N 0 3 398.345 3.179 10 0 GGAEHN Cc1ccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cc1S(C)(=O)=O ZINC000649871270 566401768 /nfs/dbraw/zinc/40/17/68/566401768.db2.gz WRDRMHYAROTGBZ-CHWSQXEVSA-N 0 3 379.400 3.085 10 0 GGAEHN Cc1cc(C(=O)N(C)C[C@@H]2CCCN2C)nn1-c1ccc(Br)cc1 ZINC000421715993 566403618 /nfs/dbraw/zinc/40/36/18/566403618.db2.gz ZLJHNOKUSWNMSK-INIZCTEOSA-N 0 3 391.313 3.109 10 0 GGAEHN O[C@@H](COc1cc(F)cc(Br)c1)CN1CC[C@@]2(CC2(F)F)C1 ZINC000649908216 566404137 /nfs/dbraw/zinc/40/41/37/566404137.db2.gz JOCNMZRXIXCRLO-TZMCWYRMSA-N 0 3 380.204 3.059 10 0 GGAEHN O[C@H](COc1cc(F)cc(Br)c1)CN1CC[C@]2(CC2(F)F)C1 ZINC000649908214 566404864 /nfs/dbraw/zinc/40/48/64/566404864.db2.gz JOCNMZRXIXCRLO-JSGCOSHPSA-N 0 3 380.204 3.059 10 0 GGAEHN C[C@@H](NCCC1CCS(=O)(=O)CC1)c1cc(Br)ccc1F ZINC000536842468 566405008 /nfs/dbraw/zinc/40/50/08/566405008.db2.gz XMDKUXLUADZVIN-LLVKDONJSA-N 0 3 378.307 3.454 10 0 GGAEHN CCSc1ccc(CC(=O)NCC2=CCN(C)CC2)c(Br)c1 ZINC000626367922 566405543 /nfs/dbraw/zinc/40/55/43/566405543.db2.gz UASRADJMANKEOG-UHFFFAOYSA-N 0 3 383.355 3.482 10 0 GGAEHN CN1CCC2(CCCN2C(=O)[C@H]2CCOc3ccc(Br)cc32)CC1 ZINC000649934808 566406802 /nfs/dbraw/zinc/40/68/02/566406802.db2.gz BRKUNWCNHYYSPJ-HNNXBMFYSA-N 0 3 393.325 3.402 10 0 GGAEHN CCNC(=O)N1CC[C@H](N[C@@H]2CCc3c2cc(Br)cc3Cl)C1 ZINC000536854440 566407602 /nfs/dbraw/zinc/40/76/02/566407602.db2.gz XQTUNPVGTZQLSW-XHDPSFHLSA-N 0 3 386.721 3.483 10 0 GGAEHN COC[C@@](C)(CO)NCc1cc(Br)c(C)c(Br)c1 ZINC000671190911 566408063 /nfs/dbraw/zinc/40/80/63/566408063.db2.gz LUYONKRHBXHITG-CYBMUJFWSA-N 0 3 381.108 3.007 10 0 GGAEHN CCNC(=O)N1CC[C@H](N[C@H]2CCc3c2cc(Br)cc3Cl)C1 ZINC000536854438 566407587 /nfs/dbraw/zinc/40/75/87/566407587.db2.gz XQTUNPVGTZQLSW-NHYWBVRUSA-N 0 3 386.721 3.483 10 0 GGAEHN Cc1nccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)c1Br ZINC000649949054 566407728 /nfs/dbraw/zinc/40/77/28/566407728.db2.gz NGOGUNXFVHWTCJ-UWVGGRQHSA-N 0 3 381.192 3.261 10 0 GGAEHN COc1cc(C[NH2+]CCc2ccc3c[nH]nc3c2)cc(Br)c1[O-] ZINC000671193414 566407947 /nfs/dbraw/zinc/40/79/47/566407947.db2.gz UNVFWJHAKLCAAB-UHFFFAOYSA-N 0 3 376.254 3.372 10 0 GGAEHN CC[C@@H]1C[C@H](N[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)CCO1 ZINC000421849467 566411464 /nfs/dbraw/zinc/41/14/64/566411464.db2.gz BUNLZNCDHNUQHE-GMTAPVOTSA-N 0 3 381.325 3.249 10 0 GGAEHN CC[C@@H]1C[C@@H](N[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)CCO1 ZINC000421849466 566412264 /nfs/dbraw/zinc/41/22/64/566412264.db2.gz BUNLZNCDHNUQHE-GARJFASQSA-N 0 3 381.325 3.249 10 0 GGAEHN C[C@H](CNC(=O)N(C)[C@H]1CCN(C2CC2)C1)Oc1ccccc1Br ZINC000484009244 566412360 /nfs/dbraw/zinc/41/23/60/566412360.db2.gz PCBJGSTVJHXEHU-HIFRSBDPSA-N 0 3 396.329 3.095 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@H](C)OCC1CC1)c1ccc(Br)cn1 ZINC000649988971 566412581 /nfs/dbraw/zinc/41/25/81/566412581.db2.gz VQPGHIJTSHDNKZ-AWEZNQCLSA-N 0 3 398.345 3.334 10 0 GGAEHN CN(Cc1ccccc1Br)C(=O)CN1CCCCC[C@H]1CCO ZINC000671247818 566412876 /nfs/dbraw/zinc/41/28/76/566412876.db2.gz GBXAWPHELJEQFL-INIZCTEOSA-N 0 3 383.330 3.035 10 0 GGAEHN CN(Cc1cc(Br)cs1)C(=O)CN1CCCCC[C@@H]1CCO ZINC000671248456 566413084 /nfs/dbraw/zinc/41/30/84/566413084.db2.gz WCGAOOZJAMGYMA-CQSZACIVSA-N 0 3 389.359 3.096 10 0 GGAEHN C[C@H](NC(=O)CN1CCCCC[C@@H]1CCO)c1ccc(Br)cc1 ZINC000671248370 566413373 /nfs/dbraw/zinc/41/33/73/566413373.db2.gz RKLQMUOKHVXCBX-WMLDXEAASA-N 0 3 383.330 3.253 10 0 GGAEHN C[C@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CC[C@]2(C1)CCCOC2 ZINC000671254310 566413418 /nfs/dbraw/zinc/41/34/18/566413418.db2.gz BMSGNNADCWDKIQ-BEFAXECRSA-N 0 3 395.341 3.299 10 0 GGAEHN Cc1ccc(I)c(C(=O)NCCN2CCC(C)CC2)c1 ZINC000510801744 566414321 /nfs/dbraw/zinc/41/43/21/566414321.db2.gz AQLCJUHFWSLEOF-UHFFFAOYSA-N 0 3 386.277 3.061 10 0 GGAEHN CSC1CCN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CC1 ZINC000601601674 566414532 /nfs/dbraw/zinc/41/45/32/566414532.db2.gz MWRAFUUPMWCSQA-UHFFFAOYSA-N 0 3 379.492 3.329 10 0 GGAEHN COC[C@H](NCc1cnn(-c2ccc(Br)cc2)c1)C1CCOCC1 ZINC000447560637 566415480 /nfs/dbraw/zinc/41/54/80/566415480.db2.gz XAEFFPKJSMHRJP-SFHVURJKSA-N 0 3 394.313 3.166 10 0 GGAEHN Cc1ccc(I)c(C(=O)NCCN2CCC[C@@H](C)C2)c1 ZINC000510851586 566417783 /nfs/dbraw/zinc/41/77/83/566417783.db2.gz HNMGXNOYYKZRPK-CYBMUJFWSA-N 0 3 386.277 3.061 10 0 GGAEHN O=C(CC(F)(F)F)NC[C@H]1CCCN(CCOc2ccc(Cl)cc2)C1 ZINC000510930892 566420124 /nfs/dbraw/zinc/42/01/24/566420124.db2.gz JLQCTBFSJSLLDX-CYBMUJFWSA-N 0 3 378.822 3.499 10 0 GGAEHN CCO[C@@H]1C[C@H](NCc2ccc(S(=O)(=O)N(C)C)s2)C12CCCCC2 ZINC000557792533 566420736 /nfs/dbraw/zinc/42/07/36/566420736.db2.gz UYGUQWLUBDGFGL-JKSUJKDBSA-N 0 3 386.583 3.216 10 0 GGAEHN CC(C)N1CC[C@H](N(C)C(=O)[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000650085758 566421436 /nfs/dbraw/zinc/42/14/36/566421436.db2.gz XRIJEQZLJFLNGL-GJZGRUSLSA-N 0 3 381.314 3.256 10 0 GGAEHN O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCOc2ccc(Cl)cc2)C1 ZINC000510930893 566421354 /nfs/dbraw/zinc/42/13/54/566421354.db2.gz JLQCTBFSJSLLDX-ZDUSSCGKSA-N 0 3 378.822 3.499 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)COc1ccccc1Br ZINC000484302553 566425489 /nfs/dbraw/zinc/42/54/89/566425489.db2.gz CFPMLDSXEPAEPQ-INIZCTEOSA-N 0 3 391.309 3.117 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)COc1ccccc1Br ZINC000484302554 566425630 /nfs/dbraw/zinc/42/56/30/566425630.db2.gz CFPMLDSXEPAEPQ-MRXNPFEDSA-N 0 3 391.309 3.117 10 0 GGAEHN CN1CCC2(CCCN2C(=O)NCCc2ccccc2Br)CC1 ZINC000510984482 566426010 /nfs/dbraw/zinc/42/60/10/566426010.db2.gz KDFDFRLWPDRHBB-UHFFFAOYSA-N 0 3 380.330 3.261 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1C(=O)N(C)C[C@@H]1CCCN1C ZINC000422033333 566427976 /nfs/dbraw/zinc/42/79/76/566427976.db2.gz HHJQKWGMDJVSLA-INIZCTEOSA-N 0 3 391.313 3.109 10 0 GGAEHN COCCCN1CCC(NC(=O)N2CCc3c2cccc3Br)CC1 ZINC000422162809 566437505 /nfs/dbraw/zinc/43/75/05/566437505.db2.gz WBOIPAVWBMEMLY-UHFFFAOYSA-N 0 3 396.329 3.022 10 0 GGAEHN CO[C@@H](CS(=O)(=O)[N-]c1ccc(SCC[NH+]2CCCC2)cc1)C1CC1 ZINC000650218160 566439292 /nfs/dbraw/zinc/43/92/92/566439292.db2.gz UGBUAXSUKXLQOR-SFHVURJKSA-N 0 3 384.567 3.041 10 0 GGAEHN O=C(C(=O)N1CCC[C@@H]1CN1CCCCC1)c1ccc(Br)cc1 ZINC000511132363 566440483 /nfs/dbraw/zinc/44/04/83/566440483.db2.gz WGTNLAGSZIFGQE-MRXNPFEDSA-N 0 3 379.298 3.109 10 0 GGAEHN Cn1nccc1[C@H]1CCCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000511134557 566440828 /nfs/dbraw/zinc/44/08/28/566440828.db2.gz GBCHCFFPWGSVCU-UONOGXRCSA-N 0 3 384.307 3.346 10 0 GGAEHN COc1ccc(COCCN[C@@](C)(CO)c2ccc(Br)cc2)cc1 ZINC000671708214 566442412 /nfs/dbraw/zinc/44/24/12/566442412.db2.gz BSSAVODMKKDEIS-IBGZPJMESA-N 0 3 394.309 3.472 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1cc(F)c(Br)c(Cl)c1 ZINC000511210152 566444988 /nfs/dbraw/zinc/44/49/88/566444988.db2.gz TVBULZNWHBGDPL-LLVKDONJSA-N 0 3 393.684 3.082 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1cccc2cccc(Br)c21 ZINC000511210546 566445834 /nfs/dbraw/zinc/44/58/34/566445834.db2.gz YDAJJEKVLIUCPY-HNNXBMFYSA-N 0 3 391.309 3.443 10 0 GGAEHN C[C@H](NC(=O)N1CCc2cc(Br)cc(F)c21)C1=CCN(C)CC1 ZINC000511247904 566448202 /nfs/dbraw/zinc/44/82/02/566448202.db2.gz KZZCHKWKNQDRJW-NSHDSACASA-N 0 3 382.277 3.311 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@@H]1CN[C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000671769482 566449620 /nfs/dbraw/zinc/44/96/20/566449620.db2.gz ZYTNDQWVXFLYSE-IAQYHMDHSA-N 0 3 377.337 3.384 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)N[C@@H](C)C1=CCN(C)CC1)CC2 ZINC000511273238 566449819 /nfs/dbraw/zinc/44/98/19/566449819.db2.gz LXDNERFEDGFWPE-AWEZNQCLSA-N 0 3 392.341 3.476 10 0 GGAEHN Cc1nc([C@@H]2CCCN(C[C@H](O)COc3c(Cl)cccc3Cl)C2)n[nH]1 ZINC000537562218 566451326 /nfs/dbraw/zinc/45/13/26/566451326.db2.gz MARYLLDHMGKWCZ-OLZOCXBDSA-N 0 3 385.295 3.039 10 0 GGAEHN Cc1n[nH]c([C@@H]2CCCN(C[C@H](O)COc3c(Cl)cccc3Cl)C2)n1 ZINC000537562218 566451332 /nfs/dbraw/zinc/45/13/32/566451332.db2.gz MARYLLDHMGKWCZ-OLZOCXBDSA-N 0 3 385.295 3.039 10 0 GGAEHN Cc1nnc([C@@H]2CCCN(C[C@H](O)COc3c(Cl)cccc3Cl)C2)[nH]1 ZINC000537562218 566451338 /nfs/dbraw/zinc/45/13/38/566451338.db2.gz MARYLLDHMGKWCZ-OLZOCXBDSA-N 0 3 385.295 3.039 10 0 GGAEHN CN1CCN(S(=O)(=O)Cc2cc(Cl)sc2Cl)c2cnccc21 ZINC000650455031 566455848 /nfs/dbraw/zinc/45/58/48/566455848.db2.gz HEWYBUHOOINBNW-UHFFFAOYSA-N 0 3 378.306 3.236 10 0 GGAEHN COc1ccc(Br)c2[nH]c(C(=O)N(C)[C@H]3CN4CCC3CC4)cc21 ZINC000558200996 566457763 /nfs/dbraw/zinc/45/77/63/566457763.db2.gz SRACIFHPOSUZJK-HNNXBMFYSA-N 0 3 392.297 3.105 10 0 GGAEHN CN(C)[C@H](CNC(=O)CN1CCc2sc(Cl)cc2C1)c1ccccc1 ZINC000577726125 566459236 /nfs/dbraw/zinc/45/92/36/566459236.db2.gz NJHCTMAJSHOZMU-MRXNPFEDSA-N 0 3 377.941 3.179 10 0 GGAEHN C[C@H](NC[C@H]1CCN(c2cccc(Br)c2)C1)c1cnccc1N ZINC000422902199 566465459 /nfs/dbraw/zinc/46/54/59/566465459.db2.gz UADYYMBPFWEIBF-UONOGXRCSA-N 0 3 375.314 3.434 10 0 GGAEHN C[C@H](NC[C@@H]1CCN(c2ccc(Br)cc2)C1)c1cnccc1N ZINC000422941499 566467273 /nfs/dbraw/zinc/46/72/73/566467273.db2.gz JIVYPNYJTBXJBG-KBPBESRZSA-N 0 3 375.314 3.434 10 0 GGAEHN Cc1nc(CN)ccc1[C@H](C)NCc1cc(Br)c2c(c1)OCCO2 ZINC000422932181 566467417 /nfs/dbraw/zinc/46/74/17/566467417.db2.gz DXXMZEORFDOFIV-NSHDSACASA-N 0 3 392.297 3.233 10 0 GGAEHN CN(C(=O)N[C@@H]1C[C@H]1c1cccc(Br)c1)[C@@H]1CCN(C2CC2)C1 ZINC000558389385 566468595 /nfs/dbraw/zinc/46/85/95/566468595.db2.gz QHKIOIFYPWWMMY-IXDOHACOSA-N 0 3 378.314 3.183 10 0 GGAEHN Cc1nc(CN)ccc1[C@@H](C)N[C@@H](CCO)c1ccccc1Br ZINC000423026156 566468585 /nfs/dbraw/zinc/46/85/85/566468585.db2.gz ARZPODZQAPBEDE-ACJLOTCBSA-N 0 3 378.314 3.386 10 0 GGAEHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000627161511 566469240 /nfs/dbraw/zinc/46/92/40/566469240.db2.gz SXUYMQDNQWAZRM-HPZZWOGRSA-N 0 3 389.337 3.420 10 0 GGAEHN CN(C(=O)N[C@@H]1C[C@@H]1c1cccc(Br)c1)[C@H]1CCN(C2CC2)C1 ZINC000558389384 566469830 /nfs/dbraw/zinc/46/98/30/566469830.db2.gz QHKIOIFYPWWMMY-GVDBMIGSSA-N 0 3 378.314 3.183 10 0 GGAEHN Cc1nc(CN)ccc1[C@@H](C)N[C@H](CCO)c1ccccc1Br ZINC000423026157 566469774 /nfs/dbraw/zinc/46/97/74/566469774.db2.gz ARZPODZQAPBEDE-FZKQIMNGSA-N 0 3 378.314 3.386 10 0 GGAEHN C[C@@](CO)(NCCC(=O)Nc1ccc(F)cc1)c1ccc(Br)cc1 ZINC000511544373 566470059 /nfs/dbraw/zinc/47/00/59/566470059.db2.gz YUGZFZFZZNOVGB-SFHVURJKSA-N 0 3 395.272 3.414 10 0 GGAEHN O=C(C(=O)N1CCC(N2CCCCC2)CC1)c1ccc(Br)cc1 ZINC000511543435 566470233 /nfs/dbraw/zinc/47/02/33/566470233.db2.gz XFJVQXIRWDXFLA-UHFFFAOYSA-N 0 3 379.298 3.109 10 0 GGAEHN Cc1ccc(S(=O)(=O)C[C@H](C)NC[C@@H]2CSc3ccccc3O2)cc1 ZINC000577849856 566471048 /nfs/dbraw/zinc/47/10/48/566471048.db2.gz JQIUGIXIJGSGSG-JKSUJKDBSA-N 0 3 377.531 3.300 10 0 GGAEHN CCCCN1CCCC[C@@H]1CNC(=O)C(=O)c1ccc(Br)cc1 ZINC000511552712 566471157 /nfs/dbraw/zinc/47/11/57/566471157.db2.gz OYDNQEQHLKYFEG-MRXNPFEDSA-N 0 3 381.314 3.403 10 0 GGAEHN C[C@H]1CCC[C@@](CNC(=O)C(=O)c2ccc(Br)cc2)(N(C)C)C1 ZINC000511560616 566471310 /nfs/dbraw/zinc/47/13/10/566471310.db2.gz OYSHUGJUTZXBOY-SCLBCKFNSA-N 0 3 381.314 3.259 10 0 GGAEHN O=C(N[C@H]1CCCSc2ccc(Br)cc21)N1CCCNCC1 ZINC000627180038 566471379 /nfs/dbraw/zinc/47/13/79/566471379.db2.gz VDTCWGMPHHNGAI-AWEZNQCLSA-N 0 3 384.343 3.381 10 0 GGAEHN C[C@@H]1CCC[C@](CNC(=O)C(=O)c2ccc(Br)cc2)(N(C)C)C1 ZINC000511560614 566472038 /nfs/dbraw/zinc/47/20/38/566472038.db2.gz OYSHUGJUTZXBOY-ACJLOTCBSA-N 0 3 381.314 3.259 10 0 GGAEHN C[C@@H]1CCC[C@@](CNC(=O)C(=O)c2ccc(Br)cc2)(N(C)C)C1 ZINC000511560615 566472217 /nfs/dbraw/zinc/47/22/17/566472217.db2.gz OYSHUGJUTZXBOY-FZKQIMNGSA-N 0 3 381.314 3.259 10 0 GGAEHN N[C@H](C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1)C1CCC1 ZINC000423099784 566474586 /nfs/dbraw/zinc/47/45/86/566474586.db2.gz UHLWCXZQVXHIOP-KRWDZBQOSA-N 0 3 380.275 3.269 10 0 GGAEHN C[C@H]1[C@H](C)N(CCCOc2cccc(I)c2)CCN1C ZINC000537851711 566475947 /nfs/dbraw/zinc/47/59/47/566475947.db2.gz QGIUFQKOXNXZCO-KBPBESRZSA-N 0 3 388.293 3.085 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)c(C)c2)[C@H](C)C1 ZINC000558470931 566476364 /nfs/dbraw/zinc/47/63/64/566476364.db2.gz KOSNBRQTXMYYPR-CJNGLKHVSA-N 0 3 378.460 3.365 10 0 GGAEHN Cn1cnnc1Sc1ccc(NC(=O)[C@@H]2NCCCC2(C)C)cc1Cl ZINC000423111512 566476836 /nfs/dbraw/zinc/47/68/36/566476836.db2.gz WCXJFYNIKUXRGU-AWEZNQCLSA-N 0 3 379.917 3.336 10 0 GGAEHN CCN1CC[C@@H](CNC(=O)CCCC(=O)c2ccc(Br)cc2)C1 ZINC000485119376 566477168 /nfs/dbraw/zinc/47/71/68/566477168.db2.gz NFXYRDNODMLHPS-AWEZNQCLSA-N 0 3 381.314 3.260 10 0 GGAEHN O=C(CCOC1CNC1)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 ZINC000577947381 566479201 /nfs/dbraw/zinc/47/92/01/566479201.db2.gz YKBOTVFYRUWWME-UHFFFAOYSA-N 0 3 382.247 3.498 10 0 GGAEHN Cc1ccc(C[C@H](CO)CN[C@H](C)c2cnccc2N)cc1Br ZINC000423161646 566479862 /nfs/dbraw/zinc/47/98/62/566479862.db2.gz NYBKYQCQIMTFQJ-HIFRSBDPSA-N 0 3 378.314 3.067 10 0 GGAEHN CCS(=O)(=O)c1cc(Cl)cc(CN[C@@H](C)c2ccc(CN)nc2C)c1 ZINC000423165853 566480654 /nfs/dbraw/zinc/48/06/54/566480654.db2.gz BJSVVUDLACDDKG-LBPRGKRZSA-N 0 3 381.929 3.147 10 0 GGAEHN OC[C@@H]1CN(CCCc2nc(-c3cccs3)no2)CC[C@H]1C(F)(F)F ZINC000511681171 566481371 /nfs/dbraw/zinc/48/13/71/566481371.db2.gz KZAWNLVZBSKTEM-NWDGAFQWSA-N 0 3 375.416 3.223 10 0 GGAEHN OC[C@H]1CN(CCCc2nc(-c3cccs3)no2)CC[C@@H]1C(F)(F)F ZINC000511681165 566481781 /nfs/dbraw/zinc/48/17/81/566481781.db2.gz KZAWNLVZBSKTEM-NEPJUHHUSA-N 0 3 375.416 3.223 10 0 GGAEHN CC[C@H](NCCNS(=O)(=O)c1cc(C)sc1C)c1cccc(OC)c1 ZINC000537954937 566482313 /nfs/dbraw/zinc/48/23/13/566482313.db2.gz ZYDYLVHGDNDXTM-KRWDZBQOSA-N 0 3 382.551 3.393 10 0 GGAEHN CC1(C)CCCN[C@H]1C(=O)Nc1nccn1Cc1ccc(Br)cc1 ZINC000423286921 566484411 /nfs/dbraw/zinc/48/44/11/566484411.db2.gz JMFFXTKFPBSZMA-HNNXBMFYSA-N 0 3 391.313 3.411 10 0 GGAEHN Cc1cc(N2CCC[C@@H](N[C@H](C)c3cncc(Br)c3)C2)n(C)n1 ZINC000578027422 566484535 /nfs/dbraw/zinc/48/45/35/566484535.db2.gz ZQOMLVJDJSTPSX-CZUORRHYSA-N 0 3 378.318 3.206 10 0 GGAEHN C[C@H]1C[C@H](NCCN2CCN(C(=O)C3CCC3)CC2)c2ccsc2S1 ZINC000537978204 566484622 /nfs/dbraw/zinc/48/46/22/566484622.db2.gz KPMOMHBMKONOOD-YOEHRIQHSA-N 0 3 379.595 3.207 10 0 GGAEHN Fc1ccc2c(c1Br)CC[C@@H]2Nc1ccc(N2CCNCC2)cn1 ZINC000423242092 566484800 /nfs/dbraw/zinc/48/48/00/566484800.db2.gz YKNZPFRQZWWDLC-INIZCTEOSA-N 0 3 391.288 3.492 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1cc(C(F)(F)F)ccc1Cl ZINC000627518631 566485240 /nfs/dbraw/zinc/48/52/40/566485240.db2.gz PCGREDFNVVEMSD-CABCVRRESA-N 0 3 376.806 3.294 10 0 GGAEHN C[C@@H](N[C@@H]1CNCCC1(F)F)c1ccc(F)c(I)c1 ZINC000423472776 566490083 /nfs/dbraw/zinc/49/00/83/566490083.db2.gz GDIWZVCVJLUROU-PRHODGIISA-N 0 3 384.183 3.078 10 0 GGAEHN COc1ccc(CN[C@@H]2CCCN(c3cc(C)nn3C)C2)c(Br)c1 ZINC000511793201 566488424 /nfs/dbraw/zinc/48/84/24/566488424.db2.gz PLZVAMKXNCZBLM-OAHLLOKOSA-N 0 3 393.329 3.258 10 0 GGAEHN COc1ccc(CN[C@H]2CCCN(c3cc(C)nn3C)C2)c(Br)c1 ZINC000511793199 566488606 /nfs/dbraw/zinc/48/86/06/566488606.db2.gz PLZVAMKXNCZBLM-HNNXBMFYSA-N 0 3 393.329 3.258 10 0 GGAEHN C[C@]1(F)CNCCN(CC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000578070731 566489359 /nfs/dbraw/zinc/48/93/59/566489359.db2.gz DLGOYVUIYOVODM-WMZOPIPTSA-N 0 3 388.314 3.290 10 0 GGAEHN O=C(CCN[C@@H]1CCOc2c(Br)cccc21)Nc1cccnc1 ZINC000558616412 566493454 /nfs/dbraw/zinc/49/34/54/566493454.db2.gz URQVVHNHXSTUEP-OAHLLOKOSA-N 0 3 376.254 3.286 10 0 GGAEHN CSC1(CNC(=O)C2(c3ccccc3Br)CC2)CCN(C)CC1 ZINC000558610171 566493569 /nfs/dbraw/zinc/49/35/69/566493569.db2.gz PAOJFVGCISBYFB-UHFFFAOYSA-N 0 3 397.382 3.424 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)N[C@@H]1C[C@H](C)N(C3CC3)C1)CC2 ZINC000538126631 566494131 /nfs/dbraw/zinc/49/41/31/566494131.db2.gz NEYQJCQQRFNXNP-XJKSGUPXSA-N 0 3 392.341 3.450 10 0 GGAEHN O=C(NCCN1CCCCCC1)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651089624 566494856 /nfs/dbraw/zinc/49/48/56/566494856.db2.gz LMCARYXVPMEASE-OAHLLOKOSA-N 0 3 381.314 3.307 10 0 GGAEHN CC1CCN(CCNC(=O)[C@H]2CCOc3ccc(Br)cc32)CC1 ZINC000651105694 566496231 /nfs/dbraw/zinc/49/62/31/566496231.db2.gz FDEGVFOVNRTEPH-HNNXBMFYSA-N 0 3 381.314 3.163 10 0 GGAEHN C[C@@H](CN1CCCCC1)NC(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651096313 566497113 /nfs/dbraw/zinc/49/71/13/566497113.db2.gz BLOWWUYROIQHLH-DZGCQCFKSA-N 0 3 381.314 3.306 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651108672 566497276 /nfs/dbraw/zinc/49/72/76/566497276.db2.gz UMWLFOMMBUFMAV-DZGCQCFKSA-N 0 3 381.314 3.306 10 0 GGAEHN CC(C)(NCCc1nnnn1-c1ccccc1)c1ccccc1Br ZINC000538225955 566499602 /nfs/dbraw/zinc/49/96/02/566499602.db2.gz HUYNQPJDUBYVJV-UHFFFAOYSA-N 0 3 386.297 3.492 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)Cc1ccc(F)cc1Br ZINC000485470375 566501130 /nfs/dbraw/zinc/50/11/30/566501130.db2.gz QPNZZKLUBURCJY-KRWDZBQOSA-N 0 3 393.300 3.420 10 0 GGAEHN O=C([C@H]1CCOc2ccc(Br)cc21)N1CCC[C@@H]1CN1CCCC1 ZINC000651204415 566502307 /nfs/dbraw/zinc/50/23/07/566502307.db2.gz PHNWQKCMSAYEEI-CVEARBPZSA-N 0 3 393.325 3.402 10 0 GGAEHN O=C(COc1cc(Cl)ccc1Cl)N1CCC(N2CCCOCC2)CC1 ZINC000627738374 566502617 /nfs/dbraw/zinc/50/26/17/566502617.db2.gz RXFQLKRAKAZPBO-UHFFFAOYSA-N 0 3 387.307 3.086 10 0 GGAEHN C[C@@H](C(=O)N1CCC(N2CCCOCC2)CC1)c1cccc(Br)c1 ZINC000627742480 566503046 /nfs/dbraw/zinc/50/30/46/566503046.db2.gz YCCIBBGDJGZAFI-OAHLLOKOSA-N 0 3 395.341 3.266 10 0 GGAEHN COc1ccc(F)cc1[C@@H](C)N[C@@H](C)Cn1cc(Br)ccc1=O ZINC000578227493 566503230 /nfs/dbraw/zinc/50/32/30/566503230.db2.gz MSHXVQWFBCMQHD-NWDGAFQWSA-N 0 3 383.261 3.498 10 0 GGAEHN C[C@H](C(=O)N1CCC(N2CCCOCC2)CC1)c1ccc(Br)cc1 ZINC000627740896 566503318 /nfs/dbraw/zinc/50/33/18/566503318.db2.gz JXSMLDVOZQHPGO-HNNXBMFYSA-N 0 3 395.341 3.266 10 0 GGAEHN COc1cc(Cl)c(Cl)cc1C(=O)N1CCC(N2CCCOCC2)CC1 ZINC000627740611 566503364 /nfs/dbraw/zinc/50/33/64/566503364.db2.gz YDKGRHTVDVVLKH-UHFFFAOYSA-N 0 3 387.307 3.329 10 0 GGAEHN O=C(c1c(Cl)cc(F)cc1Cl)N1CCC(N2CCCOCC2)CC1 ZINC000627741872 566503663 /nfs/dbraw/zinc/50/36/63/566503663.db2.gz YITULMAWYASLIM-UHFFFAOYSA-N 0 3 375.271 3.459 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNCc1ncc(I)s1 ZINC000512003783 566504040 /nfs/dbraw/zinc/50/40/40/566504040.db2.gz ANHVLCWVVANGTN-QWRGUYRKSA-N 0 3 379.311 3.100 10 0 GGAEHN CS(=O)(=O)N1CC[C@H](CNC2(c3cc(C(F)(F)F)ccc3Cl)CC2)C1 ZINC000558740722 566503823 /nfs/dbraw/zinc/50/38/23/566503823.db2.gz CRTMVVLCJRCACH-LLVKDONJSA-N 0 3 396.862 3.219 10 0 GGAEHN COc1ccc(F)cc1[C@H](C)N[C@@H](C)Cn1cc(Br)ccc1=O ZINC000578227494 566503866 /nfs/dbraw/zinc/50/38/66/566503866.db2.gz MSHXVQWFBCMQHD-RYUDHWBXSA-N 0 3 383.261 3.498 10 0 GGAEHN CCN1CCC(N(C)C(=O)[C@@H]2CCOc3ccc(Br)cc32)CC1 ZINC000651235238 566504310 /nfs/dbraw/zinc/50/43/10/566504310.db2.gz NFEKTINUEGQGMN-OAHLLOKOSA-N 0 3 381.314 3.258 10 0 GGAEHN C[C@@H]1CC[C@H](C)N(CC(=O)N2CCN(c3ncc(Cl)cc3Cl)CC2)C1 ZINC000464825412 566506145 /nfs/dbraw/zinc/50/61/45/566506145.db2.gz WZYHHWPLESMKQI-KGLIPLIRSA-N 0 3 385.339 3.157 10 0 GGAEHN C[C@@H]1CC[C@H](C)CN1CC(=O)N1CCN(c2ncc(Cl)cc2Cl)CC1 ZINC000464825413 566506205 /nfs/dbraw/zinc/50/62/05/566506205.db2.gz WZYHHWPLESMKQI-UONOGXRCSA-N 0 3 385.339 3.157 10 0 GGAEHN COc1cnc(NCc2ccc(OCCN(C)C)cc2)c(Br)c1 ZINC000672812097 566506418 /nfs/dbraw/zinc/50/64/18/566506418.db2.gz CDOSOVVOGNAWLA-UHFFFAOYSA-N 0 3 380.286 3.405 10 0 GGAEHN O=C(CCN1CCC[C@H]2COCC[C@H]21)Nc1ccc(Br)cc1F ZINC000464859889 566508482 /nfs/dbraw/zinc/50/84/82/566508482.db2.gz RJCDJVPREYMXCP-BLLLJJGKSA-N 0 3 385.277 3.418 10 0 GGAEHN CN(C)CCOc1ccc(CNC(=O)Cc2sccc2Br)cc1 ZINC000448881694 566509323 /nfs/dbraw/zinc/50/93/23/566509323.db2.gz ANFCAGDXBFUBHA-UHFFFAOYSA-N 0 3 397.338 3.310 10 0 GGAEHN Cc1cc(C(=O)N2CCC[C@H]2CN(C)C)nn1-c1ccc(Br)cc1 ZINC000464923980 566509866 /nfs/dbraw/zinc/50/98/66/566509866.db2.gz BABGLFLNAAKAQQ-INIZCTEOSA-N 0 3 391.313 3.109 10 0 GGAEHN CC(C)N1CC[C@@H](NC[C@@H](C)CS(C)(=O)=O)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558829548 566510007 /nfs/dbraw/zinc/51/00/07/566510007.db2.gz SCMHRHJXHILJAT-FSPWUOQZSA-N 0 3 390.952 3.273 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1cc(Cl)c(F)cc1Br ZINC000448905944 566510630 /nfs/dbraw/zinc/51/06/30/566510630.db2.gz BTCZVOYLUMFZQV-SNVBAGLBSA-N 0 3 393.684 3.082 10 0 GGAEHN Fc1ccc2c(Br)cnc(N3CCN(C[C@H]4CCOC4)CC3)c2c1 ZINC000651324727 566512021 /nfs/dbraw/zinc/51/20/21/566512021.db2.gz OAAHJPMMYVPDGP-CYBMUJFWSA-N 0 3 394.288 3.295 10 0 GGAEHN Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)NC(=O)[C@@H]1C[C@@H]1N ZINC000424120121 566512376 /nfs/dbraw/zinc/51/23/76/566512376.db2.gz GRXUMCASEFNNKJ-WQHBLYJGSA-N 0 3 380.311 3.405 10 0 GGAEHN C[C@@H](O)CN1CCN(c2ncc(Br)c3ccc(F)cc32)[C@H](C)C1 ZINC000651342837 566514274 /nfs/dbraw/zinc/51/42/74/566514274.db2.gz QKRGVIRWEWZASD-VXGBXAGGSA-N 0 3 382.277 3.028 10 0 GGAEHN CN(C(=O)c1cc2c(ccc(F)c2Br)[nH]1)[C@H]1CCN(C2CC2)C1 ZINC000448962791 566515063 /nfs/dbraw/zinc/51/50/63/566515063.db2.gz RDDARTXPPPBMHS-NSHDSACASA-N 0 3 380.261 3.378 10 0 GGAEHN CC[C@@H](CN1CCCC1)NC(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651349203 566517242 /nfs/dbraw/zinc/51/72/42/566517242.db2.gz WNIMWIPKRDDZIR-LSDHHAIUSA-N 0 3 381.314 3.306 10 0 GGAEHN CC(C)C[C@@H](CNCc1ccc(S(C)(=O)=O)s1)C(=O)OC(C)(C)C ZINC000424191479 566517336 /nfs/dbraw/zinc/51/73/36/566517336.db2.gz RCSGOPAKPZUWJF-ZDUSSCGKSA-N 0 3 375.556 3.245 10 0 GGAEHN Cc1ccc(C[C@H](CO)CNCc2cncn2C(C)C)cc1Br ZINC000424170497 566517602 /nfs/dbraw/zinc/51/76/02/566517602.db2.gz IDSGXPKBQFIPCE-INIZCTEOSA-N 0 3 380.330 3.476 10 0 GGAEHN CC(C)n1cncc1CNCCOc1ccc(I)cc1 ZINC000424173451 566518143 /nfs/dbraw/zinc/51/81/43/566518143.db2.gz DSPGNLMTXLGHCW-UHFFFAOYSA-N 0 3 385.249 3.237 10 0 GGAEHN C[C@@H]1CN(c2ncc(Br)c3ccc(F)cc32)[C@H](C)CN1CCO ZINC000651357809 566518490 /nfs/dbraw/zinc/51/84/90/566518490.db2.gz HVNWAOWBTNUMAY-VXGBXAGGSA-N 0 3 382.277 3.028 10 0 GGAEHN Cc1cc(Br)cc(CNC[C@H]2CCN(C)C(=O)C2)c1OC(F)F ZINC000424191773 566518551 /nfs/dbraw/zinc/51/85/51/566518551.db2.gz RQZWBLZWGIPDBG-NSHDSACASA-N 0 3 391.256 3.317 10 0 GGAEHN CCOc1c(Br)cc(CN[C@@H]2CC[C@H]2O)cc1Br ZINC000424205168 566520175 /nfs/dbraw/zinc/52/01/75/566520175.db2.gz UDNMJEVJALTRPZ-VXGBXAGGSA-N 0 3 379.092 3.223 10 0 GGAEHN CN(C)Cc1ccc(NC(=O)C2CCN(C3CC3)CC2)cc1Br ZINC000559038558 566520860 /nfs/dbraw/zinc/52/08/60/566520860.db2.gz HNGMRYAWACNIOQ-UHFFFAOYSA-N 0 3 380.330 3.324 10 0 GGAEHN CN(Cc1ccccc1)[C@@H]1CCN(C(=O)c2nscc2Br)C1 ZINC000651398723 566520984 /nfs/dbraw/zinc/52/09/84/566520984.db2.gz ZVIJRHQSBVPMTR-CYBMUJFWSA-N 0 3 380.311 3.252 10 0 GGAEHN CO[C@H]1C[C@H]2C[C@@H](N[C@H]3CCN(c4cccc(Br)c4)C3=O)C[C@H]2C1 ZINC000424280782 566525120 /nfs/dbraw/zinc/52/51/20/566525120.db2.gz MGEREYMPGXVKRI-FWOLOJGPSA-N 0 3 393.325 3.348 10 0 GGAEHN O=C1C[C@@H]([C@@H]2CCCCN2Cc2ccnc3c(Br)cccc23)CN1 ZINC000449040153 566525159 /nfs/dbraw/zinc/52/51/59/566525159.db2.gz GUXFJAKZXOEZGP-PBHICJAKSA-N 0 3 388.309 3.488 10 0 GGAEHN CCN(CC)S(=O)(=O)c1ccc(CN[C@@H]2C[C@@H]3C[C@H](OC)C[C@@H]3C2)s1 ZINC000424273993 566525368 /nfs/dbraw/zinc/52/53/68/566525368.db2.gz VAINFQCONOZNKV-GEEKYZPCSA-N 0 3 386.583 3.072 10 0 GGAEHN CCN1CCCN(c2nnc([C@H]3CCCS3)n2Cc2cccs2)CC1 ZINC000424354490 566529393 /nfs/dbraw/zinc/52/93/93/566529393.db2.gz IDHPILUHORNAPL-MRXNPFEDSA-N 0 3 377.583 3.488 10 0 GGAEHN C[C@H](NCCOc1ccc(S(C)(=O)=O)cc1)c1ccc2ncsc2c1 ZINC000485810885 566529514 /nfs/dbraw/zinc/52/95/14/566529514.db2.gz BJRVVMOOQBDPHW-ZDUSSCGKSA-N 0 3 376.503 3.429 10 0 GGAEHN C[C@@H](NCc1ccc(S(=O)(=O)N2CCOCC2)s1)[C@H]1CCCC[C@H]1C ZINC000449128782 566531540 /nfs/dbraw/zinc/53/15/40/566531540.db2.gz ARCXFIWBBKNDCI-INMHGKMJSA-N 0 3 386.583 3.073 10 0 GGAEHN C[C@@H](NCc1ccc(S(=O)(=O)N2CCOCC2)s1)[C@@H]1CCCC[C@H]1C ZINC000449128780 566531558 /nfs/dbraw/zinc/53/15/58/566531558.db2.gz ARCXFIWBBKNDCI-BFYDXBDKSA-N 0 3 386.583 3.073 10 0 GGAEHN O=C(NC[C@H](O)CN1CCCCC1)c1cnc(-c2cccc(Cl)c2)s1 ZINC000651541591 566532123 /nfs/dbraw/zinc/53/21/23/566532123.db2.gz ZVOLPZVLWVMRPC-HNNXBMFYSA-N 0 3 379.913 3.040 10 0 GGAEHN O=C1COc2ccccc2N1CCCNCc1cccc(Br)c1F ZINC000449169992 566533089 /nfs/dbraw/zinc/53/30/89/566533089.db2.gz HXMQGLUATTUNEZ-UHFFFAOYSA-N 0 3 393.256 3.494 10 0 GGAEHN C[C@@H](COc1ccc(Cl)c(Cl)c1)N[C@H]1CCN(C2CCOCC2)C1=O ZINC000449178342 566533532 /nfs/dbraw/zinc/53/35/32/566533532.db2.gz SISUJZZAXZFYEN-SJCJKPOMSA-N 0 3 387.307 3.130 10 0 GGAEHN O=S(=O)(Cc1cc(Cl)sc1Cl)N1CC[C@@H](CN2CCCC2)C1 ZINC000651573758 566535102 /nfs/dbraw/zinc/53/51/02/566535102.db2.gz HGKXYWMMIOUGBS-NSHDSACASA-N 0 3 383.366 3.302 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCN=c1[nH]cc(Cn2cc(Br)cn2)s1 ZINC000485873560 566536090 /nfs/dbraw/zinc/53/60/90/566536090.db2.gz NRQDKQHDOCIXBW-CHWSQXEVSA-N 0 3 398.374 3.247 10 0 GGAEHN CN1CCC[C@H](CNC(=O)NCCOCC(F)(F)F)[C@@H]1c1cccs1 ZINC000465551979 566536544 /nfs/dbraw/zinc/53/65/44/566536544.db2.gz TZOSTEQTBHWTPS-TZMCWYRMSA-N 0 3 379.448 3.009 10 0 GGAEHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ncsc1Br ZINC000512489677 566540143 /nfs/dbraw/zinc/54/01/43/566540143.db2.gz RQNTZYOLVDLSGE-UHFFFAOYSA-N 0 3 386.290 3.249 10 0 GGAEHN CN1CC[C@@H]2[C@H](CCCN2S(=O)(=O)Cc2cc(Cl)sc2Cl)C1 ZINC000651607164 566540801 /nfs/dbraw/zinc/54/08/01/566540801.db2.gz FUHGVAXREVVCFW-ZYHUDNBSSA-N 0 3 383.366 3.301 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)c1c(F)cccc1I ZINC000485938380 566541628 /nfs/dbraw/zinc/54/16/28/566541628.db2.gz FPOAQWIGSMUADH-NSHDSACASA-N 0 3 392.256 3.136 10 0 GGAEHN CNC(=O)[C@@H](C)Oc1ccc(Br)cc1CNC[C@H]1CCC(C)(C)O1 ZINC000449259667 566543130 /nfs/dbraw/zinc/54/31/30/566543130.db2.gz RYPVSCQFZNKPDU-IUODEOHRSA-N 0 3 399.329 3.010 10 0 GGAEHN C[C@H](CNC(=O)Cc1noc2ccc(Br)cc21)N1CCC[C@H](C)C1 ZINC000424585819 566543671 /nfs/dbraw/zinc/54/36/71/566543671.db2.gz QUYJWSSNWBHLCB-QWHCGFSZSA-N 0 3 394.313 3.369 10 0 GGAEHN COc1ncc(C(=O)Nc2ccc(OCCN(C)C)cc2)cc1Br ZINC000424605875 566544819 /nfs/dbraw/zinc/54/48/19/566544819.db2.gz RGESGPQIXNPGAO-UHFFFAOYSA-N 0 3 394.269 3.045 10 0 GGAEHN Cc1cc(CN[C@H](C2CCOCC2)C2(CO)CCC2)ncc1Br ZINC000628319382 566546294 /nfs/dbraw/zinc/54/62/94/566546294.db2.gz HKJDKWJPZLGIPE-QGZVFWFLSA-N 0 3 383.330 3.200 10 0 GGAEHN Cc1cc(Br)cc(C)c1CNC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000465806749 566546812 /nfs/dbraw/zinc/54/68/12/566546812.db2.gz GUJOPEIUSJNORU-MRXNPFEDSA-N 0 3 378.314 3.222 10 0 GGAEHN O[C@H](CN[C@@H]1CCOc2ccc(Br)cc21)COCc1ccccc1 ZINC000603948906 566546741 /nfs/dbraw/zinc/54/67/41/566546741.db2.gz ZMJDYVWOAUZCLO-SJLPKXTDSA-N 0 3 392.293 3.440 10 0 GGAEHN C[C@H](CNC(=O)Cc1noc2ccc(Br)cc21)N1CCC(C)CC1 ZINC000424616710 566547231 /nfs/dbraw/zinc/54/72/31/566547231.db2.gz MUZYPCOJIHENCY-CYBMUJFWSA-N 0 3 394.313 3.369 10 0 GGAEHN C[C@H](NC1CC(c2ccc(Br)cc2F)C1)C1(S(C)(=O)=O)CC1 ZINC000449318964 566548087 /nfs/dbraw/zinc/54/80/87/566548087.db2.gz FHIMXERKDRASAB-ZBOXLXRLSA-N 0 3 390.318 3.390 10 0 GGAEHN CNC(=O)[C@H](C)Oc1ccc(Br)cc1CNCCC1(F)CCC1 ZINC000449328008 566550868 /nfs/dbraw/zinc/55/08/68/566550868.db2.gz DNGVRGFYLUMGSK-LBPRGKRZSA-N 0 3 387.293 3.334 10 0 GGAEHN CC(C)Oc1cc(Br)cc(C(=O)Nc2cnn(CCN(C)C)c2)c1 ZINC000673719643 566552188 /nfs/dbraw/zinc/55/21/88/566552188.db2.gz WCBJLBKQBNOISZ-UHFFFAOYSA-N 0 3 395.301 3.247 10 0 GGAEHN O=S1(=O)C[C@@H](CNCc2ccc(F)c(Br)c2)c2ccccc21 ZINC000449363032 566552702 /nfs/dbraw/zinc/55/27/02/566552702.db2.gz OOYPNZDNYJUTGP-GFCCVEGCSA-N 0 3 384.270 3.249 10 0 GGAEHN C[C@@H]1C[C@@H](N2CCCC2)CN1S(=O)(=O)Cc1cc(Cl)sc1Cl ZINC000651701977 566553011 /nfs/dbraw/zinc/55/30/11/566553011.db2.gz GZPIIBFUMIAYJM-ZYHUDNBSSA-N 0 3 383.366 3.443 10 0 GGAEHN COc1c(Br)ccc(C)c1C(=O)N1CCC[C@@H](N2CCCC2)C1 ZINC000424658408 566553576 /nfs/dbraw/zinc/55/35/76/566553576.db2.gz GITDVJRAPYXPLX-CQSZACIVSA-N 0 3 381.314 3.467 10 0 GGAEHN C[C@@H](NC(=O)[C@H]1CCOc2ccc(Br)cc21)C1=CCN(C)CC1 ZINC000651696286 566553487 /nfs/dbraw/zinc/55/34/87/566553487.db2.gz MJNWFPHZEVKNIX-DOMZBBRYSA-N 0 3 379.298 3.082 10 0 GGAEHN C[C@H](NS(=O)(=O)c1ccc(CN(C)C)cc1)c1ccc2ncsc2c1 ZINC000559502281 566554373 /nfs/dbraw/zinc/55/43/73/566554373.db2.gz MDBRWTNZVPQZFT-ZDUSSCGKSA-N 0 3 375.519 3.397 10 0 GGAEHN O=c1ccc(Br)cn1CCNCc1ccccc1OCC1CC1 ZINC000449377602 566554681 /nfs/dbraw/zinc/55/46/81/566554681.db2.gz PHILPJIYNNTWDY-UHFFFAOYSA-N 0 3 377.282 3.189 10 0 GGAEHN COc1c(Br)ccc(C)c1C(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000424670193 566555338 /nfs/dbraw/zinc/55/53/38/566555338.db2.gz ZDKMXZJVGCWLSX-CQSZACIVSA-N 0 3 381.314 3.467 10 0 GGAEHN COC[C@@](C)(O)CCNCc1cc(Br)c(C)c(Br)c1 ZINC000449386616 566556544 /nfs/dbraw/zinc/55/65/44/566556544.db2.gz UPEOBVNHFWWNIB-AWEZNQCLSA-N 0 3 395.135 3.397 10 0 GGAEHN COC[C@](C)(O)CCNCc1c(C)nn(-c2ccc(Br)cc2)c1C ZINC000449383410 566556844 /nfs/dbraw/zinc/55/68/44/566556844.db2.gz HAOKZVJIFAWMNS-GOSISDBHSA-N 0 3 396.329 3.129 10 0 GGAEHN Cn1nccc1CN1CC[C@H](Cc2cccc(I)c2)C1 ZINC000449392088 566556882 /nfs/dbraw/zinc/55/68/82/566556882.db2.gz IUWLQXXCSUCSBP-CQSZACIVSA-N 0 3 381.261 3.089 10 0 GGAEHN Ic1cccc(C[C@@H]2CCN(Cc3cncnc3)C2)c1 ZINC000449394333 566557054 /nfs/dbraw/zinc/55/70/54/566557054.db2.gz NRQLWLISNUQZNH-AWEZNQCLSA-N 0 3 379.245 3.146 10 0 GGAEHN Cc1nccc(CN2CC[C@@H](Cc3cccc(I)c3)C2)n1 ZINC000449390171 566557124 /nfs/dbraw/zinc/55/71/24/566557124.db2.gz FZAKUAFVNWNPTG-HNNXBMFYSA-N 0 3 393.272 3.454 10 0 GGAEHN Nc1c(Br)cc(Br)cc1CN[C@@H]1CO[C@@H](C2CC2)C1 ZINC000628463065 566557849 /nfs/dbraw/zinc/55/78/49/566557849.db2.gz RHTXZSDSAJMXKV-WCQYABFASA-N 0 3 390.119 3.451 10 0 GGAEHN CC(C)N1CCC[C@H](NC(=O)[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000651751655 566558110 /nfs/dbraw/zinc/55/81/10/566558110.db2.gz CEHNZJNYKUDDLO-GJZGRUSLSA-N 0 3 381.314 3.304 10 0 GGAEHN CC(C)N1CCC[C@@H](NC(=O)[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000651751654 566558318 /nfs/dbraw/zinc/55/83/18/566558318.db2.gz CEHNZJNYKUDDLO-CABCVRRESA-N 0 3 381.314 3.304 10 0 GGAEHN CCOC(=O)COc1c(Br)cc(C)cc1CNCC1=CCOCC1 ZINC000449403741 566558919 /nfs/dbraw/zinc/55/89/19/566558919.db2.gz RJPWYZQFLVACLV-UHFFFAOYSA-N 0 3 398.297 3.136 10 0 GGAEHN CN(C)C[C@@H](CNS(=O)(=O)C[C@H]1CCCC1(F)F)c1ccc(Cl)cc1 ZINC000651764838 566559937 /nfs/dbraw/zinc/55/99/37/566559937.db2.gz QIHAOZCAWNOYEM-HUUCEWRRSA-N 0 3 394.915 3.340 10 0 GGAEHN CC[C@H](N[C@@H](C)CC(=O)Nc1cccc(Br)c1)[C@@H](O)C(F)F ZINC000449422936 566560402 /nfs/dbraw/zinc/56/04/02/566560402.db2.gz MZPYCMORERGWSD-DUFXMDAXSA-N 0 3 379.245 3.160 10 0 GGAEHN CC[C@H](N[C@@H](C)CC(=O)Nc1cccc(Br)c1)[C@H](O)C(F)F ZINC000449422939 566560476 /nfs/dbraw/zinc/56/04/76/566560476.db2.gz MZPYCMORERGWSD-WFBYXXMGSA-N 0 3 379.245 3.160 10 0 GGAEHN CC[C@H](N[C@H](C)CC(=O)Nc1cccc(Br)c1)[C@H](O)C(F)F ZINC000449422938 566561313 /nfs/dbraw/zinc/56/13/13/566561313.db2.gz MZPYCMORERGWSD-LQJRIPTKSA-N 0 3 379.245 3.160 10 0 GGAEHN CNS(=O)(=O)C[C@H]1CCCN(Cc2ccc(-c3ccc(C)cc3)s2)C1 ZINC000628496513 566562368 /nfs/dbraw/zinc/56/23/68/566562368.db2.gz SGGVBEOKCJCINU-INIZCTEOSA-N 0 3 378.563 3.485 10 0 GGAEHN CNS(=O)(=O)C[C@@H]1CCCN(Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000628496574 566562558 /nfs/dbraw/zinc/56/25/58/566562558.db2.gz UMVVEOOUTSOTGC-CQSZACIVSA-N 0 3 382.526 3.315 10 0 GGAEHN Cc1cc(Br)cc(C)c1CNC(=O)N[C@H]1CN(C2CC2)C[C@H]1C ZINC000466293876 566562923 /nfs/dbraw/zinc/56/29/23/566562923.db2.gz RUVZVRWQUPOHJK-DYVFJYSZSA-N 0 3 380.330 3.348 10 0 GGAEHN COc1ncc(C(=O)N(CCN(C)C)Cc2cccs2)cc1Br ZINC000424723281 566563111 /nfs/dbraw/zinc/56/31/11/566563111.db2.gz ZQVUXOBHZWHKNT-UHFFFAOYSA-N 0 3 398.326 3.118 10 0 GGAEHN CN(C)CCn1cc(NC(=O)NC(C)(C)c2ccc(Br)cc2)cn1 ZINC000673868642 566563389 /nfs/dbraw/zinc/56/33/89/566563389.db2.gz CVOJSYKCIWRXMU-UHFFFAOYSA-N 0 3 394.317 3.264 10 0 GGAEHN C[C@@H](NC(=O)Nc1cnn(CCN(C)C)c1)c1ccc(Br)cc1 ZINC000673868219 566563437 /nfs/dbraw/zinc/56/34/37/566563437.db2.gz ZQHBXXTXSDCMKD-GFCCVEGCSA-N 0 3 380.290 3.090 10 0 GGAEHN CN(C)CCn1cc(NC(=O)NC(c2cccs2)c2cccs2)cn1 ZINC000673871862 566563821 /nfs/dbraw/zinc/56/38/21/566563821.db2.gz QZYOEEOGKIJVQR-UHFFFAOYSA-N 0 3 375.523 3.479 10 0 GGAEHN CCN(Cc1cccc(Br)c1)C(=O)Nc1cnn(CCN(C)C)c1 ZINC000673871528 566563859 /nfs/dbraw/zinc/56/38/59/566563859.db2.gz MBQLGTBEEAIKEK-UHFFFAOYSA-N 0 3 394.317 3.261 10 0 GGAEHN C[C@H](CNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1)Oc1cccc(Br)c1 ZINC000466300078 566564343 /nfs/dbraw/zinc/56/43/43/566564343.db2.gz VWFFFAQXZRSMDQ-FMKPAKJESA-N 0 3 398.345 3.341 10 0 GGAEHN C[C@H](CNC(=O)N(C)[C@@H]1CCN(C2CC2)C1)Oc1cccc(Br)c1 ZINC000466303070 566564686 /nfs/dbraw/zinc/56/46/86/566564686.db2.gz OAIIFEOITNWNAA-CZUORRHYSA-N 0 3 396.329 3.095 10 0 GGAEHN CN1CCC2(CCCN2C(=O)Cc2noc3ccc(Br)cc32)CC1 ZINC000424758180 566566847 /nfs/dbraw/zinc/56/68/47/566566847.db2.gz GBCUMRVMIZNZSR-UHFFFAOYSA-N 0 3 392.297 3.220 10 0 GGAEHN COc1cc(Br)ccc1CN[C@H]1CCCN(C(=O)N2CCCC2)C1 ZINC000512894294 566568050 /nfs/dbraw/zinc/56/80/50/566568050.db2.gz JAPKOIPMYVCFNY-INIZCTEOSA-N 0 3 396.329 3.228 10 0 GGAEHN CC[C@H]1C[C@@H](C[NH2+]CC[N-]S(=O)(=O)c2cccc(Cl)c2Cl)CCO1 ZINC000512903531 566568164 /nfs/dbraw/zinc/56/81/64/566568164.db2.gz AIWWCSQJYSRSRO-STQMWFEESA-N 0 3 395.352 3.067 10 0 GGAEHN Cn1cc(N2CCC[C@H](N[C@H]3CCc4sc(Br)cc43)C2)cn1 ZINC000559767260 566568741 /nfs/dbraw/zinc/56/87/41/566568741.db2.gz QMFZRJWLAOKCPR-FZMZJTMJSA-N 0 3 381.343 3.490 10 0 GGAEHN Cc1cccc(CN(CCN(C)C)C(=O)c2ncsc2Br)c1 ZINC000512938127 566568806 /nfs/dbraw/zinc/56/88/06/566568806.db2.gz YHLZKUCMJNQDDK-UHFFFAOYSA-N 0 3 382.327 3.418 10 0 GGAEHN CC(C)N1CC[C@H](NC(=O)[C@H](N)CC(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000578985821 566570619 /nfs/dbraw/zinc/57/06/19/566570619.db2.gz VSWICSRNCHJGCF-IJEWVQPXSA-N 0 3 377.838 3.102 10 0 GGAEHN OC[C@]1(CNCc2cn3ccc(Br)cc3n2)CCc2ccccc21 ZINC000651883296 566571615 /nfs/dbraw/zinc/57/16/15/566571615.db2.gz AMZQVUMHIBKYEX-LJQANCHMSA-N 0 3 386.293 3.063 10 0 GGAEHN Cc1cc([C@@H](C)NC[C@@H]2CCCCN2S(C)(=O)=O)sc1Br ZINC000513012640 566573641 /nfs/dbraw/zinc/57/36/41/566573641.db2.gz RJXIDKXQHOBJLQ-NEPJUHHUSA-N 0 3 395.388 3.284 10 0 GGAEHN Cc1cc([C@H](C)NC[C@H]2CCCCN2S(C)(=O)=O)sc1Br ZINC000513012642 566574765 /nfs/dbraw/zinc/57/47/65/566574765.db2.gz RJXIDKXQHOBJLQ-NWDGAFQWSA-N 0 3 395.388 3.284 10 0 GGAEHN COC[C@](C)(CO)NCc1ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc1 ZINC000674067499 566575760 /nfs/dbraw/zinc/57/57/60/566575760.db2.gz KETZQIGENWJJLP-STQMWFEESA-N 0 3 375.309 3.046 10 0 GGAEHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)Cc1noc2ccc(Br)cc21 ZINC000424828190 566577157 /nfs/dbraw/zinc/57/71/57/566577157.db2.gz FYVIALRCKNQICS-TZMCWYRMSA-N 0 3 392.297 3.218 10 0 GGAEHN CCCn1cc(CNC[C@H](CO)Cc2ccc(C)c(Br)c2)cn1 ZINC000449597514 566578285 /nfs/dbraw/zinc/57/82/85/566578285.db2.gz FHQOYYISLIHGJL-MRXNPFEDSA-N 0 3 380.330 3.305 10 0 GGAEHN CN(C(=O)NCCCc1ccc(Br)cc1F)[C@@H]1CCN(C2CC2)C1 ZINC000604824076 566579408 /nfs/dbraw/zinc/57/94/08/566579408.db2.gz NMQHMEOFAYTMIO-MRXNPFEDSA-N 0 3 398.320 3.399 10 0 GGAEHN COc1cc(CNCc2ccc(C[S@](C)=O)cc2)cc(Br)c1O ZINC000513111354 566579539 /nfs/dbraw/zinc/57/95/39/566579539.db2.gz CWVWCBWMIFMELG-QHCPKHFHSA-N 0 3 398.322 3.332 10 0 GGAEHN COc1c(Br)ccc(C)c1C(=O)N1CCN(C2CC2)C[C@H](C)C1 ZINC000424852645 566579781 /nfs/dbraw/zinc/57/97/81/566579781.db2.gz OKMQJOFQHSLWRX-LBPRGKRZSA-N 0 3 381.314 3.322 10 0 GGAEHN COc1cc(C)nc(CNC[C@@H](CO)Cc2cc(Br)ccc2F)c1 ZINC000449599806 566580046 /nfs/dbraw/zinc/58/00/46/566580046.db2.gz MCJGUWAPTCULGI-ZDUSSCGKSA-N 0 3 397.288 3.241 10 0 GGAEHN COc1c(O)cccc1CNC[C@H](CO)Cc1ccc(C)c(Br)c1 ZINC000449600564 566580775 /nfs/dbraw/zinc/58/07/75/566580775.db2.gz OIYHYNDXPXNBTH-OAHLLOKOSA-N 0 3 394.309 3.413 10 0 GGAEHN CC(C)N1CC[C@H](N(C)C(=O)Cc2noc3ccc(Br)cc32)C1 ZINC000424867447 566582007 /nfs/dbraw/zinc/58/20/07/566582007.db2.gz QWRLRGCXMUAEEV-ZDUSSCGKSA-N 0 3 380.286 3.074 10 0 GGAEHN COC(=O)C[C@](C)(NCCCn1ccnc1)c1ccc(Br)cc1 ZINC000513133728 566582619 /nfs/dbraw/zinc/58/26/19/566582619.db2.gz NJRUBIZSLDEXNL-KRWDZBQOSA-N 0 3 380.286 3.104 10 0 GGAEHN COC(=O)C[C@@](C)(NCCn1ccnc1C)c1ccc(Br)cc1 ZINC000513158990 566584553 /nfs/dbraw/zinc/58/45/53/566584553.db2.gz JLSUZNVFAUDIMK-QGZVFWFLSA-N 0 3 380.286 3.022 10 0 GGAEHN CCn1cc(CCN[C@@](C)(CC(=O)OC)c2ccc(Br)cc2)cn1 ZINC000513150737 566584824 /nfs/dbraw/zinc/58/48/24/566584824.db2.gz SGMCQHDPRJYURD-SFHVURJKSA-N 0 3 394.313 3.276 10 0 GGAEHN COC(=O)C[C@@](C)(NCCC(=O)OC(C)C)c1ccc(Br)cc1 ZINC000513159871 566585089 /nfs/dbraw/zinc/58/50/89/566585089.db2.gz MZSGPHXXVOQZJZ-QGZVFWFLSA-N 0 3 386.286 3.159 10 0 GGAEHN COC(=O)C[C@@](C)(NC[C@@H](O)CC(F)(F)F)c1ccc(Br)cc1 ZINC000513168734 566585393 /nfs/dbraw/zinc/58/53/93/566585393.db2.gz VYKBXCNPUBCEPT-GXTWGEPZSA-N 0 3 398.219 3.130 10 0 GGAEHN COc1ncc(Br)cc1CNC(=O)[C@H]1CCCCN1C1CCCC1 ZINC000628793471 566585374 /nfs/dbraw/zinc/58/53/74/566585374.db2.gz GZGWIYXZZXVTOY-MRXNPFEDSA-N 0 3 396.329 3.266 10 0 GGAEHN CN1CCC[C@H](NC(=O)NCCOc2c(Cl)cc(Cl)cc2Cl)C1 ZINC000674327398 566585606 /nfs/dbraw/zinc/58/56/06/566585606.db2.gz DEOXSNQOSIFDDN-NSHDSACASA-N 0 3 380.703 3.419 10 0 GGAEHN Nc1c(Br)cc(Br)cc1CNCCC1(CO)CCC1 ZINC000652038501 566585864 /nfs/dbraw/zinc/58/58/64/566585864.db2.gz WFXYUPSCFRXZAR-UHFFFAOYSA-N 0 3 392.135 3.436 10 0 GGAEHN COc1ncc(Br)cc1CNC(=O)C[C@@H](c1ccccc1)N(C)C ZINC000628793415 566585996 /nfs/dbraw/zinc/58/59/96/566585996.db2.gz GKCIDCXQAOGAAW-INIZCTEOSA-N 0 3 392.297 3.162 10 0 GGAEHN COc1ccc(Br)cc1CN[C@H]1CCCc2c1ccc(=O)n2C ZINC000652044929 566586030 /nfs/dbraw/zinc/58/60/30/566586030.db2.gz WPXAEVLCWBTYNR-HNNXBMFYSA-N 0 3 377.282 3.324 10 0 GGAEHN COc1ccc(CN[C@@H]2CCCc3c2ccc(=O)n3C)cc1Br ZINC000652044510 566586039 /nfs/dbraw/zinc/58/60/39/566586039.db2.gz OOUDVJLMKOWLQT-OAHLLOKOSA-N 0 3 377.282 3.324 10 0 GGAEHN COc1ncc(C(=O)Nc2ccc(CN(C)C)c(C)c2)cc1Br ZINC000424895906 566586102 /nfs/dbraw/zinc/58/61/02/566586102.db2.gz PZOVSGWJDHUYPO-UHFFFAOYSA-N 0 3 378.270 3.475 10 0 GGAEHN COc1ncc(C(=O)N(CCN(C)C)Cc2ccsc2)cc1Br ZINC000424901897 566586196 /nfs/dbraw/zinc/58/61/96/566586196.db2.gz WXCVPASVOIAGKV-UHFFFAOYSA-N 0 3 398.326 3.118 10 0 GGAEHN COc1cc(C[NH2+][C@@H]2CCCc3c2ccc(=O)n3C)cc(Br)c1[O-] ZINC000652044043 566586243 /nfs/dbraw/zinc/58/62/43/566586243.db2.gz FOUUXTVRNRXFPQ-CQSZACIVSA-N 0 3 393.281 3.029 10 0 GGAEHN CN(C)c1cc(NCc2c(Br)cnn2C)ncc1Br ZINC000449650930 566587761 /nfs/dbraw/zinc/58/77/61/566587761.db2.gz VBTWMSLMQUUSFD-UHFFFAOYSA-N 0 3 389.095 3.018 10 0 GGAEHN COc1cc(Br)ccc1CN[C@@H]1CCCc2c1ccc(=O)n2C ZINC000652049598 566587984 /nfs/dbraw/zinc/58/79/84/566587984.db2.gz KIGYJLVXDIDFKK-OAHLLOKOSA-N 0 3 377.282 3.324 10 0 GGAEHN C[C@H]1OCC[C@H]1N(CCO)Cc1ccc(Br)c(Br)c1 ZINC000449676930 566589428 /nfs/dbraw/zinc/58/94/28/566589428.db2.gz KLKHDOSCXRLMRP-QMTHXVAHSA-N 0 3 393.119 3.183 10 0 GGAEHN C[C@@H]1OCC[C@H]1N(CCO)Cc1ccc(Br)cc1C(F)(F)F ZINC000449684268 566590731 /nfs/dbraw/zinc/59/07/31/566590731.db2.gz ZVVSHFLGDFKFBS-IINYFYTJSA-N 0 3 382.220 3.440 10 0 GGAEHN CNC(=O)CC[C@H]1CCCCN1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000513216244 566590695 /nfs/dbraw/zinc/59/06/95/566590695.db2.gz ZBLOTWHGSGJUPD-KGLIPLIRSA-N 0 3 389.323 3.114 10 0 GGAEHN COc1cc(C)nc(CNC[C@H](CO)Cc2cccc(Br)c2C)c1 ZINC000449680169 566591031 /nfs/dbraw/zinc/59/10/31/566591031.db2.gz GHDANZTZCYABMY-OAHLLOKOSA-N 0 3 393.325 3.410 10 0 GGAEHN C[C@@H]1OCC[C@@H]1N(CCO)Cc1ccc(Br)cc1C(F)(F)F ZINC000449684267 566591226 /nfs/dbraw/zinc/59/12/26/566591226.db2.gz ZVVSHFLGDFKFBS-HZMBPMFUSA-N 0 3 382.220 3.440 10 0 GGAEHN CC[C@H](NC(=O)N(C)[C@H]1CCN(C2CC2)C1)c1nc(C(F)(F)F)cs1 ZINC000466696607 566591548 /nfs/dbraw/zinc/59/15/48/566591548.db2.gz OHBKFJCBAOINIS-RYUDHWBXSA-N 0 3 376.448 3.491 10 0 GGAEHN C[C@@H]1OCC[C@@H]1N(CCO)Cc1cc(Br)cc(C(F)(F)F)c1 ZINC000449680969 566591620 /nfs/dbraw/zinc/59/16/20/566591620.db2.gz UZLBTCVRVLETFR-HZMBPMFUSA-N 0 3 382.220 3.440 10 0 GGAEHN COC1CCN(C(C)(C)CNC(=O)Nc2cc(Cl)c(Cl)cn2)CC1 ZINC000466696977 566591963 /nfs/dbraw/zinc/59/19/63/566591963.db2.gz UNTYJMOXACQCOP-UHFFFAOYSA-N 0 3 375.300 3.399 10 0 GGAEHN CN(CCCN1CCCC1)S(=O)(=O)c1cccc(Br)c1Cl ZINC000560058022 566592362 /nfs/dbraw/zinc/59/23/62/566592362.db2.gz XGJSKXLDJLIYJG-UHFFFAOYSA-N 0 3 395.750 3.209 10 0 GGAEHN Cc1cc(CNCCNC(=O)c2ccc(Br)cc2)cc(C)c1O ZINC000560050745 566592456 /nfs/dbraw/zinc/59/24/56/566592456.db2.gz CNHZYPMJSXZAPP-UHFFFAOYSA-N 0 3 377.282 3.291 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)c2cc(Br)cnc2OCC2CC2)CCN1C ZINC000513299046 566594180 /nfs/dbraw/zinc/59/41/80/566594180.db2.gz ROVKPLVRKTVCAU-DOMZBBRYSA-N 0 3 396.329 3.188 10 0 GGAEHN CC[C@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1cccc(Br)c1 ZINC000579264205 566594615 /nfs/dbraw/zinc/59/46/15/566594615.db2.gz BFMZKJXAAFYSSG-CVEARBPZSA-N 0 3 389.359 3.304 10 0 GGAEHN CO[C@H](C(=O)NC[C@H]1CCN1C1CCCC1)c1ccccc1Br ZINC000628966453 566599203 /nfs/dbraw/zinc/59/92/03/566599203.db2.gz UVWIVSMOUGGVMB-PBHICJAKSA-N 0 3 381.314 3.270 10 0 GGAEHN C[C@H](C(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1)N1CCSCC1 ZINC000628969152 566600805 /nfs/dbraw/zinc/60/08/05/566600805.db2.gz OJTNCJSGYRLUOV-WBMJQRKESA-N 0 3 390.380 3.150 10 0 GGAEHN NC[C@H](C(=O)N1CCc2c(Br)ccc(F)c2C1)c1ccc(F)cc1 ZINC000579351352 566601292 /nfs/dbraw/zinc/60/12/92/566601292.db2.gz KQGHIHUDQWGFOI-AWEZNQCLSA-N 0 3 395.247 3.355 10 0 GGAEHN COc1cc(Br)ccc1CN[C@H]1CCO[C@H](c2nccn2C)C1 ZINC000449773331 566601615 /nfs/dbraw/zinc/60/16/15/566601615.db2.gz MSZYQUYIEXASJP-HOCLYGCPSA-N 0 3 380.286 3.201 10 0 GGAEHN CN(C)C[C@@H](NC(=O)CN(C)[C@H]1CCSC1)c1ccc(Cl)c(Cl)c1 ZINC000628969844 566602564 /nfs/dbraw/zinc/60/25/64/566602564.db2.gz ZNEPRKYFVZPFQN-XJKSGUPXSA-N 0 3 390.380 3.150 10 0 GGAEHN CN(Cc1cc(Br)c2c(c1)OCCCO2)[C@@H]1CCN(C2CC2)C1 ZINC000513466267 566604268 /nfs/dbraw/zinc/60/42/68/566604268.db2.gz BZYBGHWSMUMSMK-OAHLLOKOSA-N 0 3 381.314 3.279 10 0 GGAEHN CN(Cc1cc(Br)c2c(c1)OCCCO2)[C@H]1CCN(C2CC2)C1 ZINC000513466266 566604354 /nfs/dbraw/zinc/60/43/54/566604354.db2.gz BZYBGHWSMUMSMK-HNNXBMFYSA-N 0 3 381.314 3.279 10 0 GGAEHN CN(C)CCN(C)c1ccc(Br)cc1NC(=O)c1cc(F)c[nH]1 ZINC000425098627 566604974 /nfs/dbraw/zinc/60/49/74/566604974.db2.gz MEVWGTJADSDURS-UHFFFAOYSA-N 0 3 383.265 3.166 10 0 GGAEHN Cc1[nH]nc(C(=O)Nc2cc(Br)ccc2N(C)CCN(C)C)c1C ZINC000425101019 566605310 /nfs/dbraw/zinc/60/53/10/566605310.db2.gz XCVXVKSIJVUVCT-UHFFFAOYSA-N 0 3 394.317 3.039 10 0 GGAEHN Cc1cccc(Br)c1C(=O)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000486624718 566605497 /nfs/dbraw/zinc/60/54/97/566605497.db2.gz FDNPXHRTDDGGQR-MRXNPFEDSA-N 0 3 395.341 3.475 10 0 GGAEHN CN(C)[C@H](CNc1cc(Br)cc(F)c1C(N)=O)c1ccsc1 ZINC000539843128 566606499 /nfs/dbraw/zinc/60/64/99/566606499.db2.gz VCYNARKEAGVQLP-CYBMUJFWSA-N 0 3 386.290 3.463 10 0 GGAEHN CC[NH+](CC)CC1CCN(C(=O)NCc2ccc([O-])c(Br)c2)CC1 ZINC000486639894 566606531 /nfs/dbraw/zinc/60/65/31/566606531.db2.gz LBZHJFOFDXKDQV-UHFFFAOYSA-N 0 3 398.345 3.418 10 0 GGAEHN CCNC(=O)C[C@@H]1CCCCN1CCOc1cc(F)cc(Br)c1 ZINC000560176572 566606896 /nfs/dbraw/zinc/60/68/96/566606896.db2.gz CVYQTDSDLARZDN-HNNXBMFYSA-N 0 3 387.293 3.348 10 0 GGAEHN C[C@H](c1ccccc1Br)N1CCC[C@@H](C(=O)N2CCOCC2)C1 ZINC000513683847 566617541 /nfs/dbraw/zinc/61/75/41/566617541.db2.gz NDADAJDBVKQMPW-HUUCEWRRSA-N 0 3 381.314 3.081 10 0 GGAEHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)CSCc1cc(-c2cccs2)on1 ZINC000467037746 566619875 /nfs/dbraw/zinc/61/98/75/566619875.db2.gz ZDVYALOPDGQNJL-SWLSCSKDSA-N 0 3 377.535 3.235 10 0 GGAEHN CC(=O)N1C[C@@H]2CCC[C@@H](NCc3nc4cc(Br)ccc4[nH]3)[C@@H]2C1 ZINC000579577386 566620219 /nfs/dbraw/zinc/62/02/19/566620219.db2.gz VMRIVKKKINXJIR-NWANDNLSSA-N 0 3 391.313 3.062 10 0 GGAEHN CC(=O)N1C[C@@H]2CCC[C@@H](NCc3nc4cc(Br)ccc4[nH]3)[C@H]2C1 ZINC000579577384 566620856 /nfs/dbraw/zinc/62/08/56/566620856.db2.gz VMRIVKKKINXJIR-AEGPPILISA-N 0 3 391.313 3.062 10 0 GGAEHN O=C(N[C@H]1CCN(CC2CC2)C1)N1CCc2cccc(Br)c2C1 ZINC000605882965 566621301 /nfs/dbraw/zinc/62/13/01/566621301.db2.gz OKKUHRGWVLXRKU-HNNXBMFYSA-N 0 3 378.314 3.001 10 0 GGAEHN CC(C(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1)S(C)(=O)=O ZINC000629182766 566622723 /nfs/dbraw/zinc/62/27/23/566622723.db2.gz BNPHFFDRHBDFAW-NHYWBVRUSA-N 0 3 380.853 3.044 10 0 GGAEHN CC[C@H](CNC(=O)N[C@H]1CCCN(C)C1)Cc1cccc(Br)c1 ZINC000605961579 566622890 /nfs/dbraw/zinc/62/28/90/566622890.db2.gz RYEGUHNOLUMTDD-YOEHRIQHSA-N 0 3 382.346 3.411 10 0 GGAEHN CN(C(=O)Cc1c[nH]c2cccc(Br)c12)[C@@H]1CN2CCC1CC2 ZINC000513777088 566623162 /nfs/dbraw/zinc/62/31/62/566623162.db2.gz PGXXUWQZNWSVEM-MRXNPFEDSA-N 0 3 376.298 3.026 10 0 GGAEHN CN(C)Cc1ccc(NC(=O)[C@@H]2CCCc3[nH]ncc32)cc1Br ZINC000467076642 566623507 /nfs/dbraw/zinc/62/35/07/566623507.db2.gz XAGMZCKCFQEKDG-CYBMUJFWSA-N 0 3 377.286 3.292 10 0 GGAEHN CC[C@@H](Cc1ccccc1Br)C(=O)NC[C@H]1CCCN1CCOC ZINC000467097931 566625175 /nfs/dbraw/zinc/62/51/75/566625175.db2.gz TVDRZCKZKPTQEE-DOTOQJQBSA-N 0 3 397.357 3.245 10 0 GGAEHN Cc1nc2ccc(Br)cc2c(NC[C@@H]2CCN(C)C(=O)C2)c1C ZINC000425269141 566625531 /nfs/dbraw/zinc/62/55/31/566625531.db2.gz RWLHYKBSLLXCPO-CYBMUJFWSA-N 0 3 376.298 3.316 10 0 GGAEHN C[C@@H](C(=O)Nc1ccc(Cl)cc1C(F)(F)F)N1CCNC[C@](C)(F)C1 ZINC000579713030 566632092 /nfs/dbraw/zinc/63/20/92/566632092.db2.gz YGPJWOQZCWYJIT-BONVTDFDSA-N 0 3 381.801 3.319 10 0 GGAEHN COC[C@@H](NCCC1CCS(=O)(=O)CC1)c1cccc(C(F)(F)F)c1 ZINC000540154644 566632720 /nfs/dbraw/zinc/63/27/20/566632720.db2.gz WSUFORBRUIDTHE-MRXNPFEDSA-N 0 3 379.444 3.197 10 0 GGAEHN CCn1c(CNC2CC(CC(=O)OC)C2)nc2cc(Br)ccc21 ZINC000425342937 566633062 /nfs/dbraw/zinc/63/30/62/566633062.db2.gz QREAUKGDIGFGHY-UHFFFAOYSA-N 0 3 380.286 3.250 10 0 GGAEHN O=C(c1ccsc1Br)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000450109223 566633490 /nfs/dbraw/zinc/63/34/90/566633490.db2.gz APSNUWNTYLJCRB-ZDUSSCGKSA-N 0 3 387.343 3.228 10 0 GGAEHN CS[C@@H]1CC[C@H]1NCC(C)(C)S(=O)(=O)c1ccc(Br)cc1 ZINC000425339586 566633480 /nfs/dbraw/zinc/63/34/80/566633480.db2.gz CSCBVMUKBOQVIR-ZIAGYGMSSA-N 0 3 392.384 3.485 10 0 GGAEHN CCNC(=O)N1CC[C@@H](N[C@H]2CCc3c2cc(Cl)cc3Br)C1 ZINC000540165031 566634268 /nfs/dbraw/zinc/63/42/68/566634268.db2.gz WKRKCRGSEXTFIB-ABAIWWIYSA-N 0 3 386.721 3.483 10 0 GGAEHN COc1cccc([C@@H](CNCc2c(Br)cnn2C)N2CCCC2)c1 ZINC000486956324 566638377 /nfs/dbraw/zinc/63/83/77/566638377.db2.gz NEPWMLQBBRDIMP-QGZVFWFLSA-N 0 3 393.329 3.118 10 0 GGAEHN O[C@@H](CCNCc1cc(Br)ccc1OC(F)F)C(F)(F)F ZINC000579776478 566638460 /nfs/dbraw/zinc/63/84/60/566638460.db2.gz OQVCNCQNTRTDMJ-JTQLQIEISA-N 0 3 378.135 3.453 10 0 GGAEHN COc1ccccc1[C@@H](CNCc1c(Br)cnn1C)N1CCCC1 ZINC000486968393 566640208 /nfs/dbraw/zinc/64/02/08/566640208.db2.gz JCGWVTKPILMVNH-MRXNPFEDSA-N 0 3 393.329 3.118 10 0 GGAEHN C[C@H](NC[C@H]1CCCCN1S(C)(=O)=O)[C@H](C)c1nc2ccccc2s1 ZINC000560585625 566640640 /nfs/dbraw/zinc/64/06/40/566640640.db2.gz FGOGCGDIIXDFRN-SOUVJXGZSA-N 0 3 381.567 3.192 10 0 GGAEHN C[C@H](NC[C@@H]1CCCCN1S(C)(=O)=O)[C@H](C)c1nc2ccccc2s1 ZINC000560585620 566640755 /nfs/dbraw/zinc/64/07/55/566640755.db2.gz FGOGCGDIIXDFRN-KKUMJFAQSA-N 0 3 381.567 3.192 10 0 GGAEHN C[C@H](NCc1ccc(S(=O)(=O)N(C)C)s1)[C@H]1Oc2ccccc2[C@H]1C ZINC000425437675 566643399 /nfs/dbraw/zinc/64/33/99/566643399.db2.gz ZCNQWGFEVUUOMR-VBHSOAQHSA-N 0 3 380.535 3.041 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)NC[C@H]1CCCN(C)C1)CC2 ZINC000540324585 566645010 /nfs/dbraw/zinc/64/50/10/566645010.db2.gz CSWHNNMPGQJDHE-CQSZACIVSA-N 0 3 380.330 3.167 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)NC[C@@H]1CCCN(C)C1)CC2 ZINC000540324578 566645398 /nfs/dbraw/zinc/64/53/98/566645398.db2.gz CSWHNNMPGQJDHE-AWEZNQCLSA-N 0 3 380.330 3.167 10 0 GGAEHN O=C(NC[C@@H](O)CN1CCCCC1)c1ccc2scc(Br)c2c1 ZINC000450228302 566645584 /nfs/dbraw/zinc/64/55/84/566645584.db2.gz AYHNDLDBNYITJG-CYBMUJFWSA-N 0 3 397.338 3.240 10 0 GGAEHN COc1ccc(Br)cc1CNC(=O)NCCN1CCCC[C@H]1C ZINC000514214376 566646945 /nfs/dbraw/zinc/64/69/45/566646945.db2.gz MOMMFOHRJGBBQZ-CYBMUJFWSA-N 0 3 384.318 3.131 10 0 GGAEHN CS(=O)(=O)N1CC[C@@H](CN2CC=C(c3ccc(Cl)c(Cl)c3)CC2)C1 ZINC000514229421 566647041 /nfs/dbraw/zinc/64/70/41/566647041.db2.gz PZEBDRRNCBMDHW-ZDUSSCGKSA-N 0 3 389.348 3.364 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2c(C)cccc2Br)C[C@@H]1N1CCCC1 ZINC000487092541 566647395 /nfs/dbraw/zinc/64/73/95/566647395.db2.gz AYFAGOVNDIUNPJ-LSDHHAIUSA-N 0 3 383.355 3.409 10 0 GGAEHN CN1CC[C@H]2[C@H](CCCN2C(=O)CCc2cccc(F)c2Br)C1 ZINC000450234967 566648189 /nfs/dbraw/zinc/64/81/89/566648189.db2.gz TTWJVTKBQBMJDD-ZBFHGGJFSA-N 0 3 383.305 3.464 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)N[C@H]1CCN(C3CC3)C1)CC2 ZINC000540378218 566648719 /nfs/dbraw/zinc/64/87/19/566648719.db2.gz JUNDURJEMZSCAU-HNNXBMFYSA-N 0 3 378.314 3.062 10 0 GGAEHN Brc1ccc(C2(NCCc3nnnn3-c3ccccc3)CC2)cc1 ZINC000540380638 566649018 /nfs/dbraw/zinc/64/90/18/566649018.db2.gz XCRSTBYXMJDCQL-UHFFFAOYSA-N 0 3 384.281 3.246 10 0 GGAEHN O=C(NCc1ccc2c(c1)CNC2)[C@H]1CCOc2ccc(Br)cc21 ZINC000653132915 566653014 /nfs/dbraw/zinc/65/30/14/566653014.db2.gz LVRKCUKSGGNSJJ-INIZCTEOSA-N 0 3 387.277 3.235 10 0 GGAEHN CCC1(N2CCOCC2)CCN(C(=O)Cc2ccccc2Br)CC1 ZINC000629417544 566654665 /nfs/dbraw/zinc/65/46/65/566654665.db2.gz FHWLNOZOPWGWLO-UHFFFAOYSA-N 0 3 395.341 3.095 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)N[C@@H]2CCCOc3c(Cl)cccc32)CCSC1 ZINC000540486251 566654887 /nfs/dbraw/zinc/65/48/87/566654887.db2.gz XMRHGVMKAWNCRK-CRAIPNDOSA-N 0 3 383.945 3.290 10 0 GGAEHN O=C(CC1(N2CCOCC2)CCCC1)NCc1csc(C(F)(F)F)c1 ZINC000629427716 566656230 /nfs/dbraw/zinc/65/62/30/566656230.db2.gz OUXBEWIYSSYMKV-UHFFFAOYSA-N 0 3 376.444 3.418 10 0 GGAEHN CCN1CC[C@@H](N(C)C(=O)c2n[nH]c3ccc(Br)cc32)C[C@H]1C ZINC000607128299 566658572 /nfs/dbraw/zinc/65/85/72/566658572.db2.gz YXPXXAKBSZRNEF-DGCLKSJQSA-N 0 3 379.302 3.270 10 0 GGAEHN CCCN1CCC[C@H]1C(=O)N[C@H]1CCN(c2ccc(Br)cc2)C1 ZINC000487261463 566659205 /nfs/dbraw/zinc/65/92/05/566659205.db2.gz MKEJZZIQRGBUNE-RDJZCZTQSA-N 0 3 380.330 3.018 10 0 GGAEHN CN1CCC[C@H](NC(=O)Nc2cc(Br)ccc2N2CCCC2)C1 ZINC000675697934 566660072 /nfs/dbraw/zinc/66/00/72/566660072.db2.gz AENLAUQDUUROEC-AWEZNQCLSA-N 0 3 381.318 3.265 10 0 GGAEHN OC1(CNCc2nc(-c3ccc(Br)cc3)c[nH]2)Cc2ccccc2C1 ZINC000540614105 566661152 /nfs/dbraw/zinc/66/11/52/566661152.db2.gz DCVBLRLYPTTXKX-UHFFFAOYSA-N 0 3 398.304 3.459 10 0 GGAEHN CN1C[C@@H]2CCCN(C(=O)N[C@@H]3CCOc4ccc(Br)cc43)[C@@H]2C1 ZINC000425654655 566662688 /nfs/dbraw/zinc/66/26/88/566662688.db2.gz DQAWIAJTHDWXGU-APHBMKBZSA-N 0 3 394.313 3.008 10 0 GGAEHN CN(C)C[C@H](c1ccc(Cl)c(Cl)c1)N1C(=O)N[C@@](C)(CCF)C1=O ZINC000629487222 566662825 /nfs/dbraw/zinc/66/28/25/566662825.db2.gz KEVMJMMOZMQZEJ-CJNGLKHVSA-N 0 3 376.259 3.266 10 0 GGAEHN Brc1ccc2c(c1)[C@H](NC1CCN(c3cnccn3)CC1)CCO2 ZINC000675779412 566664114 /nfs/dbraw/zinc/66/41/14/566664114.db2.gz VMEQWBWPFPVJIP-MRXNPFEDSA-N 0 3 389.297 3.321 10 0 GGAEHN O=C1c2ccccc2C(=O)N1CCN[C@@H]1CCc2cc(Br)ccc21 ZINC000675778391 566664457 /nfs/dbraw/zinc/66/44/57/566664457.db2.gz WQTBZPMIOLBJRQ-QGZVFWFLSA-N 0 3 385.261 3.322 10 0 GGAEHN CCS(=O)(=O)NCCN(C)[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000540675504 566665538 /nfs/dbraw/zinc/66/55/38/566665538.db2.gz KKDWZUVXWNNWCC-JKSUJKDBSA-N 0 3 378.460 3.213 10 0 GGAEHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)Nc1cnc2c(Br)cccn12 ZINC000425672699 566665827 /nfs/dbraw/zinc/66/58/27/566665827.db2.gz LFPFIBSBFDIRNM-LBPRGKRZSA-N 0 3 394.317 3.291 10 0 GGAEHN NCc1cccc2c1N(CC(=O)Nc1ccc(Br)cc1F)CCC2 ZINC000629558379 566666125 /nfs/dbraw/zinc/66/61/25/566666125.db2.gz GSLIVDDQHPDPLT-UHFFFAOYSA-N 0 3 392.272 3.438 10 0 GGAEHN COc1cc(Br)ccc1[C@@H]1CCCN1C[C@@H]1CCC2(CNC2)O1 ZINC000629558180 566666344 /nfs/dbraw/zinc/66/63/44/566666344.db2.gz CJVOWLHEWQRJNM-HOCLYGCPSA-N 0 3 381.314 3.116 10 0 GGAEHN CCN(C[C@H]1CCCN1CC)C(=O)c1cc(OC)c(Br)s1 ZINC000580144381 566667789 /nfs/dbraw/zinc/66/77/89/566667789.db2.gz AKWMREXGIDVICF-LLVKDONJSA-N 0 3 375.332 3.466 10 0 GGAEHN O=C1CC[C@H](CN2CCC[C@@H]2c2ccccc2I)CCN1 ZINC000450403850 566668283 /nfs/dbraw/zinc/66/82/83/566668283.db2.gz MYUAOUZQNUGERD-XJKSGUPXSA-N 0 3 398.288 3.344 10 0 GGAEHN O[C@@H](CNC[C@@H]1Cc2ccccc2CO1)COc1c(Cl)cccc1Cl ZINC000629587800 566669304 /nfs/dbraw/zinc/66/93/04/566669304.db2.gz UTMHQVNMWBYBEG-HOTGVXAUSA-N 0 3 382.287 3.464 10 0 GGAEHN O[C@H](CNC[C@H](n1cccn1)C(F)(F)F)COc1ccc(Cl)cc1Cl ZINC000629596159 566670413 /nfs/dbraw/zinc/67/04/13/566670413.db2.gz DVQUVRTXTIQDQC-RISCZKNCSA-N 0 3 398.212 3.323 10 0 GGAEHN O[C@@H](CNC[C@H](n1cccn1)C(F)(F)F)COc1ccc(Cl)cc1Cl ZINC000629596158 566670826 /nfs/dbraw/zinc/67/08/26/566670826.db2.gz DVQUVRTXTIQDQC-FZMZJTMJSA-N 0 3 398.212 3.323 10 0 GGAEHN O[C@@H](CNC[C@H](n1cccn1)C(F)(F)F)COc1c(Cl)cccc1Cl ZINC000629600801 566670937 /nfs/dbraw/zinc/67/09/37/566670937.db2.gz QZMIUXUDZPFQAG-GWCFXTLKSA-N 0 3 398.212 3.323 10 0 GGAEHN O[C@@H](CNC[C@@H](n1cccn1)C(F)(F)F)COc1ccc(Cl)cc1Cl ZINC000629596160 566671332 /nfs/dbraw/zinc/67/13/32/566671332.db2.gz DVQUVRTXTIQDQC-SMDDNHRTSA-N 0 3 398.212 3.323 10 0 GGAEHN COc1ccc(Br)cc1SCC(=O)NC1CCN(C2CC2)CC1 ZINC000607438472 566671792 /nfs/dbraw/zinc/67/17/92/566671792.db2.gz LHGDTNYRSDCNEO-UHFFFAOYSA-N 0 3 399.354 3.293 10 0 GGAEHN C[C@@H](NC(=O)C(=O)Nc1cc(Cl)c(Cl)c(Cl)c1)C1=CCN(C)CC1 ZINC000580204085 566673303 /nfs/dbraw/zinc/67/33/03/566673303.db2.gz SLNBBEHSDJFCIR-SECBINFHSA-N 0 3 390.698 3.352 10 0 GGAEHN Cc1nc(CSc2ccc(C(=O)N[C@H]3CNCCC3(F)F)cc2)cs1 ZINC000580193561 566673355 /nfs/dbraw/zinc/67/33/55/566673355.db2.gz IOAZOGJFMYXXDQ-HNNXBMFYSA-N 0 3 383.489 3.471 10 0 GGAEHN CC(C(=O)N(Cc1cccs1)Cc1ccc2[nH]ccc2c1)S(C)(=O)=O ZINC000629643028 566675568 /nfs/dbraw/zinc/67/55/68/566675568.db2.gz XBCSHQQZPZRCGI-ZDUSSCGKSA-N 0 3 376.503 3.191 10 0 GGAEHN CC(C)(C)N1CCCN(C(=O)Nc2cnc3c(Br)cccn23)CC1 ZINC000514933645 566680480 /nfs/dbraw/zinc/68/04/80/566680480.db2.gz XPYPSVLGSAHLNF-UHFFFAOYSA-N 0 3 394.317 3.435 10 0 GGAEHN CN(CCC(=O)N1CCc2cc(F)cc(Br)c2C1)c1ccncc1 ZINC000629740217 566681200 /nfs/dbraw/zinc/68/12/00/566681200.db2.gz ASQPBAXVSVLICH-UHFFFAOYSA-N 0 3 392.272 3.394 10 0 GGAEHN CCCOc1ccc(Br)cc1CNC[C@H](CO)c1cccnc1 ZINC000514964695 566681931 /nfs/dbraw/zinc/68/19/31/566681931.db2.gz CMJHUWFBKNBLIN-MRXNPFEDSA-N 0 3 379.298 3.499 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)C(=O)Nc1cc(Cl)c(Cl)c(Cl)c1 ZINC000580317778 566682537 /nfs/dbraw/zinc/68/25/37/566682537.db2.gz CNUKTCBTKRPJPD-UHFFFAOYSA-N 0 3 392.714 3.386 10 0 GGAEHN CN(CCN1CCCC1)C(=O)CSCc1ccc(Br)cc1F ZINC000487650758 566685478 /nfs/dbraw/zinc/68/54/78/566685478.db2.gz WSZDMYIXNUOPLK-UHFFFAOYSA-N 0 3 389.334 3.376 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N(C)Cc1cc(Br)cn1C ZINC000468160682 566686471 /nfs/dbraw/zinc/68/64/71/566686471.db2.gz REQDFIIOVNOXBO-ZIAGYGMSSA-N 0 3 385.350 3.192 10 0 GGAEHN CCN1CC[C@H]2OCCN(CC3=Cc4cc(Br)ccc4OC3)[C@H]2C1 ZINC000580355629 566686861 /nfs/dbraw/zinc/68/68/61/566686861.db2.gz HJRITSNXFXYNIV-PKOBYXMFSA-N 0 3 393.325 3.020 10 0 GGAEHN C/C(=C\c1cccc(C(F)(F)F)c1)CN[C@@H]1CCCN(S(C)(=O)=O)C1 ZINC000580371764 566687869 /nfs/dbraw/zinc/68/78/69/566687869.db2.gz WEIZJHVOWZTFTQ-LRFDDAOPSA-N 0 3 376.444 3.122 10 0 GGAEHN CC[C@@H](O)CC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000515038108 566688408 /nfs/dbraw/zinc/68/84/08/566688408.db2.gz KBPFRZPPRXVWRJ-MRXNPFEDSA-N 0 3 383.330 3.033 10 0 GGAEHN CS(=O)(=O)CC1(CN[C@@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000426059022 566688893 /nfs/dbraw/zinc/68/88/93/566688893.db2.gz GQKOPQYDYMJPTM-SFHVURJKSA-N 0 3 378.925 3.433 10 0 GGAEHN Cc1nc2ccc(CN(C)[C@@H](C)c3ccc(S(N)(=O)=O)cc3)cc2s1 ZINC000426043941 566689331 /nfs/dbraw/zinc/68/93/31/566689331.db2.gz QEOBHNCSTJRZRQ-LBPRGKRZSA-N 0 3 375.519 3.445 10 0 GGAEHN O=c1[nH]c2ccccc2n1CCCN[C@@H](CO)c1cccc(Br)c1 ZINC000541052358 566691608 /nfs/dbraw/zinc/69/16/08/566691608.db2.gz YHGFZVZVHMLJJX-INIZCTEOSA-N 0 3 390.281 3.218 10 0 GGAEHN OC[C@H](NCCOCCOc1ccccc1)c1cccc(Br)c1 ZINC000541053186 566691718 /nfs/dbraw/zinc/69/17/18/566691718.db2.gz GSZNDSQSGZXBQV-SFHVURJKSA-N 0 3 380.282 3.168 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@@H]1O[C@@H](C)C[C@@H]1C)c1ccc(Br)cn1 ZINC000580436476 566692593 /nfs/dbraw/zinc/69/25/93/566692593.db2.gz YKNDXCDWAJHNOR-GRDNDAEWSA-N 0 3 398.345 3.332 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)Cc2ccccc2C(F)(F)F)[C@@H](C)C1 ZINC000608027601 566693037 /nfs/dbraw/zinc/69/30/37/566693037.db2.gz NLMHJWDAGSVQII-BBRMVZONSA-N 0 3 378.460 3.197 10 0 GGAEHN CC[C@@H]1CN(Cc2c(Br)cnn2C)CCN1Cc1ccccc1 ZINC000426163170 566695581 /nfs/dbraw/zinc/69/55/81/566695581.db2.gz RNGZXRFZTNNUJS-MRXNPFEDSA-N 0 3 377.330 3.279 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)NCCN1CCCC[C@@H]1C ZINC000487940282 566697592 /nfs/dbraw/zinc/69/75/92/566697592.db2.gz CWUDLFPUWFXPNY-ZDUSSCGKSA-N 0 3 384.318 3.131 10 0 GGAEHN COc1ccc2c(c1)[C@H](NC[C@H]1CS(=O)(=O)c3ccccc31)CCS2 ZINC000515208139 566697673 /nfs/dbraw/zinc/69/76/73/566697673.db2.gz NGFYPPLXAQZFOS-SUMWQHHRSA-N 0 3 375.515 3.393 10 0 GGAEHN COc1ccc2c(c1)[C@@H](NC[C@H]1CS(=O)(=O)c3ccccc31)CCS2 ZINC000515208138 566697754 /nfs/dbraw/zinc/69/77/54/566697754.db2.gz NGFYPPLXAQZFOS-GUYCJALGSA-N 0 3 375.515 3.393 10 0 GGAEHN CCN1CCC(NC(=O)N[C@H](C)c2ccc(Br)cc2OC)CC1 ZINC000468441126 566700764 /nfs/dbraw/zinc/70/07/64/566700764.db2.gz AWNSKBYYLNWHTN-GFCCVEGCSA-N 0 3 384.318 3.302 10 0 GGAEHN CCN1CCC(NC(=O)N[C@@H](C)c2ccc(Br)cc2OC)CC1 ZINC000468441127 566700952 /nfs/dbraw/zinc/70/09/52/566700952.db2.gz AWNSKBYYLNWHTN-LBPRGKRZSA-N 0 3 384.318 3.302 10 0 GGAEHN Cc1cc(Br)cc(C)c1N1CCC[C@H](N[C@@H](C)[C@H](C)CO)C1=O ZINC000450737400 566701152 /nfs/dbraw/zinc/70/11/52/566701152.db2.gz JAEKHPIGBMOFQC-YCPHGPKFSA-N 0 3 383.330 3.168 10 0 GGAEHN CO[C@@H](CCNC(=O)NC[C@H](c1cccs1)N1CCCC1)C(F)(F)F ZINC000468428208 566701332 /nfs/dbraw/zinc/70/13/32/566701332.db2.gz PJVZTCZSFRBLHN-OCCSQVGLSA-N 0 3 379.448 3.152 10 0 GGAEHN CC[C@@H](NCC(=O)N(C)Cc1cc(Br)cs1)[C@H]1CCCCO1 ZINC000653876866 566701608 /nfs/dbraw/zinc/70/16/08/566701608.db2.gz JAAHMEZRKXIZFS-HUUCEWRRSA-N 0 3 389.359 3.406 10 0 GGAEHN COCCOc1ccc(Br)cc1NC(=O)[C@H](CN)c1ccccc1 ZINC000580555684 566704114 /nfs/dbraw/zinc/70/41/14/566704114.db2.gz VIZCRKOSESSEHI-OAHLLOKOSA-N 0 3 393.281 3.155 10 0 GGAEHN Cc1cc(Cl)cc2c1OCCC[C@H]2NC[C@H]1CCCCN1S(C)(=O)=O ZINC000580588196 566705512 /nfs/dbraw/zinc/70/55/12/566705512.db2.gz CDVPYLKQJRMVNG-NVXWUHKLSA-N 0 3 386.945 3.266 10 0 GGAEHN CN1CC[C@@]2(CCN(C(=O)N[C@@H]3CCOc4ccc(Br)cc43)C2)C1 ZINC000488074567 566705907 /nfs/dbraw/zinc/70/59/07/566705907.db2.gz NLOLLEUXRBRLMW-CRAIPNDOSA-N 0 3 394.313 3.010 10 0 GGAEHN Cc1cc(Cl)cc2c1OCCC[C@@H]2NC[C@@H]1CCCCN1S(C)(=O)=O ZINC000580588197 566706053 /nfs/dbraw/zinc/70/60/53/566706053.db2.gz CDVPYLKQJRMVNG-RDJZCZTQSA-N 0 3 386.945 3.266 10 0 GGAEHN C[C@@H]1[C@@H]([NH2+]CC[N-]S(=O)(=O)c2ccc(Cl)s2)C[C@@H]1c1ccccc1 ZINC000541239296 566706287 /nfs/dbraw/zinc/70/62/87/566706287.db2.gz CTAOJSLZHZTMPG-QEJZJMRPSA-N 0 3 384.954 3.462 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNS(=O)(=O)Cc1ccccc1Br ZINC000561505453 566710115 /nfs/dbraw/zinc/71/01/15/566710115.db2.gz VZJHXPOXJNIVQY-OKILXGFUSA-N 0 3 389.359 3.131 10 0 GGAEHN O[C@H](CNCc1ccc(Br)cc1N1CCOCC1)CC1CCCC1 ZINC000515414140 566711705 /nfs/dbraw/zinc/71/17/05/566711705.db2.gz CODPUCHTGHNVGE-SFHVURJKSA-N 0 3 397.357 3.317 10 0 GGAEHN COC(=O)C1(CN[C@H](CO)c2ccc(Br)cc2C(F)(F)F)CC1 ZINC000450901083 566719354 /nfs/dbraw/zinc/71/93/54/566719354.db2.gz VOJVYOCGILUBGP-GFCCVEGCSA-N 0 3 396.203 3.044 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@H]1CN(C2CC2)C[C@H]1C ZINC000468694352 566721715 /nfs/dbraw/zinc/72/17/15/566721715.db2.gz OXTHEMHNOSVLCV-WQGACYEGSA-N 0 3 396.329 3.301 10 0 GGAEHN O[C@H](COc1ccc(Br)cc1)CN1CCC(c2ccccn2)CC1 ZINC000677142207 566725686 /nfs/dbraw/zinc/72/56/86/566725686.db2.gz AFAARPIGMRYIHA-KRWDZBQOSA-N 0 3 391.309 3.463 10 0 GGAEHN O[C@@H](COc1ccc(Br)cc1)CN1CCC(c2ccccn2)CC1 ZINC000677142208 566726098 /nfs/dbraw/zinc/72/60/98/566726098.db2.gz AFAARPIGMRYIHA-QGZVFWFLSA-N 0 3 391.309 3.463 10 0 GGAEHN O=C(Cc1c(F)ccc(Br)c1F)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000654315859 566727003 /nfs/dbraw/zinc/72/70/03/566727003.db2.gz XCBSQGLPXWFRPK-GJZGRUSLSA-N 0 3 387.268 3.403 10 0 GGAEHN O=C(Cc1c(F)ccc(Br)c1F)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000654315858 566727830 /nfs/dbraw/zinc/72/78/30/566727830.db2.gz XCBSQGLPXWFRPK-CABCVRRESA-N 0 3 387.268 3.403 10 0 GGAEHN CN(C)CCOC1CCN(c2ccc(Br)c(C(F)(F)F)n2)CC1 ZINC000580850804 566727816 /nfs/dbraw/zinc/72/78/16/566727816.db2.gz QNOFEYNODHQJDA-UHFFFAOYSA-N 0 3 396.251 3.410 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N[C@H]1CCCN2CCCC[C@H]12 ZINC000654312059 566728001 /nfs/dbraw/zinc/72/80/01/566728001.db2.gz MQCQLDIKBSEEDU-JKSUJKDBSA-N 0 3 381.314 3.133 10 0 GGAEHN C[C@H]1CN(Cc2ccccc2)CC[C@H]1NCc1ccc(S(C)(=O)=O)s1 ZINC000468786091 566730038 /nfs/dbraw/zinc/73/00/38/566730038.db2.gz BGDAXTMLVKLNQP-MAUKXSAKSA-N 0 3 378.563 3.152 10 0 GGAEHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc[nH]c(=O)c2Br)C1 ZINC000468801510 566731407 /nfs/dbraw/zinc/73/14/07/566731407.db2.gz CMESOLJTJVAQEP-TZMCWYRMSA-N 0 3 390.281 3.115 10 0 GGAEHN Cc1c([C@H](C)NCC[C@@H]2CCOC2)nnn1-c1cccc(Br)c1 ZINC000541559155 566733101 /nfs/dbraw/zinc/73/31/01/566733101.db2.gz WGRPFNHTVFLLEM-GXTWGEPZSA-N 0 3 379.302 3.415 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CC[C@H](N3CCCC3)[C@@H]2C)c1 ZINC000561755818 566735614 /nfs/dbraw/zinc/73/56/14/566735614.db2.gz VOOOOLZPBFVRKV-BBRMVZONSA-N 0 3 398.288 3.298 10 0 GGAEHN CCN(CC(=O)NC1CCN(C2CC2)CC1)Cc1ccccc1Br ZINC000515885229 566737296 /nfs/dbraw/zinc/73/72/96/566737296.db2.gz LTHHXOBWGMCAGG-UHFFFAOYSA-N 0 3 394.357 3.014 10 0 GGAEHN CC(C)(C)[C@@H]1CCN(C[C@H](O)COc2c(Cl)cccc2Cl)C[C@H]1O ZINC000541618367 566737993 /nfs/dbraw/zinc/73/79/93/566737993.db2.gz MQOAQACFCBAGBI-WOSRLPQWSA-N 0 3 376.324 3.462 10 0 GGAEHN C[C@@H](NC(=O)N1CCOc2cccc(Br)c2C1)C1=CCN(C)CC1 ZINC000654524315 566738282 /nfs/dbraw/zinc/73/82/82/566738282.db2.gz XTHXTLJODLLNGT-CYBMUJFWSA-N 0 3 394.313 3.004 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000654536457 566739796 /nfs/dbraw/zinc/73/97/96/566739796.db2.gz SQDMMJSIBXBGAH-CVEARBPZSA-N 0 3 396.329 3.274 10 0 GGAEHN O=C(CSCc1cc(-c2cccs2)on1)N1CC[C@@H](N2CCCC2)C1 ZINC000608906083 566741975 /nfs/dbraw/zinc/74/19/75/566741975.db2.gz PBLAKTCZIUDRHG-OAHLLOKOSA-N 0 3 377.535 3.333 10 0 GGAEHN C[C@H](c1ccc(F)c(Br)c1)n1cc([C@H](N)C2CCOCC2)nn1 ZINC000630592986 566742111 /nfs/dbraw/zinc/74/21/11/566742111.db2.gz CCQFDFYYSJSQQP-QLJPJBMISA-N 0 3 383.265 3.215 10 0 GGAEHN C[C@H](c1ccc(F)c(Br)c1)n1cc([C@@H](N)C2CCOCC2)nn1 ZINC000630592983 566742888 /nfs/dbraw/zinc/74/28/88/566742888.db2.gz CCQFDFYYSJSQQP-HWPZZCPQSA-N 0 3 383.265 3.215 10 0 GGAEHN C[C@H](NC[C@H](O)COc1c(Cl)cccc1Cl)C(=O)N1CCCC[C@@H]1C ZINC000516050060 566744476 /nfs/dbraw/zinc/74/44/76/566744476.db2.gz KOUNNFYNTGGZRS-IHRRRGAJSA-N 0 3 389.323 3.112 10 0 GGAEHN C[C@@]1(c2cccc(Br)c2)C[C@H]1C(=O)NC1CCN(C2CC2)CC1 ZINC000630626402 566745002 /nfs/dbraw/zinc/74/50/02/566745002.db2.gz GAPCLWIHMMZPQP-HKUYNNGSSA-N 0 3 377.326 3.470 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)CSCc1ccc(Cl)cc1Cl ZINC000609045731 566747796 /nfs/dbraw/zinc/74/77/96/566747796.db2.gz QEQRKQZDJLUTFK-OAHLLOKOSA-N 0 3 391.364 3.454 10 0 GGAEHN C[C@H](CNC(=O)Cc1csc(CCC(F)(F)F)n1)N1CCC[C@H](C)C1 ZINC000630741413 566749496 /nfs/dbraw/zinc/74/94/96/566749496.db2.gz WXNHSHJCLIAHSI-QWHCGFSZSA-N 0 3 377.476 3.417 10 0 GGAEHN C[C@@H](CNC(=O)Cc1csc(CCC(F)(F)F)n1)N1CCC[C@H](C)C1 ZINC000630741414 566749744 /nfs/dbraw/zinc/74/97/44/566749744.db2.gz WXNHSHJCLIAHSI-STQMWFEESA-N 0 3 377.476 3.417 10 0 GGAEHN CN(C)CCn1cc(NC(=O)c2cc(Br)cc3cccnc32)cn1 ZINC000677529824 566752503 /nfs/dbraw/zinc/75/25/03/566752503.db2.gz ZIHATCVHRAYGFQ-UHFFFAOYSA-N 0 3 388.269 3.008 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1cccc(Br)c1F ZINC000469007361 566753290 /nfs/dbraw/zinc/75/32/90/566753290.db2.gz PYCWOBBPUOURJQ-CQSZACIVSA-N 0 3 379.273 3.491 10 0 GGAEHN COc1ccc(Br)c(C(=O)N2C[C@@H](SC)[C@H](N3CCCC3)C2)c1 ZINC000541840108 566753768 /nfs/dbraw/zinc/75/37/68/566753768.db2.gz CGYWWXQHUXXENY-HZPDHXFCSA-N 0 3 399.354 3.110 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2c(F)cccc2Br)C[C@@H]1N1CCCC1 ZINC000541840513 566754035 /nfs/dbraw/zinc/75/40/35/566754035.db2.gz DIIXBWNUSQEHMG-UONOGXRCSA-N 0 3 387.318 3.240 10 0 GGAEHN COc1ccc(Br)c(C(=O)N2C[C@@H](SC)[C@@H](N3CCCC3)C2)c1 ZINC000541840109 566754214 /nfs/dbraw/zinc/75/42/14/566754214.db2.gz CGYWWXQHUXXENY-JKSUJKDBSA-N 0 3 399.354 3.110 10 0 GGAEHN O=S(=O)(C[C@@H]1CCCC1(F)F)N1CCCN(CC2CCCCC2)CC1 ZINC000451092775 566754177 /nfs/dbraw/zinc/75/41/77/566754177.db2.gz UONGJUIPWYHJRO-KRWDZBQOSA-N 0 3 378.529 3.340 10 0 GGAEHN CS[C@H]1CN(C(=O)c2c(F)cccc2Br)C[C@H]1N1CCCC1 ZINC000541840512 566754700 /nfs/dbraw/zinc/75/47/00/566754700.db2.gz DIIXBWNUSQEHMG-KGLIPLIRSA-N 0 3 387.318 3.240 10 0 GGAEHN C[C@@H]1CSCCN1CCCOc1cccc(I)c1 ZINC000561983693 566754787 /nfs/dbraw/zinc/75/47/87/566754787.db2.gz ROTZDZIZSZRUGY-GFCCVEGCSA-N 0 3 377.291 3.497 10 0 GGAEHN CS[C@H]1CN(C(=O)COc2cc(Cl)ccc2Cl)C[C@@H]1N1CCCC1 ZINC000541843634 566754793 /nfs/dbraw/zinc/75/47/93/566754793.db2.gz GUBWZYGHOWQMQU-HOCLYGCPSA-N 0 3 389.348 3.410 10 0 GGAEHN C[C@H](CNC(=O)Cc1csc(CCC(F)(F)F)n1)N1CCC(C)CC1 ZINC000630839641 566756144 /nfs/dbraw/zinc/75/61/44/566756144.db2.gz RKMHWRYRXSEARB-CYBMUJFWSA-N 0 3 377.476 3.417 10 0 GGAEHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)[C@H]1CCC(C)(C)O1 ZINC000469041385 566756238 /nfs/dbraw/zinc/75/62/38/566756238.db2.gz UBRGFYQNHDEVJZ-MRXNPFEDSA-N 0 3 383.330 3.297 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)Cc1cc(F)ccc1Br ZINC000516293591 566756910 /nfs/dbraw/zinc/75/69/10/566756910.db2.gz KKGYDKZJIRNVOG-QGZVFWFLSA-N 0 3 377.257 3.215 10 0 GGAEHN CCNC(=O)C[C@@H]1CCCCN1C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000581265806 566762165 /nfs/dbraw/zinc/76/21/65/566762165.db2.gz LAOUFKKXPWNUOD-UONOGXRCSA-N 0 3 389.323 3.114 10 0 GGAEHN C[C@H]1CC[C@@]2(CCN(Cc3cc(=O)n4cc(Br)ccc4n3)C2)C1 ZINC000541953843 566762312 /nfs/dbraw/zinc/76/23/12/566762312.db2.gz SUQNBJBSAQMASQ-SCLBCKFNSA-N 0 3 376.298 3.469 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)[C@@H]1[C@@H]2Cc3cc(Br)ccc3[C@@H]21 ZINC000630925782 566764410 /nfs/dbraw/zinc/76/44/10/566764410.db2.gz PMSUVDBEZLHMNM-FGTMMUONSA-N 0 3 377.326 3.135 10 0 GGAEHN O=C(CCCSc1ccc(Br)cc1)N[C@H]1CNCCC1(F)F ZINC000516465830 566765003 /nfs/dbraw/zinc/76/50/03/566765003.db2.gz WNCDCTUOOLZWBE-ZDUSSCGKSA-N 0 3 393.297 3.435 10 0 GGAEHN FC(F)c1ccc(CNc2cc(N3CCOCC3)c(Br)cn2)cn1 ZINC000630954277 566766272 /nfs/dbraw/zinc/76/62/72/566766272.db2.gz HKLQFPKCCCBIEA-UHFFFAOYSA-N 0 3 399.239 3.047 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)COc1cccc(Br)c1 ZINC000516537252 566767808 /nfs/dbraw/zinc/76/78/08/566767808.db2.gz LKRGJMMSFXILKM-KRWDZBQOSA-N 0 3 391.309 3.117 10 0 GGAEHN Cc1nc2ccc(S(=O)(=O)NCc3ccccc3CN(C)C)cc2s1 ZINC000489081015 566768456 /nfs/dbraw/zinc/76/84/56/566768456.db2.gz VCLRBUHVYDFPMP-UHFFFAOYSA-N 0 3 375.519 3.145 10 0 GGAEHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)CCOCC1CC1 ZINC000427379532 566770545 /nfs/dbraw/zinc/77/05/45/566770545.db2.gz KQHFNXVMAKHIQZ-UHFFFAOYSA-N 0 3 383.330 3.156 10 0 GGAEHN O=S(=O)(C1CCC(C(F)(F)F)CC1)N1CCCC[C@@H](N2CCCC2)C1 ZINC000451177328 566772193 /nfs/dbraw/zinc/77/21/93/566772193.db2.gz VGKUNCLVDNQBDT-HWOWSKLDSA-N 0 3 382.492 3.388 10 0 GGAEHN CC(C)n1ncnc1CNCC1(c2cccc(Br)c2)CCOCC1 ZINC000631047865 566774030 /nfs/dbraw/zinc/77/40/30/566774030.db2.gz WEFQNYUKERFQRN-UHFFFAOYSA-N 0 3 393.329 3.460 10 0 GGAEHN CCCN(CCN1CCCCC1)C(=O)Nc1ccnc(C)c1Br ZINC000562269679 566774948 /nfs/dbraw/zinc/77/49/48/566774948.db2.gz YOOJZXWGKRNYQL-UHFFFAOYSA-N 0 3 383.334 3.304 10 0 GGAEHN O=C(NCCNCc1ccc(C(F)F)nc1)c1cccc(Br)c1 ZINC000631071416 566776225 /nfs/dbraw/zinc/77/62/25/566776225.db2.gz LPXXRACLGBHDCO-UHFFFAOYSA-N 0 3 384.224 3.301 10 0 GGAEHN CCN(C[C@@H]1CCCN1CC)C(=O)c1cc(Br)cc(C(=O)OC)c1 ZINC000562279255 566777469 /nfs/dbraw/zinc/77/74/69/566777469.db2.gz AEYFUMRZUVYANA-INIZCTEOSA-N 0 3 397.313 3.182 10 0 GGAEHN C[C@@H](C(=O)N(CCO)Cc1cc(Br)cs1)N1[C@H](C)CC[C@H]1C ZINC000427555808 566777937 /nfs/dbraw/zinc/77/79/37/566777937.db2.gz LZNYFRRZDHZVNL-UPJWGTAASA-N 0 3 389.359 3.093 10 0 GGAEHN Cc1c(Br)ccc(C(=O)NC[C@]2(N(C)C)CCSC2)c1F ZINC000469286471 566778954 /nfs/dbraw/zinc/77/89/54/566778954.db2.gz OTBKXJKBLPBILX-OAHLLOKOSA-N 0 3 375.307 3.064 10 0 GGAEHN COC(=O)[C@@H]1CCCCC[C@@H]1NCC(=O)Nc1ccccc1Br ZINC000451233024 566780086 /nfs/dbraw/zinc/78/00/86/566780086.db2.gz WKCLUXUIWKEHKC-OCCSQVGLSA-N 0 3 383.286 3.099 10 0 GGAEHN CN(C[C@H]1CCCN(C)C1)C(=O)CSCc1cc(-c2cccs2)on1 ZINC000609664534 566780792 /nfs/dbraw/zinc/78/07/92/566780792.db2.gz NSZIGVRRKFTOKF-AWEZNQCLSA-N 0 3 379.551 3.437 10 0 GGAEHN CN(C)CCn1ccc(C(=O)NC2(c3ccccc3Br)CCC2)n1 ZINC000655162544 566782498 /nfs/dbraw/zinc/78/24/98/566782498.db2.gz OPXYIBWJWQCZHZ-UHFFFAOYSA-N 0 3 391.313 3.016 10 0 GGAEHN CC[C@@H]1[C@H](CO)CCN1Cc1ccnc(-c2ccc(Br)cc2)n1 ZINC000451247838 566783660 /nfs/dbraw/zinc/78/36/60/566783660.db2.gz AJPKGJRRTYHODB-WMLDXEAASA-N 0 3 376.298 3.499 10 0 GGAEHN CN1CCC[C@H](CNc2c(F)cccc2S(N)(=O)=O)[C@@H]1c1cccs1 ZINC000631128469 566783927 /nfs/dbraw/zinc/78/39/27/566783927.db2.gz MSTSBIISFGDVEY-SJKOYZFVSA-N 0 3 383.514 3.030 10 0 GGAEHN O=C(Cc1csc(CCC(F)(F)F)n1)N1CC[C@@H](N2CCCCC2)C1 ZINC000631149671 566785268 /nfs/dbraw/zinc/78/52/68/566785268.db2.gz NQLVQKLKZWPBPZ-CQSZACIVSA-N 0 3 375.460 3.267 10 0 GGAEHN O[C@@H](COc1ccc(Br)cc1)CN1CCC(c2cccnc2)CC1 ZINC000678166926 566786525 /nfs/dbraw/zinc/78/65/25/566786525.db2.gz FDVPDNICXKUXAW-GOSISDBHSA-N 0 3 391.309 3.463 10 0 GGAEHN CC[C@@H](N[C@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)C(=O)NC ZINC000451281516 566787898 /nfs/dbraw/zinc/78/78/98/566787898.db2.gz JSFICCCBNQDSKS-BXKDBHETSA-N 0 3 379.810 3.190 10 0 GGAEHN CC[C@H](N[C@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)C(=O)NC ZINC000451281519 566788059 /nfs/dbraw/zinc/78/80/59/566788059.db2.gz JSFICCCBNQDSKS-SKDRFNHKSA-N 0 3 379.810 3.190 10 0 GGAEHN C[C@H](CC(=O)c1cccc(Br)c1)C(=O)NC[C@H]1C[C@@H](N(C)C)C1 ZINC000655247157 566790875 /nfs/dbraw/zinc/79/08/75/566790875.db2.gz UYCBBTFSHNPKEV-IOASZLSFSA-N 0 3 381.314 3.114 10 0 GGAEHN CN1CCC(n2cc(NCc3cn4ccc(Br)cc4n3)cn2)CC1 ZINC000631225220 566792652 /nfs/dbraw/zinc/79/26/52/566792652.db2.gz JLYLIGHRPKQPEP-UHFFFAOYSA-N 0 3 389.301 3.172 10 0 GGAEHN COc1cc(CNc2cnn(C3CC[NH+](C)CC3)c2)cc(Br)c1[O-] ZINC000631226814 566793173 /nfs/dbraw/zinc/79/31/73/566793173.db2.gz QFHZSRIQCSKXDH-UHFFFAOYSA-N 0 3 395.301 3.239 10 0 GGAEHN C[C@@H](Cc1ccc(F)cc1Br)[NH2+]Cc1nnc(C2CCOCC2)[n-]1 ZINC000631214748 566793428 /nfs/dbraw/zinc/79/34/28/566793428.db2.gz XNEMQNHWKMEGNL-NSHDSACASA-N 0 3 397.292 3.321 10 0 GGAEHN O=C(N[C@H]1CCCN2CCCC[C@@H]12)c1cc(Br)cc2[nH]cnc21 ZINC000655347815 566795429 /nfs/dbraw/zinc/79/54/29/566795429.db2.gz CJVBTMQZJIDOFH-ZFWWWQNUSA-N 0 3 377.286 3.072 10 0 GGAEHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)c1cc(Br)cc2[nH]cnc21 ZINC000655347814 566795610 /nfs/dbraw/zinc/79/56/10/566795610.db2.gz CJVBTMQZJIDOFH-UKRRQHHQSA-N 0 3 377.286 3.072 10 0 GGAEHN O[C@@H](COC[C@@H]1CCCO1)CN1CCC(c2cccc(Br)c2)CC1 ZINC000562498937 566796651 /nfs/dbraw/zinc/79/66/51/566796651.db2.gz GYCOYSDBZYNHRD-MOPGFXCFSA-N 0 3 398.341 3.185 10 0 GGAEHN O[C@@H](COC[C@H]1CCCO1)CN1CCC(c2cccc(Br)c2)CC1 ZINC000562498940 566796724 /nfs/dbraw/zinc/79/67/24/566796724.db2.gz GYCOYSDBZYNHRD-RTBURBONSA-N 0 3 398.341 3.185 10 0 GGAEHN CN(C(=O)CNC[C@H](O)COc1c(Cl)cccc1Cl)C1CCCCC1 ZINC000581662415 566796661 /nfs/dbraw/zinc/79/66/61/566796661.db2.gz JFMLDHDTPIHSII-AWEZNQCLSA-N 0 3 389.323 3.114 10 0 GGAEHN Cc1c(Br)csc1C(=O)N1CCC(OCCN(C)C)CC1 ZINC000631271538 566796928 /nfs/dbraw/zinc/79/69/28/566796928.db2.gz SKBFFKPSVSHKBX-UHFFFAOYSA-N 0 3 375.332 3.002 10 0 GGAEHN CCSc1cc(CN[C@H](C)Cn2cc(Br)ccc2=O)ccn1 ZINC000581681575 566797843 /nfs/dbraw/zinc/79/78/43/566797843.db2.gz WNOPEVKEKBGZII-GFCCVEGCSA-N 0 3 382.327 3.296 10 0 GGAEHN CN(C)CCOc1ccc(NC(=O)c2ncc(Br)s2)cc1F ZINC000655435514 566799676 /nfs/dbraw/zinc/79/96/76/566799676.db2.gz HNRJXRVYHXLNOF-UHFFFAOYSA-N 0 3 388.262 3.237 10 0 GGAEHN CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2ccc(Br)c3c2OCCC3)C1 ZINC000469599947 566801673 /nfs/dbraw/zinc/80/16/73/566801673.db2.gz BPNSDEFMYLNMPF-WBMJQRKESA-N 0 3 381.314 3.233 10 0 GGAEHN CC(C)N1C[C@@H](C)[C@H](NC(=O)c2ccc(Br)c3c2OCCC3)C1 ZINC000469599946 566801921 /nfs/dbraw/zinc/80/19/21/566801921.db2.gz BPNSDEFMYLNMPF-MLGOLLRUSA-N 0 3 381.314 3.233 10 0 GGAEHN CCC(CC)(CNC(=O)[C@H](N)CCC(=O)OC)c1ccc(Cl)c(Cl)c1 ZINC000581724394 566802516 /nfs/dbraw/zinc/80/25/16/566802516.db2.gz ZYUCGWUPQVZGRD-OAHLLOKOSA-N 0 3 389.323 3.448 10 0 GGAEHN O=C([C@H]1CNCc2ccccc21)N1CCOc2cccc(Br)c2C1 ZINC000655502909 566804808 /nfs/dbraw/zinc/80/48/08/566804808.db2.gz CMSPTNIKWLTVDB-HNNXBMFYSA-N 0 3 387.277 3.057 10 0 GGAEHN Fc1ccc(OCCN2CCC(Nc3ncncc3Br)CC2)cc1 ZINC000517065779 566805080 /nfs/dbraw/zinc/80/50/80/566805080.db2.gz JKLLSKQFVLAJNS-UHFFFAOYSA-N 0 3 395.276 3.334 10 0 GGAEHN O=S1(=O)CCCN1CCCN[C@H]1CCCOc2c(Cl)c(Cl)ccc21 ZINC000678582215 566805452 /nfs/dbraw/zinc/80/54/52/566805452.db2.gz HDRXGBHLJPUTRU-AWEZNQCLSA-N 0 3 393.336 3.222 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)[C@@H]1[C@@H]2Cc3cc(Br)ccc3[C@@H]21 ZINC000631464715 566805522 /nfs/dbraw/zinc/80/55/22/566805522.db2.gz IWDZRCLKFIQMHO-FKHNRKFTSA-N 0 3 377.326 3.133 10 0 GGAEHN Cc1nc(CSc2ccccc2C(=O)N[C@@H](CN)C(F)(F)F)cs1 ZINC000655515335 566806016 /nfs/dbraw/zinc/80/60/16/566806016.db2.gz YGOGVKBNTRDHKP-ZDUSSCGKSA-N 0 3 375.441 3.363 10 0 GGAEHN CCC1(N(C)C)CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)CC1 ZINC000631477654 566806223 /nfs/dbraw/zinc/80/62/23/566806223.db2.gz MJUZFZOUMPFXDC-UHFFFAOYSA-N 0 3 378.460 3.420 10 0 GGAEHN CC(C)(C)CC(=O)Nc1ccc(Cl)c(C(=O)N[C@@H](CN)C(F)(F)F)c1 ZINC000655512579 566806517 /nfs/dbraw/zinc/80/65/17/566806517.db2.gz HSYVRGHQVHONKD-LBPRGKRZSA-N 0 3 379.810 3.334 10 0 GGAEHN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N[C@@H](CN)C(F)(F)F ZINC000655515074 566806554 /nfs/dbraw/zinc/80/65/54/566806554.db2.gz WPGBQFNLHASFBY-NSHDSACASA-N 0 3 393.818 3.303 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)NCc1sccc1Br ZINC000581822772 566806899 /nfs/dbraw/zinc/80/68/99/566806899.db2.gz ORSXYPIKXBOSLY-AWEZNQCLSA-N 0 3 380.311 3.278 10 0 GGAEHN OC[C@@H](N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1 ZINC000678609928 566807668 /nfs/dbraw/zinc/80/76/68/566807668.db2.gz ATCKYNBGGNGUAE-RBUKOAKNSA-N 0 3 375.310 3.347 10 0 GGAEHN Cc1c(Br)cccc1CS(=O)(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000655524135 566808833 /nfs/dbraw/zinc/80/88/33/566808833.db2.gz UFNFOOYHIXGPAK-IUODEOHRSA-N 0 3 389.359 3.002 10 0 GGAEHN CN(C)CCN(CCN(C)C)C(=O)c1ccc2scc(Br)c2c1 ZINC000562639018 566809275 /nfs/dbraw/zinc/80/92/75/566809275.db2.gz SHDRMRRVUQRVPG-UHFFFAOYSA-N 0 3 398.370 3.229 10 0 GGAEHN COc1cc(CNCc2ccc3cnn(C)c3c2)cc(Br)c1O ZINC000581858264 566810136 /nfs/dbraw/zinc/81/01/36/566810136.db2.gz LJSJSSHZHBPZDX-UHFFFAOYSA-N 0 3 376.254 3.340 10 0 GGAEHN CC(C)(C)[C@@H]1CCN(C[C@H](O)COc2cc(Cl)ccc2Cl)C[C@H]1O ZINC000542547035 566810844 /nfs/dbraw/zinc/81/08/44/566810844.db2.gz SYOVKYNZYMLWPH-SQWLQELKSA-N 0 3 376.324 3.462 10 0 GGAEHN CC[C@H](CN(C)CCCS(=O)(=O)NC)Oc1ccc(Cl)c(Cl)c1 ZINC000469748151 566811034 /nfs/dbraw/zinc/81/10/34/566811034.db2.gz HXPZPAUULIJOCD-GFCCVEGCSA-N 0 3 383.341 3.022 10 0 GGAEHN COc1ccc(-c2nc([C@H](N)CC(C)C)no2)c(I)c1 ZINC000581883911 566811780 /nfs/dbraw/zinc/81/17/80/566811780.db2.gz ISCYTGZXIRVRKJ-GFCCVEGCSA-N 0 3 387.221 3.396 10 0 GGAEHN CN(C)C(=O)C1(NC[C@H](O)COc2c(Cl)cccc2Cl)CCCCC1 ZINC000451405520 566812393 /nfs/dbraw/zinc/81/23/93/566812393.db2.gz PEZWCXIVXSMELR-ZDUSSCGKSA-N 0 3 389.323 3.114 10 0 GGAEHN C[C@@H](N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)c1ccc(S(N)(=O)=O)cc1 ZINC000631655360 566813029 /nfs/dbraw/zinc/81/30/29/566813029.db2.gz ZDTHUKCXJUPYDX-PJSAGSTRSA-N 0 3 380.897 3.168 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)N[C@H]1CCN(CC3CC3)C1)CC2 ZINC000678720437 566813400 /nfs/dbraw/zinc/81/34/00/566813400.db2.gz SYEOEKPWNSAORS-KRWDZBQOSA-N 0 3 392.341 3.310 10 0 GGAEHN Brc1ccc2c(c1)CC[C@H]([NH2+]Cc1nnc(C3CCOCC3)[n-]1)C2 ZINC000631696036 566817881 /nfs/dbraw/zinc/81/78/81/566817881.db2.gz MCYYWKJYIUCSJV-INIZCTEOSA-N 0 3 391.313 3.108 10 0 GGAEHN Brc1ccc2c(c1)CC[C@H](NCc1nnc(C3CCOCC3)[nH]1)C2 ZINC000631696036 566817886 /nfs/dbraw/zinc/81/78/86/566817886.db2.gz MCYYWKJYIUCSJV-INIZCTEOSA-N 0 3 391.313 3.108 10 0 GGAEHN CCC[NH+]1CCC(C[N-]S(=O)(=O)c2cc(Cl)c(OC)cc2Cl)CC1 ZINC000517284624 566817994 /nfs/dbraw/zinc/81/79/94/566817994.db2.gz GKJCLHYHWMRVRS-UHFFFAOYSA-N 0 3 395.352 3.402 10 0 GGAEHN O=S1(=O)CC[C@H](N[C@@H]2CCOC3(CCSCC3)C2)c2cc(F)ccc21 ZINC000678807268 566818437 /nfs/dbraw/zinc/81/84/37/566818437.db2.gz FPMLUCUIJXNMDG-ZBFHGGJFSA-N 0 3 385.526 3.079 10 0 GGAEHN O=S1(=O)CC[C@H](N[C@H]2CCOC3(CCSCC3)C2)c2cc(F)ccc21 ZINC000678807266 566819065 /nfs/dbraw/zinc/81/90/65/566819065.db2.gz FPMLUCUIJXNMDG-HOCLYGCPSA-N 0 3 385.526 3.079 10 0 GGAEHN Cc1c(Br)cccc1CS(=O)(=O)NC(C)(C)CN1CCCC1 ZINC000655606766 566821170 /nfs/dbraw/zinc/82/11/70/566821170.db2.gz VWLXGDJCGSIPAO-UHFFFAOYSA-N 0 3 389.359 3.051 10 0 GGAEHN COCCC[C@H](NC1CN(c2ccncn2)C1)c1ccc(Br)cc1 ZINC000631746474 566822449 /nfs/dbraw/zinc/82/24/49/566822449.db2.gz KHPOKGPOMGGKGA-KRWDZBQOSA-N 0 3 391.313 3.185 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)COc1ccc(Br)cc1F ZINC000517397390 566824317 /nfs/dbraw/zinc/82/43/17/566824317.db2.gz BQPQASNHHABALK-BETUJISGSA-N 0 3 387.293 3.346 10 0 GGAEHN COc1ccc(Cl)cc1CN[C@@H](C)Cn1cc(Br)ccc1=O ZINC000428223869 566825133 /nfs/dbraw/zinc/82/51/33/566825133.db2.gz KUSNPUPACXNITK-NSHDSACASA-N 0 3 385.689 3.451 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@H](CCCO)c1ccccc1 ZINC000428215994 566825474 /nfs/dbraw/zinc/82/54/74/566825474.db2.gz BBNJXIUULNMLGD-RHSMWYFYSA-N 0 3 379.298 3.103 10 0 GGAEHN C[C@@H](NCCCN(C)S(C)(=O)=O)c1cc2cc(Br)ccc2o1 ZINC000678923773 566825670 /nfs/dbraw/zinc/82/56/70/566825670.db2.gz CLQGXWWIBHFCMZ-LLVKDONJSA-N 0 3 389.315 3.127 10 0 GGAEHN O=C(c1c(F)cccc1Br)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000469914840 566826268 /nfs/dbraw/zinc/82/62/68/566826268.db2.gz FBFUDFOAALEDOY-AWEZNQCLSA-N 0 3 399.304 3.305 10 0 GGAEHN O=C(c1cc(Br)ccc1F)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000469923673 566827797 /nfs/dbraw/zinc/82/77/97/566827797.db2.gz BNFBPXXBYDTFJM-OAHLLOKOSA-N 0 3 399.304 3.305 10 0 GGAEHN O=C(c1ccc(Br)c(F)c1)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000469919820 566827854 /nfs/dbraw/zinc/82/78/54/566827854.db2.gz XIWJIZZDWVYAMQ-OAHLLOKOSA-N 0 3 399.304 3.305 10 0 GGAEHN O=C(c1ccc(F)cc1Br)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000469921989 566828081 /nfs/dbraw/zinc/82/80/81/566828081.db2.gz ZIWSAHHOPOMONW-HNNXBMFYSA-N 0 3 399.304 3.305 10 0 GGAEHN Cc1cc(Br)oc1C(=O)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000469933655 566828931 /nfs/dbraw/zinc/82/89/31/566828931.db2.gz CYRNSQSZFLHTCJ-AWEZNQCLSA-N 0 3 385.302 3.068 10 0 GGAEHN C[C@@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)N1CCC[C@@H](C)C1 ZINC000517643358 566837780 /nfs/dbraw/zinc/83/77/80/566837780.db2.gz WXBZEPXPCSBTFQ-NEPJUHHUSA-N 0 3 379.302 3.176 10 0 GGAEHN C[C@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)N1CCC[C@H](C)C1 ZINC000517643359 566837900 /nfs/dbraw/zinc/83/79/00/566837900.db2.gz WXBZEPXPCSBTFQ-NWDGAFQWSA-N 0 3 379.302 3.176 10 0 GGAEHN NCc1cccc2c1N(S(=O)(=O)c1cscc1Br)CCC2 ZINC000631954650 566837931 /nfs/dbraw/zinc/83/79/31/566837931.db2.gz STRFPMREMPLTSR-UHFFFAOYSA-N 0 3 387.324 3.111 10 0 GGAEHN OC[C@H](NCCOCCOc1ccccc1)c1ccc(Br)cc1 ZINC000542911414 566838199 /nfs/dbraw/zinc/83/81/99/566838199.db2.gz CZSSMFTXQRGSKG-SFHVURJKSA-N 0 3 380.282 3.168 10 0 GGAEHN CN(CCC(=O)N1CCC[C@H]1c1ccc(Br)cn1)c1ccncc1 ZINC000562968903 566839193 /nfs/dbraw/zinc/83/91/93/566839193.db2.gz SPBKWOCUHYWVAH-KRWDZBQOSA-N 0 3 389.297 3.429 10 0 GGAEHN CC(C)(C)OC(=O)[C@@H]1CCN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000610538597 566839910 /nfs/dbraw/zinc/83/99/10/566839910.db2.gz GGGXSQKMVITKJZ-OLZOCXBDSA-N 0 3 390.307 3.397 10 0 GGAEHN CN(C(=O)CCSc1ccc(Br)cc1)[C@@H]1CN2CCC1CC2 ZINC000517698040 566841207 /nfs/dbraw/zinc/84/12/07/566841207.db2.gz DMPCPBLCPVRIFZ-MRXNPFEDSA-N 0 3 383.355 3.484 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000517696723 566842380 /nfs/dbraw/zinc/84/23/80/566842380.db2.gz AJJYMVZDTFPMJU-OAHLLOKOSA-N 0 3 390.325 3.407 10 0 GGAEHN C[C@@H]1CN(CCCNC(=O)c2cc3c(cccc3Br)[nH]2)CCCO1 ZINC000470066181 566843995 /nfs/dbraw/zinc/84/39/95/566843995.db2.gz MSLVPHZCEXYVJN-CYBMUJFWSA-N 0 3 394.313 3.161 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC1CCN([C@H]2CCOC2)CC1 ZINC000655757749 566844691 /nfs/dbraw/zinc/84/46/91/566844691.db2.gz KQIXVLNLYPWJCQ-BBRMVZONSA-N 0 3 383.330 3.362 10 0 GGAEHN C[C@H](N[C@@H]([C@H](CO)C1CC1)C1CC1)C(=O)Nc1ccccc1Br ZINC000451585360 566844963 /nfs/dbraw/zinc/84/49/63/566844963.db2.gz DFCDAUGWQIAHPJ-FABXCBLPSA-N 0 3 381.314 3.163 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC1CCN([C@@H]2CCOC2)CC1 ZINC000655757752 566844940 /nfs/dbraw/zinc/84/49/40/566844940.db2.gz KQIXVLNLYPWJCQ-XJKSGUPXSA-N 0 3 383.330 3.362 10 0 GGAEHN COC(=O)[C@@H]1CCCC[C@@H]1N[C@H](C)C(=O)Nc1ccc(Br)cc1 ZINC000451586362 566845153 /nfs/dbraw/zinc/84/51/53/566845153.db2.gz HQCKZKFLIGXAMD-DFBGVHRSSA-N 0 3 383.286 3.098 10 0 GGAEHN CN(C)Cc1ccc(NC2CCN([C@H]3CCOC3)CC2)cc1Br ZINC000655758270 566845152 /nfs/dbraw/zinc/84/51/52/566845152.db2.gz VBDYHERQWZXIFB-KRWDZBQOSA-N 0 3 382.346 3.176 10 0 GGAEHN COc1cccc2c1CC[C@@H]2N[C@H](C)Cn1cc(Br)ccc1=O ZINC000428450810 566845326 /nfs/dbraw/zinc/84/53/26/566845326.db2.gz YPATWTXYGQGERH-WBMJQRKESA-N 0 3 377.282 3.285 10 0 GGAEHN C[C@H](N[C@H]([C@@H](CO)C1CC1)C1CC1)C(=O)Nc1ccccc1Br ZINC000451585363 566845650 /nfs/dbraw/zinc/84/56/50/566845650.db2.gz DFCDAUGWQIAHPJ-YLVFBTJISA-N 0 3 381.314 3.163 10 0 GGAEHN COC(=O)[C@@H]1CCCC[C@@H]1N[C@H](C)C(=O)Nc1ccccc1Br ZINC000451598866 566846420 /nfs/dbraw/zinc/84/64/20/566846420.db2.gz PKUYQVPABJQRMU-BZPMIXESSA-N 0 3 383.286 3.098 10 0 GGAEHN O=C1CCCN1CCCN[C@H](c1ccc(Br)cc1)[C@H]1CCCO1 ZINC000679330095 566847477 /nfs/dbraw/zinc/84/74/77/566847477.db2.gz YDHFSGGQSXBARV-SJLPKXTDSA-N 0 3 381.314 3.271 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)[NH2+]Cc1nnc([C@H]2CCCO2)[n-]1 ZINC000655795855 566848621 /nfs/dbraw/zinc/84/86/21/566848621.db2.gz DFKMMHIYCCAAQR-QMTHXVAHSA-N 0 3 383.265 3.279 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)NCc1nc([C@H]2CCCO2)n[nH]1 ZINC000655795855 566848629 /nfs/dbraw/zinc/84/86/29/566848629.db2.gz DFKMMHIYCCAAQR-QMTHXVAHSA-N 0 3 383.265 3.279 10 0 GGAEHN Cc1c(Br)cccc1C[C@H](CO)CNCc1cc2n(n1)CCCC2 ZINC000655780213 566849019 /nfs/dbraw/zinc/84/90/19/566849019.db2.gz WMORRCOKQMOJKV-HNNXBMFYSA-N 0 3 392.341 3.231 10 0 GGAEHN O=S1(=O)CCC[C@H](NCC2(c3cccc(OC(F)(F)F)c3)CCC2)C1 ZINC000655819921 566852256 /nfs/dbraw/zinc/85/22/56/566852256.db2.gz DHKRONBYMORXDU-AWEZNQCLSA-N 0 3 377.428 3.174 10 0 GGAEHN COc1cc(C)nc(CNC[C@H](CO)Cc2ccc(Br)cc2)c1 ZINC000428535526 566852315 /nfs/dbraw/zinc/85/23/15/566852315.db2.gz LDRJVHWAHDYTDX-OAHLLOKOSA-N 0 3 379.298 3.102 10 0 GGAEHN COc1cc(C)nc(CNC[C@H](CO)Cc2cccc(Br)c2)c1 ZINC000428538951 566854350 /nfs/dbraw/zinc/85/43/50/566854350.db2.gz ROWWBKSUWLMHID-OAHLLOKOSA-N 0 3 379.298 3.102 10 0 GGAEHN O=C(NCCCNCc1cccnc1)c1cc(F)c(F)cc1Br ZINC000563107087 566854925 /nfs/dbraw/zinc/85/49/25/566854925.db2.gz VZCIQHYYVOMYNO-UHFFFAOYSA-N 0 3 384.224 3.032 10 0 GGAEHN O=C(COc1ccc(Cl)cc1C(F)(F)F)NC1CCN(C2CC2)CC1 ZINC000543149140 566856950 /nfs/dbraw/zinc/85/69/50/566856950.db2.gz ZABFZMDHFNOUPW-UHFFFAOYSA-N 0 3 376.806 3.481 10 0 GGAEHN O=C(COc1ccc(Cl)c(C(F)(F)F)c1)NC1CCN(C2CC2)CC1 ZINC000517996781 566857794 /nfs/dbraw/zinc/85/77/94/566857794.db2.gz AVNUNQOJMMRXFE-UHFFFAOYSA-N 0 3 376.806 3.481 10 0 GGAEHN NC[C@H](NC(=O)N1CCC[C@H]1c1ccccc1Br)C(F)(F)F ZINC000655921710 566858532 /nfs/dbraw/zinc/85/85/32/566858532.db2.gz PBMFJTRQHCWOEC-RYUDHWBXSA-N 0 3 380.208 3.185 10 0 GGAEHN NC[C@@H](NC(=O)N1CCC(Sc2ccc(Cl)cc2)CC1)C(F)(F)F ZINC000655919785 566858938 /nfs/dbraw/zinc/85/89/38/566858938.db2.gz FKFSUMRGPNSQLM-CYBMUJFWSA-N 0 3 381.851 3.496 10 0 GGAEHN Cc1sc(CNC(=O)N[C@@H](CN)C(F)(F)F)nc1-c1ccc(Cl)cc1 ZINC000655914813 566858948 /nfs/dbraw/zinc/85/89/48/566858948.db2.gz OXXUZVHYVMEUHQ-NSHDSACASA-N 0 3 392.834 3.461 10 0 GGAEHN CN(CC1(c2ccc(Br)cc2)CC1)C(=O)N[C@H](CN)C(F)(F)F ZINC000655922081 566859017 /nfs/dbraw/zinc/85/90/17/566859017.db2.gz ZUHNGYQPPJXYOP-GFCCVEGCSA-N 0 3 394.235 3.012 10 0 GGAEHN NC[C@H](NC(=O)N1CCC[C@@H](COc2ccccc2Cl)C1)C(F)(F)F ZINC000655919445 566859078 /nfs/dbraw/zinc/85/90/78/566859078.db2.gz CORXNFLSAUHPJO-RISCZKNCSA-N 0 3 379.810 3.030 10 0 GGAEHN CC[C@@H](Cc1ccccc1Br)N(C)C(=O)N[C@H](CN)C(F)(F)F ZINC000655924612 566860722 /nfs/dbraw/zinc/86/07/22/566860722.db2.gz MUMKVARQBFKARW-WCQYABFASA-N 0 3 396.251 3.301 10 0 GGAEHN NC[C@@H](NC(=O)N1CCC[C@@H]1c1ccc(Br)c(F)c1)C(F)(F)F ZINC000655928544 566860774 /nfs/dbraw/zinc/86/07/74/566860774.db2.gz OILZLYDQPVIUAR-VXGBXAGGSA-N 0 3 398.198 3.324 10 0 GGAEHN NC[C@@H](NC(=O)N1CC=C(c2cccc(Br)c2)CC1)C(F)(F)F ZINC000655924922 566860926 /nfs/dbraw/zinc/86/09/26/566860926.db2.gz SUGZRZVRRPSCSW-CYBMUJFWSA-N 0 3 392.219 3.137 10 0 GGAEHN NC[C@H](NC(=O)N1CC=C(c2cccc(Br)c2)CC1)C(F)(F)F ZINC000655924923 566860935 /nfs/dbraw/zinc/86/09/35/566860935.db2.gz SUGZRZVRRPSCSW-ZDUSSCGKSA-N 0 3 392.219 3.137 10 0 GGAEHN COCCC[C@H](CNC(=O)N[C@H](CN)C(F)(F)F)c1ccc(Cl)cc1 ZINC000655927780 566861005 /nfs/dbraw/zinc/86/10/05/566861005.db2.gz INTQBUSCSHBLQL-TZMCWYRMSA-N 0 3 381.826 3.039 10 0 GGAEHN CN(Cc1ccc(Br)cc1Cl)C(=O)N[C@H](CN)C(F)(F)F ZINC000655928981 566861041 /nfs/dbraw/zinc/86/10/41/566861041.db2.gz PFRSPIGGIQWLFA-SNVBAGLBSA-N 0 3 388.615 3.134 10 0 GGAEHN CN(Cc1ccc(Br)cc1Cl)C(=O)N[C@@H](CN)C(F)(F)F ZINC000655928979 566861564 /nfs/dbraw/zinc/86/15/64/566861564.db2.gz PFRSPIGGIQWLFA-JTQLQIEISA-N 0 3 388.615 3.134 10 0 GGAEHN NC[C@@H](NC(=O)NCC1(c2ccccc2Br)CCC1)C(F)(F)F ZINC000655927598 566861700 /nfs/dbraw/zinc/86/17/00/566861700.db2.gz PHVTXRWKXSYAKQ-GFCCVEGCSA-N 0 3 394.235 3.060 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)Nc2cc(F)cc(Br)c2F)CCSC1 ZINC000490535061 566862848 /nfs/dbraw/zinc/86/28/48/566862848.db2.gz OBDDOINPHUDDMG-CQSZACIVSA-N 0 3 394.285 3.286 10 0 GGAEHN CN(C)CCN1CCC(Nc2nc3ccccc3cc2Br)CC1 ZINC000656108072 566870961 /nfs/dbraw/zinc/87/09/61/566870961.db2.gz MFGJUUYUVIDGFE-UHFFFAOYSA-N 0 3 377.330 3.435 10 0 GGAEHN C[C@@H]1COCCCN1CCCOc1cccc(I)c1 ZINC000610991001 566878602 /nfs/dbraw/zinc/87/86/02/566878602.db2.gz XPOHVZUCRNHYNO-CYBMUJFWSA-N 0 3 375.250 3.171 10 0 GGAEHN C[C@@H]1CN(CCOc2c(Cl)cccc2Cl)CC[C@H]1N1CCN(C)CC1 ZINC000490652070 566873432 /nfs/dbraw/zinc/87/34/32/566873432.db2.gz QICQTFNTNUJCPO-CRAIPNDOSA-N 0 3 386.367 3.330 10 0 GGAEHN Cc1cc(Br)cc(C)c1NC(=O)CCCN(CC(N)=O)CC(C)C ZINC000679815769 566874340 /nfs/dbraw/zinc/87/43/40/566874340.db2.gz DESVFPAYHRVPHD-UHFFFAOYSA-N 0 3 398.345 3.228 10 0 GGAEHN Cc1cccc(C)c1OC[C@H](O)CN[C@H](CO)c1cccc(Br)c1 ZINC000679831107 566876352 /nfs/dbraw/zinc/87/63/52/566876352.db2.gz HHTDURIWHSSESR-QZTJIDSGSA-N 0 3 394.309 3.129 10 0 GGAEHN COCCN1CC[C@H](Nc2ccc(CCn3cc(Br)cn3)cc2)C1 ZINC000543396701 566877456 /nfs/dbraw/zinc/87/74/56/566877456.db2.gz VZNVCMHLCVJKQQ-SFHVURJKSA-N 0 3 393.329 3.021 10 0 GGAEHN C[C@@H](NCc1ccc(S(=O)(=O)N2CCOCC2)s1)C1CCCCCC1 ZINC000543411590 566879242 /nfs/dbraw/zinc/87/92/42/566879242.db2.gz KVKWMNWXXWPODF-OAHLLOKOSA-N 0 3 386.583 3.218 10 0 GGAEHN C[C@H](NC(=O)[C@@H]1C[C@@]1(C)c1cccc(Br)c1)C1=CCN(C)CC1 ZINC000632367619 566879445 /nfs/dbraw/zinc/87/94/45/566879445.db2.gz RSOZNZMCZNQDSD-IXDGSTSKSA-N 0 3 377.326 3.493 10 0 GGAEHN C[C@H](NC(=O)[C@@H]1C[C@]1(C)c1cccc(Br)c1)C1=CCN(C)CC1 ZINC000632367620 566879542 /nfs/dbraw/zinc/87/95/42/566879542.db2.gz RSOZNZMCZNQDSD-SOVGHPHASA-N 0 3 377.326 3.493 10 0 GGAEHN C[C@H](NC(=O)[C@H]1C[C@@]1(C)c1cccc(Br)c1)C1=CCN(C)CC1 ZINC000632367618 566879900 /nfs/dbraw/zinc/87/99/00/566879900.db2.gz RSOZNZMCZNQDSD-IRWQIABSSA-N 0 3 377.326 3.493 10 0 GGAEHN CS(=O)(=O)N[C@@H]1CCCC[C@@H]1CNCc1ncc(-c2ccccc2)s1 ZINC000518411702 566882417 /nfs/dbraw/zinc/88/24/17/566882417.db2.gz WGKVBUHYNALRIZ-HZPDHXFCSA-N 0 3 379.551 3.008 10 0 GGAEHN N[C@@H]1CN(S(=O)(=O)c2cc(Cl)ccc2F)CC[C@H]1c1ccc(F)cc1 ZINC000563446341 566885771 /nfs/dbraw/zinc/88/57/71/566885771.db2.gz QNKDKDZXELDPCE-GOEBONIOSA-N 0 3 386.851 3.124 10 0 GGAEHN O[C@@H](CNCCSCCOc1cccc(Br)c1)C(F)(F)F ZINC000518519149 566888012 /nfs/dbraw/zinc/88/80/12/566888012.db2.gz NNBOSDHWOWETDK-LBPRGKRZSA-N 0 3 388.249 3.074 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1C[C@@H](C(N)=O)CC[C@H]1C ZINC000656249797 566888055 /nfs/dbraw/zinc/88/80/55/566888055.db2.gz CKEVQMODSOUKQF-OCCSQVGLSA-N 0 3 391.313 3.029 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1C[C@@H](C(N)=O)CC[C@@H]1C ZINC000656249795 566888247 /nfs/dbraw/zinc/88/82/47/566888247.db2.gz CKEVQMODSOUKQF-JSGCOSHPSA-N 0 3 391.313 3.029 10 0 GGAEHN C[C@H](NCC(=O)Nc1ccc(Br)cn1)[C@H]1Oc2ccccc2[C@@H]1C ZINC000543547499 566888738 /nfs/dbraw/zinc/88/87/38/566888738.db2.gz QJKSMBRZWDFPMG-PZROIBLQSA-N 0 3 390.281 3.325 10 0 GGAEHN COCCN(C)CCCNC(=O)c1cc(Br)cc2ccccc21 ZINC000518547702 566890492 /nfs/dbraw/zinc/89/04/92/566890492.db2.gz SUISBSGXNIRIME-UHFFFAOYSA-N 0 3 379.298 3.300 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1C[C@H](C(N)=O)CC[C@@H]1C ZINC000656250616 566890679 /nfs/dbraw/zinc/89/06/79/566890679.db2.gz WLJMKJQBFBIXFN-GXTWGEPZSA-N 0 3 391.313 3.029 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1CC[C@@H]2CN(C)C[C@H]21 ZINC000656260055 566892622 /nfs/dbraw/zinc/89/26/22/566892622.db2.gz IHLWLLPJHPTWLX-RDTXWAMCSA-N 0 3 375.314 3.079 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1CC[C@H]2CN(C)C[C@H]21 ZINC000656259803 566893649 /nfs/dbraw/zinc/89/36/49/566893649.db2.gz CSJIKCJTNXRLMD-KBXCAEBGSA-N 0 3 375.314 3.079 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)c1cccc(I)c1 ZINC000518600883 566894022 /nfs/dbraw/zinc/89/40/22/566894022.db2.gz ZVQKJHZCEKIXRJ-STQMWFEESA-N 0 3 386.277 3.284 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)c1ccccc1I ZINC000518597500 566894086 /nfs/dbraw/zinc/89/40/86/566894086.db2.gz HKHLAURBGFZWFQ-CHWSQXEVSA-N 0 3 386.277 3.284 10 0 GGAEHN CN1CC[C@H](NC(=O)Cc2ccc(Br)cc2O)[C@H]1c1ccccc1 ZINC000491119290 566896154 /nfs/dbraw/zinc/89/61/54/566896154.db2.gz VPHGBKXBHVTKQR-QFBILLFUSA-N 0 3 389.293 3.259 10 0 GGAEHN C[C@@H]1CN(CCC(=O)Nc2ccccc2Cl)CCN(CC(F)(F)F)C1 ZINC000451876043 566898572 /nfs/dbraw/zinc/89/85/72/566898572.db2.gz XIXGZXPOEXRBBD-CYBMUJFWSA-N 0 3 377.838 3.485 10 0 GGAEHN O=C(CCN1CC[C@@H]([C@@H](O)C(F)(F)F)C1)Nc1ccccc1Br ZINC000451881511 566901300 /nfs/dbraw/zinc/90/13/00/566901300.db2.gz BKJHHQSPCLWIHH-QMTHXVAHSA-N 0 3 395.219 3.023 10 0 GGAEHN O=C(CCN1CC[C@H]([C@@H](O)C(F)(F)F)C1)Nc1ccccc1Br ZINC000451881506 566901482 /nfs/dbraw/zinc/90/14/82/566901482.db2.gz BKJHHQSPCLWIHH-IINYFYTJSA-N 0 3 395.219 3.023 10 0 GGAEHN COc1cc(C(=O)N2CCc3ccccc3[C@@H]2CN)sc1Br ZINC000563626788 566902444 /nfs/dbraw/zinc/90/24/44/566902444.db2.gz VSRRCCUOQOUOBD-LBPRGKRZSA-N 0 3 381.295 3.218 10 0 GGAEHN O=C(CCOC1CNC1)N[C@@H](c1ccccc1)c1ccc(Br)cc1 ZINC000518755577 566902692 /nfs/dbraw/zinc/90/26/92/566902692.db2.gz JHIJOUNXTRDLBY-IBGZPJMESA-N 0 3 389.293 3.033 10 0 GGAEHN O=C(CCN1CC[C@H]([C@@H](O)C(F)(F)F)C1)Nc1cccc(Br)c1 ZINC000451891948 566903013 /nfs/dbraw/zinc/90/30/13/566903013.db2.gz OXLKSBCLAIZGAR-IINYFYTJSA-N 0 3 395.219 3.023 10 0 GGAEHN CS[C@@H]1CN(C(=O)CCc2ccc(Br)cc2)C[C@@H]1N1CCCC1 ZINC000543700298 566903310 /nfs/dbraw/zinc/90/33/10/566903310.db2.gz APALASPXKYORIP-DLBZAZTESA-N 0 3 397.382 3.420 10 0 GGAEHN CS[C@@H]1CN(C(=O)CCc2ccc(Br)cc2)C[C@H]1N1CCCC1 ZINC000543700302 566903733 /nfs/dbraw/zinc/90/37/33/566903733.db2.gz APALASPXKYORIP-IAGOWNOFSA-N 0 3 397.382 3.420 10 0 GGAEHN CCOC(=O)C[C@@H](O)CN1CCC(COc2cc(Cl)cc(Cl)c2)CC1 ZINC000611237992 566904244 /nfs/dbraw/zinc/90/42/44/566904244.db2.gz WHVHKZLURVXQHN-MRXNPFEDSA-N 0 3 390.307 3.398 10 0 GGAEHN C[C@H](OC[C@H](O)CN1CC[C@@H]([C@@H](O)C(F)(F)F)C1)c1ccc(Cl)cc1 ZINC000451911336 566906223 /nfs/dbraw/zinc/90/62/23/566906223.db2.gz POTRBKCFPOBCKO-KSZJFAHPSA-N 0 3 381.822 3.024 10 0 GGAEHN O[C@@H]([C@@H]1CCN(CCc2nc(-c3cccc(Cl)c3)no2)C1)C(F)(F)F ZINC000451915568 566906372 /nfs/dbraw/zinc/90/63/72/566906372.db2.gz VRCPXQRXMJKKTG-RISCZKNCSA-N 0 3 375.778 3.178 10 0 GGAEHN C[C@H](OC[C@H](O)CN1CC[C@@H]([C@H](O)C(F)(F)F)C1)c1ccc(Cl)cc1 ZINC000451911339 566906786 /nfs/dbraw/zinc/90/67/86/566906786.db2.gz POTRBKCFPOBCKO-ZCDTZLGTSA-N 0 3 381.822 3.024 10 0 GGAEHN O[C@H]([C@@H]1CCN(CCc2nc(-c3ccc(Cl)cc3)no2)C1)C(F)(F)F ZINC000451919237 566907376 /nfs/dbraw/zinc/90/73/76/566907376.db2.gz ZGDVSCQGFSINIC-BXUZGUMPSA-N 0 3 375.778 3.178 10 0 GGAEHN COc1ccccc1CNC(=O)C(C)S(=O)(=O)Cc1ccsc1Cl ZINC000656532575 566912373 /nfs/dbraw/zinc/91/23/73/566912373.db2.gz AATMCACFFQNPEY-LLVKDONJSA-N 0 3 387.910 3.030 10 0 GGAEHN CC(C(=O)N[C@H]1CCOc2ccccc21)S(=O)(=O)Cc1ccsc1Cl ZINC000656533162 566912700 /nfs/dbraw/zinc/91/27/00/566912700.db2.gz PLWITMQZDBUPSU-RISCZKNCSA-N 0 3 399.921 3.345 10 0 GGAEHN CCO[C@H]1C[C@@](N)(C(=O)N2CCc3cc(Br)cc(C)c3C2)C1(C)C ZINC000518973273 566913734 /nfs/dbraw/zinc/91/37/34/566913734.db2.gz LHLUEIZVCQLYNY-QFBILLFUSA-N 0 3 395.341 3.175 10 0 GGAEHN Cc1ccc(OC[C@H](O)CN[C@H](CO)c2cccc(Br)c2)c(C)c1 ZINC000543835954 566914006 /nfs/dbraw/zinc/91/40/06/566914006.db2.gz DGVJCSQXUFIQCS-QZTJIDSGSA-N 0 3 394.309 3.129 10 0 GGAEHN Cc1ccc(OC[C@@H](O)CN[C@H](CO)c2cccc(Br)c2)c(C)c1 ZINC000543835956 566914202 /nfs/dbraw/zinc/91/42/02/566914202.db2.gz DGVJCSQXUFIQCS-ZWKOTPCHSA-N 0 3 394.309 3.129 10 0 GGAEHN CN1CCCC(C)(C)[C@@H]1CNC(=O)Cc1csc(CCC(F)(F)F)n1 ZINC000632797905 566914245 /nfs/dbraw/zinc/91/42/45/566914245.db2.gz OXPPBAXZLLLRSC-ZDUSSCGKSA-N 0 3 377.476 3.417 10 0 GGAEHN Cc1ccsc1[C@H](CO)NC[C@H](O)COc1cc(Cl)ccc1Cl ZINC000563764806 566914806 /nfs/dbraw/zinc/91/48/06/566914806.db2.gz MTNSITMUWXCMKU-JSGCOSHPSA-N 0 3 376.305 3.426 10 0 GGAEHN O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)c1c(F)cncc1Br ZINC000632813158 566915770 /nfs/dbraw/zinc/91/57/70/566915770.db2.gz CZOLZNMOLACECF-AWEZNQCLSA-N 0 3 392.272 3.235 10 0 GGAEHN C[C@@H]1[C@@H](C(F)(F)F)CCN1C[C@H](O)COc1ccc(Br)cc1 ZINC000470948895 566916944 /nfs/dbraw/zinc/91/69/44/566916944.db2.gz MIIPZBXMJMJYFN-OSMZGAPFSA-N 0 3 382.220 3.462 10 0 GGAEHN C[C@@H]1[C@@H](C(F)(F)F)CCN1C[C@@H](O)COc1ccc(Br)cc1 ZINC000470948896 566917216 /nfs/dbraw/zinc/91/72/16/566917216.db2.gz MIIPZBXMJMJYFN-QKCSRTOESA-N 0 3 382.220 3.462 10 0 GGAEHN CC[C@@H]1CN(C)CCCN1C(=O)[C@@H]1[C@@H]2Cc3cc(Br)ccc3[C@@H]21 ZINC000632822111 566917320 /nfs/dbraw/zinc/91/73/20/566917320.db2.gz VTIMRBPBOJFWCI-NRSFXHEJSA-N 0 3 377.326 3.278 10 0 GGAEHN O=S(=O)(CCN[C@@H]1C[C@@H]1c1ccccc1)c1cccc(Br)c1 ZINC000583061466 566918096 /nfs/dbraw/zinc/91/80/96/566918096.db2.gz KNBJBLHIJCEYKS-IAGOWNOFSA-N 0 3 380.307 3.369 10 0 GGAEHN O=C1C[C@H]2CC[C@@H](C1)N2CCCOc1cccc(I)c1 ZINC000563843379 566922723 /nfs/dbraw/zinc/92/27/23/566922723.db2.gz XTYGZRDCOLNGGN-OKILXGFUSA-N 0 3 385.245 3.256 10 0 GGAEHN CN(Cc1ccc(Cl)s1)C(=O)CN(C)C1CCN(CC(F)(F)F)CC1 ZINC000452041037 566926340 /nfs/dbraw/zinc/92/63/40/566926340.db2.gz RMSWDEKJYAGEND-UHFFFAOYSA-N 0 3 397.894 3.318 10 0 GGAEHN COC[C@@H](N[C@@H](C)C(=O)Nc1ccc(C)cc1Br)C1CCOCC1 ZINC000656676711 566931724 /nfs/dbraw/zinc/93/17/24/566931724.db2.gz CPOMVJIUZKNXME-SUMWQHHRSA-N 0 3 399.329 3.116 10 0 GGAEHN COC[C@@H](N[C@@H](C)C(=O)Nc1ccc(Br)c(C)c1)C1CCOCC1 ZINC000656677902 566932536 /nfs/dbraw/zinc/93/25/36/566932536.db2.gz IGLPXHGIKVPWKG-SUMWQHHRSA-N 0 3 399.329 3.116 10 0 GGAEHN COC[C@H](N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)C1CCOCC1 ZINC000656680036 566933273 /nfs/dbraw/zinc/93/32/73/566933273.db2.gz SZVNKAJLUOIHSZ-IRXDYDNUSA-N 0 3 387.307 3.130 10 0 GGAEHN COC[C@H](N[C@H](C)C(=O)Nc1ccc(Cl)cc1Cl)C1CCOCC1 ZINC000656680902 566933532 /nfs/dbraw/zinc/93/35/32/566933532.db2.gz XEKMGUXXIDXLJE-BZNIZROVSA-N 0 3 375.296 3.352 10 0 GGAEHN NC(=O)[C@H](Cc1ccccc1)NCC1(Cc2ccc(Br)cc2)CC1 ZINC000656684150 566934006 /nfs/dbraw/zinc/93/40/06/566934006.db2.gz BBQQPUYVAQRLRX-SFHVURJKSA-N 0 3 387.321 3.458 10 0 GGAEHN CN1CCN([C@H]2CC[C@@H](NC(=O)Cc3ccc(Cl)cc3Cl)CC2)CC1 ZINC000680841169 566934432 /nfs/dbraw/zinc/93/44/32/566934432.db2.gz NHWMFWSAPFYOBP-CALCHBBNSA-N 0 3 384.351 3.211 10 0 GGAEHN CC(C)(CN1CCCC1)NCC(=O)Nc1c(F)cc(F)cc1Br ZINC000452096995 566934933 /nfs/dbraw/zinc/93/49/33/566934933.db2.gz PRHISFHOSSRPBG-UHFFFAOYSA-N 0 3 390.272 3.130 10 0 GGAEHN C[C@H](c1ccc(Br)cc1)N1CCN(CC2(O)CCSCC2)CC1 ZINC000656698618 566935749 /nfs/dbraw/zinc/93/57/49/566935749.db2.gz MZKFFLGVNFCKOA-OAHLLOKOSA-N 0 3 399.398 3.386 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)NCCNc1ncc(Cl)cc1Cl ZINC000519372839 566936163 /nfs/dbraw/zinc/93/61/63/566936163.db2.gz HIQQLNSXWMLRPT-CHWSQXEVSA-N 0 3 388.343 3.362 10 0 GGAEHN Cc1cc(Br)c(CNC[C@@H](O)CN(C)Cc2ccccc2)s1 ZINC000656716257 566937150 /nfs/dbraw/zinc/93/71/50/566937150.db2.gz UHIQJNUTDASVLH-OAHLLOKOSA-N 0 3 383.355 3.402 10 0 GGAEHN N[C@@H]1CCCc2cn(CCCOc3cccc(I)c3)nc21 ZINC000519385149 566938012 /nfs/dbraw/zinc/93/80/12/566938012.db2.gz WSPNMULKKKEYJY-OAHLLOKOSA-N 0 3 397.260 3.293 10 0 GGAEHN C[C@@H](NC(=O)N[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]12)C1=CCN(C)CC1 ZINC000633158159 566938519 /nfs/dbraw/zinc/93/85/19/566938519.db2.gz IMRDERQZDPBDDJ-JZDMUPLMSA-N 0 3 390.325 3.037 10 0 GGAEHN Cc1c(I)cccc1C(=O)NCCN1CCCC[C@@H]1C ZINC000471237911 566939271 /nfs/dbraw/zinc/93/92/71/566939271.db2.gz FWWMYJOKNRTQIH-LBPRGKRZSA-N 0 3 386.277 3.204 10 0 GGAEHN O[C@@H](COc1ccc(Br)cc1)CN1CC[C@H](Cc2ccncc2)C1 ZINC000680888937 566939665 /nfs/dbraw/zinc/93/96/65/566939665.db2.gz MCMFURXNXYPIQS-SJLPKXTDSA-N 0 3 391.309 3.148 10 0 GGAEHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1cc(F)cc(Br)c1 ZINC000519465079 566940648 /nfs/dbraw/zinc/94/06/48/566940648.db2.gz MGFKNADOBUMLNO-AWEZNQCLSA-N 0 3 399.216 3.026 10 0 GGAEHN CC[C@H](C)N[C@H](CNC(=O)c1cc[nH]c(=O)c1Br)c1ccco1 ZINC000519458899 566940923 /nfs/dbraw/zinc/94/09/23/566940923.db2.gz XTQOZXUWNAYOIF-CMPLNLGQSA-N 0 3 382.258 3.002 10 0 GGAEHN CC[C@@H](C)N[C@@H](CNC(=O)c1cc[nH]c(=O)c1Br)c1ccco1 ZINC000519458901 566941190 /nfs/dbraw/zinc/94/11/90/566941190.db2.gz XTQOZXUWNAYOIF-PWSUYJOCSA-N 0 3 382.258 3.002 10 0 GGAEHN Cc1cc(N2CCC[C@@H](N[C@@H](C)c3ccc(Br)cn3)C2)n(C)n1 ZINC000519505865 566942816 /nfs/dbraw/zinc/94/28/16/566942816.db2.gz SGOPLOMZEUOGSZ-DZGCQCFKSA-N 0 3 378.318 3.206 10 0 GGAEHN CN(C)CCn1nccc1NC(=O)c1oc2ccccc2c1Br ZINC000633211604 566943020 /nfs/dbraw/zinc/94/30/20/566943020.db2.gz BNZDNTJVGSRQFA-UHFFFAOYSA-N 0 3 377.242 3.206 10 0 GGAEHN CN1CCC[C@@]2(CCN(C(=O)CCc3cccc(F)c3Br)C2)C1 ZINC000452151788 566945069 /nfs/dbraw/zinc/94/50/69/566945069.db2.gz NZVFRXHKCOTRCL-GOSISDBHSA-N 0 3 383.305 3.465 10 0 GGAEHN C[C@H]1CN(C(=O)CCc2cccc(F)c2Br)CCN(C2CC2)C1 ZINC000452160257 566945270 /nfs/dbraw/zinc/94/52/70/566945270.db2.gz CJAZKHMBEIFWNG-CYBMUJFWSA-N 0 3 383.305 3.464 10 0 GGAEHN C[C@H]1CN(C(=O)Cc2c(F)ccc(Br)c2F)CCN(C2CC2)C1 ZINC000452171646 566945985 /nfs/dbraw/zinc/94/59/85/566945985.db2.gz KXBAHQZNJLRIOF-LLVKDONJSA-N 0 3 387.268 3.213 10 0 GGAEHN C[C@H]1CN(C(=O)c2c[nH]c3cccc(Br)c23)CCN(C2CC2)C1 ZINC000452167646 566946896 /nfs/dbraw/zinc/94/68/96/566946896.db2.gz BVDLHPIEUJYFHK-GFCCVEGCSA-N 0 3 376.298 3.487 10 0 GGAEHN C[C@H]1CN(C(=O)C2(c3ccccc3Br)CC2)CCN(C2CC2)C1 ZINC000452171058 566947181 /nfs/dbraw/zinc/94/71/81/566947181.db2.gz JRNBPWDCGCPPOM-CQSZACIVSA-N 0 3 377.326 3.423 10 0 GGAEHN CN(Cc1cc(Br)cn1C)C(=O)CCN1CCc2ccccc2C1 ZINC000471354537 566948857 /nfs/dbraw/zinc/94/88/57/566948857.db2.gz UDWJBHHVMSEYNL-UHFFFAOYSA-N 0 3 390.325 3.194 10 0 GGAEHN O=C(Cc1sccc1Br)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000452193360 566950376 /nfs/dbraw/zinc/95/03/76/566950376.db2.gz NLUKYQULIBINAE-CQSZACIVSA-N 0 3 395.322 3.258 10 0 GGAEHN COc1ccc(CCC(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)c(Br)c1 ZINC000612102605 566952931 /nfs/dbraw/zinc/95/29/31/566952931.db2.gz CCZLKBQEGHRNIR-OCCSQVGLSA-N 0 3 381.314 3.132 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)c2cc(Br)cc(N3CCCC3)c2)CN1C1CC1 ZINC000612107404 566953239 /nfs/dbraw/zinc/95/32/39/566953239.db2.gz UOOXAYNDJLHDPZ-CJNGLKHVSA-N 0 3 392.341 3.404 10 0 GGAEHN CN1C(=O)N(C[C@H]2CCN2C(C)(C)C)C(=O)[C@H]1c1cccc(Br)c1 ZINC000656821436 566954013 /nfs/dbraw/zinc/95/40/13/566954013.db2.gz IOUNYTMJWBLYIA-HUUCEWRRSA-N 0 3 394.313 3.257 10 0 GGAEHN C[C@H]1C[C@@H](NC(=O)c2cc(Br)cc(N3CCCC3)c2)CN1C1CC1 ZINC000612107406 566954778 /nfs/dbraw/zinc/95/47/78/566954778.db2.gz UOOXAYNDJLHDPZ-XJKSGUPXSA-N 0 3 392.341 3.404 10 0 GGAEHN CN1C(=O)N(C[C@H]2CCN2C(C)(C)C)C(=O)[C@@H]1c1cccc(Br)c1 ZINC000656821434 566954803 /nfs/dbraw/zinc/95/48/03/566954803.db2.gz IOUNYTMJWBLYIA-CABCVRRESA-N 0 3 394.313 3.257 10 0 GGAEHN COc1cc(CN(C)C)ccc1NC(=O)c1c(F)cncc1Br ZINC000633379324 566954955 /nfs/dbraw/zinc/95/49/55/566954955.db2.gz HCBDCTZUMWTPIA-UHFFFAOYSA-N 0 3 382.233 3.306 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CN1C(=O)N[C@H](Cc2cc(Cl)cc(Cl)c2)C1=O ZINC000656820182 566955157 /nfs/dbraw/zinc/95/51/57/566955157.db2.gz BJORCPLZDOWSFY-LSDHHAIUSA-N 0 3 384.307 3.329 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CN1C(=O)CN(Cc2cccc(Br)c2)C1=O ZINC000656823719 566955175 /nfs/dbraw/zinc/95/51/75/566955175.db2.gz WYJYXSLBYMMNPJ-OAHLLOKOSA-N 0 3 394.313 3.086 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)N[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000633395898 566956373 /nfs/dbraw/zinc/95/63/73/566956373.db2.gz JGPSIIXLCCPQMS-BPQIPLTHSA-N 0 3 392.341 3.070 10 0 GGAEHN CCOC1CC(C(=O)N(CCN(CC)CC)c2ccc(Br)cn2)C1 ZINC000519658273 566957227 /nfs/dbraw/zinc/95/72/27/566957227.db2.gz WZBWBWHJNUUMRN-UHFFFAOYSA-N 0 3 398.345 3.334 10 0 GGAEHN Cc1cc(NC(=O)c2c(F)cncc2Br)ccc1OCCN(C)C ZINC000633404649 566957376 /nfs/dbraw/zinc/95/73/76/566957376.db2.gz MJOUVTRQKPFQAO-UHFFFAOYSA-N 0 3 396.260 3.484 10 0 GGAEHN CCN(C[C@@H]1CCCN1CC)C(=O)c1c(C)nc2ccc(Br)cn21 ZINC000583518670 566958428 /nfs/dbraw/zinc/95/84/28/566958428.db2.gz IEGOGGUONWHXHN-HNNXBMFYSA-N 0 3 393.329 3.352 10 0 GGAEHN CCN(C[C@H]1CCCN1CC)C(=O)c1c(C)nc2ccc(Br)cn21 ZINC000583518671 566958780 /nfs/dbraw/zinc/95/87/80/566958780.db2.gz IEGOGGUONWHXHN-OAHLLOKOSA-N 0 3 393.329 3.352 10 0 GGAEHN CC[C@H](NC[C@H](O)COc1cccc(Br)c1)c1c(C)nn(C)c1C ZINC000564297978 566961578 /nfs/dbraw/zinc/96/15/78/566961578.db2.gz LXNBHFHAXKFTDN-RDJZCZTQSA-N 0 3 396.329 3.280 10 0 GGAEHN COc1ccc(N(C)C(=O)C(C[C@H]2COCCO2)C(F)(F)F)cc1Cl ZINC000612301562 566962825 /nfs/dbraw/zinc/96/28/25/566962825.db2.gz RWNLFVIVFYNZFZ-RYUDHWBXSA-N 0 3 381.778 3.295 10 0 GGAEHN Cc1ccccc1C[C@@H](CO)NC[C@@H](O)COc1c(Cl)cccc1Cl ZINC000583565094 566963512 /nfs/dbraw/zinc/96/35/12/566963512.db2.gz QBXRXOAYKBLULV-JKSUJKDBSA-N 0 3 384.303 3.235 10 0 GGAEHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000612305593 566963596 /nfs/dbraw/zinc/96/35/96/566963596.db2.gz ZQAFFNZHVKMULQ-ACJLOTCBSA-N 0 3 392.341 3.262 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)N[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]12 ZINC000633451353 566963648 /nfs/dbraw/zinc/96/36/48/566963648.db2.gz AERZFXCVWAVZNT-RCCFBDPRSA-N 0 3 392.341 3.070 10 0 GGAEHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000612305594 566963631 /nfs/dbraw/zinc/96/36/31/566963631.db2.gz ZQAFFNZHVKMULQ-FZKQIMNGSA-N 0 3 392.341 3.262 10 0 GGAEHN COCCN(Cc1cc(Br)cs1)C[C@@H](O)CC(F)(F)F ZINC000494027106 566966766 /nfs/dbraw/zinc/96/67/66/566966766.db2.gz LIHMWBMTNSKWOJ-JTQLQIEISA-N 0 3 376.238 3.272 10 0 GGAEHN C[C@@H](CC(F)(F)F)CS(=O)(=O)NCC1CCN(Cc2cccs2)CC1 ZINC000656890824 566967065 /nfs/dbraw/zinc/96/70/65/566967065.db2.gz YMXVCDJGUNFIHH-ZDUSSCGKSA-N 0 3 398.516 3.468 10 0 GGAEHN Cc1cc(C(=O)N(C)C2CCN(C)CC2)nn1-c1ccc(Br)cc1 ZINC000429942973 566968764 /nfs/dbraw/zinc/96/87/64/566968764.db2.gz GJRZWSRQWKIEEE-UHFFFAOYSA-N 0 3 391.313 3.109 10 0 GGAEHN CS(=O)(=O)N1CC[C@@H](CN[C@@H](c2c(Cl)cccc2Cl)C2CC2)C1 ZINC000564379027 566969089 /nfs/dbraw/zinc/96/90/89/566969089.db2.gz MDFOOTKPPZWKJV-MEDUHNTESA-N 0 3 377.337 3.316 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N1C[C@H](CN(C)C)Oc2ccccc21 ZINC000612400719 566970597 /nfs/dbraw/zinc/97/05/97/566970597.db2.gz PVBWBKKGAVEOCT-ZDUSSCGKSA-N 0 3 390.281 3.122 10 0 GGAEHN CN1CCN(CCCCNC(=O)N[C@H]2CCCc3sc(Cl)cc32)CC1 ZINC000519799349 566970753 /nfs/dbraw/zinc/97/07/53/566970753.db2.gz JSKVBFUEUJFPSN-HNNXBMFYSA-N 0 3 384.977 3.106 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000612433435 566972166 /nfs/dbraw/zinc/97/21/66/566972166.db2.gz XLCOITFGCYBHEW-INIZCTEOSA-N 0 3 388.309 3.499 10 0 GGAEHN Cc1cc(Br)cc2c(C(=O)N[C@H]3CCCN(CCCO)C3)coc21 ZINC000452387281 566972895 /nfs/dbraw/zinc/97/28/95/566972895.db2.gz ZVCLXPHGAGTRKQ-AWEZNQCLSA-N 0 3 395.297 3.080 10 0 GGAEHN OCC[C@@]1(CNCc2cc(C(F)(F)F)ccc2Br)CCOC1 ZINC000564411215 566973886 /nfs/dbraw/zinc/97/38/86/566973886.db2.gz MQXDQFWUENVDBA-AWEZNQCLSA-N 0 3 382.220 3.347 10 0 GGAEHN O=C(Cc1csc(-c2ccc(Cl)s2)n1)NC[C@@H]1CCCCN1CCO ZINC000452395980 566974155 /nfs/dbraw/zinc/97/41/55/566974155.db2.gz XOFZWVWYWNKTFB-ZDUSSCGKSA-N 0 3 399.969 3.031 10 0 GGAEHN CC(C)(C)OCCNC[C@H](O)COc1ccc(Cl)cc1Br ZINC000583688689 566974905 /nfs/dbraw/zinc/97/49/05/566974905.db2.gz VTPAJQBSEPCSFF-LBPRGKRZSA-N 0 3 380.710 3.247 10 0 GGAEHN CN(CCc1nnnn1-c1ccccc1)Cc1ccc(Br)c(F)c1 ZINC000494243137 566976207 /nfs/dbraw/zinc/97/62/07/566976207.db2.gz XYIICTZGXNTJEN-UHFFFAOYSA-N 0 3 390.260 3.238 10 0 GGAEHN CN1C(=O)C[C@H](NCC[S@](=O)c2ccccc2)[C@H]1c1ccc(Cl)cc1 ZINC000494271618 566980615 /nfs/dbraw/zinc/98/06/15/566980615.db2.gz RODVAFVKYJFDCO-MVIPISOYSA-N 0 3 376.909 3.009 10 0 GGAEHN CS[C@H]1CN(C(=O)Cc2csc(-c3cccs3)n2)C[C@H]1N1CCCC1 ZINC000544684734 566981140 /nfs/dbraw/zinc/98/11/40/566981140.db2.gz DGOQFBFGUJWQBQ-ZBFHGGJFSA-N 0 3 393.603 3.452 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)NCCc1cc(Br)ccc1F ZINC000519949494 566981248 /nfs/dbraw/zinc/98/12/48/566981248.db2.gz MEZZIPHJERWVEW-CYBMUJFWSA-N 0 3 386.309 3.304 10 0 GGAEHN Cc1cccc2c1OCC[C@H]2N[C@@H](C)Cn1cc(Br)ccc1=O ZINC000583767814 566981798 /nfs/dbraw/zinc/98/17/98/566981798.db2.gz WQJQGDUMHBTRDF-XJKSGUPXSA-N 0 3 377.282 3.421 10 0 GGAEHN CC(C)(C)c1ccc(CCNC[C@@H](O)CS(=O)(=O)c2cccs2)cc1 ZINC000564529935 566983380 /nfs/dbraw/zinc/98/33/80/566983380.db2.gz WHJGGWXKBUQLMY-QGZVFWFLSA-N 0 3 381.563 3.013 10 0 GGAEHN CC(C)[C@@](C)(CO)NCc1cc(Br)cc(Br)c1N ZINC000583784651 566984040 /nfs/dbraw/zinc/98/40/40/566984040.db2.gz ONCLXDTYKFQDTF-CYBMUJFWSA-N 0 3 380.124 3.290 10 0 GGAEHN COc1ccc(CCC(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c(Br)c1 ZINC000612648801 566985169 /nfs/dbraw/zinc/98/51/69/566985169.db2.gz IWWUERDRDNEEML-MAUKXSAKSA-N 0 3 395.341 3.333 10 0 GGAEHN C[C@@H](CC(F)(F)F)CS(=O)(=O)NC[C@@H]1CCN(Cc2ccccc2)C1 ZINC000656976216 566987284 /nfs/dbraw/zinc/98/72/84/566987284.db2.gz IBPZZGKHDFPXBY-HOCLYGCPSA-N 0 3 378.460 3.016 10 0 GGAEHN CN(CCNC(=O)Nc1ccc(Cl)c(S(C)(=O)=O)c1)C1CCCCC1 ZINC000471948926 566989321 /nfs/dbraw/zinc/98/93/21/566989321.db2.gz OTPOZCOGPFAYDH-UHFFFAOYSA-N 0 3 387.933 3.130 10 0 GGAEHN OC[C@@H](N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)c(F)c1 ZINC000430148903 566993019 /nfs/dbraw/zinc/99/30/19/566993019.db2.gz UJROSXYMHAFFPM-VQIMIIECSA-N 0 3 393.300 3.486 10 0 GGAEHN Cc1cc(C)c(NC(=O)Nc2cnn(CCN(C)C)c2)cc1Br ZINC000681615225 566994899 /nfs/dbraw/zinc/99/48/99/566994899.db2.gz VZNWRJTVMLMGRS-UHFFFAOYSA-N 0 3 380.290 3.468 10 0 GGAEHN Cc1ccc(OCCC(=O)N(C)[C@H]2CCN(C3CC3)C2)c(Br)c1 ZINC000520366477 566998843 /nfs/dbraw/zinc/99/88/43/566998843.db2.gz QNQFNIIKHQYRFM-HNNXBMFYSA-N 0 3 381.314 3.222 10 0 GGAEHN CN1CCC[C@@H](NC(=O)Nc2ccnn2Cc2c(Cl)cccc2Cl)C1 ZINC000681779921 567004767 /nfs/dbraw/zinc/00/47/67/567004767.db2.gz SKUZRABAHJXHGH-GFCCVEGCSA-N 0 3 382.295 3.454 10 0 GGAEHN C[C@H]1CCN(CC(=O)NC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)C1 ZINC000520424716 567005084 /nfs/dbraw/zinc/00/50/84/567005084.db2.gz BIBPTQVAVMRYAS-AWEZNQCLSA-N 0 3 384.351 3.416 10 0 GGAEHN COc1ccc(CN(C)C)cc1NC(=O)Cc1ccc(Br)cc1O ZINC000564770219 567006496 /nfs/dbraw/zinc/00/64/96/567006496.db2.gz JWQWAFVQJMJFSY-UHFFFAOYSA-N 0 3 393.281 3.406 10 0 GGAEHN CCOC(=O)C1(O)CCN(CC/C=C\c2ccc(Br)cc2)CC1 ZINC000494548183 567008012 /nfs/dbraw/zinc/00/80/12/567008012.db2.gz MONKWSFNXVLNPP-HYXAFXHYSA-N 0 3 382.298 3.242 10 0 GGAEHN Cc1cc(C(=O)N[C@@H]2CNCCC2(F)F)c2ccc(Br)cc2n1 ZINC000564798165 567009273 /nfs/dbraw/zinc/00/92/73/567009273.db2.gz NZMLDJMJJPFFNI-CQSZACIVSA-N 0 3 384.224 3.033 10 0 GGAEHN Cc1cc(Br)cc2c1[C@@H](N[C@@H]1CCN(C3CCOCC3)C1=O)CC2 ZINC000494613938 567011595 /nfs/dbraw/zinc/01/15/95/567011595.db2.gz LELCYEFUPJRKRX-DLBZAZTESA-N 0 3 393.325 3.114 10 0 GGAEHN Cc1sc(C(C)(C)NC(=O)C(C)S(C)(=O)=O)nc1-c1ccccc1F ZINC000452758911 567013502 /nfs/dbraw/zinc/01/35/02/567013502.db2.gz SMFSLHIDZGTQEP-LLVKDONJSA-N 0 3 384.498 3.042 10 0 GGAEHN Ic1cnc(CN2CCCC[C@H](N3CCCC3)C2)s1 ZINC000584140039 567015476 /nfs/dbraw/zinc/01/54/76/567015476.db2.gz OFCOVJPZLLABOS-LBPRGKRZSA-N 0 3 391.322 3.198 10 0 GGAEHN CC(C)Oc1cc(NC(=O)c2cnn(CCN(C)C)c2)ccc1Br ZINC000634057420 567015140 /nfs/dbraw/zinc/01/51/40/567015140.db2.gz LXTUVLVXUVIKPF-UHFFFAOYSA-N 0 3 395.301 3.247 10 0 GGAEHN CN1CCC(n2cc(NC(=O)c3cc(F)cc(Br)c3)cn2)CC1 ZINC000634090604 567016384 /nfs/dbraw/zinc/01/63/84/567016384.db2.gz GTFGWVWVKMHOHD-UHFFFAOYSA-N 0 3 381.249 3.304 10 0 GGAEHN Cc1ccsc1[C@H](CO)NC[C@@H](O)COc1ccccc1C(F)(F)F ZINC000494672998 567016897 /nfs/dbraw/zinc/01/68/97/567016897.db2.gz OMLSKAASMDKYAG-OCCSQVGLSA-N 0 3 375.412 3.138 10 0 GGAEHN CN1CCC(n2cc(NC(=O)c3c(F)ccc(Br)c3F)cn2)CC1 ZINC000634095691 567017183 /nfs/dbraw/zinc/01/71/83/567017183.db2.gz PMEAILPHTFFUAF-UHFFFAOYSA-N 0 3 399.239 3.443 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)c1cnc2ncc(Br)cc2c1 ZINC000681969819 567017497 /nfs/dbraw/zinc/01/74/97/567017497.db2.gz PSHBZELEGHPUJE-HNNXBMFYSA-N 0 3 379.302 3.098 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1C(=O)N1CCC[C@@H]1CN(C)C ZINC000494739240 567018634 /nfs/dbraw/zinc/01/86/34/567018634.db2.gz PQEDDCDZJNQQBW-MRXNPFEDSA-N 0 3 391.313 3.109 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)c1cnc2ncc(Br)cc2c1 ZINC000681991778 567019645 /nfs/dbraw/zinc/01/96/45/567019645.db2.gz BSMFPRQPYJOAGS-BETUJISGSA-N 0 3 391.313 3.385 10 0 GGAEHN CN(C(=O)c1cn(-c2ccc(Cl)c(Cl)c2)cn1)[C@H]1CCN(C2CC2)C1 ZINC000430582468 567022465 /nfs/dbraw/zinc/02/24/65/567022465.db2.gz KQOPLFXKGAXPQZ-AWEZNQCLSA-N 0 3 379.291 3.488 10 0 GGAEHN C[C@H]1C[C@H](Nc2ncnc3cccc(I)c32)CN1C1CC1 ZINC000545163193 567024204 /nfs/dbraw/zinc/02/42/04/567024204.db2.gz AWMRTOJVSVECBC-QWRGUYRKSA-N 0 3 394.260 3.272 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)N[C@@H]1C[C@H]1c1cccc(Br)c1 ZINC000520781024 567025122 /nfs/dbraw/zinc/02/51/22/567025122.db2.gz JHGQPYZNNSUADH-XOKHGSTOSA-N 0 3 380.330 3.479 10 0 GGAEHN C[C@@H](CC(=O)Nc1ccnn1CCN(C)C)c1ccc(Br)cc1 ZINC000584251432 567025232 /nfs/dbraw/zinc/02/52/32/567025232.db2.gz QAGCTRMNBYAMRH-ZDUSSCGKSA-N 0 3 379.302 3.340 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)N[C@H]1C[C@@H]1c1cccc(Br)c1 ZINC000520781025 567025645 /nfs/dbraw/zinc/02/56/45/567025645.db2.gz JHGQPYZNNSUADH-XYPHTWIQSA-N 0 3 380.330 3.479 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)c2ncnc3cccc(I)c32)CCN1C ZINC000545166430 567025810 /nfs/dbraw/zinc/02/58/10/567025810.db2.gz XRDOJBDZYAPUFA-NEPJUHHUSA-N 0 3 396.276 3.153 10 0 GGAEHN CSc1ccccc1C[C@H](C)NC[C@H]1CS(=O)(=O)c2ccccc2O1 ZINC000564964524 567025844 /nfs/dbraw/zinc/02/58/44/567025844.db2.gz OFTSTVADWPTCJH-HOCLYGCPSA-N 0 3 377.531 3.164 10 0 GGAEHN CCc1cccc(OC[C@@H](O)CN[C@@H](CO)c2cccc(Br)c2)c1 ZINC000520783224 567025897 /nfs/dbraw/zinc/02/58/97/567025897.db2.gz WFPRAXYJJANZGG-HKUYNNGSSA-N 0 3 394.309 3.074 10 0 GGAEHN COc1ccc(CN2CCc3ccccc3[C@@H]2C[NH3+])c(Br)c1[O-] ZINC000564973856 567025981 /nfs/dbraw/zinc/02/59/81/567025981.db2.gz YTFSAIFUUSKAEQ-HNNXBMFYSA-N 0 3 377.282 3.221 10 0 GGAEHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)[C@@H]2CCc3cc(Br)ccc32)C1 ZINC000564998476 567029332 /nfs/dbraw/zinc/02/93/32/567029332.db2.gz NOOYHUYRCCJGJQ-BMGDILEWSA-N 0 3 377.326 3.422 10 0 GGAEHN C[C@@H](c1ccccc1)N1CC[C@H](Nc2ncc(I)cn2)C1 ZINC000545208470 567029662 /nfs/dbraw/zinc/02/96/62/567029662.db2.gz VNHHGBRZEAUIHT-WFASDCNBSA-N 0 3 394.260 3.329 10 0 GGAEHN C[C@@H](c1ccccc1)N1CC[C@H](Nc2cc(Br)cnc2C(N)=O)C1 ZINC000472493887 567029762 /nfs/dbraw/zinc/02/97/62/567029762.db2.gz FIELFJJVLLEZMR-WFASDCNBSA-N 0 3 389.297 3.190 10 0 GGAEHN CCO[C@@H]1C[C@@](N)(C(=O)NCc2c(Cl)cccc2OC(F)F)C1(C)C ZINC000634298988 567030254 /nfs/dbraw/zinc/03/02/54/567030254.db2.gz DPAKKFNNJSXKCG-CXAGYDPISA-N 0 3 376.831 3.090 10 0 GGAEHN NC(=O)c1ncc(Br)cc1NC[C@@H]1CCCN1Cc1ccccc1 ZINC000472501421 567031621 /nfs/dbraw/zinc/03/16/21/567031621.db2.gz PGRXKLLQDYIZEY-HNNXBMFYSA-N 0 3 389.297 3.020 10 0 GGAEHN NC(=O)c1ncc(Br)cc1NC[C@H]1CCCN1Cc1ccccc1 ZINC000472501433 567031714 /nfs/dbraw/zinc/03/17/14/567031714.db2.gz PGRXKLLQDYIZEY-OAHLLOKOSA-N 0 3 389.297 3.020 10 0 GGAEHN C[C@H]1C[C@H](Nc2cc(Br)cnc2C(N)=O)CN1Cc1ccccc1 ZINC000472500579 567031826 /nfs/dbraw/zinc/03/18/26/567031826.db2.gz NIZMJKHFHWNDCG-WFASDCNBSA-N 0 3 389.297 3.018 10 0 GGAEHN C[C@@H](NC[C@@H]1CCCCS1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430740812 567032708 /nfs/dbraw/zinc/03/27/08/567032708.db2.gz CQFUWOYATRLUCM-PWSUYJOCSA-N 0 3 393.372 3.033 10 0 GGAEHN C[C@@H](NC(=O)c1cc(Br)cc(N2CCCC2)c1)C1=CCN(C)CC1 ZINC000613374382 567033424 /nfs/dbraw/zinc/03/34/24/567033424.db2.gz FFQXVPAJWWIQAD-CQSZACIVSA-N 0 3 392.341 3.430 10 0 GGAEHN O[C@H](COc1c(Cl)cccc1Cl)CN1CCOC2(CCOCC2)CC1 ZINC000545277742 567034006 /nfs/dbraw/zinc/03/40/06/567034006.db2.gz XVJWGGLQTSCTLE-AWEZNQCLSA-N 0 3 390.307 3.005 10 0 GGAEHN O[C@@H](COc1c(Cl)cccc1Cl)CN1CCOC2(CCOCC2)CC1 ZINC000545277743 567034674 /nfs/dbraw/zinc/03/46/74/567034674.db2.gz XVJWGGLQTSCTLE-CQSZACIVSA-N 0 3 390.307 3.005 10 0 GGAEHN C[C@@H]1CN(Cc2c(Br)cnn2C)[C@@H](C)CN1Cc1ccccc1 ZINC000494998242 567038163 /nfs/dbraw/zinc/03/81/63/567038163.db2.gz RCUBCYSUUPTHIP-CABCVRRESA-N 0 3 377.330 3.277 10 0 GGAEHN CN1CCN(C(=O)c2[nH]nc3ccc(Br)cc32)[C@H](c2ccccc2)C1 ZINC000521066308 567038234 /nfs/dbraw/zinc/03/82/34/567038234.db2.gz OXTCWTGGLMODPU-KRWDZBQOSA-N 0 3 399.292 3.454 10 0 GGAEHN Cc1ncc(Br)cc1NC(=O)c1ccccc1OCCN(C)C ZINC000452997449 567039427 /nfs/dbraw/zinc/03/94/27/567039427.db2.gz KVDUUUHWPAGHMK-UHFFFAOYSA-N 0 3 378.270 3.345 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N(C)[C@H]2CCN(C3CC3)C2)cc1OC ZINC000521082193 567040608 /nfs/dbraw/zinc/04/06/08/567040608.db2.gz PVWUJVKWNFLIHF-AWEZNQCLSA-N 0 3 397.313 3.165 10 0 GGAEHN COc1ccc(C(=O)N2CCc3ccccc3[C@H]2CN)c(Br)c1 ZINC000584412902 567040758 /nfs/dbraw/zinc/04/07/58/567040758.db2.gz QTVOTNBZUGQESG-QGZVFWFLSA-N 0 3 375.266 3.156 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000613543280 567045062 /nfs/dbraw/zinc/04/50/62/567045062.db2.gz AUTXFPZYBYURQF-SCLBCKFNSA-N 0 3 388.309 3.403 10 0 GGAEHN COc1ccc(CCC(=O)N[C@@H]2CCCN(C(C)C)C2)c(Br)c1 ZINC000613579488 567045824 /nfs/dbraw/zinc/04/58/24/567045824.db2.gz OTJLXAHRWBMNEC-OAHLLOKOSA-N 0 3 383.330 3.379 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000682458440 567045992 /nfs/dbraw/zinc/04/59/92/567045992.db2.gz XGBLWTUOMUCOAL-WFASDCNBSA-N 0 3 396.329 3.302 10 0 GGAEHN Brc1cccc(N2CC[C@@H](CNCc3cnn4c3CCC4)C2)c1 ZINC000657328577 567046135 /nfs/dbraw/zinc/04/61/35/567046135.db2.gz AILSOALECPKOFS-AWEZNQCLSA-N 0 3 375.314 3.208 10 0 GGAEHN COc1ccc(CCC(=O)N[C@H]2CCCN(C(C)C)C2)c(Br)c1 ZINC000613579487 567046411 /nfs/dbraw/zinc/04/64/11/567046411.db2.gz OTJLXAHRWBMNEC-HNNXBMFYSA-N 0 3 383.330 3.379 10 0 GGAEHN Cc1cc(C(=O)N2CCC[C@H](N(C)C)C2)nn1-c1ccc(Br)cc1 ZINC000431017682 567046481 /nfs/dbraw/zinc/04/64/81/567046481.db2.gz BQDKIPQNNWUJCL-INIZCTEOSA-N 0 3 391.313 3.109 10 0 GGAEHN Brc1ccc(N2CC[C@H](CNCc3cc4n(n3)CCC4)C2)cc1 ZINC000657326323 567046675 /nfs/dbraw/zinc/04/66/75/567046675.db2.gz LOUZREXSBSRPHR-CQSZACIVSA-N 0 3 375.314 3.208 10 0 GGAEHN CCN(CCNC(=O)c1cc(C)n(-c2ccc(Br)cc2)n1)C1CC1 ZINC000431020125 567046745 /nfs/dbraw/zinc/04/67/45/567046745.db2.gz WSAIFWJKPZZJRL-UHFFFAOYSA-N 0 3 391.313 3.157 10 0 GGAEHN CCN(CCc1nnnn1-c1ccccc1)Cc1cccc(Br)c1 ZINC000521221840 567048646 /nfs/dbraw/zinc/04/86/46/567048646.db2.gz ZNURTQKKTWDQRQ-UHFFFAOYSA-N 0 3 386.297 3.489 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)[C@@H](N)Cc1ccccc1 ZINC000584524585 567050202 /nfs/dbraw/zinc/05/02/02/567050202.db2.gz RQBAEWDMXZBVPO-LRDDRELGSA-N 0 3 377.282 3.205 10 0 GGAEHN C[C@@H](N[C@@H](C)Cn1ncc2ccccc2c1=O)c1cncc(Br)c1 ZINC000565241928 567050460 /nfs/dbraw/zinc/05/04/60/567050460.db2.gz AMDNTKWNXVSYTE-QWHCGFSZSA-N 0 3 387.281 3.293 10 0 GGAEHN CC[C@@H](c1ccc(Br)cc1)N1CCC[C@H](C(=O)N2CCOCC2)C1 ZINC000472775444 567051021 /nfs/dbraw/zinc/05/10/21/567051021.db2.gz UUAXJJKZNYPUJG-WMZOPIPTSA-N 0 3 395.341 3.471 10 0 GGAEHN CC[C@H]1C[C@H](NCC(C)(C)S(=O)(=O)c2ccc(Br)cc2)CO1 ZINC000657365280 567051252 /nfs/dbraw/zinc/05/12/52/567051252.db2.gz ZLKACVXRSWXCLJ-KBPBESRZSA-N 0 3 390.343 3.159 10 0 GGAEHN Cn1ncc(C(F)(F)F)c1CNCC1(N2CCSCC2)CCCCC1 ZINC000657369493 567051534 /nfs/dbraw/zinc/05/15/34/567051534.db2.gz HNXXYBYLMHDYDZ-UHFFFAOYSA-N 0 3 376.492 3.280 10 0 GGAEHN CC[C@H]1C[C@@H](NCC(C)(C)S(=O)(=O)c2ccc(Br)cc2)CO1 ZINC000657365282 567052094 /nfs/dbraw/zinc/05/20/94/567052094.db2.gz ZLKACVXRSWXCLJ-KGLIPLIRSA-N 0 3 390.343 3.159 10 0 GGAEHN Cc1c(Br)cncc1CNC[C@H](CO)Cc1ccc(F)c(F)c1 ZINC000657448664 567056283 /nfs/dbraw/zinc/05/62/83/567056283.db2.gz VKDLEBHEDFDQKZ-CYBMUJFWSA-N 0 3 385.252 3.372 10 0 GGAEHN CO[C@H](c1ccc(Br)cc1)[C@H](C)NC[C@H](O)C[C@@](C)(O)C1CC1 ZINC000634710006 567056343 /nfs/dbraw/zinc/05/63/43/567056343.db2.gz QXOKLBVUKFLFGR-PSMGESJCSA-N 0 3 386.330 3.027 10 0 GGAEHN CO[C@H](c1ccc(Br)cc1)[C@H](C)NC[C@H](O)C[C@](C)(O)C1CC1 ZINC000634710005 567056474 /nfs/dbraw/zinc/05/64/74/567056474.db2.gz QXOKLBVUKFLFGR-LSZYVWPRSA-N 0 3 386.330 3.027 10 0 GGAEHN Cc1c(Br)cncc1CNC[C@@H](CO)Cc1ccc(F)c(F)c1 ZINC000657448665 567056860 /nfs/dbraw/zinc/05/68/60/567056860.db2.gz VKDLEBHEDFDQKZ-ZDUSSCGKSA-N 0 3 385.252 3.372 10 0 GGAEHN CC(C)(CNC(=O)N1CCN2CCC1CC2)c1ccc(Br)cc1 ZINC000584581295 567058128 /nfs/dbraw/zinc/05/81/28/567058128.db2.gz KEBCFAFKMWZSPD-UHFFFAOYSA-N 0 3 380.330 3.216 10 0 GGAEHN O=C(NC[C@H]1CCCN(Cc2cccs2)C1)N[C@@H](CO)c1ccsc1 ZINC000472962482 567058480 /nfs/dbraw/zinc/05/84/80/567058480.db2.gz WHYMJVXYZWHUIT-PBHICJAKSA-N 0 3 379.551 3.054 10 0 GGAEHN Brc1cccc(N2CC[C@H](NCc3ccnn3-c3ccncc3)C2)c1 ZINC000657451206 567059175 /nfs/dbraw/zinc/05/91/75/567059175.db2.gz KBXHUQCFAIJKFL-INIZCTEOSA-N 0 3 398.308 3.398 10 0 GGAEHN Cc1c(Br)cncc1CN[C@@H]1CC(=O)N(Cc2ccccc2)[C@H]1C ZINC000657458706 567059300 /nfs/dbraw/zinc/05/93/00/567059300.db2.gz OBSLOQZXWVOVRE-KBXCAEBGSA-N 0 3 388.309 3.432 10 0 GGAEHN COc1ccc2c(c1)C[C@H](N[C@H](CO)c1cccc(Br)c1)CO2 ZINC000453158004 567059404 /nfs/dbraw/zinc/05/94/04/567059404.db2.gz IAVMRKPENAZEFY-DOTOQJQBSA-N 0 3 378.266 3.084 10 0 GGAEHN C[C@H](CCN[C@@H](C)c1ccc(F)c(I)c1)[S@](C)=O ZINC000453167856 567059706 /nfs/dbraw/zinc/05/97/06/567059706.db2.gz UKJWBGRJGXAZTK-JJQCHNSYSA-N 0 3 383.270 3.238 10 0 GGAEHN O[C@H]1CCN(Cc2cccc(NCc3c(F)cncc3Br)c2)C1 ZINC000657471884 567060161 /nfs/dbraw/zinc/06/01/61/567060161.db2.gz CSSFLUDAJLSBJY-AWEZNQCLSA-N 0 3 380.261 3.162 10 0 GGAEHN CC[C@H](N[C@@H](C)c1ccc(F)c(I)c1)[C@@H](O)C(F)F ZINC000453268000 567071334 /nfs/dbraw/zinc/07/13/34/567071334.db2.gz JDRRSYWUYHDKQL-CQFDHEJISA-N 0 3 387.183 3.486 10 0 GGAEHN CCN1CCN(c2ccc(Nc3ncncc3Br)c(C)c2)CC1 ZINC000473100031 567063408 /nfs/dbraw/zinc/06/34/08/567063408.db2.gz LPYJSXFBTBQNGK-UHFFFAOYSA-N 0 3 376.302 3.433 10 0 GGAEHN COc1cc(C[NH2+]C[C@H](c2ccnn2C)C(C)C)cc(Br)c1[O-] ZINC000682616878 567064501 /nfs/dbraw/zinc/06/45/01/567064501.db2.gz KWMBVIMBOMRSFM-ZDUSSCGKSA-N 0 3 382.302 3.426 10 0 GGAEHN CN(C(=O)N[C@@H]1C[C@H]1c1ccccc1Br)[C@H]1CCN(C2CC2)C1 ZINC000431190910 567065562 /nfs/dbraw/zinc/06/55/62/567065562.db2.gz CGCLNXYJVFQFSB-JLJPHGGASA-N 0 3 378.314 3.183 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNCc1ccc(Br)cc1N1CCOCC1 ZINC000657527640 567065672 /nfs/dbraw/zinc/06/56/72/567065672.db2.gz WYQNAEMLVDBUJO-KRWDZBQOSA-N 0 3 396.373 3.248 10 0 GGAEHN CC(C)N1CCCN(C(=O)N[C@@H]2C[C@H]2c2ccccc2Br)CC1 ZINC000431190338 567065789 /nfs/dbraw/zinc/06/57/89/567065789.db2.gz GTZIURZZHHRGAB-DOTOQJQBSA-N 0 3 380.330 3.431 10 0 GGAEHN CCCC[C@H](NCCc1ccccc1Br)C(=O)Nc1cc(C)on1 ZINC000495748142 567066123 /nfs/dbraw/zinc/06/61/23/567066123.db2.gz ZMNRZHUEROBYEW-INIZCTEOSA-N 0 3 394.313 3.497 10 0 GGAEHN CCCC[C@@H](NCCc1ccccc1Br)C(=O)Nc1cc(C)on1 ZINC000495748143 567066293 /nfs/dbraw/zinc/06/62/93/567066293.db2.gz ZMNRZHUEROBYEW-MRXNPFEDSA-N 0 3 394.313 3.497 10 0 GGAEHN OCCCN1CCC[C@H](N[C@H]2CCCOc3ccc(Br)cc32)C1 ZINC000453253252 567066445 /nfs/dbraw/zinc/06/64/45/567066445.db2.gz CTILENJEASAARE-RDJZCZTQSA-N 0 3 383.330 3.099 10 0 GGAEHN CO[C@H](CNCc1cccc(Br)c1OC(F)F)[C@H]1CCOC1 ZINC000657541465 567066612 /nfs/dbraw/zinc/06/66/12/567066612.db2.gz KTIHCXTVLFAKAM-WCQYABFASA-N 0 3 380.229 3.192 10 0 GGAEHN CO[C@@H](CNCc1cn(-c2cccc(Br)c2)nc1C)[C@@H]1CCOC1 ZINC000657541630 567066809 /nfs/dbraw/zinc/06/68/09/567066809.db2.gz QPLDJVKGWAZSOL-KDOFPFPSSA-N 0 3 394.313 3.084 10 0 GGAEHN OCCCN1CCC[C@H](N[C@@H]2CCCOc3ccc(Br)cc32)C1 ZINC000453253250 567067228 /nfs/dbraw/zinc/06/72/28/567067228.db2.gz CTILENJEASAARE-DOTOQJQBSA-N 0 3 383.330 3.099 10 0 GGAEHN COc1cc(CNCc2ccc(CNC(C)=O)cc2)cc(Br)c1O ZINC000657541759 567067827 /nfs/dbraw/zinc/06/78/27/567067827.db2.gz RNPPVMZYSRGICY-UHFFFAOYSA-N 0 3 393.281 3.089 10 0 GGAEHN Cc1ccc2c(c1)[C@H](NCCn1cc(Br)ccc1=O)CCCO2 ZINC000453245516 567067877 /nfs/dbraw/zinc/06/78/77/567067877.db2.gz IAJWYXGWJLDIKX-MRXNPFEDSA-N 0 3 377.282 3.423 10 0 GGAEHN O=C(N1CCN(c2ccncc2)CC1)C1(c2ccccc2Br)CC1 ZINC000682705972 567068121 /nfs/dbraw/zinc/06/81/21/567068121.db2.gz UXBPOXZTHZDXNC-UHFFFAOYSA-N 0 3 386.293 3.225 10 0 GGAEHN CS(=O)(=O)CC1(CCNCc2ccc(Cl)cc2Br)CC1 ZINC000657548156 567068502 /nfs/dbraw/zinc/06/85/02/567068502.db2.gz RPFXAWRDKWUSQV-UHFFFAOYSA-N 0 3 380.735 3.407 10 0 GGAEHN CS(=O)(=O)CC1(CCNCc2ccc(Br)cc2Cl)CC1 ZINC000657547019 567068815 /nfs/dbraw/zinc/06/88/15/567068815.db2.gz ABVHVRBSOHBCKN-UHFFFAOYSA-N 0 3 380.735 3.407 10 0 GGAEHN COc1c(Br)cc(CN[C@@H](CO)C2CCC2)cc1Br ZINC000657558267 567069052 /nfs/dbraw/zinc/06/90/52/567069052.db2.gz LYGBAQJCLQNKGP-ZDUSSCGKSA-N 0 3 393.119 3.471 10 0 GGAEHN OCCN1CCCC[C@H]1CN[C@@H]1CCCOc2cc(Br)ccc21 ZINC000453267749 567069238 /nfs/dbraw/zinc/06/92/38/567069238.db2.gz PQOPGQGLUMCLQM-DOTOQJQBSA-N 0 3 383.330 3.099 10 0 GGAEHN OCCCN1CCC[C@H]1CN[C@H]1CCCOc2ccc(Br)cc21 ZINC000453266982 567069758 /nfs/dbraw/zinc/06/97/58/567069758.db2.gz OVHCDUNOUIZAEM-RDJZCZTQSA-N 0 3 383.330 3.099 10 0 GGAEHN OCCN1CCCC[C@H]1CN[C@H]1CCCOc2c(Br)cccc21 ZINC000453255298 567069837 /nfs/dbraw/zinc/06/98/37/567069837.db2.gz FKFKNHGAFYJRJT-YOEHRIQHSA-N 0 3 383.330 3.099 10 0 GGAEHN OCCN1CCCC[C@H]1CN[C@@H]1CCCOc2c(Br)cccc21 ZINC000453255294 567069859 /nfs/dbraw/zinc/06/98/59/567069859.db2.gz FKFKNHGAFYJRJT-WMLDXEAASA-N 0 3 383.330 3.099 10 0 GGAEHN OCCCN1CCC[C@@H]1CN[C@H]1CCCOc2ccc(Br)cc21 ZINC000453266986 567070000 /nfs/dbraw/zinc/07/00/00/567070000.db2.gz OVHCDUNOUIZAEM-WBVHZDCISA-N 0 3 383.330 3.099 10 0 GGAEHN Cc1ccc(S(=O)(=O)NCCN(C)C2CCCCC2)c(Br)c1 ZINC000521638400 567070408 /nfs/dbraw/zinc/07/04/08/567070408.db2.gz UILZCXQDILYOAU-UHFFFAOYSA-N 0 3 389.359 3.300 10 0 GGAEHN COC[C@@H](NCC1=Cc2cc(Br)ccc2OC1)C1CCOCC1 ZINC000657565728 567070495 /nfs/dbraw/zinc/07/04/95/567070495.db2.gz UHIHAHAEEISHKY-QGZVFWFLSA-N 0 3 382.298 3.256 10 0 GGAEHN OCCN1CCCC[C@@H]1CN[C@H]1CCCOc2ccc(Br)cc21 ZINC000453270780 567071412 /nfs/dbraw/zinc/07/14/12/567071412.db2.gz SPEVSIAIPCVHHM-WBVHZDCISA-N 0 3 383.330 3.099 10 0 GGAEHN Ic1ccc2c(c1)[C@H](NCC1=CCOCC1)CCCO2 ZINC000453278461 567071496 /nfs/dbraw/zinc/07/14/96/567071496.db2.gz CXYDKLOOTBHESX-OAHLLOKOSA-N 0 3 385.245 3.441 10 0 GGAEHN CC[C@H](N[C@H](C)c1ccc(S(=O)(=O)C2CCCC2)cc1)[C@H](O)C(F)F ZINC000453273104 567071523 /nfs/dbraw/zinc/07/15/23/567071523.db2.gz UAXNPALDGBBKNM-DQYPLSBCSA-N 0 3 375.481 3.458 10 0 GGAEHN OCCN1CCCC[C@H]1CN[C@H]1CCCOc2cc(Br)ccc21 ZINC000453267753 567071560 /nfs/dbraw/zinc/07/15/60/567071560.db2.gz PQOPGQGLUMCLQM-RDJZCZTQSA-N 0 3 383.330 3.099 10 0 GGAEHN CO[C@@H]1CCC[C@H]([C@H](CO)NCc2cc(Br)cc3c2OCC3)C1 ZINC000657579037 567072429 /nfs/dbraw/zinc/07/24/29/567072429.db2.gz VYYUWEHNTRZMLD-VUCTXSBTSA-N 0 3 384.314 3.040 10 0 GGAEHN CO[C@@H]1CCC[C@@H]([C@H](CO)NCc2cc(Br)cc3c2OCC3)C1 ZINC000657579036 567072625 /nfs/dbraw/zinc/07/26/25/567072625.db2.gz VYYUWEHNTRZMLD-JLZZUVOBSA-N 0 3 384.314 3.040 10 0 GGAEHN CO[C@@H]1CCC[C@@H]([C@@H](CO)NCc2cc(Br)cc3c2OCC3)C1 ZINC000657579034 567072982 /nfs/dbraw/zinc/07/29/82/567072982.db2.gz VYYUWEHNTRZMLD-CSMYWGQOSA-N 0 3 384.314 3.040 10 0 GGAEHN CO[C@@H]1CCC[C@H]([C@@H](CO)NCc2cc(Br)cc3c2OCC3)C1 ZINC000657579035 567073065 /nfs/dbraw/zinc/07/30/65/567073065.db2.gz VYYUWEHNTRZMLD-JCURWCKSSA-N 0 3 384.314 3.040 10 0 GGAEHN [O-]c1cccc(CNCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c1Br ZINC000657597300 567074748 /nfs/dbraw/zinc/07/47/48/567074748.db2.gz SPAYTBYUXZBRAE-KRWDZBQOSA-N 0 3 391.309 3.011 10 0 GGAEHN [O-]c1cccc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c1Br ZINC000657597300 567074756 /nfs/dbraw/zinc/07/47/56/567074756.db2.gz SPAYTBYUXZBRAE-KRWDZBQOSA-N 0 3 391.309 3.011 10 0 GGAEHN C[C@H](NC[C@H]1CCCC1(F)F)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000453326534 567074898 /nfs/dbraw/zinc/07/48/98/567074898.db2.gz YDPCPLLJKAUCCH-GXSJLCMTSA-N 0 3 397.285 3.183 10 0 GGAEHN O=C(CCN[C@@H]1CCOc2ccc(Br)cc21)Nc1cccnc1 ZINC000682845969 567076559 /nfs/dbraw/zinc/07/65/59/567076559.db2.gz SWXBFHSTPBCUBR-OAHLLOKOSA-N 0 3 376.254 3.286 10 0 GGAEHN Brc1ccc(CN[C@H]2COC3(CCC3)C2)c(N2CCOCC2)c1 ZINC000657630975 567079191 /nfs/dbraw/zinc/07/91/91/567079191.db2.gz SSHBNMVRWAPKDV-MRXNPFEDSA-N 0 3 381.314 3.087 10 0 GGAEHN C[C@H]1CC[C@H](NCc2ccc(Br)c3cccnc23)CS1(=O)=O ZINC000657636144 567079217 /nfs/dbraw/zinc/07/92/17/567079217.db2.gz DPWJADAQOKFLIW-AAEUAGOBSA-N 0 3 383.311 3.053 10 0 GGAEHN CN(C)C(=O)N1CCC(N[C@H]2CSCc3ccc(Br)cc32)CC1 ZINC000657642199 567080432 /nfs/dbraw/zinc/08/04/32/567080432.db2.gz WQXAOWLGOANEFL-INIZCTEOSA-N 0 3 398.370 3.473 10 0 GGAEHN C[C@H](Cc1ccc(F)cc1Br)N[C@H]1CC[C@H](C)S(=O)(=O)C1 ZINC000657640235 567080878 /nfs/dbraw/zinc/08/08/78/567080878.db2.gz WRKQGQIHLXSGRW-SUNKGSAMSA-N 0 3 378.307 3.075 10 0 GGAEHN CN(C)C[C@@]1(O)CCCN(C(=O)C2(c3c(Cl)cccc3Cl)CCC2)C1 ZINC000614065664 567081295 /nfs/dbraw/zinc/08/12/95/567081295.db2.gz RRYFOTHXWTXTED-SFHVURJKSA-N 0 3 385.335 3.330 10 0 GGAEHN C[C@H]1CCC[C@@H](CNCc2ccc(Br)cc2N2CCOCC2)O1 ZINC000657662524 567082325 /nfs/dbraw/zinc/08/23/25/567082325.db2.gz ADKHWLABOZQNNC-YOEHRIQHSA-N 0 3 383.330 3.333 10 0 GGAEHN Cc1sc([C@@H](C)NC(=O)CCOC2CNC2)nc1-c1ccc(Cl)cc1 ZINC000521860931 567082956 /nfs/dbraw/zinc/08/29/56/567082956.db2.gz FRGZCXRDWIBOTL-LLVKDONJSA-N 0 3 379.913 3.328 10 0 GGAEHN CCN1CCC(N(C)c2ncnc3cccc(I)c32)CC1 ZINC000545868198 567084021 /nfs/dbraw/zinc/08/40/21/567084021.db2.gz ZIZLKRKVFNGIMU-UHFFFAOYSA-N 0 3 396.276 3.155 10 0 GGAEHN C[C@H](CC(=O)NC[C@@]1(N(C)C)CCSC1)c1ccc(Br)cc1 ZINC000431493312 567084535 /nfs/dbraw/zinc/08/45/35/567084535.db2.gz IGTZFSUXUXEVSG-DYVFJYSZSA-N 0 3 385.371 3.496 10 0 GGAEHN Cc1ccc(C(=O)Nc2ccc(=O)n(CCN(C)C)c2)c(C)c1Br ZINC000682926266 567084787 /nfs/dbraw/zinc/08/47/87/567084787.db2.gz SOACDAAGFMBANW-UHFFFAOYSA-N 0 3 392.297 3.042 10 0 GGAEHN Cc1ccc(C(=O)NC(C)(C)CCN2CCN(C)CC2)c(C)c1Br ZINC000682934825 567086076 /nfs/dbraw/zinc/08/60/76/567086076.db2.gz PBTKJXZXKPSTOL-UHFFFAOYSA-N 0 3 396.373 3.212 10 0 GGAEHN CCOCCOc1ccc(Br)cc1CN[C@@H]1C[C@@H](O)C12CCC2 ZINC000657702844 567086136 /nfs/dbraw/zinc/08/61/36/567086136.db2.gz JRSGVOPQJNKWBI-IAGOWNOFSA-N 0 3 384.314 3.258 10 0 GGAEHN COc1cc(C[NH2+][C@@H]2CCC[C@H]2Cc2cnn(C)c2)cc(Br)c1[O-] ZINC000657689878 567086411 /nfs/dbraw/zinc/08/64/11/567086411.db2.gz ZLCFQFVBGYBUJH-GOEBONIOSA-N 0 3 394.313 3.398 10 0 GGAEHN COc1cc(C[NH2+][C@H]2CCC[C@H]2Cc2cnn(C)c2)cc(Br)c1[O-] ZINC000657689881 567086425 /nfs/dbraw/zinc/08/64/25/567086425.db2.gz ZLCFQFVBGYBUJH-HOCLYGCPSA-N 0 3 394.313 3.398 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN[C@@H]1C[C@H](O)C12CCC2 ZINC000657710627 567087344 /nfs/dbraw/zinc/08/73/44/567087344.db2.gz XIEPEJKVKPNJGI-SJORKVTESA-N 0 3 376.298 3.336 10 0 GGAEHN CCN(CC)CCN(C(=O)c1cnn(CC)c1)c1ccc(Br)cn1 ZINC000565660888 567087732 /nfs/dbraw/zinc/08/77/32/567087732.db2.gz OVHOIWTYUFHRSC-UHFFFAOYSA-N 0 3 394.317 3.049 10 0 GGAEHN Cc1cncc(CCNCc2cc(Br)c3c(c2)OCCCO3)n1 ZINC000657712620 567088188 /nfs/dbraw/zinc/08/81/88/567088188.db2.gz ZBPCQHVNINXNHS-UHFFFAOYSA-N 0 3 378.270 3.041 10 0 GGAEHN COC(=O)c1ccc(CNCC[C@H](OC)C(F)(F)F)c(Br)c1 ZINC000585767555 567089629 /nfs/dbraw/zinc/08/96/29/567089629.db2.gz LDMDUENVHIYTEZ-LBPRGKRZSA-N 0 3 384.192 3.293 10 0 GGAEHN CN(C)[C@H](CNC(=O)c1n[nH]c2ccc(Br)cc21)c1ccsc1 ZINC000521967851 567089625 /nfs/dbraw/zinc/08/96/25/567089625.db2.gz GUTPTWJYCZEOHY-CQSZACIVSA-N 0 3 393.310 3.420 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1ccc(Br)c2cc(C)oc21 ZINC000473633086 567093758 /nfs/dbraw/zinc/09/37/58/567093758.db2.gz GNHUYHNVJHGBQQ-CYBMUJFWSA-N 0 3 395.297 3.344 10 0 GGAEHN CN(C)CCn1cc(NC(=O)Nc2c(F)cc(F)cc2Br)cn1 ZINC000683082535 567096767 /nfs/dbraw/zinc/09/67/67/567096767.db2.gz VFQUAFARTDMKQO-UHFFFAOYSA-N 0 3 388.216 3.129 10 0 GGAEHN Cc1csc([C@H](C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)n1 ZINC000614248623 567097925 /nfs/dbraw/zinc/09/79/25/567097925.db2.gz RBWWNBRMZJNVSZ-LMWSTFAQSA-N 0 3 375.460 3.477 10 0 GGAEHN CN(Cc1nnc(-c2ccccc2Br)o1)[C@@H]1CCN(C2CC2)C1 ZINC000522069463 567098638 /nfs/dbraw/zinc/09/86/38/567098638.db2.gz RTGQJHFIMUEMRP-CYBMUJFWSA-N 0 3 377.286 3.168 10 0 GGAEHN COCCN1CCC(NC(=O)c2coc3c2cc(Br)cc3C)CC1 ZINC000473764148 567101732 /nfs/dbraw/zinc/10/17/32/567101732.db2.gz VJEYBNTWZKHHSR-UHFFFAOYSA-N 0 3 395.297 3.344 10 0 GGAEHN CC[C@H]1CN(C)CCCN1C(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000614332950 567103661 /nfs/dbraw/zinc/10/36/61/567103661.db2.gz WSRDEDRDYTZYKS-LSDHHAIUSA-N 0 3 381.314 3.258 10 0 GGAEHN COC[C@H](CC1CCOCC1)NCC(=O)Nc1ccc(Br)cc1C ZINC000657909260 567103743 /nfs/dbraw/zinc/10/37/43/567103743.db2.gz MAJGPDMASNPBLI-INIZCTEOSA-N 0 3 399.329 3.117 10 0 GGAEHN CC[C@H]1CN(C)CCCN1C(=O)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000614333651 567103987 /nfs/dbraw/zinc/10/39/87/567103987.db2.gz DTZQQBWDVCZNJF-ZDUSSCGKSA-N 0 3 392.297 3.259 10 0 GGAEHN C[N@H+](CCCNC(=O)Cc1ccc(Br)cc1[O-])C1CCCCC1 ZINC000431789500 567107002 /nfs/dbraw/zinc/10/70/02/567107002.db2.gz RZBHMXNOHAQJPS-UHFFFAOYSA-N 0 3 383.330 3.468 10 0 GGAEHN C[N@@H+](CCCNC(=O)Cc1ccc(Br)cc1[O-])C1CCCCC1 ZINC000431789500 567107007 /nfs/dbraw/zinc/10/70/07/567107007.db2.gz RZBHMXNOHAQJPS-UHFFFAOYSA-N 0 3 383.330 3.468 10 0 GGAEHN CN1CCN(CCC(C)(C)NC(=O)NCc2ccc(Cl)cc2Cl)CC1 ZINC000473896298 567112860 /nfs/dbraw/zinc/11/28/60/567112860.db2.gz MIAIBIXOUURNPX-UHFFFAOYSA-N 0 3 387.355 3.209 10 0 GGAEHN O=S(=O)([N-]CC[NH2+][C@H]1CCCSCC1)c1cccc(Cl)c1Cl ZINC000658009207 567114326 /nfs/dbraw/zinc/11/43/26/567114326.db2.gz CPDMUZGCSXCNQF-NSHDSACASA-N 0 3 383.366 3.147 10 0 GGAEHN CN1CCN([C@H]2CC[C@@H](NC(=O)c3c(Cl)cc(F)cc3Cl)CC2)CC1 ZINC000683333170 567115512 /nfs/dbraw/zinc/11/55/12/567115512.db2.gz CYBGRQXJTKQRLO-OKILXGFUSA-N 0 3 388.314 3.421 10 0 GGAEHN COC[C@@H](CC1CCOCC1)NCc1cc(OC)c(O)cc1Br ZINC000658042280 567117212 /nfs/dbraw/zinc/11/72/12/567117212.db2.gz BZKZGRRONXBNAL-CQSZACIVSA-N 0 3 388.302 3.085 10 0 GGAEHN CC[C@@H](NC[C@H]1CCN1C(C)(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000658061469 567118452 /nfs/dbraw/zinc/11/84/52/567118452.db2.gz OKKBJUBVTZDMEM-GDBMZVCRSA-N 0 3 387.977 3.162 10 0 GGAEHN COC1CC(CCN[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)C1 ZINC000658061050 567118517 /nfs/dbraw/zinc/11/85/17/567118517.db2.gz SAUXSSXQEBVRBC-KPPDAEKUSA-N 0 3 381.325 3.107 10 0 GGAEHN CC[C@H](NC[C@H]1CCN1C(C)(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000658061475 567119375 /nfs/dbraw/zinc/11/93/75/567119375.db2.gz OKKBJUBVTZDMEM-ZBFHGGJFSA-N 0 3 387.977 3.162 10 0 GGAEHN COC1CC(CCN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)C1 ZINC000658057848 567119508 /nfs/dbraw/zinc/11/95/08/567119508.db2.gz ZKWXEXBZJWWRES-HGMXIMQMSA-N 0 3 388.327 3.072 10 0 GGAEHN COc1cc([C@@H](C)NCCNC(=O)c2ccc(Br)cn2)ccc1F ZINC000658091893 567120312 /nfs/dbraw/zinc/12/03/12/567120312.db2.gz IXGXBIDXRQBDBV-LLVKDONJSA-N 0 3 396.260 3.072 10 0 GGAEHN C[C@H](NCCC1(CS(C)(=O)=O)CC1)c1ccc(F)cc1Br ZINC000658078660 567120349 /nfs/dbraw/zinc/12/03/49/567120349.db2.gz SZMISJVZXZRCQV-NSHDSACASA-N 0 3 378.307 3.454 10 0 GGAEHN COC[C@@H](CCN[C@@H](C)c1nnn(-c2cccc(Br)c2)c1C)OC ZINC000658084790 567120429 /nfs/dbraw/zinc/12/04/29/567120429.db2.gz NYNJDYOVZJKMBC-BLLLJJGKSA-N 0 3 397.317 3.040 10 0 GGAEHN CS(=O)(=O)CC1(CCN[C@@H]2CCc3c2c(Br)ccc3F)CC1 ZINC000658077213 567120716 /nfs/dbraw/zinc/12/07/16/567120716.db2.gz HYICLSCXKFDIFN-CQSZACIVSA-N 0 3 390.318 3.380 10 0 GGAEHN CCSCCNCC(C)(C)S(=O)(=O)c1ccc(Br)cc1 ZINC000546331821 567124295 /nfs/dbraw/zinc/12/42/95/567124295.db2.gz LJBIEPIQKRHJDE-UHFFFAOYSA-N 0 3 380.373 3.344 10 0 GGAEHN CC1(C)CC[C@H](CNCc2ccc(Br)cc2N2CCOCC2)O1 ZINC000473996594 567124370 /nfs/dbraw/zinc/12/43/70/567124370.db2.gz QIKHPCHPMFCBMS-MRXNPFEDSA-N 0 3 383.330 3.333 10 0 GGAEHN Cc1ccncc1CCN[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000658123053 567124302 /nfs/dbraw/zinc/12/43/02/567124302.db2.gz IVEFHDMHYSELAE-LLVKDONJSA-N 0 3 388.320 3.238 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1cccc(F)c1Br ZINC000432034363 567125391 /nfs/dbraw/zinc/12/53/91/567125391.db2.gz RLFPEOPVXDWRKY-CQSZACIVSA-N 0 3 379.273 3.491 10 0 GGAEHN C[C@H](NC[C@]1(OCCO)CCOC1)c1cc2cc(Br)ccc2o1 ZINC000658148322 567126649 /nfs/dbraw/zinc/12/66/49/567126649.db2.gz LCFFQOKRJXNUBU-YVEFUNNKSA-N 0 3 384.270 3.014 10 0 GGAEHN CN(C)[C@H](CNC(=O)Cc1cscc1Br)Cc1ccccc1 ZINC000432047191 567127412 /nfs/dbraw/zinc/12/74/12/567127412.db2.gz MENNAJWHNSSOQO-HNNXBMFYSA-N 0 3 381.339 3.342 10 0 GGAEHN CN(C)[C@@H](CNC(=O)Cc1cscc1Br)Cc1ccccc1 ZINC000432047192 567127857 /nfs/dbraw/zinc/12/78/57/567127857.db2.gz MENNAJWHNSSOQO-OAHLLOKOSA-N 0 3 381.339 3.342 10 0 GGAEHN CN(C)C1(CNC(=O)CSCc2ccc(Br)cc2F)CCC1 ZINC000474091320 567132269 /nfs/dbraw/zinc/13/22/69/567132269.db2.gz XCFPPJPHXDITQK-UHFFFAOYSA-N 0 3 389.334 3.422 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N1CC[C@@H](Cc2ccc(Br)cc2)C1 ZINC000432099586 567132558 /nfs/dbraw/zinc/13/25/58/567132558.db2.gz RFNLWZWLTMXWPK-RDJZCZTQSA-N 0 3 380.330 3.117 10 0 GGAEHN CCS(=O)(=O)C1(CN[C@H](C)Cc2ccc(Br)cc2F)CC1 ZINC000658298590 567132937 /nfs/dbraw/zinc/13/29/37/567132937.db2.gz IDIFBJZYFZLWDP-LLVKDONJSA-N 0 3 378.307 3.076 10 0 GGAEHN C[C@H](NC[C@H]1C(C)(C)C1(F)F)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000658282375 567132998 /nfs/dbraw/zinc/13/29/98/567132998.db2.gz UZMAMCPMOWIGAK-UFBFGSQYSA-N 0 3 397.285 3.038 10 0 GGAEHN C[C@H](N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2)c1ccc(Br)cn1 ZINC000658290815 567133447 /nfs/dbraw/zinc/13/34/47/567133447.db2.gz ONJKAIUKAIATPI-IAOVAPTHSA-N 0 3 380.330 3.138 10 0 GGAEHN CC(C)[C@H](O)[C@H](N[C@H](C)Cn1cc(Br)ccc1=O)c1ccccc1 ZINC000658288417 567134575 /nfs/dbraw/zinc/13/45/75/567134575.db2.gz OPQZDYNXCBRYDC-ZMYBRWDISA-N 0 3 393.325 3.347 10 0 GGAEHN CN(Cc1ccc(F)cc1Br)C(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C ZINC000566195896 567136993 /nfs/dbraw/zinc/13/69/93/567136993.db2.gz SJFNMFASXAGDDO-DDUZABMNSA-N 0 3 399.304 3.079 10 0 GGAEHN Cc1c2ccc(C(F)(F)F)nc2sc1C(=O)N[C@H]1CNCCC1(F)F ZINC000566212769 567138412 /nfs/dbraw/zinc/13/84/12/567138412.db2.gz WCDYXNXYSDLRAT-JTQLQIEISA-N 0 3 379.354 3.351 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)Nc1ccc(Cl)cc1I ZINC000474130638 567138560 /nfs/dbraw/zinc/13/85/60/567138560.db2.gz FXRFNKCVZQICSQ-JTQLQIEISA-N 0 3 393.656 3.160 10 0 GGAEHN O=S(=O)(Cc1cc(Cl)ccc1F)N[C@@H]1CNCC[C@@H]1c1ccccc1 ZINC000658391487 567139835 /nfs/dbraw/zinc/13/98/35/567139835.db2.gz JOGRAPQHVDCPIU-SJLPKXTDSA-N 0 3 382.888 3.044 10 0 GGAEHN CSc1ccccc1S(=O)(=O)N1CC[C@H](c2ccc(F)cc2)[C@@H](N)C1 ZINC000658403152 567140567 /nfs/dbraw/zinc/14/05/67/567140567.db2.gz IKVKUAVKMYQJFF-CVEARBPZSA-N 0 3 380.510 3.053 10 0 GGAEHN O=S(=O)([N-][C@@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)cc(Br)c1 ZINC000658401510 567141285 /nfs/dbraw/zinc/14/12/85/567141285.db2.gz FTOIBXLOZRLBFT-GFCCVEGCSA-N 0 3 393.734 3.056 10 0 GGAEHN Cc1ccc(S(=O)(=O)N2CC[C@H](c3ccc(F)cc3)[C@@H](N)C2)c(Cl)c1 ZINC000658403993 567142289 /nfs/dbraw/zinc/14/22/89/567142289.db2.gz FZWNXEBIEBHZKF-WBVHZDCISA-N 0 3 382.888 3.293 10 0 GGAEHN N[C@@H]1CN(S(=O)(=O)Cc2ccc(Cl)cc2)CC[C@H]1c1ccc(F)cc1 ZINC000658403859 567143208 /nfs/dbraw/zinc/14/32/08/567143208.db2.gz RBKQVSPNELOHIO-ZWKOTPCHSA-N 0 3 382.888 3.126 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000614865643 567144688 /nfs/dbraw/zinc/14/46/88/567144688.db2.gz WJKOMNMFDVCACM-INIZCTEOSA-N 0 3 380.261 3.324 10 0 GGAEHN O=C1c2ccccc2C(=O)N1CCNCc1cc2cc(Br)ccc2[nH]1 ZINC000683711820 567147398 /nfs/dbraw/zinc/14/73/98/567147398.db2.gz YWBHSRRBJNVHDC-UHFFFAOYSA-N 0 3 398.260 3.316 10 0 GGAEHN O=C(NC[C@H]1CCCCN1CCO)Nc1cc(C(F)(F)F)ccc1Cl ZINC000454137454 567147832 /nfs/dbraw/zinc/14/78/32/567147832.db2.gz OXMZAGGIDBTWAS-GFCCVEGCSA-N 0 3 379.810 3.327 10 0 GGAEHN Cn1ncc(Br)c1CNC[C@@H]1CCN(c2ccc(Cl)cc2)C1 ZINC000683766185 567153487 /nfs/dbraw/zinc/15/34/87/567153487.db2.gz CEROHZAGBIUNLF-LBPRGKRZSA-N 0 3 383.721 3.452 10 0 GGAEHN C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)N1CCC[C@](O)(CN(C)C)C1 ZINC000683912952 567160354 /nfs/dbraw/zinc/16/03/54/567160354.db2.gz OWTHTURQCXPKRQ-SJCJKPOMSA-N 0 3 391.364 3.389 10 0 GGAEHN COC(=O)C[C@](C)(NCCOc1ccccc1Br)c1ccncc1 ZINC000589163929 567160696 /nfs/dbraw/zinc/16/06/96/567160696.db2.gz GCQIYKZUDHFYCM-SFHVURJKSA-N 0 3 393.281 3.291 10 0 GGAEHN Cc1cc(Br)cc2cc(C(=O)N3CCC[C@](O)(CN(C)C)C3)oc21 ZINC000683909147 567160692 /nfs/dbraw/zinc/16/06/92/567160692.db2.gz GVYQCUIOESYWLQ-SFHVURJKSA-N 0 3 395.297 3.032 10 0 GGAEHN CN(Cc1noc(Cc2ccc(Br)cc2)n1)[C@H]1CCN(C2CC2)C1 ZINC000523582694 567164804 /nfs/dbraw/zinc/16/48/04/567164804.db2.gz DFXSEODAHIKJEC-INIZCTEOSA-N 0 3 391.313 3.091 10 0 GGAEHN Cc1c(Br)ccc(NC(=O)Nc2cnn(CCN(C)C)c2)c1F ZINC000683959476 567165753 /nfs/dbraw/zinc/16/57/53/567165753.db2.gz SUFUMWBVTRYDHN-UHFFFAOYSA-N 0 3 384.253 3.299 10 0 GGAEHN C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NCCN1CCCC[C@@H]1C ZINC000498320078 567165933 /nfs/dbraw/zinc/16/59/33/567165933.db2.gz CGJSNWIQUMFWOO-STQMWFEESA-N 0 3 386.323 3.102 10 0 GGAEHN O=C(N[C@@H]1CCc2cc(Br)ccc21)N1CC[C@H](N2CCCC2)C1 ZINC000589215752 567166696 /nfs/dbraw/zinc/16/66/96/567166696.db2.gz HOSKIMHLBNIKQN-DOTOQJQBSA-N 0 3 378.314 3.316 10 0 GGAEHN C[C@@H]1CN(CCCNC(=O)c2c[nH]c3cccc(Br)c23)CCCO1 ZINC000432545645 567168884 /nfs/dbraw/zinc/16/88/84/567168884.db2.gz JRCKNFJIXYEPDJ-CYBMUJFWSA-N 0 3 394.313 3.161 10 0 GGAEHN N[C@@H]1CN(C(=O)Cc2cccc(Br)c2)CC[C@@H]1c1cccc(F)c1 ZINC000658945486 567171394 /nfs/dbraw/zinc/17/13/94/567171394.db2.gz FNXYZTDOCSQQMM-QZTJIDSGSA-N 0 3 391.284 3.474 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1ccc(Cl)cc1Br ZINC000615261603 567173162 /nfs/dbraw/zinc/17/31/62/567173162.db2.gz DMEJMJPHAPLISJ-LSDHHAIUSA-N 0 3 387.705 3.038 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)CCOc1cccc(Cl)c1Cl ZINC000615263791 567173783 /nfs/dbraw/zinc/17/37/83/567173783.db2.gz JKLMXKMDPHSONQ-GJZGRUSLSA-N 0 3 387.307 3.084 10 0 GGAEHN COc1ccc(Br)cc1[C@H]1CCCN1C(=O)NC[C@@H]1CCCN1C ZINC000523876650 567174373 /nfs/dbraw/zinc/17/43/73/567174373.db2.gz NYQPRWSONQPNHI-GOEBONIOSA-N 0 3 396.329 3.398 10 0 GGAEHN Cc1cc(C)c(Br)c(C(=O)N2CCOC[C@H]2[C@H]2CCCN2C)c1 ZINC000615268493 567174689 /nfs/dbraw/zinc/17/46/89/567174689.db2.gz HNWVWHSDYDWWOI-CVEARBPZSA-N 0 3 381.314 3.001 10 0 GGAEHN CSc1cc(Br)ccc1C(=O)N1CCOC[C@@H]1[C@@H]1CCCN1C ZINC000615274786 567175411 /nfs/dbraw/zinc/17/54/11/567175411.db2.gz KEHXJHFNWOCKJG-LSDHHAIUSA-N 0 3 399.354 3.106 10 0 GGAEHN CSc1cc(Br)ccc1C(=O)N1CCOC[C@H]1[C@@H]1CCCN1C ZINC000615274784 567175827 /nfs/dbraw/zinc/17/58/27/567175827.db2.gz KEHXJHFNWOCKJG-GJZGRUSLSA-N 0 3 399.354 3.106 10 0 GGAEHN N[C@@H]1CN(C(=O)Nc2ccc(Br)cc2Br)CC[C@H]1F ZINC000658976556 567176232 /nfs/dbraw/zinc/17/62/32/567176232.db2.gz GHZBIZRRXDRFAG-NXEZZACHSA-N 0 3 395.070 3.115 10 0 GGAEHN N[C@@H]1CN(C(=O)Nc2ccnn2Cc2cccc(Cl)c2Cl)CC[C@H]1F ZINC000659009571 567177362 /nfs/dbraw/zinc/17/73/62/567177362.db2.gz IISATGJCZFRMEP-CHWSQXEVSA-N 0 3 386.258 3.141 10 0 GGAEHN N[C@@H]1CN(C(=O)Nc2ccc(C(F)(F)F)c(Br)c2)CC[C@H]1F ZINC000659010693 567177525 /nfs/dbraw/zinc/17/75/25/567177525.db2.gz WSNLYKDGXXCHNK-GHMZBOCLSA-N 0 3 384.171 3.371 10 0 GGAEHN Cc1nc(CNC(=O)NC[C@H](C)N2CCC[C@H](C)C2)sc1Br ZINC000454492816 567178191 /nfs/dbraw/zinc/17/81/91/567178191.db2.gz ABCIDTBTPRNIRW-QWRGUYRKSA-N 0 3 389.363 3.134 10 0 GGAEHN Cc1nc(CNC(=O)NC[C@@H](C)N2CCC[C@H](C)C2)sc1Br ZINC000454492819 567178432 /nfs/dbraw/zinc/17/84/32/567178432.db2.gz ABCIDTBTPRNIRW-WDEREUQCSA-N 0 3 389.363 3.134 10 0 GGAEHN Cc1nc(CNC(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)sc1Br ZINC000454492806 567178660 /nfs/dbraw/zinc/17/86/60/567178660.db2.gz ABCIDTBTPRNIRW-GHMZBOCLSA-N 0 3 389.363 3.134 10 0 GGAEHN O=C(NCc1ccccc1Br)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659032855 567178903 /nfs/dbraw/zinc/17/89/03/567178903.db2.gz UFXATCZFYRGOOB-KRWDZBQOSA-N 0 3 390.281 3.432 10 0 GGAEHN O=C(NCc1ccc(Br)s1)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659034015 567179078 /nfs/dbraw/zinc/17/90/78/567179078.db2.gz YYKIGHLKXCMCIW-CQSZACIVSA-N 0 3 396.310 3.493 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CCNC[C@](C)(F)C1 ZINC000566679197 567180075 /nfs/dbraw/zinc/18/00/75/567180075.db2.gz PKYJFHSLHDGIED-KRWDZBQOSA-N 0 3 381.293 3.077 10 0 GGAEHN COc1cc(NC(=O)N2CC[C@@H](F)[C@H](N)C2)c(Cl)cc1Br ZINC000659048467 567180635 /nfs/dbraw/zinc/18/06/35/567180635.db2.gz SVKJFARKKGDZHP-NXEZZACHSA-N 0 3 380.645 3.014 10 0 GGAEHN Brc1cnn(Cc2noc(-c3cccc(CN4CCCC4)c3)n2)c1 ZINC000547179483 567189841 /nfs/dbraw/zinc/18/98/41/567189841.db2.gz VFKWECJKMBILND-UHFFFAOYSA-N 0 3 388.269 3.340 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000498646822 567192675 /nfs/dbraw/zinc/19/26/75/567192675.db2.gz OXIMMLGGLCPNOD-HNNXBMFYSA-N 0 3 379.913 3.128 10 0 GGAEHN CC(C)[C@H](O)CN(C)Cc1cccc(Br)c1OC[C@@H]1CCCO1 ZINC000432793845 567192923 /nfs/dbraw/zinc/19/29/23/567192923.db2.gz QUCCRYKIXWNOLI-DOTOQJQBSA-N 0 3 386.330 3.456 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N(Cc1cc(Br)ccc1F)C1CC1 ZINC000589771946 567193827 /nfs/dbraw/zinc/19/38/27/567193827.db2.gz PCZRCFZAVFFJNI-HNNXBMFYSA-N 0 3 384.293 3.356 10 0 GGAEHN O=C(C[C@H]1NCc2ccccc21)N1CCC(n2cc(Br)cn2)CC1 ZINC000659280225 567197479 /nfs/dbraw/zinc/19/74/79/567197479.db2.gz JEPOZEASWGNFES-QGZVFWFLSA-N 0 3 389.297 3.044 10 0 GGAEHN O=C(C[C@@H]1NCc2ccccc21)NCCc1ccc(F)c(Br)c1 ZINC000659281189 567197661 /nfs/dbraw/zinc/19/76/61/567197661.db2.gz QUNOWSOINVEKJI-KRWDZBQOSA-N 0 3 377.257 3.482 10 0 GGAEHN COc1ccc(Br)c(CNC(=O)C[C@H]2NCc3ccccc32)c1 ZINC000659274055 567198554 /nfs/dbraw/zinc/19/85/54/567198554.db2.gz OHDRXWSQWXVZEN-QGZVFWFLSA-N 0 3 375.266 3.309 10 0 GGAEHN Cc1ccc(C(=O)NCCN2CCCCCC2)cc1I ZINC000524418830 567199849 /nfs/dbraw/zinc/19/98/49/567199849.db2.gz HQAQCWGIIMPNMM-UHFFFAOYSA-N 0 3 386.277 3.205 10 0 GGAEHN C[C@@H](CNC(=O)c1sc2c(c1Br)CNC2)N1CCCC[C@H]1C ZINC000659292352 567200242 /nfs/dbraw/zinc/20/02/42/567200242.db2.gz OSDWOQLKBLYYNN-MNOVXSKESA-N 0 3 386.359 3.107 10 0 GGAEHN Ic1cnc(N[C@H](CN2CCCC2)c2ccccc2)nc1 ZINC000547328045 567200258 /nfs/dbraw/zinc/20/02/58/567200258.db2.gz SQZKBRWHTSUXDO-OAHLLOKOSA-N 0 3 394.260 3.330 10 0 GGAEHN CCNC(=O)N1CC[C@H](NCc2ccc(Br)cc2C(F)(F)F)C1 ZINC000474795240 567200546 /nfs/dbraw/zinc/20/05/46/567200546.db2.gz NIDRPAMVNDWODK-LBPRGKRZSA-N 0 3 394.235 3.361 10 0 GGAEHN CC(C)C[C@@H](CNC[C@@H](O)CS(=O)(=O)c1cccs1)c1ccccc1 ZINC000474803485 567200646 /nfs/dbraw/zinc/20/06/46/567200646.db2.gz CHTUQDJJFHPQBH-ZWKOTPCHSA-N 0 3 381.563 3.302 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)c1cc(I)ccc1F ZINC000474809207 567202258 /nfs/dbraw/zinc/20/22/58/567202258.db2.gz HRXOWKNIYJHTCD-LBPRGKRZSA-N 0 3 392.256 3.136 10 0 GGAEHN O=C(Nc1cscc1Br)[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000615735167 567202703 /nfs/dbraw/zinc/20/27/03/567202703.db2.gz XCHPREDHMVOHBJ-MRXNPFEDSA-N 0 3 381.295 3.086 10 0 GGAEHN COC[C@](C)(CCO)NCc1ccc(OC(F)(F)F)c(Br)c1 ZINC000474824417 567202477 /nfs/dbraw/zinc/20/24/77/567202477.db2.gz ZTHRKAONJPOSAV-ZDUSSCGKSA-N 0 3 386.208 3.225 10 0 GGAEHN C[C@H]1CN(C(=O)[C@H]2CCc3cc(Br)ccc32)CCN(C2CC2)C1 ZINC000566918243 567202727 /nfs/dbraw/zinc/20/27/27/567202727.db2.gz UDEIMYWBTSFXRT-ACJLOTCBSA-N 0 3 377.326 3.422 10 0 GGAEHN O=C(C[C@H]1NCc2ccccc21)N[C@@H]1COc2cc(F)c(Br)cc21 ZINC000659314960 567203777 /nfs/dbraw/zinc/20/37/77/567203777.db2.gz MNUWUICBQPWOEU-HZPDHXFCSA-N 0 3 391.240 3.373 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2Cc2ccc(I)cc2Cl)C1 ZINC000590010387 567203963 /nfs/dbraw/zinc/20/39/63/567203963.db2.gz GUASUONZLZUKTK-FZMZJTMJSA-N 0 3 376.669 3.081 10 0 GGAEHN CN1C[C@H]2CCN(Cc3ccc(I)c(Cl)c3)[C@@H]2C1 ZINC000590010645 567204748 /nfs/dbraw/zinc/20/47/48/567204748.db2.gz OCABLSRBEQYBBL-BXUZGUMPSA-N 0 3 376.669 3.081 10 0 GGAEHN CN(C)[C@]1(CNC(=O)[C@@H]2CCc3cc(Br)ccc32)CCSC1 ZINC000566974819 567207909 /nfs/dbraw/zinc/20/79/09/567207909.db2.gz KHZNIWPOYVBIBS-WBVHZDCISA-N 0 3 383.355 3.032 10 0 GGAEHN Cc1nc2ccc(Br)cn2c1C(=O)NCCN1CCCC[C@H]1C ZINC000474904129 567208004 /nfs/dbraw/zinc/20/80/04/567208004.db2.gz DMHXGLXBTIPMNK-GFCCVEGCSA-N 0 3 379.302 3.009 10 0 GGAEHN COCc1csc(NC(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)n1 ZINC000454888864 567208858 /nfs/dbraw/zinc/20/88/58/567208858.db2.gz UIVNCJAUCPISBH-HNNXBMFYSA-N 0 3 380.539 3.436 10 0 GGAEHN O=C(Cc1cc(F)ccc1Br)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659364052 567209303 /nfs/dbraw/zinc/20/93/03/567209303.db2.gz GLGYWMCMBGDIKI-KRWDZBQOSA-N 0 3 393.256 3.430 10 0 GGAEHN O=C(Cc1ccc(Br)cc1F)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659364080 567209357 /nfs/dbraw/zinc/20/93/57/567209357.db2.gz GYCPLIMCTCNBES-KRWDZBQOSA-N 0 3 393.256 3.430 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)CSc1cccc(C(F)(F)F)c1 ZINC000590119390 567209421 /nfs/dbraw/zinc/20/94/21/567209421.db2.gz VGOFDYLJWBJQOB-CQSZACIVSA-N 0 3 376.444 3.025 10 0 GGAEHN O=C(Cc1ccc(Br)cc1F)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659364081 567209643 /nfs/dbraw/zinc/20/96/43/567209643.db2.gz GYCPLIMCTCNBES-QGZVFWFLSA-N 0 3 393.256 3.430 10 0 GGAEHN CN(C)[C@H](CNc1cc(Br)cnc1C(N)=O)c1ccc(Cl)cc1 ZINC000547443964 567209603 /nfs/dbraw/zinc/20/96/03/567209603.db2.gz QMKCLVKTKOVJNK-CQSZACIVSA-N 0 3 397.704 3.311 10 0 GGAEHN COc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)sc1Br ZINC000659365776 567209972 /nfs/dbraw/zinc/20/99/72/567209972.db2.gz ICANQSSRBLOMQH-CYBMUJFWSA-N 0 3 397.294 3.432 10 0 GGAEHN O=C(COc1ccccc1Br)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659367054 567210032 /nfs/dbraw/zinc/21/00/32/567210032.db2.gz LKTFLUOZESPZRQ-QGZVFWFLSA-N 0 3 391.265 3.128 10 0 GGAEHN COc1ccc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)cc1Br ZINC000659371087 567210097 /nfs/dbraw/zinc/21/00/97/567210097.db2.gz YSYSIUFJQQFKLH-QGZVFWFLSA-N 0 3 391.265 3.371 10 0 GGAEHN O=C(COc1cccc(Br)c1)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659368073 567210130 /nfs/dbraw/zinc/21/01/30/567210130.db2.gz KTBDXIHTFNMSKW-KRWDZBQOSA-N 0 3 391.265 3.128 10 0 GGAEHN O=C(Cc1ccc(F)c(Br)c1)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659373466 567210537 /nfs/dbraw/zinc/21/05/37/567210537.db2.gz SXQIPUNICXNQAB-QGZVFWFLSA-N 0 3 393.256 3.430 10 0 GGAEHN N[C@@H]1CN(C(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)CC[C@H]1F ZINC000659390090 567210892 /nfs/dbraw/zinc/21/08/92/567210892.db2.gz SMLNNDBXWCNGLP-ZIAGYGMSSA-N 0 3 386.254 3.479 10 0 GGAEHN C[C@H]1CN(C)CC[C@H]1N(C)C(=O)N[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]12 ZINC000637651170 567211171 /nfs/dbraw/zinc/21/11/71/567211171.db2.gz UHYLHEDPINDIAV-RNEPWOLLSA-N 0 3 392.341 3.069 10 0 GGAEHN NC(=O)CC1(NCc2ccc(OC(F)(F)F)c(Br)c2)CCC1 ZINC000474942652 567212674 /nfs/dbraw/zinc/21/26/74/567212674.db2.gz ODFMYQIDUJQIDM-UHFFFAOYSA-N 0 3 381.192 3.235 10 0 GGAEHN N[C@@H]1CN(C(=O)Cc2csc(-c3cccc(Br)c3)n2)CC[C@H]1F ZINC000659391338 567212934 /nfs/dbraw/zinc/21/29/34/567212934.db2.gz SZHNDCXJKSCJHZ-ZIAGYGMSSA-N 0 3 398.301 3.013 10 0 GGAEHN COCCN(CCN(C)C)C(=O)c1ccccc1SCc1cscn1 ZINC000567069516 567215329 /nfs/dbraw/zinc/21/53/29/567215329.db2.gz JQXHHFXGXDTWTH-UHFFFAOYSA-N 0 3 379.551 3.086 10 0 GGAEHN COc1cc(C)c(S(=O)(=O)N2CCCC[C@H](N3CCCC3)C2)cc1Cl ZINC000433012981 567215480 /nfs/dbraw/zinc/21/54/80/567215480.db2.gz MYQRFRDOEAMKSH-HNNXBMFYSA-N 0 3 386.945 3.296 10 0 GGAEHN CC[C@H](NCCc1nnnn1C)c1ccc(Br)cc1C(F)(F)F ZINC000684552904 567215841 /nfs/dbraw/zinc/21/58/41/567215841.db2.gz QGMAMRWYZAUZBC-LBPRGKRZSA-N 0 3 392.223 3.275 10 0 GGAEHN OCCN1CCCN(c2cc(C3CC3)nc3c(Br)cccc23)CC1 ZINC000433019543 567217476 /nfs/dbraw/zinc/21/74/76/567217476.db2.gz OASHQVJTZFEWQS-UHFFFAOYSA-N 0 3 390.325 3.379 10 0 GGAEHN CC1(C)Cc2c(cccc2Br)[C@@H]1NC(=O)N1CC[C@@H](F)[C@H](N)C1 ZINC000659494973 567218165 /nfs/dbraw/zinc/21/81/65/567218165.db2.gz HQFSTGVOAIMDSR-KFWWJZLASA-N 0 3 384.293 3.153 10 0 GGAEHN Cc1cc(Br)c(CNC(=O)NCc2ccc3c(c2)CNC3)s1 ZINC000659533177 567218500 /nfs/dbraw/zinc/21/85/00/567218500.db2.gz DEKPJTFFFIOMNW-UHFFFAOYSA-N 0 3 380.311 3.422 10 0 GGAEHN Cc1cc(Br)c(CNC(=O)NCCCNCc2cccnc2)s1 ZINC000659513586 567218654 /nfs/dbraw/zinc/21/86/54/567218654.db2.gz JIFFZQJUGKJPTL-UHFFFAOYSA-N 0 3 397.342 3.193 10 0 GGAEHN CSC1(CNC(=O)N2CCc3c(Cl)cc(F)cc3C2)CCN(C)CC1 ZINC000454980006 567218780 /nfs/dbraw/zinc/21/87/80/567218780.db2.gz VKEONJQXDQGGBP-UHFFFAOYSA-N 0 3 385.936 3.374 10 0 GGAEHN N[C@@H](CNC(=O)N1CCOc2cc(Br)ccc2C1)c1ccccc1 ZINC000659520095 567218963 /nfs/dbraw/zinc/21/89/63/567218963.db2.gz PBLNNVWXHXAUQA-INIZCTEOSA-N 0 3 390.281 3.053 10 0 GGAEHN Cc1cc(C)c(NC(=O)NC[C@@H]2CCCCN2CCO)c(Br)c1 ZINC000454990402 567220141 /nfs/dbraw/zinc/22/01/41/567220141.db2.gz KSQJHYOFTANIOF-AWEZNQCLSA-N 0 3 384.318 3.034 10 0 GGAEHN CC(C)C[C@@H](CN1CCCC1)NC(=O)N[C@H](C)c1ncc(Br)cn1 ZINC000454996329 567220164 /nfs/dbraw/zinc/22/01/64/567220164.db2.gz JUAPTAIJKGJYKS-HIFRSBDPSA-N 0 3 398.349 3.110 10 0 GGAEHN CC[C@@H]1CN(C)CCCN1C(=O)c1cc(C)ccc1I ZINC000590345146 567221439 /nfs/dbraw/zinc/22/14/39/567221439.db2.gz UAZDAURNNNQODD-CYBMUJFWSA-N 0 3 386.277 3.156 10 0 GGAEHN CCN(C)CCNC(=O)c1cc(Oc2cccc(Br)c2)ccn1 ZINC000475047278 567222371 /nfs/dbraw/zinc/22/23/71/567222371.db2.gz GOASVROEKNZYBQ-UHFFFAOYSA-N 0 3 378.270 3.318 10 0 GGAEHN NC(=O)CC1(NCc2ccc(Br)c(Br)c2)CCC1 ZINC000475101999 567226491 /nfs/dbraw/zinc/22/64/91/567226491.db2.gz QPWRZPXULVEBNA-UHFFFAOYSA-N 0 3 376.092 3.099 10 0 GGAEHN COc1ccc(Br)c2[nH]c(C(=O)N(C)[C@H]3CCN(C)[C@@H](C)C3)cc21 ZINC000525106715 567229349 /nfs/dbraw/zinc/22/93/49/567229349.db2.gz YJWFMVBQRNQUME-RYUDHWBXSA-N 0 3 394.313 3.494 10 0 GGAEHN C[C@@H]1OCC[C@@]1(O)CNCc1cnc(-c2ccc(Br)cc2)s1 ZINC000433189840 567229346 /nfs/dbraw/zinc/22/93/46/567229346.db2.gz SSLIPPXZHPQDPM-MEDUHNTESA-N 0 3 383.311 3.202 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NCCN(C)Cc1ccccc1 ZINC000525136793 567229391 /nfs/dbraw/zinc/22/93/91/567229391.db2.gz GPGXEUZWOXULAE-UHFFFAOYSA-N 0 3 391.309 3.248 10 0 GGAEHN COc1ccc(CCC(=O)N(C)[C@H]2CCN(C(C)C)C2)c(Br)c1 ZINC000616155406 567230109 /nfs/dbraw/zinc/23/01/09/567230109.db2.gz KATQTQLHGAUPFJ-HNNXBMFYSA-N 0 3 383.330 3.331 10 0 GGAEHN CCC[C@@H](C)[C@H](CO)NCC(=O)Nc1ccc(Br)cc1Cl ZINC000567276895 567233021 /nfs/dbraw/zinc/23/30/21/567233021.db2.gz ZMOQSMKJTNKSPS-YGRLFVJLSA-N 0 3 377.710 3.428 10 0 GGAEHN COc1cc(OC)c(NC(=O)CCN(C)c2ccncc2)cc1Br ZINC000547657594 567236738 /nfs/dbraw/zinc/23/67/38/567236738.db2.gz KYJAMBDISRMWEM-UHFFFAOYSA-N 0 3 394.269 3.326 10 0 GGAEHN CN(C)CCn1cc(NC(=O)N[C@@H]2C[C@H]2c2ccc(Cl)cc2Cl)cn1 ZINC000684776694 567237404 /nfs/dbraw/zinc/23/74/04/567237404.db2.gz QFECFLXASWMSIK-GOEBONIOSA-N 0 3 382.295 3.429 10 0 GGAEHN Cc1nc(CCNC(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)cs1 ZINC000525256620 567238986 /nfs/dbraw/zinc/23/89/86/567238986.db2.gz DCIKPBDKFNWJBI-WMLDXEAASA-N 0 3 378.567 3.438 10 0 GGAEHN CO[C@H](CN1CCN([C@H](C)c2ccc(Br)cc2)CC1)[C@@H]1CCOC1 ZINC000659957888 567241728 /nfs/dbraw/zinc/24/17/28/567241728.db2.gz YPAJBCMFIUYVGA-SZVBFZGTSA-N 0 3 397.357 3.179 10 0 GGAEHN CO[C@H](CN1CCN([C@H](C)c2ccc(Br)cc2)CC1)[C@H]1CCOC1 ZINC000659957886 567241987 /nfs/dbraw/zinc/24/19/87/567241987.db2.gz YPAJBCMFIUYVGA-HHXXYDBFSA-N 0 3 397.357 3.179 10 0 GGAEHN OC[C@@H](CNCc1ccc(-c2cc[nH]n2)o1)Cc1ccc(Br)cc1 ZINC000433328639 567242457 /nfs/dbraw/zinc/24/24/57/567242457.db2.gz ATJLIYZDXSQWTO-CQSZACIVSA-N 0 3 390.281 3.373 10 0 GGAEHN Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)NCCN1[C@@H](C)CCC[C@@H]1C ZINC000567404698 567243017 /nfs/dbraw/zinc/24/30/17/567243017.db2.gz JFOYBILQJZWHPE-QWRGUYRKSA-N 0 3 380.842 3.243 10 0 GGAEHN CS[C@H]1CN(C(=O)Cc2cscc2Br)C[C@@H]1N1CCCC1 ZINC000499400976 567243561 /nfs/dbraw/zinc/24/35/61/567243561.db2.gz SRAQYJPPBCDSBB-KBPBESRZSA-N 0 3 389.384 3.091 10 0 GGAEHN COC(=O)CC1(NCC(=O)N(C)Cc2ccc(Cl)c(Cl)c2)CCCC1 ZINC000547771207 567244893 /nfs/dbraw/zinc/24/48/93/567244893.db2.gz VFIYSIXZUSGGGY-UHFFFAOYSA-N 0 3 387.307 3.417 10 0 GGAEHN Cc1nc2ccccn2c(=O)c1CCN1CCc2cccc(Br)c2C1 ZINC000567431102 567244831 /nfs/dbraw/zinc/24/48/31/567244831.db2.gz ZOJMSTLKJZZEDV-UHFFFAOYSA-N 0 3 398.304 3.366 10 0 GGAEHN COC(=O)c1cc(NC(=O)NCCN2CCCC[C@@H]2C)ccc1Br ZINC000547754336 567244919 /nfs/dbraw/zinc/24/49/19/567244919.db2.gz UBRMBXXETNBZBG-LBPRGKRZSA-N 0 3 398.301 3.232 10 0 GGAEHN CN1CCC[C@H](CNC(=O)N[C@@H](CO)c2ccsc2)[C@H]1c1cccs1 ZINC000547775058 567245210 /nfs/dbraw/zinc/24/52/10/567245210.db2.gz MRNFCHULVYJUCZ-KMFMINBZSA-N 0 3 379.551 3.225 10 0 GGAEHN CN1CCC[C@H](CNC(=O)N[C@@H](CO)c2ccsc2)[C@@H]1c1cccs1 ZINC000547775059 567245909 /nfs/dbraw/zinc/24/59/09/567245909.db2.gz MRNFCHULVYJUCZ-UKPHBRMFSA-N 0 3 379.551 3.225 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)NCC1(S(C)(=O)=O)CCC1 ZINC000475422785 567246809 /nfs/dbraw/zinc/24/68/09/567246809.db2.gz LREXRIHSRHPAON-LLVKDONJSA-N 0 3 378.307 3.076 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)c1c(Cl)cccc1Br)CCO2 ZINC000616492922 567248626 /nfs/dbraw/zinc/24/86/26/567248626.db2.gz AYQRRZGESRYWTB-UHFFFAOYSA-N 0 3 387.705 3.039 10 0 GGAEHN Cc1cc(Br)cc(C(=O)N2CCOC3(CCN(C)CC3)C2)c1C ZINC000616494009 567249289 /nfs/dbraw/zinc/24/92/89/567249289.db2.gz XNHVNGLPNJOZFL-UHFFFAOYSA-N 0 3 381.314 3.003 10 0 GGAEHN CN(CCCNS(=O)(=O)c1ccc2ncsc2c1)Cc1ccccc1 ZINC000475548417 567256291 /nfs/dbraw/zinc/25/62/91/567256291.db2.gz QMCGLNMUDHYFLO-UHFFFAOYSA-N 0 3 375.519 3.097 10 0 GGAEHN CCN(CC)CCN(C(=O)CC[C@@H]1CCCO1)c1ccc(Br)cn1 ZINC000567593028 567259179 /nfs/dbraw/zinc/25/91/79/567259179.db2.gz OPFQDWZTLOCNLO-INIZCTEOSA-N 0 3 398.345 3.478 10 0 GGAEHN CCOc1ccc(CN[C@H](C)Cn2cc(Br)ccc2=O)cc1OC ZINC000567598717 567259196 /nfs/dbraw/zinc/25/91/96/567259196.db2.gz JAXRGDWPLVYBRD-CYBMUJFWSA-N 0 3 395.297 3.196 10 0 GGAEHN CCN(CC)CCN(C(=O)CC[C@H]1CCCO1)c1ccc(Br)cn1 ZINC000567593029 567260173 /nfs/dbraw/zinc/26/01/73/567260173.db2.gz OPFQDWZTLOCNLO-MRXNPFEDSA-N 0 3 398.345 3.478 10 0 GGAEHN CC(C)N1CC[C@H](N[C@@H]2CCN(C)[C@H](c3ccc(Br)cc3)C2)C1=O ZINC000638639590 567262308 /nfs/dbraw/zinc/26/23/08/567262308.db2.gz TVZUCEXFCYQFDX-SQNIBIBYSA-N 0 3 394.357 3.183 10 0 GGAEHN COc1cnccc1N1CCN(Cc2c(F)cccc2Br)CC1 ZINC000475618593 567262707 /nfs/dbraw/zinc/26/27/07/567262707.db2.gz CDASSLMUAZTKLM-UHFFFAOYSA-N 0 3 380.261 3.314 10 0 GGAEHN COc1cnccc1N1CCN(Cc2ccc(F)cc2Br)CC1 ZINC000475624275 567262825 /nfs/dbraw/zinc/26/28/25/567262825.db2.gz JDKGLBYEQNYKJN-UHFFFAOYSA-N 0 3 380.261 3.314 10 0 GGAEHN COc1cnccc1N1CCN(Cc2cc(Br)ccc2F)CC1 ZINC000475619943 567263126 /nfs/dbraw/zinc/26/31/26/567263126.db2.gz RGPIBPOBWXSXTE-UHFFFAOYSA-N 0 3 380.261 3.314 10 0 GGAEHN COc1cnccc1N1CCN(Cc2ccc(F)c(Br)c2)CC1 ZINC000475630149 567263799 /nfs/dbraw/zinc/26/37/99/567263799.db2.gz ZUHSLEMGNCONJD-UHFFFAOYSA-N 0 3 380.261 3.314 10 0 GGAEHN COc1cc(CN(C)[C@@H]2CCCN(Cc3cc(OC)ns3)CC2)sn1 ZINC000660126320 567264705 /nfs/dbraw/zinc/26/47/05/567264705.db2.gz WEACJYPNZOHGKS-CYBMUJFWSA-N 0 3 382.555 3.103 10 0 GGAEHN CC[C@@H](NCCn1nc2ccccn2c1=O)c1cc(F)cc(Br)c1 ZINC000547948020 567267985 /nfs/dbraw/zinc/26/79/85/567267985.db2.gz CYTZTHFXQNRZPA-OAHLLOKOSA-N 0 3 393.260 3.139 10 0 GGAEHN Cc1nccc(NC(=O)NC[C@H](C)N(C)Cc2ccccc2)c1Br ZINC000525848555 567269541 /nfs/dbraw/zinc/26/95/41/567269541.db2.gz LKDBHRROKWRNAH-ZDUSSCGKSA-N 0 3 391.313 3.216 10 0 GGAEHN Cc1nccc(NC(=O)N(CCN(C)C)Cc2ccccc2)c1Br ZINC000525845903 567269595 /nfs/dbraw/zinc/26/95/95/567269595.db2.gz ZFXYBPOSMVLJJC-UHFFFAOYSA-N 0 3 391.313 3.170 10 0 GGAEHN O=C(NC[C@H]1CCCCN1CCO)Nc1cccc(Br)c1Cl ZINC000455404719 567271240 /nfs/dbraw/zinc/27/12/40/567271240.db2.gz ZCEQSWRTOUVVAD-LLVKDONJSA-N 0 3 390.709 3.071 10 0 GGAEHN CO[C@@H](CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1)[C@H]1CCOC1 ZINC000660158407 567272067 /nfs/dbraw/zinc/27/20/67/567272067.db2.gz WVONIENQKXPCBD-LPHOPBHVSA-N 0 3 387.351 3.205 10 0 GGAEHN O=C(Nc1cc(Cl)ccc1C(F)(F)F)N[C@@H]1CCCN(CCCO)C1 ZINC000455412834 567272420 /nfs/dbraw/zinc/27/24/20/567272420.db2.gz RKKYGYOVULDKJR-GFCCVEGCSA-N 0 3 379.810 3.327 10 0 GGAEHN O=S1(=O)CCC(CN(Cc2cccc(Br)c2)CC2CC2)CC1 ZINC000475749649 567272705 /nfs/dbraw/zinc/27/27/05/567272705.db2.gz RGEZUOUPRPCKFF-UHFFFAOYSA-N 0 3 386.355 3.486 10 0 GGAEHN C[C@@H](CNC(=O)N1CCc2nc(-c3ccccc3Cl)sc2C1)N(C)C ZINC000455425895 567273800 /nfs/dbraw/zinc/27/38/00/567273800.db2.gz DVRNZRPRUNEEJP-LBPRGKRZSA-N 0 3 378.929 3.481 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)c1cc(=O)[nH]c2c(Br)cccc12 ZINC000617011536 567274823 /nfs/dbraw/zinc/27/48/23/567274823.db2.gz HCYGRCOYJMTJFO-NSHDSACASA-N 0 3 392.297 3.306 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)Cc1c[nH]c2cccc(Br)c12 ZINC000617011218 567275049 /nfs/dbraw/zinc/27/50/49/567275049.db2.gz ALAIYILHJQGORL-ZDUSSCGKSA-N 0 3 378.314 3.462 10 0 GGAEHN COc1cc(C(=O)NC[C@@H]2CCN2C(C)(C)C)cc(OC)c1Br ZINC000617020772 567275230 /nfs/dbraw/zinc/27/52/30/567275230.db2.gz JLLGIAPYIAAXRH-LBPRGKRZSA-N 0 3 385.302 3.069 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)c1cc(=O)[nH]c2c(Br)cccc12 ZINC000617011535 567275321 /nfs/dbraw/zinc/27/53/21/567275321.db2.gz HCYGRCOYJMTJFO-LLVKDONJSA-N 0 3 392.297 3.306 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)Cc1c(F)ccc(Br)c1F ZINC000617006701 567275475 /nfs/dbraw/zinc/27/54/75/567275475.db2.gz DKKSOAIWTNYWPP-SNVBAGLBSA-N 0 3 375.257 3.259 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)c1ccn(-c2ccc(Br)cc2)n1 ZINC000617007586 567275720 /nfs/dbraw/zinc/27/57/20/567275720.db2.gz WBDLUFVDLVSWMX-OAHLLOKOSA-N 0 3 391.313 3.237 10 0 GGAEHN COc1cc(C(=O)NC[C@@H]2CCN2C(C)(C)C)cc(Br)c1OC ZINC000617007302 567275878 /nfs/dbraw/zinc/27/58/78/567275878.db2.gz QDIIOJRXJKEVHW-LBPRGKRZSA-N 0 3 385.302 3.069 10 0 GGAEHN C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NC[C@H]1CCN1C(C)(C)C ZINC000617017267 567275947 /nfs/dbraw/zinc/27/59/47/567275947.db2.gz VUPVJUXHSPSNPF-VXGBXAGGSA-N 0 3 386.323 3.101 10 0 GGAEHN COc1ccc(Br)cc1C1(C(=O)NC[C@@H]2CCN2C(C)(C)C)CC1 ZINC000617005300 567276112 /nfs/dbraw/zinc/27/61/12/567276112.db2.gz FNUCUUQALMAKFG-AWEZNQCLSA-N 0 3 395.341 3.478 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)Cc1c[nH]c2cc(Br)ccc12 ZINC000617012313 567276273 /nfs/dbraw/zinc/27/62/73/567276273.db2.gz YPVGQESMLFQTGS-CQSZACIVSA-N 0 3 378.314 3.462 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)c1cnn(-c2cccc(Br)c2)c1 ZINC000617012698 567276355 /nfs/dbraw/zinc/27/63/55/567276355.db2.gz GHHLXWOELWAETH-INIZCTEOSA-N 0 3 391.313 3.237 10 0 GGAEHN C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000617017266 567276602 /nfs/dbraw/zinc/27/66/02/567276602.db2.gz VUPVJUXHSPSNPF-RYUDHWBXSA-N 0 3 386.323 3.101 10 0 GGAEHN CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)NC[C@H]1CCN1C(C)(C)C ZINC000617006578 567276625 /nfs/dbraw/zinc/27/66/25/567276625.db2.gz AUVLLXDYQRTVKJ-IUODEOHRSA-N 0 3 385.961 3.145 10 0 GGAEHN COc1cc(C(=O)NC[C@H]2CCN2C(C)(C)C)cc(OC)c1Br ZINC000617020771 567276778 /nfs/dbraw/zinc/27/67/78/567276778.db2.gz JLLGIAPYIAAXRH-GFCCVEGCSA-N 0 3 385.302 3.069 10 0 GGAEHN Brc1cnc2c(CN[C@H](c3ccccc3)[C@H]3CCOC3)cnn2c1 ZINC000638856035 567276819 /nfs/dbraw/zinc/27/68/19/567276819.db2.gz SLNXRJMUPSTRTL-WMLDXEAASA-N 0 3 387.281 3.359 10 0 GGAEHN CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)Cc1ccc(Br)cc1[O-] ZINC000548074598 567279042 /nfs/dbraw/zinc/27/90/42/567279042.db2.gz YLPLADYMAVBLEK-MRXNPFEDSA-N 0 3 383.330 3.468 10 0 GGAEHN CCCC[N@H+]1CCCC[C@@H]1CNC(=O)Cc1ccc(Br)cc1[O-] ZINC000548074598 567279046 /nfs/dbraw/zinc/27/90/46/567279046.db2.gz YLPLADYMAVBLEK-MRXNPFEDSA-N 0 3 383.330 3.468 10 0 GGAEHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)Cc1c(F)ccc(Br)c1F ZINC000499880294 567279767 /nfs/dbraw/zinc/27/97/67/567279767.db2.gz OOOJAIZTONVVHA-QMTHXVAHSA-N 0 3 375.257 3.068 10 0 GGAEHN COc1cc(C)c(S(=O)(=O)N2CC[C@H]3CC[C@@H](C2)N3C(C)C)cc1Cl ZINC000433867390 567280196 /nfs/dbraw/zinc/28/01/96/567280196.db2.gz ZYZMPXMUTSEKRL-CABCVRRESA-N 0 3 386.945 3.293 10 0 GGAEHN CCCN1CCC[C@@H]1C(=O)N1CCO[C@H](c2ccc(F)c(Br)c2)C1 ZINC000475832293 567280477 /nfs/dbraw/zinc/28/04/77/567280477.db2.gz AIKCTSCRBXMIHB-SJORKVTESA-N 0 3 399.304 3.363 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)Cc2c(F)ccc(Br)c2F)CCN1C ZINC000499888466 567281593 /nfs/dbraw/zinc/28/15/93/567281593.db2.gz RSGCVJXMPFMQQW-WDEREUQCSA-N 0 3 375.257 3.211 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)Cc2c(F)ccc(Br)c2F)CCN1C ZINC000499888463 567281805 /nfs/dbraw/zinc/28/18/05/567281805.db2.gz RSGCVJXMPFMQQW-GHMZBOCLSA-N 0 3 375.257 3.211 10 0 GGAEHN CN1CC[C@H](NC(=O)Nc2cc(Br)ccn2)[C@H]1c1ccccc1 ZINC000499891802 567281833 /nfs/dbraw/zinc/28/18/33/567281833.db2.gz CVVOWIFIAAVVSC-GOEBONIOSA-N 0 3 375.270 3.411 10 0 GGAEHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)CCOc1cccc(Cl)c1Cl ZINC000499897745 567282459 /nfs/dbraw/zinc/28/24/59/567282459.db2.gz RNKYDVWHDOMDNO-AWEZNQCLSA-N 0 3 389.323 3.332 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)NC[C@@H]1CCCCN1C1CC1 ZINC000433904972 567282902 /nfs/dbraw/zinc/28/29/02/567282902.db2.gz AWTSULNZRWDFOB-INIZCTEOSA-N 0 3 396.329 3.274 10 0 GGAEHN CN(C)[C@H](CNC(=O)c1cc(Br)cc2[nH]cnc21)c1ccccc1 ZINC000499911007 567283756 /nfs/dbraw/zinc/28/37/56/567283756.db2.gz NIMHQHHSJRMCOR-MRXNPFEDSA-N 0 3 387.281 3.358 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NC[C@H]1CSc2ccccc2O1 ZINC000567857914 567284192 /nfs/dbraw/zinc/28/41/92/567284192.db2.gz PQWVOPUHQOBXQY-OCCSQVGLSA-N 0 3 395.322 3.142 10 0 GGAEHN COc1c(Br)cc(Cl)cc1NC(=O)N[C@H]1CCCN(C)C1 ZINC000591528311 567284857 /nfs/dbraw/zinc/28/48/57/567284857.db2.gz XYYSUXCSORWWJN-JTQLQIEISA-N 0 3 376.682 3.327 10 0 GGAEHN CC[C@H](NC[C@@H](O)COc1c(Cl)cccc1Cl)[C@H](O)C(F)(F)F ZINC000567872484 567286386 /nfs/dbraw/zinc/28/63/86/567286386.db2.gz ADSOYSVNYPGEPA-WLTAIBSBSA-N 0 3 376.202 3.025 10 0 GGAEHN NC(=O)Cc1ccc(CN[C@H]2CCCOc3ccc(Br)cc32)cc1 ZINC000685656621 567289984 /nfs/dbraw/zinc/28/99/84/567289984.db2.gz XEFUPAHRXIBNAS-KRWDZBQOSA-N 0 3 389.293 3.480 10 0 GGAEHN CC(C)[C@H](N[C@H](C)C(=O)NC(=O)NCC(F)(F)F)c1ccc(Cl)cc1 ZINC000567933048 567291733 /nfs/dbraw/zinc/29/17/33/567291733.db2.gz GFFZKTAOIJPAER-MFKMUULPSA-N 0 3 379.810 3.403 10 0 GGAEHN CN(C)S(=O)(=O)CCN[C@@H]1CCC(C)(C)c2ccc(Br)cc21 ZINC000685666117 567292268 /nfs/dbraw/zinc/29/22/68/567292268.db2.gz SPPFRLTZDREDLE-OAHLLOKOSA-N 0 3 389.359 3.043 10 0 GGAEHN Cc1nccc(NC(=O)N2CCCN(C3CCCC3)CC2)c1Br ZINC000526097307 567292770 /nfs/dbraw/zinc/29/27/70/567292770.db2.gz GWVHVXSLUCVDTM-UHFFFAOYSA-N 0 3 381.318 3.057 10 0 GGAEHN CC(C)C[C@@](C)(NCCN1C(=O)CN(C)C1=O)c1cccc(Br)c1 ZINC000660452190 567296261 /nfs/dbraw/zinc/29/62/61/567296261.db2.gz CNGJJBZXJKEBOI-GOSISDBHSA-N 0 3 396.329 3.194 10 0 GGAEHN COC(=O)CC1(NCc2ccc(I)c(Cl)c2)CC1 ZINC000567995551 567296410 /nfs/dbraw/zinc/29/64/10/567296410.db2.gz NQPDSWHJDCDONN-UHFFFAOYSA-N 0 3 379.625 3.130 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)Cc1ccc(Br)cc1 ZINC000617288670 567296653 /nfs/dbraw/zinc/29/66/53/567296653.db2.gz QGYODHKKAIRXIZ-SFHVURJKSA-N 0 3 375.310 3.281 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1cc(F)cc(Br)c1 ZINC000617291083 567297575 /nfs/dbraw/zinc/29/75/75/567297575.db2.gz SFRWBQCABVGFHY-QGZVFWFLSA-N 0 3 379.273 3.491 10 0 GGAEHN CC(=O)c1nc(CCN[C@H]2CCOc3c(Br)cccc32)[nH]c1C ZINC000660479158 567299351 /nfs/dbraw/zinc/29/93/51/567299351.db2.gz FRPJVRZRMIZYNT-AWEZNQCLSA-N 0 3 378.270 3.339 10 0 GGAEHN CC(=O)c1[nH]c(CCN[C@H]2CCOc3c(Br)cccc32)nc1C ZINC000660479158 567299360 /nfs/dbraw/zinc/29/93/60/567299360.db2.gz FRPJVRZRMIZYNT-AWEZNQCLSA-N 0 3 378.270 3.339 10 0 GGAEHN CC(C)(C)N1CC[C@@H](NC(=O)[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000617341776 567299776 /nfs/dbraw/zinc/29/97/76/567299776.db2.gz YMDWKPXZUWHZAZ-ZIAGYGMSSA-N 0 3 381.314 3.304 10 0 GGAEHN CN(C(=O)NCCc1ccc(F)c(Br)c1)[C@@H]1CCN(C2CC2)C1 ZINC000476145142 567300064 /nfs/dbraw/zinc/30/00/64/567300064.db2.gz IFVCMDHUOSWHSA-CQSZACIVSA-N 0 3 384.293 3.009 10 0 GGAEHN COc1ncc(Br)cc1CN[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000660490719 567301182 /nfs/dbraw/zinc/30/11/82/567301182.db2.gz YHAWKUJZRXNIOD-DLBZAZTESA-N 0 3 376.298 3.388 10 0 GGAEHN COC(=O)CC1(NCc2cnc3c(C)cc(Br)cn23)CCCC1 ZINC000526989667 567303168 /nfs/dbraw/zinc/30/31/68/567303168.db2.gz HQVIBLSLCQAKSJ-UHFFFAOYSA-N 0 3 380.286 3.371 10 0 GGAEHN CCO[C@@H]1C[C@@H](NC(=O)NC[C@H](c2cccs2)N2CCCC2)[C@@H]1SC ZINC000591894873 567303410 /nfs/dbraw/zinc/30/34/10/567303410.db2.gz LJYNVFYPOYHITI-ANQUJSFKSA-N 0 3 383.583 3.093 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000476184711 567303485 /nfs/dbraw/zinc/30/34/85/567303485.db2.gz VGWGOXLPFJBGNM-GUYCJALGSA-N 0 3 380.330 3.258 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000476184710 567303830 /nfs/dbraw/zinc/30/38/30/567303830.db2.gz VGWGOXLPFJBGNM-DYVFJYSZSA-N 0 3 380.330 3.258 10 0 GGAEHN CS[C@@H]1CN(c2nc(-c3cc(F)cc(F)c3)ns2)C[C@H]1N1CCCC1 ZINC000591931949 567305286 /nfs/dbraw/zinc/30/52/86/567305286.db2.gz ICKRXMOOSKVVPN-HUUCEWRRSA-N 0 3 382.505 3.499 10 0 GGAEHN Brc1cnc2c(CNCC3([C@@H]4CCCCO4)CCC3)cnn2c1 ZINC000639387589 567305446 /nfs/dbraw/zinc/30/54/46/567305446.db2.gz SVRYXBGQUHFLHE-HNNXBMFYSA-N 0 3 379.302 3.321 10 0 GGAEHN CC(=O)N1C[C@@H]2CCC[C@@H](NCc3ncc(Br)cc3Cl)[C@@H]2C1 ZINC000660560968 567308474 /nfs/dbraw/zinc/30/84/74/567308474.db2.gz PMTZZWHGVGKQFP-NJZAAPMLSA-N 0 3 386.721 3.234 10 0 GGAEHN O=C(CSCc1ccc(Cl)cc1Cl)NC[C@H](O)CN1CCCCC1 ZINC000434421874 567308831 /nfs/dbraw/zinc/30/88/31/567308831.db2.gz NTSDGPDKZWUGGC-HNNXBMFYSA-N 0 3 391.364 3.190 10 0 GGAEHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)NCCc1ccccc1Br ZINC000434461924 567309475 /nfs/dbraw/zinc/30/94/75/567309475.db2.gz YKCVWMYOVFOCOZ-CVEARBPZSA-N 0 3 380.330 3.260 10 0 GGAEHN O=C(NCC1(N2CCSCC2)CCCC1)N1CC[C@H](CC(F)(F)F)C1 ZINC000434481391 567310141 /nfs/dbraw/zinc/31/01/41/567310141.db2.gz POTPPOHMJWEYFS-CQSZACIVSA-N 0 3 379.492 3.332 10 0 GGAEHN CSc1nnc(CNC(=O)NC[C@H]2CCCN(C)[C@@H]2c2cccs2)s1 ZINC000527081519 567310458 /nfs/dbraw/zinc/31/04/58/567310458.db2.gz ZPPSFQATPZPONJ-RISCZKNCSA-N 0 3 397.595 3.204 10 0 GGAEHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)c1cc(F)c(Br)cc1Cl ZINC000476303082 567313038 /nfs/dbraw/zinc/31/30/38/567313038.db2.gz DZJVVWJBFWVZEL-RMLUDKJBSA-N 0 3 375.669 3.454 10 0 GGAEHN O[C@@H](COc1ccc(Br)cc1)CN1CCC[C@@H](c2ccccn2)C1 ZINC000660628391 567313252 /nfs/dbraw/zinc/31/32/52/567313252.db2.gz LRMGTOKFSIRHGV-NVXWUHKLSA-N 0 3 391.309 3.463 10 0 GGAEHN Cn1cc([C@@H](NCCOc2ccc(Br)cc2)C2(CO)CCC2)cn1 ZINC000660607565 567313710 /nfs/dbraw/zinc/31/37/10/567313710.db2.gz XUVVWJFVFIOOAV-QGZVFWFLSA-N 0 3 394.313 3.055 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000548402484 567314169 /nfs/dbraw/zinc/31/41/69/567314169.db2.gz XCRYGGFTUFESRZ-MRXNPFEDSA-N 0 3 381.314 3.174 10 0 GGAEHN COc1ccc([C@@H](C)NC(=O)N(C)[C@@H]2CCN(C3CC3)C2)cc1Br ZINC000476326343 567314483 /nfs/dbraw/zinc/31/44/83/567314483.db2.gz VFCLQOCHQBMMDO-IUODEOHRSA-N 0 3 396.329 3.397 10 0 GGAEHN O=c1cc(CN2CCC[C@H](c3ccccn3)C2)nc2ccc(Br)cn12 ZINC000660629083 567314831 /nfs/dbraw/zinc/31/48/31/567314831.db2.gz ZUGQTEJASSZWEW-AWEZNQCLSA-N 0 3 399.292 3.232 10 0 GGAEHN COc1ccc([C@@H](C)NC(=O)N(C)[C@H]2CCN(C3CC3)C2)cc1Br ZINC000476326342 567315214 /nfs/dbraw/zinc/31/52/14/567315214.db2.gz VFCLQOCHQBMMDO-DOMZBBRYSA-N 0 3 396.329 3.397 10 0 GGAEHN CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)N(C)Cc2c(F)cccc2Cl)[C@@H]1SC ZINC000592165944 567318248 /nfs/dbraw/zinc/31/82/48/567318248.db2.gz CGQBUYSJUOFNSP-QYHDQYMBSA-N 0 3 388.936 3.325 10 0 GGAEHN CCO[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)[C@@H]1SC ZINC000592168166 567319519 /nfs/dbraw/zinc/31/95/19/567319519.db2.gz GFWHLKMWEGAJOA-UGGSBELWSA-N 0 3 380.337 3.232 10 0 GGAEHN CCN(C(=O)c1cc(Br)ccc1Br)[C@H]1CCN(C)C1 ZINC000617552111 567321137 /nfs/dbraw/zinc/32/11/37/567321137.db2.gz GSXZJUZXMNBQHL-NSHDSACASA-N 0 3 390.119 3.378 10 0 GGAEHN Cc1ccc2c(c1Br)CN(C(=O)N[C@H]1CCN(CC3CC3)C1)C2 ZINC000660703023 567321152 /nfs/dbraw/zinc/32/11/52/567321152.db2.gz NFKGPZAOZLSFCY-HNNXBMFYSA-N 0 3 378.314 3.267 10 0 GGAEHN CCN(C(=O)c1cc(Br)ccc1Br)[C@@H]1CCN(C)C1 ZINC000617552110 567321261 /nfs/dbraw/zinc/32/12/61/567321261.db2.gz GSXZJUZXMNBQHL-LLVKDONJSA-N 0 3 390.119 3.378 10 0 GGAEHN CCN(C(=O)CCSc1ncnc2sc(C)c(C)c21)[C@H]1CCN(C)C1 ZINC000617557644 567321388 /nfs/dbraw/zinc/32/13/88/567321388.db2.gz POPPXBAVAARBLV-AWEZNQCLSA-N 0 3 378.567 3.343 10 0 GGAEHN CCN(C(=O)c1cc(C)n(-c2ccc(Br)cc2)n1)[C@H]1CCN(C)C1 ZINC000617553959 567321679 /nfs/dbraw/zinc/32/16/79/567321679.db2.gz UEVVUXGNTGAXPI-INIZCTEOSA-N 0 3 391.313 3.109 10 0 GGAEHN CCCOc1c(Br)cc(C(=O)N(CC)[C@H]2CCN(C)C2)cc1OC ZINC000617560257 567324155 /nfs/dbraw/zinc/32/41/55/567324155.db2.gz KXANXTDWGJJRGM-AWEZNQCLSA-N 0 3 399.329 3.413 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@@H]1N(C)C ZINC000476456835 567324643 /nfs/dbraw/zinc/32/46/43/567324643.db2.gz JCTBFTPRLKYAEU-STQMWFEESA-N 0 3 395.725 3.359 10 0 GGAEHN CC1(C)NC(=O)CC[C@@H]1NCc1ccc(I)cc1Cl ZINC000548991981 567366717 /nfs/dbraw/zinc/36/67/17/567366717.db2.gz ZORISRSVWSHDFS-LBPRGKRZSA-N 0 3 392.668 3.091 10 0 GGAEHN C[C@@H]1CN(CCCCNC(=O)c2csc(Br)c2)C[C@@H](C)O1 ZINC000434775633 567327268 /nfs/dbraw/zinc/32/72/68/567327268.db2.gz KYKMVDQALAIFCL-VXGBXAGGSA-N 0 3 375.332 3.130 10 0 GGAEHN Fc1ccc(I)c(F)c1CNCC[C@H]1CCCOC1 ZINC000527741209 567371641 /nfs/dbraw/zinc/37/16/41/567371641.db2.gz YSWMRZVDUZXMBN-SNVBAGLBSA-N 0 3 381.204 3.476 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)c1csc(Br)c1 ZINC000617697559 567329368 /nfs/dbraw/zinc/32/93/68/567329368.db2.gz CAFXNZHZXDUWJD-HNNXBMFYSA-N 0 3 395.322 3.007 10 0 GGAEHN C[C@H](C(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1ccc(Cl)s1 ZINC000617700769 567329635 /nfs/dbraw/zinc/32/96/35/567329635.db2.gz LASOWAIBXGEGKN-XJKSGUPXSA-N 0 3 378.925 3.388 10 0 GGAEHN CN1CCC[C@H](NC(=O)N[C@@H]2CSCc3ccc(Br)cc32)C1 ZINC000660837883 567329886 /nfs/dbraw/zinc/32/98/86/567329886.db2.gz QGLUDXTYDRCGRD-DZGCQCFKSA-N 0 3 384.343 3.130 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)c1ccc(Br)s1 ZINC000617697899 567330071 /nfs/dbraw/zinc/33/00/71/567330071.db2.gz JPGRFNLZXHUECJ-AWEZNQCLSA-N 0 3 395.322 3.007 10 0 GGAEHN CCN(CCc1ccc(C(F)(F)F)cc1)Cc1coc(S(N)(=O)=O)c1 ZINC000660862303 567331580 /nfs/dbraw/zinc/33/15/80/567331580.db2.gz ADBAYDJBEYYCAD-UHFFFAOYSA-N 0 3 376.400 3.010 10 0 GGAEHN COc1cc(Br)ccc1CN[C@@H](C1CC1)C1(CO)CCOCC1 ZINC000568493966 567333349 /nfs/dbraw/zinc/33/33/49/567333349.db2.gz GACSMTSXAXIRQG-KRWDZBQOSA-N 0 3 384.314 3.115 10 0 GGAEHN COc1ncncc1CN[C@@H](C)CCc1ccc(I)cc1 ZINC000592367495 567333468 /nfs/dbraw/zinc/33/34/68/567333468.db2.gz YPXBMHSFQADPOP-LBPRGKRZSA-N 0 3 397.260 3.201 10 0 GGAEHN CCO[C@@H]1C[C@@H](N[C@@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)[C@@H]1SC ZINC000592394619 567334789 /nfs/dbraw/zinc/33/47/89/567334789.db2.gz JYMJVMNOMSOUAP-QQXKLLMISA-N 0 3 384.973 3.210 10 0 GGAEHN CCO[C@@H]1C[C@@H](N[C@@H](c2ccc(Cl)cc2)[C@@H]2CN(C)CCO2)[C@@H]1SC ZINC000592394617 567335415 /nfs/dbraw/zinc/33/54/15/567335415.db2.gz JYMJVMNOMSOUAP-GFEQUFNTSA-N 0 3 384.973 3.210 10 0 GGAEHN CCN1CCCN(c2nnc(COc3ccc(Cl)cc3Cl)n2C)CC1 ZINC000568567829 567338723 /nfs/dbraw/zinc/33/87/23/567338723.db2.gz UYPFSXVNKUXOOP-UHFFFAOYSA-N 0 3 384.311 3.233 10 0 GGAEHN Cc1ccc2c(c1Br)CN(C(=O)N[C@@H](C)C1=CCN(C)CC1)C2 ZINC000661009436 567340009 /nfs/dbraw/zinc/34/00/09/567340009.db2.gz JDXNSVIOSPEJHT-ZDUSSCGKSA-N 0 3 378.314 3.433 10 0 GGAEHN CCN(CC)CCN(C(=O)C[C@H]1CCCCO1)c1ccc(Br)cn1 ZINC000568587310 567340758 /nfs/dbraw/zinc/34/07/58/567340758.db2.gz KSLGFAFABNJMRP-MRXNPFEDSA-N 0 3 398.345 3.478 10 0 GGAEHN CN(Cc1ccc2nc(NC(=O)Cn3cc(Cl)cn3)sc2c1)C1CC1 ZINC000617865604 567342746 /nfs/dbraw/zinc/34/27/46/567342746.db2.gz KDEGVQGHASEPPA-UHFFFAOYSA-N 0 3 375.885 3.379 10 0 GGAEHN CCOC(=O)c1sc2ccsc2c1CNC(=O)[C@H]1CNCCC1(F)F ZINC000592532053 567344465 /nfs/dbraw/zinc/34/44/65/567344465.db2.gz MDASDBYRCIHNTI-SNVBAGLBSA-N 0 3 388.461 3.001 10 0 GGAEHN N[C@H](CNC(=O)N1CCc2ccc(F)c(Br)c2C1)c1ccccc1 ZINC000527593003 567344580 /nfs/dbraw/zinc/34/45/80/567344580.db2.gz DDKRVZLMTYDQOK-MRXNPFEDSA-N 0 3 392.272 3.356 10 0 GGAEHN CCN(C(=O)c1cc(OC)c(OC)cc1Br)[C@@H]1CCN(CC)C1 ZINC000617923936 567346020 /nfs/dbraw/zinc/34/60/20/567346020.db2.gz KLMPBIPJSWVCEL-GFCCVEGCSA-N 0 3 385.302 3.023 10 0 GGAEHN CCN(C(=O)c1cnn(-c2cccc(Br)c2)c1)[C@@H]1CCN(CC)C1 ZINC000617930202 567346222 /nfs/dbraw/zinc/34/62/22/567346222.db2.gz YOCNKDLCNROKGQ-QGZVFWFLSA-N 0 3 391.313 3.191 10 0 GGAEHN CN(C[C@@H](O)COc1c(Cl)cccc1Cl)[C@H](CO)Cc1ccccc1 ZINC000661096773 567346331 /nfs/dbraw/zinc/34/63/31/567346331.db2.gz HAUPICGWBGTMNQ-JKSUJKDBSA-N 0 3 384.303 3.269 10 0 GGAEHN CCN(C(=O)CCc1ccc(OC)c(Br)c1)[C@@H]1CCN(CC)C1 ZINC000617930927 567346330 /nfs/dbraw/zinc/34/63/30/567346330.db2.gz LUUQDUJXUSXHCS-OAHLLOKOSA-N 0 3 383.330 3.333 10 0 GGAEHN CCN(C(=O)c1cc(Br)c(OC)c(OC)c1)[C@H]1CCN(CC)C1 ZINC000617923827 567346394 /nfs/dbraw/zinc/34/63/94/567346394.db2.gz JJMFKTYSBZKCQG-ZDUSSCGKSA-N 0 3 385.302 3.023 10 0 GGAEHN CN(C[C@H](O)COc1c(Cl)cccc1Cl)[C@H](CO)Cc1ccccc1 ZINC000661096770 567347159 /nfs/dbraw/zinc/34/71/59/567347159.db2.gz HAUPICGWBGTMNQ-HOTGVXAUSA-N 0 3 384.303 3.269 10 0 GGAEHN CCN(C(=O)c1cc(OC)c(Br)c(OC)c1)[C@@H]1CCN(CC)C1 ZINC000617931866 567347219 /nfs/dbraw/zinc/34/72/19/567347219.db2.gz FRDYSHHECNBQIO-CYBMUJFWSA-N 0 3 385.302 3.023 10 0 GGAEHN CCN(C(=O)[C@@H](C)NC(=O)c1cccc(Cl)c1Cl)[C@@H]1CCN(CC)C1 ZINC000617930679 567347242 /nfs/dbraw/zinc/34/72/42/567347242.db2.gz GEMQGZUQZCWKPK-CHWSQXEVSA-N 0 3 386.323 3.054 10 0 GGAEHN CCN(C(=O)c1cc(OC)c(OC)cc1Br)[C@H]1CCN(CC)C1 ZINC000617923937 567347269 /nfs/dbraw/zinc/34/72/69/567347269.db2.gz KLMPBIPJSWVCEL-LBPRGKRZSA-N 0 3 385.302 3.023 10 0 GGAEHN CCN(C(=O)Cc1c[nH]c2cccc(Br)c12)[C@H]1CCN(CC)C1 ZINC000617927237 567347311 /nfs/dbraw/zinc/34/73/11/567347311.db2.gz SRXBBMOKISCPEX-AWEZNQCLSA-N 0 3 378.314 3.416 10 0 GGAEHN CN(C[C@@H](O)COc1c(Cl)cccc1Cl)[C@@H](CO)Cc1ccccc1 ZINC000661096772 567347356 /nfs/dbraw/zinc/34/73/56/567347356.db2.gz HAUPICGWBGTMNQ-HZPDHXFCSA-N 0 3 384.303 3.269 10 0 GGAEHN CCN(C(=O)c1cc(=O)[nH]c2ccc(Br)cc21)[C@@H]1CCN(CC)C1 ZINC000617927992 567347367 /nfs/dbraw/zinc/34/73/67/567347367.db2.gz HLVNRCZFWXQHEN-CYBMUJFWSA-N 0 3 392.297 3.259 10 0 GGAEHN CCN(C(=O)c1[nH]nc(-c2ccccc2)c1Br)[C@@H]1CCN(CC)C1 ZINC000617929728 567347380 /nfs/dbraw/zinc/34/73/80/567347380.db2.gz PFPLLESILSRQDT-CQSZACIVSA-N 0 3 391.313 3.396 10 0 GGAEHN CN(C(=O)NCCc1cc(Br)ccc1F)[C@H]1CCN(C2CC2)C1 ZINC000476787388 567349473 /nfs/dbraw/zinc/34/94/73/567349473.db2.gz FQVKCPFSWVXHAY-HNNXBMFYSA-N 0 3 384.293 3.009 10 0 GGAEHN NC[C@H](C(=O)N1CCc2ccc(F)c(Br)c2C1)c1ccc(F)cc1 ZINC000527617860 567350231 /nfs/dbraw/zinc/35/02/31/567350231.db2.gz SCGGWEPIBCZRJL-AWEZNQCLSA-N 0 3 395.247 3.355 10 0 GGAEHN CCO[C@@H]1C[C@@](N)(C(=O)N2CCc3ccc(F)c(Br)c3C2)C1(C)C ZINC000527617852 567350385 /nfs/dbraw/zinc/35/03/85/567350385.db2.gz RTISXANZGHQWDT-RDTXWAMCSA-N 0 3 399.304 3.005 10 0 GGAEHN CCO[C@H]1C[C@@](N)(C(=O)N2CCc3ccc(F)c(Br)c3C2)C1(C)C ZINC000527617847 567350727 /nfs/dbraw/zinc/35/07/27/567350727.db2.gz RTISXANZGHQWDT-KBXCAEBGSA-N 0 3 399.304 3.005 10 0 GGAEHN CN(CCC(=O)N1CCc2ccc(F)c(Br)c2C1)c1ccncc1 ZINC000527627900 567351899 /nfs/dbraw/zinc/35/18/99/567351899.db2.gz IEENBDHGXFMKTD-UHFFFAOYSA-N 0 3 392.272 3.394 10 0 GGAEHN COC[C@H](NCC(=O)N[C@H](C)c1ccc(Cl)cc1Cl)C1CCOCC1 ZINC000661160081 567353047 /nfs/dbraw/zinc/35/30/47/567353047.db2.gz XLFGUGFRKPXORZ-PXAZEXFGSA-N 0 3 389.323 3.202 10 0 GGAEHN COC[C@@H](NCC(=O)N[C@@H](C)c1ccc(Cl)c(Cl)c1)C1CCOCC1 ZINC000661161084 567353067 /nfs/dbraw/zinc/35/30/67/567353067.db2.gz QTFCPYKNIRSQCS-YVEFUNNKSA-N 0 3 389.323 3.202 10 0 GGAEHN COC[C@H](NCC(=O)N[C@@H](C)c1ccc(Cl)cc1Cl)C1CCOCC1 ZINC000661160084 567353544 /nfs/dbraw/zinc/35/35/44/567353544.db2.gz XLFGUGFRKPXORZ-SJCJKPOMSA-N 0 3 389.323 3.202 10 0 GGAEHN Fc1c(Br)ccc(CN[C@H]2CCCN(c3ncccn3)C2)c1F ZINC000527642134 567354430 /nfs/dbraw/zinc/35/44/30/567354430.db2.gz XPMCCWWOOOWUCF-LBPRGKRZSA-N 0 3 383.240 3.276 10 0 GGAEHN CC(C)C(=O)N1CCC(NCc2ccc(Br)c(F)c2F)CC1 ZINC000527637377 567354713 /nfs/dbraw/zinc/35/47/13/567354713.db2.gz ZNHPGMLISWWLBY-UHFFFAOYSA-N 0 3 375.257 3.464 10 0 GGAEHN CCN1CCN(c2ccc(CNCc3ccsc3Br)cn2)CC1 ZINC000527638494 567355408 /nfs/dbraw/zinc/35/54/08/567355408.db2.gz KDBXOZXOZOOXEB-UHFFFAOYSA-N 0 3 395.370 3.337 10 0 GGAEHN CS(=O)(=O)NC[C@H]1CCC[C@@H]1NCc1csc(-c2ccc(Cl)cc2)n1 ZINC000548847266 567355543 /nfs/dbraw/zinc/35/55/43/567355543.db2.gz ZQRANZBPXBIAGL-CJNGLKHVSA-N 0 3 399.969 3.271 10 0 GGAEHN CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NCc1csc(-c2ccc(Cl)cc2)n1 ZINC000548847265 567355712 /nfs/dbraw/zinc/35/57/12/567355712.db2.gz ZQRANZBPXBIAGL-BBRMVZONSA-N 0 3 399.969 3.271 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)NCc1ccc(Br)c(F)c1F ZINC000527653475 567355900 /nfs/dbraw/zinc/35/59/00/567355900.db2.gz UKKQPQPCGXIZOE-NSHDSACASA-N 0 3 376.245 3.011 10 0 GGAEHN CC(C)Oc1cc(Cl)c(CNCCC(=O)N2CCN(C)CC2)cc1Cl ZINC000527654665 567356531 /nfs/dbraw/zinc/35/65/31/567356531.db2.gz VAGZDXYOJKYWNB-UHFFFAOYSA-N 0 3 388.339 3.034 10 0 GGAEHN CN(CCC(=O)N[C@H]1CCOc2c(Br)cccc21)c1ccncc1 ZINC000548874961 567356779 /nfs/dbraw/zinc/35/67/79/567356779.db2.gz VIFSECLZSXFRBW-INIZCTEOSA-N 0 3 390.281 3.310 10 0 GGAEHN CO[C@@H]1CCC[C@H]([C@H](CO)NCC(=O)Nc2ccc(Cl)cc2Cl)C1 ZINC000661219364 567357827 /nfs/dbraw/zinc/35/78/27/567357827.db2.gz NFJCCSXDZZCTDJ-GHJWDPDVSA-N 0 3 375.296 3.088 10 0 GGAEHN CO[C@@H]1CCC[C@@H]([C@H](CO)NCC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000661215807 567357891 /nfs/dbraw/zinc/35/78/91/567357891.db2.gz HRCLVGMSVQGQHQ-JMSVASOKSA-N 0 3 375.296 3.088 10 0 GGAEHN OC[C@H]1CN(Cc2ccccc2)CC[C@H]1NCc1ccsc1Br ZINC000527663895 567358085 /nfs/dbraw/zinc/35/80/85/567358085.db2.gz GJJCHRSACDWWNO-IAGOWNOFSA-N 0 3 395.366 3.483 10 0 GGAEHN O=C1COc2ccccc2N1CCCNCc1ccsc1Br ZINC000527667579 567358657 /nfs/dbraw/zinc/35/86/57/567358657.db2.gz PEONSGYPVJOJDN-UHFFFAOYSA-N 0 3 381.295 3.416 10 0 GGAEHN O=C(NC[C@@H]1CCCCN1C1CC1)c1cc(Br)cc2[nH]cnc21 ZINC000548884146 567358649 /nfs/dbraw/zinc/35/86/49/567358649.db2.gz UYFZJZYAYUYBCL-ZDUSSCGKSA-N 0 3 377.286 3.072 10 0 GGAEHN O[C@]1(CNCc2ccsc2Br)CCN(Cc2ccccc2)C1 ZINC000527665801 567358787 /nfs/dbraw/zinc/35/87/87/567358787.db2.gz QAHQVFSBAWOTCB-KRWDZBQOSA-N 0 3 381.339 3.237 10 0 GGAEHN COc1ccc([C@H](CNC(=O)[C@H]2C[C@@]2(C)Br)N2CCCC2)cc1 ZINC000527668093 567358818 /nfs/dbraw/zinc/35/88/18/567358818.db2.gz CPTVEGQJGYPZPT-SOLBZPMBSA-N 0 3 381.314 3.122 10 0 GGAEHN CO[C@@H]1CCC[C@@H]([C@H](CO)NCC(=O)Nc2cccc(Cl)c2Cl)C1 ZINC000661221319 567359166 /nfs/dbraw/zinc/35/91/66/567359166.db2.gz RHLBCQVGGPJYNB-JMSVASOKSA-N 0 3 375.296 3.088 10 0 GGAEHN Cc1nn(C)c(CNc2cccc3c2OCC[C@@H]3N(C)C)c1Br ZINC000568835397 567360688 /nfs/dbraw/zinc/36/06/88/567360688.db2.gz GJTSCHJWCLGLAF-AWEZNQCLSA-N 0 3 379.302 3.488 10 0 GGAEHN CC(C)Oc1cc(Cl)c(CNC[C@@H]2CCN(S(C)(=O)=O)C2)cc1Cl ZINC000527685869 567361857 /nfs/dbraw/zinc/36/18/57/567361857.db2.gz WJTKEPCUVVKXAL-LBPRGKRZSA-N 0 3 395.352 3.152 10 0 GGAEHN O[C@H]1CCN(Cc2ccccc2CNCc2ccsc2Br)C1 ZINC000527691168 567361930 /nfs/dbraw/zinc/36/19/30/567361930.db2.gz LMJGMMFCSICWNZ-INIZCTEOSA-N 0 3 381.339 3.367 10 0 GGAEHN CC(C)Oc1cc(Cl)c(CNC[C@H]2CCN(S(C)(=O)=O)C2)cc1Cl ZINC000527685867 567361954 /nfs/dbraw/zinc/36/19/54/567361954.db2.gz WJTKEPCUVVKXAL-GFCCVEGCSA-N 0 3 395.352 3.152 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)NCc1sccc1Br ZINC000549007576 567368154 /nfs/dbraw/zinc/36/81/54/567368154.db2.gz YROGEBZURXRFMG-CQSZACIVSA-N 0 3 396.354 3.483 10 0 GGAEHN Cc1cc(Br)c(CNC[C@]2(C)CCC(=O)N2)cc1Br ZINC000527715957 567368918 /nfs/dbraw/zinc/36/89/18/567368918.db2.gz LOCAAQGHMOOLOU-AWEZNQCLSA-N 0 3 390.119 3.278 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2c(Cl)cc(F)cc2Cl)[C@@H](C)C1 ZINC000435443445 567370279 /nfs/dbraw/zinc/37/02/79/567370279.db2.gz NZDJSEWEVXQRRR-HZMBPMFUSA-N 0 3 383.316 3.483 10 0 GGAEHN COc1ccc(Br)cc1CN(C)C(=O)NC[C@H]1CCN1C(C)(C)C ZINC000661397438 567370380 /nfs/dbraw/zinc/37/03/80/567370380.db2.gz PNWJFKWZJQRMEN-OAHLLOKOSA-N 0 3 398.345 3.472 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)N1CCc2c(ccc(Cl)c2Cl)C1 ZINC000477105224 567371157 /nfs/dbraw/zinc/37/11/57/567371157.db2.gz BAQUTCYVBIMIRO-AWEZNQCLSA-N 0 3 386.323 3.172 10 0 GGAEHN O[C@H](CNCc1cnc(-c2ccc(Br)cc2)s1)[C@H]1CCCO1 ZINC000527757253 567372256 /nfs/dbraw/zinc/37/22/56/567372256.db2.gz IUYMRJKHGJZZOB-HUUCEWRRSA-N 0 3 383.311 3.202 10 0 GGAEHN CS[C@H]1CN(S(=O)(=O)c2cccc3ccccc32)C[C@@H]1N1CCCC1 ZINC000477129646 567373130 /nfs/dbraw/zinc/37/31/30/567373130.db2.gz WXQXZFSHWBRBCN-ROUUACIJSA-N 0 3 376.547 3.040 10 0 GGAEHN CS[C@@H]1CN(S(=O)(=O)c2cccc3ccccc32)C[C@H]1N1CCCC1 ZINC000477129645 567373148 /nfs/dbraw/zinc/37/31/48/567373148.db2.gz WXQXZFSHWBRBCN-QZTJIDSGSA-N 0 3 376.547 3.040 10 0 GGAEHN CS[C@H]1CN(c2ccc(Br)c(C(F)(F)F)n2)C[C@@H]1N(C)C ZINC000569010585 567373509 /nfs/dbraw/zinc/37/35/09/567373509.db2.gz QCFHPFRRBKKHGU-UWVGGRQHSA-N 0 3 384.265 3.345 10 0 GGAEHN COc1ccc(CN2CC[C@@H]2CNCc2cncc(Br)c2)cc1 ZINC000527773151 567373861 /nfs/dbraw/zinc/37/38/61/567373861.db2.gz MVJHOXSCUMUVFY-QGZVFWFLSA-N 0 3 376.298 3.217 10 0 GGAEHN CS[C@@H]1CN(c2ccc(Br)c(C(F)(F)F)n2)C[C@@H]1N(C)C ZINC000569010587 567374337 /nfs/dbraw/zinc/37/43/37/567374337.db2.gz QCFHPFRRBKKHGU-VHSXEESVSA-N 0 3 384.265 3.345 10 0 GGAEHN CC(C)Sc1ccc([C@@H](C)N[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)cc1 ZINC000569018484 567374423 /nfs/dbraw/zinc/37/44/23/567374423.db2.gz MNSXFKOJMAEIFD-NVXWUHKLSA-N 0 3 385.599 3.109 10 0 GGAEHN COc1sc(CNC[C@@H]2c3ccccc3C(=O)N2C)cc1Br ZINC000527804031 567374691 /nfs/dbraw/zinc/37/46/91/567374691.db2.gz AGJSUUWLKIOIQU-CQSZACIVSA-N 0 3 381.295 3.436 10 0 GGAEHN CN(CCC(=O)N(C)[C@@H](CO)c1cccc(Cl)c1Cl)c1ccncc1 ZINC000618342024 567374853 /nfs/dbraw/zinc/37/48/53/567374853.db2.gz SACYSANTJMVAGU-INIZCTEOSA-N 0 3 382.291 3.407 10 0 GGAEHN C[C@@H](NC(=O)N[C@@H]1CCCN(C)C1)c1cc(F)c(Br)cc1F ZINC000527797897 567375257 /nfs/dbraw/zinc/37/52/57/567375257.db2.gz DNYOFYFCLVQULL-NXEZZACHSA-N 0 3 376.245 3.182 10 0 GGAEHN COc1sc(CNC[C@H]2c3ccccc3C(=O)N2C)cc1Br ZINC000527804030 567375783 /nfs/dbraw/zinc/37/57/83/567375783.db2.gz AGJSUUWLKIOIQU-AWEZNQCLSA-N 0 3 381.295 3.436 10 0 GGAEHN C[C@@H]1C[C@@H](NC(=O)NCc2cc(F)c(Br)cc2F)CN1C1CC1 ZINC000527812963 567376552 /nfs/dbraw/zinc/37/65/52/567376552.db2.gz LSQSWRNOCXDCJX-MWLCHTKSSA-N 0 3 388.256 3.152 10 0 GGAEHN COc1cc(Br)c(CNCC(C)(C)C(=O)N2CCCC2)cc1OC ZINC000527811415 567376730 /nfs/dbraw/zinc/37/67/30/567376730.db2.gz RRNRQOVVPOTBQW-UHFFFAOYSA-N 0 3 399.329 3.205 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)NCc2cc(F)c(Br)cc2F)CN1C1CC1 ZINC000527812958 567377172 /nfs/dbraw/zinc/37/71/72/567377172.db2.gz LSQSWRNOCXDCJX-KOLCDFICSA-N 0 3 388.256 3.152 10 0 GGAEHN CCN(Cc1cccc(Br)c1)C(=O)NC[C@@H]1CCCN1CCOC ZINC000477185000 567379337 /nfs/dbraw/zinc/37/93/37/567379337.db2.gz GWLHTPUZMFPHGO-KRWDZBQOSA-N 0 3 398.345 3.091 10 0 GGAEHN C[C@@H]1CN(Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@H](C)[C@H]1O ZINC000661624531 567384564 /nfs/dbraw/zinc/38/45/64/567384564.db2.gz KBYGMLDHFGVLQK-LAQFHYBYSA-N 0 3 376.298 3.355 10 0 GGAEHN C[C@H](NCC[C@H]1CCCOC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000527924742 567384822 /nfs/dbraw/zinc/38/48/22/567384822.db2.gz HMTRJLTZTKTREG-WDEREUQCSA-N 0 3 381.325 3.108 10 0 GGAEHN C[C@H](NCC[C@@H]1CCCOC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000527924740 567385275 /nfs/dbraw/zinc/38/52/75/567385275.db2.gz HMTRJLTZTKTREG-QWRGUYRKSA-N 0 3 381.325 3.108 10 0 GGAEHN O=S1(=O)CC[C@@H](NCC[C@@H]2CCCOC2)c2cc(Br)ccc21 ZINC000527928154 567385313 /nfs/dbraw/zinc/38/53/13/567385313.db2.gz NFKAJOMWIDSGPV-SWLSCSKDSA-N 0 3 388.327 3.074 10 0 GGAEHN C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)Cc2ccc(Br)cc2[O-])C1 ZINC000477279236 567385548 /nfs/dbraw/zinc/38/55/48/567385548.db2.gz HOGAWBDWGMTVKK-ZIAGYGMSSA-N 0 3 383.330 3.181 10 0 GGAEHN C[NH+](C)CCOc1ccc(NC(=O)Cc2ccc(Br)cc2[O-])cc1 ZINC000477272564 567385782 /nfs/dbraw/zinc/38/57/82/567385782.db2.gz IKSBPKMFWKASTO-UHFFFAOYSA-N 0 3 393.281 3.276 10 0 GGAEHN C[N@H+](CCCNC(=O)Cc1ccc(Br)cc1[O-])Cc1ccccc1 ZINC000477296236 567386709 /nfs/dbraw/zinc/38/67/09/567386709.db2.gz SCRILEWOLJYQKB-UHFFFAOYSA-N 0 3 391.309 3.336 10 0 GGAEHN C[N@@H+](CCCNC(=O)Cc1ccc(Br)cc1[O-])Cc1ccccc1 ZINC000477296236 567386716 /nfs/dbraw/zinc/38/67/16/567386716.db2.gz SCRILEWOLJYQKB-UHFFFAOYSA-N 0 3 391.309 3.336 10 0 GGAEHN O[C@@H](CN[C@H]1CCOc2c(Br)cccc21)COc1ccccc1F ZINC000501544501 567395892 /nfs/dbraw/zinc/39/58/92/567395892.db2.gz DRURIRAOQUFFJA-LRDDRELGSA-N 0 3 396.256 3.441 10 0 GGAEHN O[C@H](CN[C@@H]1CCOc2c(Br)cccc21)COc1ccccc1F ZINC000501544502 567395914 /nfs/dbraw/zinc/39/59/14/567395914.db2.gz DRURIRAOQUFFJA-MLGOLLRUSA-N 0 3 396.256 3.441 10 0 GGAEHN CC(C)(C)O[C@H]1C[C@@H](NCc2cc(Cl)cc(S(N)(=O)=O)c2)C12CCC2 ZINC000661846101 567397011 /nfs/dbraw/zinc/39/70/11/567397011.db2.gz YGHSHVWGSXEPJE-CVEARBPZSA-N 0 3 386.945 3.203 10 0 GGAEHN O[C@@H](CN[C@H]1CCOc2c(Br)cccc21)COc1ccc(F)cc1 ZINC000501549465 567397199 /nfs/dbraw/zinc/39/71/99/567397199.db2.gz HQBBXZQIKMHNJJ-GUYCJALGSA-N 0 3 396.256 3.441 10 0 GGAEHN CC[C@H](C)OCC(=O)N(CCN(CC)CC)c1ccc(Br)cn1 ZINC000569345767 567397677 /nfs/dbraw/zinc/39/76/77/567397677.db2.gz ZCHUWOJUCFFCNG-AWEZNQCLSA-N 0 3 386.334 3.334 10 0 GGAEHN Cc1cc(Br)c(CNC(=O)N2CCN(c3ccncc3)CC2)s1 ZINC000661858796 567398442 /nfs/dbraw/zinc/39/84/42/567398442.db2.gz WJTPQZNYZMNRFI-UHFFFAOYSA-N 0 3 395.326 3.246 10 0 GGAEHN C[C@]1(Br)C[C@H]1C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1 ZINC000528180230 567399286 /nfs/dbraw/zinc/39/92/86/567399286.db2.gz PDVGNFOZVSODME-HKUYNNGSSA-N 0 3 392.341 3.331 10 0 GGAEHN Brc1cnn(Cc2c[nH]c(=NC[C@H]3CCN3C3CCCC3)s2)c1 ZINC000528206064 567400515 /nfs/dbraw/zinc/40/05/15/567400515.db2.gz BIYVTSYHQCTUED-CQSZACIVSA-N 0 3 396.358 3.001 10 0 GGAEHN O=C(NC1CCN([C@H]2CCOC2)CC1)N[C@@H]1CCCc2sc(Cl)cc21 ZINC000661987291 567403300 /nfs/dbraw/zinc/40/33/00/567403300.db2.gz PIOCWSUJSHJEGK-DZGCQCFKSA-N 0 3 383.945 3.331 10 0 GGAEHN CN(C)C(=O)N(C)[C@H]1CCN(CCC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000662015135 567404183 /nfs/dbraw/zinc/40/41/83/567404183.db2.gz RYJOGQHWJHGNNO-LBPRGKRZSA-N 0 3 387.311 3.010 10 0 GGAEHN CN(C)C(=O)N(C)[C@H]1CCN(CCC(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000662014885 567404599 /nfs/dbraw/zinc/40/45/99/567404599.db2.gz QUVVVLZMNRSSJW-ZDUSSCGKSA-N 0 3 387.311 3.010 10 0 GGAEHN C[C@@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)NC(=O)Cc1ccc(Br)cc1[O-] ZINC000477612583 567404919 /nfs/dbraw/zinc/40/49/19/567404919.db2.gz WCBJFYVRXRYIGO-MCIONIFRSA-N 0 3 383.330 3.180 10 0 GGAEHN CN(C)C(=O)N(C)[C@@H]1CCN(CCC(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000662014883 567404964 /nfs/dbraw/zinc/40/49/64/567404964.db2.gz QUVVVLZMNRSSJW-CYBMUJFWSA-N 0 3 387.311 3.010 10 0 GGAEHN C[C@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)NC(=O)Cc1ccc(Br)cc1[O-] ZINC000477612585 567405028 /nfs/dbraw/zinc/40/50/28/567405028.db2.gz WCBJFYVRXRYIGO-MGPQQGTHSA-N 0 3 383.330 3.180 10 0 GGAEHN Cc1ccc([C@H](CNC(=O)Cc2ccc(Br)cc2O)N(C)C)cc1 ZINC000477609942 567405226 /nfs/dbraw/zinc/40/52/26/567405226.db2.gz HQHGHPSMEBRRDK-KRWDZBQOSA-N 0 3 391.309 3.425 10 0 GGAEHN C[C@]1(Br)C[C@@H]1C(=O)N1CCC(N2CCc3ccccc3C2)CC1 ZINC000528270122 567405520 /nfs/dbraw/zinc/40/55/20/567405520.db2.gz MMFFRHNPSWPGHI-MJGOQNOKSA-N 0 3 377.326 3.209 10 0 GGAEHN O=c1cc(CN2CCC[C@@H](C3CCC3)C2)nc2ccc(Br)cn12 ZINC000662045393 567405798 /nfs/dbraw/zinc/40/57/98/567405798.db2.gz SNZDAGISPLHKPF-CQSZACIVSA-N 0 3 376.298 3.469 10 0 GGAEHN C[C@@]1(Br)C[C@H]1C(=O)N1CCC(N2CCc3ccccc3C2)CC1 ZINC000528270126 567405747 /nfs/dbraw/zinc/40/57/47/567405747.db2.gz MMFFRHNPSWPGHI-PKOBYXMFSA-N 0 3 377.326 3.209 10 0 GGAEHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)[C@@H]1C[C@]1(C)Br ZINC000528278337 567406721 /nfs/dbraw/zinc/40/67/21/567406721.db2.gz HNSRVYRIJGBGIB-BBRMVZONSA-N 0 3 375.257 3.029 10 0 GGAEHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)[C@@H]1C[C@]1(C)Br ZINC000528276171 567407060 /nfs/dbraw/zinc/40/70/60/567407060.db2.gz BFVHRRDKHSXREB-LRDDRELGSA-N 0 3 375.257 3.029 10 0 GGAEHN CO[C@H]1C[C@H]2C[C@H](NCC(=O)Nc3ccc(Br)cc3C)C[C@H]2C1 ZINC000569474199 567407156 /nfs/dbraw/zinc/40/71/56/567407156.db2.gz HJTCESMBIGRNRV-WBIXOSHYSA-N 0 3 381.314 3.489 10 0 GGAEHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)[C@H]1C[C@]1(C)Br ZINC000528278340 567407168 /nfs/dbraw/zinc/40/71/68/567407168.db2.gz HNSRVYRIJGBGIB-CJNGLKHVSA-N 0 3 375.257 3.029 10 0 GGAEHN COc1ccc([C@@H](CNc2ncc(C(F)(F)F)s2)N(C)C)cc1OC ZINC000477743377 567412720 /nfs/dbraw/zinc/41/27/20/567412720.db2.gz NKSFNPBDPHVBAR-LLVKDONJSA-N 0 3 375.416 3.316 10 0 GGAEHN C[C@]1(Br)C[C@@H]1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000528348334 567414005 /nfs/dbraw/zinc/41/40/05/567414005.db2.gz FXAYUMAYVATTSX-MJGOQNOKSA-N 0 3 379.342 3.327 10 0 GGAEHN CCOc1cc(C[NH2+]C[C@H](CO)Cc2ccco2)cc(Br)c1[O-] ZINC000569566792 567414163 /nfs/dbraw/zinc/41/41/63/567414163.db2.gz INRMTKKBXDLRSB-CYBMUJFWSA-N 0 3 384.270 3.087 10 0 GGAEHN CNS(=O)(=O)CCCN1CCC[C@]1(C)Cc1ccccc1C(F)(F)F ZINC000662155389 567414818 /nfs/dbraw/zinc/41/48/18/567414818.db2.gz MLYUZEASUZGMME-MRXNPFEDSA-N 0 3 378.460 3.042 10 0 GGAEHN CC(C)(C)N1CC[C@H](NCCCS(C)(=O)=O)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000569573902 567415583 /nfs/dbraw/zinc/41/55/83/567415583.db2.gz HKTFOBAXYOOYIY-IRXDYDNUSA-N 0 3 390.952 3.417 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)c1scc(Br)c1Br ZINC000528373303 567417202 /nfs/dbraw/zinc/41/72/02/567417202.db2.gz PGEGEBWVASXVCW-QMMMGPOBSA-N 0 3 396.148 3.439 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Br)C(=O)NC[C@@H]1CCCN1C ZINC000502124578 567419982 /nfs/dbraw/zinc/41/99/82/567419982.db2.gz CNBXVBIVKLGDMM-JQWIXIFHSA-N 0 3 375.694 3.080 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)c2scc(Br)c2Br)C1 ZINC000528401780 567420407 /nfs/dbraw/zinc/42/04/07/567420407.db2.gz CGJVJMRGRRWCAJ-SSDOTTSWSA-N 0 3 382.121 3.049 10 0 GGAEHN CN(C[C@H]1CCN(C)C1)C(=O)c1scc(Br)c1Br ZINC000528431141 567423722 /nfs/dbraw/zinc/42/37/22/567423722.db2.gz HJRGNNXRKYRVBD-QMMMGPOBSA-N 0 3 396.148 3.297 10 0 GGAEHN CS[C@H]1CN(c2nn3cc(C4CCCC4)nc3s2)C[C@@H]1N1CCCC1 ZINC000436428108 567424172 /nfs/dbraw/zinc/42/41/72/567424172.db2.gz JIWNGBLJOVZIDE-HOTGVXAUSA-N 0 3 377.583 3.464 10 0 GGAEHN C[C@@H](NC[C@@H]1CNCCO1)c1nc(-c2ccc(Br)cc2)cs1 ZINC000662280155 567424222 /nfs/dbraw/zinc/42/42/22/567424222.db2.gz CXUATVOHQGVONH-RISCZKNCSA-N 0 3 382.327 3.212 10 0 GGAEHN C[C@H](NCc1csc(N(C)C2CC2)n1)C1CCN(CC(F)(F)F)CC1 ZINC000550023213 567424807 /nfs/dbraw/zinc/42/48/07/567424807.db2.gz BWAMYTXTAJFOAX-LBPRGKRZSA-N 0 3 376.492 3.494 10 0 GGAEHN C[C@@H](NCc1csc(N(C)C2CC2)n1)C1CCN(CC(F)(F)F)CC1 ZINC000550023212 567425019 /nfs/dbraw/zinc/42/50/19/567425019.db2.gz BWAMYTXTAJFOAX-GFCCVEGCSA-N 0 3 376.492 3.494 10 0 GGAEHN CCN(CC)CCN(C(=O)c1ccc(F)cn1)c1ccc(Br)cn1 ZINC000550084363 567426259 /nfs/dbraw/zinc/42/62/59/567426259.db2.gz OGYGQUVTZINNNX-UHFFFAOYSA-N 0 3 395.276 3.367 10 0 GGAEHN CN(C)Cc1ccc(S(=O)(=O)N[C@@H]2[C@H]3Cc4cc(Cl)ccc4[C@@H]23)cc1 ZINC000528465488 567426542 /nfs/dbraw/zinc/42/65/42/567426542.db2.gz XSSNJWRAAZHXLY-IPMKNSEASA-N 0 3 376.909 3.018 10 0 GGAEHN N[C@@H]1CN(Cc2cccc(OCC(F)(F)F)c2Br)CC[C@H]1F ZINC000662326089 567427516 /nfs/dbraw/zinc/42/75/16/567427516.db2.gz NGRORWNODBPXHV-GHMZBOCLSA-N 0 3 385.199 3.261 10 0 GGAEHN CN(CC(=O)Nc1c(Cl)cc(Cl)cc1Cl)[C@H](CN)C(F)(F)F ZINC000662327441 567427739 /nfs/dbraw/zinc/42/77/39/567427739.db2.gz JISJNKBBWRHVBN-SECBINFHSA-N 0 3 378.609 3.407 10 0 GGAEHN C[C@H](CN1CCCCC1)NC(=O)Nc1cnc2c(Br)cccn12 ZINC000436484296 567428305 /nfs/dbraw/zinc/42/83/05/567428305.db2.gz DSTALELWHWROPA-GFCCVEGCSA-N 0 3 380.290 3.093 10 0 GGAEHN C/C(=C/c1ccccc1C(F)(F)F)CN1CCC[C@@H](CS(N)(=O)=O)C1 ZINC000502344834 567429715 /nfs/dbraw/zinc/42/97/15/567429715.db2.gz KAVKTFBEEOFTMW-RNQWEJQRSA-N 0 3 376.444 3.109 10 0 GGAEHN OC[C@]1([C@@H](NCc2ccc(Br)c(F)c2F)C2CC2)CCCO1 ZINC000528513609 567432770 /nfs/dbraw/zinc/43/27/70/567432770.db2.gz ARDQWBHPYZXPKF-HOTGVXAUSA-N 0 3 376.241 3.137 10 0 GGAEHN Cn1nc2c(c1CNC[C@@H](O)COc1ccc(Cl)cc1Cl)CCCC2 ZINC000569804555 567433991 /nfs/dbraw/zinc/43/39/91/567433991.db2.gz GJMXGKKABSZPJC-CYBMUJFWSA-N 0 3 384.307 3.135 10 0 GGAEHN COc1ccc(CCC(=O)NC[C@@H](N)c2ccccc2)c(Br)c1 ZINC000662414446 567434470 /nfs/dbraw/zinc/43/44/70/567434470.db2.gz ZRMKWUGCXDZMRA-QGZVFWFLSA-N 0 3 377.282 3.207 10 0 GGAEHN Cc1ccc(I)c(C(=O)NC(C)(C)CN2CCCC2)c1 ZINC000457037679 567434785 /nfs/dbraw/zinc/43/47/85/567434785.db2.gz BUWLEGSFFCIISY-UHFFFAOYSA-N 0 3 386.277 3.204 10 0 GGAEHN Cn1c(=O)ccc2c1CCC[C@@H]2NCc1cccc(I)c1 ZINC000593695148 567436251 /nfs/dbraw/zinc/43/62/51/567436251.db2.gz XEXDHOFFRNXFAH-HNNXBMFYSA-N 0 3 394.256 3.157 10 0 GGAEHN CC(C)N1CC[C@@H](N(C)C(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000457079097 567438012 /nfs/dbraw/zinc/43/80/12/567438012.db2.gz BFZCVNOJJIRHHP-LLVKDONJSA-N 0 3 375.257 3.211 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@H]3C[C@@H]3c3cc(Cl)cc(Cl)c3)[C@H]2C1 ZINC000502516140 567439720 /nfs/dbraw/zinc/43/97/20/567439720.db2.gz JHMPMHOWRPNWOJ-VSZNYVQBSA-N 0 3 383.319 3.419 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@@H]3C[C@@H]3c3cc(Cl)cc(Cl)c3)[C@H]2C1 ZINC000502516143 567439777 /nfs/dbraw/zinc/43/97/77/567439777.db2.gz JHMPMHOWRPNWOJ-ZJPYXAASSA-N 0 3 383.319 3.419 10 0 GGAEHN O=C(c1sc2c(c1Br)CNC2)N1CCCN(C2CCCC2)CC1 ZINC000662468795 567439888 /nfs/dbraw/zinc/43/98/88/567439888.db2.gz SQPMWCAMIVFXGU-UHFFFAOYSA-N 0 3 398.370 3.204 10 0 GGAEHN COc1cc(C(=O)NCCN2[C@H](C)CCC[C@H]2C)cc(OC)c1Br ZINC000593876441 567444807 /nfs/dbraw/zinc/44/48/07/567444807.db2.gz XYNGUOWDEJBOOC-CHWSQXEVSA-N 0 3 399.329 3.459 10 0 GGAEHN C[C@H]1CCN(CC(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)C1 ZINC000569939015 567444877 /nfs/dbraw/zinc/44/48/77/567444877.db2.gz GZRXVULWXIOPNG-AWEZNQCLSA-N 0 3 384.351 3.416 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)C(C)(C)c3ccccc3Br)[C@H]2C1 ZINC000502664639 567447259 /nfs/dbraw/zinc/44/72/59/567447259.db2.gz QWCHBAVKDHVNEF-DLBZAZTESA-N 0 3 395.341 3.048 10 0 GGAEHN O=C(C[C@@H]1NCc2ccccc21)N1CCOc2ccc(Br)cc2C1 ZINC000662545018 567448342 /nfs/dbraw/zinc/44/83/42/567448342.db2.gz KLKKUJFAMIIXIE-KRWDZBQOSA-N 0 3 387.277 3.405 10 0 GGAEHN Cn1cnnc1Sc1ccc(NC(=O)C2(N)CC3(CCC3)C2)cc1Cl ZINC000662548597 567448367 /nfs/dbraw/zinc/44/83/67/567448367.db2.gz ITVNTPDPOMABPZ-UHFFFAOYSA-N 0 3 377.901 3.220 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@H]3C[C@H]3c3ccc(Cl)c(Cl)c3)[C@H]2C1 ZINC000502738911 567448452 /nfs/dbraw/zinc/44/84/52/567448452.db2.gz QGOKNBPGFFYHIH-DFEHZGFQSA-N 0 3 383.319 3.419 10 0 GGAEHN Cc1cc(Cl)ccc1C1=CCN(C[C@H]2CCCN(S(C)(=O)=O)C2)CC1 ZINC000528739980 567450681 /nfs/dbraw/zinc/45/06/81/567450681.db2.gz DOIMVNWSDDPKFH-MRXNPFEDSA-N 0 3 382.957 3.409 10 0 GGAEHN CC1(N2CCOCC2)CCN(Cc2nc3cc(Br)ccc3o2)CC1 ZINC000528727959 567450760 /nfs/dbraw/zinc/45/07/60/567450760.db2.gz XRSFPZJOIOHQGD-UHFFFAOYSA-N 0 3 394.313 3.277 10 0 GGAEHN COc1ccc(CN2CCC(C)(N3CCOCC3)CC2)cc1Br ZINC000528731063 567451964 /nfs/dbraw/zinc/45/19/64/567451964.db2.gz PFLSJHGLHCPBBQ-UHFFFAOYSA-N 0 3 383.330 3.144 10 0 GGAEHN C[C@H](N[C@H]1[C@@H](C)[C@@H](C)O[C@H]1C)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000528752075 567452862 /nfs/dbraw/zinc/45/28/62/567452862.db2.gz DGULHGURYJQZMH-LHLGERLTSA-N 0 3 383.330 3.198 10 0 GGAEHN C[C@H](N[C@@H]1[C@H](C)O[C@H](C)[C@H]1C)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000528752076 567453127 /nfs/dbraw/zinc/45/31/27/567453127.db2.gz DGULHGURYJQZMH-RBUCKAEESA-N 0 3 383.330 3.198 10 0 GGAEHN C[C@H](N[C@@H]1[C@H](C)O[C@@H](C)[C@H]1C)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000528752077 567453187 /nfs/dbraw/zinc/45/31/87/567453187.db2.gz DGULHGURYJQZMH-RVFOSREFSA-N 0 3 383.330 3.198 10 0 GGAEHN C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1NCC(=O)Nc1ccc(Br)cc1Cl ZINC000528757500 567453591 /nfs/dbraw/zinc/45/35/91/567453591.db2.gz CFLJKKVSVQMAMR-VGAUDOQQSA-N 0 3 375.694 3.443 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)N1CCc2ccc(Cl)c(Cl)c2C1 ZINC000662627935 567454164 /nfs/dbraw/zinc/45/41/64/567454164.db2.gz LORZTCSKTABQNR-VVFCZOMOSA-N 0 3 383.319 3.411 10 0 GGAEHN O=S(=O)(c1cccc(C(F)(F)F)c1)N1CCCC[C@H](N2CCCC2)C1 ZINC000594042061 567454249 /nfs/dbraw/zinc/45/42/49/567454249.db2.gz MVPGSMCEZYWWNR-HNNXBMFYSA-N 0 3 376.444 3.344 10 0 GGAEHN O=C(CCN1CC[C@H]2CC[C@@H](C1)[S@@]2=O)Nc1c(Cl)cccc1Cl ZINC000528781012 567454528 /nfs/dbraw/zinc/45/45/28/567454528.db2.gz BYRPXMAFUWWGCW-YCDSQXFLSA-N 0 3 375.321 3.307 10 0 GGAEHN O=C(CCN1CC[C@H]2CC[C@@H](C1)[S@]2=O)Nc1c(Cl)cccc1Cl ZINC000528781024 567454970 /nfs/dbraw/zinc/45/49/70/567454970.db2.gz BYRPXMAFUWWGCW-WCBZVUCDSA-N 0 3 375.321 3.307 10 0 GGAEHN CN(C)C[C@H](NC[C@H]1CCCS(=O)(=O)C1)c1ccc(Cl)c(Cl)c1 ZINC000528770542 567455155 /nfs/dbraw/zinc/45/51/55/567455155.db2.gz XQBNSSFWCFYOPE-WBMJQRKESA-N 0 3 379.353 3.011 10 0 GGAEHN CC(C)N1CCC(N(C)C(=O)c2sc3c(c2Br)CNC3)CC1 ZINC000662673917 567455865 /nfs/dbraw/zinc/45/58/65/567455865.db2.gz SLPNCZPENXCRCX-UHFFFAOYSA-N 0 3 386.359 3.059 10 0 GGAEHN CC[C@H]1CC[C@@H](C(=O)N(CCN(CC)CC)c2ccc(Br)cn2)O1 ZINC000570097550 567456657 /nfs/dbraw/zinc/45/66/57/567456657.db2.gz HTLUXIVUOXYBCY-HOTGVXAUSA-N 0 3 398.345 3.477 10 0 GGAEHN O=C(CCN1CCC[C@H]1c1ccc(=O)[nH]n1)Nc1ccc(Br)cc1 ZINC000528792851 567457240 /nfs/dbraw/zinc/45/72/40/567457240.db2.gz JRWMBOAATCUUGE-HNNXBMFYSA-N 0 3 391.269 3.110 10 0 GGAEHN NC1(C(=O)NC[C@H]2CCN(c3ccc(Br)cc3)C2)CC2(CCC2)C1 ZINC000662691127 567457698 /nfs/dbraw/zinc/45/76/98/567457698.db2.gz GGTDZNRBIRHHRM-CQSZACIVSA-N 0 3 392.341 3.053 10 0 GGAEHN CCn1cc(Br)cc1C(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000662689938 567457841 /nfs/dbraw/zinc/45/78/41/567457841.db2.gz YPQZHZLFVFGSJX-MRXNPFEDSA-N 0 3 378.270 3.184 10 0 GGAEHN O[C@H](CNC[C@H]1COc2ccccc2O1)COc1cc(Cl)ccc1Cl ZINC000550721334 567458740 /nfs/dbraw/zinc/45/87/40/567458740.db2.gz MDZSOHRYSCGVDK-KGLIPLIRSA-N 0 3 384.259 3.163 10 0 GGAEHN O=C(CCN1CCC[C@@H]1c1ccc(=O)[nH]n1)Nc1ccccc1Br ZINC000528798513 567458841 /nfs/dbraw/zinc/45/88/41/567458841.db2.gz YVBZOZNRRHZQDC-OAHLLOKOSA-N 0 3 391.269 3.110 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2ccc(Br)c(C)c2)CC1 ZINC000478468359 567459541 /nfs/dbraw/zinc/45/95/41/567459541.db2.gz JCXIKPYMQKSCAR-UHFFFAOYSA-N 0 3 390.281 3.124 10 0 GGAEHN Cc1ccc2c(c1Br)CN(C(=O)[C@]1(N)[C@@H]3CCCO[C@@H]3C1(C)C)C2 ZINC000662740100 567459766 /nfs/dbraw/zinc/45/97/66/567459766.db2.gz WREKYNJONYDRIL-SIXWZSSISA-N 0 3 393.325 3.132 10 0 GGAEHN N[C@@H](CC(=O)N1CCOc2cc(Br)ccc2C1)c1ccccc1 ZINC000662743431 567460572 /nfs/dbraw/zinc/46/05/72/567460572.db2.gz IWMRFLDXWANDKR-INIZCTEOSA-N 0 3 375.266 3.260 10 0 GGAEHN CSC1(CNC(=O)N[C@@H](c2ccc(C)o2)C(F)(F)F)CCN(C)CC1 ZINC000594161334 567462708 /nfs/dbraw/zinc/46/27/08/567462708.db2.gz HMHQDVLKNOMYMH-ZDUSSCGKSA-N 0 3 379.448 3.318 10 0 GGAEHN O=C(Nc1cnn(-c2ccccc2Br)c1)C1(NC2CC2)CCC1 ZINC000662795927 567462751 /nfs/dbraw/zinc/46/27/51/567462751.db2.gz FZMDXQHEKNPKPQ-UHFFFAOYSA-N 0 3 375.270 3.248 10 0 GGAEHN O=C(c1cccc2c1CCNC2)N1CCOc2cccc(Br)c2C1 ZINC000662830751 567464073 /nfs/dbraw/zinc/46/40/73/567464073.db2.gz IETOJMDUUJQUQI-UHFFFAOYSA-N 0 3 387.277 3.130 10 0 GGAEHN Cc1ccc(I)c(C(=O)N[C@@H]2CCCN3CCCC[C@H]23)c1 ZINC000594199381 567464897 /nfs/dbraw/zinc/46/48/97/567464897.db2.gz YFDNNWUZNXVMSI-HZPDHXFCSA-N 0 3 398.288 3.346 10 0 GGAEHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)[C@@H]1C[C@@]1(C)Br ZINC000528905271 567467047 /nfs/dbraw/zinc/46/70/47/567467047.db2.gz YCHIPZYJPULLQQ-HHXXYDBFSA-N 0 3 395.341 3.379 10 0 GGAEHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)[C@@H]1C[C@]1(C)Br ZINC000528905269 567467169 /nfs/dbraw/zinc/46/71/69/567467169.db2.gz YCHIPZYJPULLQQ-AYBZRNKSSA-N 0 3 395.341 3.379 10 0 GGAEHN CN1CC[C@H](NC(=O)c2cc(O)cc(Br)c2)[C@@H]1c1ccccc1 ZINC000528912358 567468584 /nfs/dbraw/zinc/46/85/84/567468584.db2.gz GCJUSKMEBSRSSN-IRXDYDNUSA-N 0 3 375.266 3.330 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)Nc1ccc(F)c(Br)c1F ZINC000662922732 567468918 /nfs/dbraw/zinc/46/89/18/567468918.db2.gz XHVZZKTUFCVBQI-SGEDMPRTSA-N 0 3 389.240 3.198 10 0 GGAEHN CC(=O)c1ccc(OC[C@@H](O)CNCc2cc(F)cc(Br)c2)cc1 ZINC000551008476 567472279 /nfs/dbraw/zinc/47/22/79/567472279.db2.gz ZGIHPFLYXJKYRR-KRWDZBQOSA-N 0 3 396.256 3.320 10 0 GGAEHN CC(=O)c1cccc(OC[C@H](O)CNCc2cc(F)cc(Br)c2)c1 ZINC000551007860 567472932 /nfs/dbraw/zinc/47/29/32/567472932.db2.gz ODTZHUPNHUOPHH-QGZVFWFLSA-N 0 3 396.256 3.320 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)N[C@@H](c1cncc(Br)c1)C1CC1 ZINC000551025579 567474121 /nfs/dbraw/zinc/47/41/21/567474121.db2.gz LODFUASTFJHHRW-CXAGYDPISA-N 0 3 395.345 3.469 10 0 GGAEHN CC(=O)NCCN(Cc1ccc(Br)s1)C[C@H]1CCO[C@@H](C)C1 ZINC000503248353 567476502 /nfs/dbraw/zinc/47/65/02/567476502.db2.gz YVQDEJLTEJPFNW-JSGCOSHPSA-N 0 3 389.359 3.264 10 0 GGAEHN O[C@@H](CN[C@H]1CCOc2ccc(Br)cc21)COCc1ccccc1 ZINC000619742718 567477634 /nfs/dbraw/zinc/47/76/34/567477634.db2.gz ZMJDYVWOAUZCLO-WMZOPIPTSA-N 0 3 392.293 3.440 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)c1cc(Br)cc2[nH]cnc21 ZINC000503293127 567480166 /nfs/dbraw/zinc/48/01/66/567480166.db2.gz SGWDUFSTYDBPHD-VXGBXAGGSA-N 0 3 379.302 3.318 10 0 GGAEHN COc1cc(CN[C@@H]2CCCN(C)C2)cc(Br)c1OC(F)F ZINC000619771171 567480421 /nfs/dbraw/zinc/48/04/21/567480421.db2.gz STPLMHPRGLGTQH-LLVKDONJSA-N 0 3 379.245 3.243 10 0 GGAEHN CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)N(C)CCN(C)C ZINC000478731983 567480897 /nfs/dbraw/zinc/48/08/97/567480897.db2.gz IOXRATQMKJRMOH-MRXNPFEDSA-N 0 3 388.339 3.158 10 0 GGAEHN C[C@@H]1CC[C@H](NCC(=O)Nc2ccc(I)cc2)CS1 ZINC000594503731 567481753 /nfs/dbraw/zinc/48/17/53/567481753.db2.gz IOWDWBRUXVZVDF-MFKMUULPSA-N 0 3 390.290 3.103 10 0 GGAEHN Cc1nc(-c2ccc(CCNC(=O)N[C@@H]3CNCCC3(F)F)s2)cs1 ZINC000570424676 567482958 /nfs/dbraw/zinc/48/29/58/567482958.db2.gz FSSKFAWIEVDYON-CQSZACIVSA-N 0 3 386.493 3.019 10 0 GGAEHN NC(=O)[C@@H](NC1CCC(OC(F)F)CC1)c1ccc(Br)cc1 ZINC000642707710 567485716 /nfs/dbraw/zinc/48/57/16/567485716.db2.gz JZESYQBJVZDGDH-BPCQOVAHSA-N 0 3 377.229 3.116 10 0 GGAEHN CCCN1CC[C@H](NC(=O)c2c(F)c(F)c(Br)c(F)c2F)C1 ZINC000619903636 567486329 /nfs/dbraw/zinc/48/63/29/567486329.db2.gz BGCZFLJCRNILFP-ZETCQYMHSA-N 0 3 383.183 3.220 10 0 GGAEHN CSc1cc(Br)ccc1CN[C@H](CO)C[C@@H](O)C(C)(C)C ZINC000551219361 567489129 /nfs/dbraw/zinc/48/91/29/567489129.db2.gz JUIZTMDGQZTMSS-DZGCQCFKSA-N 0 3 376.360 3.419 10 0 GGAEHN CSc1cc(Br)ccc1CN[C@@H](CO)C[C@@H](O)C(C)(C)C ZINC000551219363 567489812 /nfs/dbraw/zinc/48/98/12/567489812.db2.gz JUIZTMDGQZTMSS-UKRRQHHQSA-N 0 3 376.360 3.419 10 0 GGAEHN COC(=O)c1cc(CNC[C@H](CO)Cc2cccc(Br)c2)c(C)o1 ZINC000594611950 567490332 /nfs/dbraw/zinc/49/03/32/567490332.db2.gz DPHUKDFNRRZASY-CQSZACIVSA-N 0 3 396.281 3.078 10 0 GGAEHN CCN(CC)CCN(CCC(F)(F)F)S(=O)(=O)c1ccc(F)cc1C ZINC000437324824 567492173 /nfs/dbraw/zinc/49/21/73/567492173.db2.gz FSXMBMDBVLOVCM-UHFFFAOYSA-N 0 3 384.439 3.419 10 0 GGAEHN COC(=O)c1cc(CNC[C@@H](CO)Cc2ccccc2Br)c(C)o1 ZINC000594616238 567492432 /nfs/dbraw/zinc/49/24/32/567492432.db2.gz ZGFPRDHZUUWKJR-ZDUSSCGKSA-N 0 3 396.281 3.078 10 0 GGAEHN CCOc1cc(CN[C@@H](C)Cn2cc(Br)ccc2=O)ccc1OC ZINC000551264904 567492385 /nfs/dbraw/zinc/49/23/85/567492385.db2.gz FTROENGGEZICJE-ZDUSSCGKSA-N 0 3 395.297 3.196 10 0 GGAEHN O=C(NCC1(c2ccc(Br)cc2)CCC1)N1CCN2CCC1CC2 ZINC000551268606 567493116 /nfs/dbraw/zinc/49/31/16/567493116.db2.gz IFSXZEKWWVAEAD-UHFFFAOYSA-N 0 3 392.341 3.360 10 0 GGAEHN C[C@H](CNC(=O)N1CCN2CCC1CC2)Sc1ccc(Br)cc1 ZINC000551308375 567496219 /nfs/dbraw/zinc/49/62/19/567496219.db2.gz JRQYRKUPGGZCCC-CYBMUJFWSA-N 0 3 398.370 3.419 10 0 GGAEHN O=C(CN1CCc2cc(Cl)cc(Cl)c2C1)NC1CCN(C2CC2)CC1 ZINC000437537709 567499289 /nfs/dbraw/zinc/49/92/89/567499289.db2.gz PKTMNLPMCQFPLN-UHFFFAOYSA-N 0 3 382.335 3.095 10 0 GGAEHN CN1CCC(Oc2ccc(CNC(=O)c3coc(Br)c3)cc2)CC1 ZINC000551355378 567500726 /nfs/dbraw/zinc/50/07/26/567500726.db2.gz ALVZKBPRRQTZRU-UHFFFAOYSA-N 0 3 393.281 3.445 10 0 GGAEHN CC1(C)[C@H](CNCCS(=O)(=O)c2cccc(Br)c2)C1(F)F ZINC000663368115 567500874 /nfs/dbraw/zinc/50/08/74/567500874.db2.gz YZRZDZFHTQKPTH-LBPRGKRZSA-N 0 3 382.270 3.104 10 0 GGAEHN C[C@H](O)[C@@H](NC[C@@H](O)COc1cc(F)cc(Br)c1)c1ccccc1 ZINC000663376297 567502408 /nfs/dbraw/zinc/50/24/08/567502408.db2.gz QTXJSFGLIFNAHX-BJOOFOGMSA-N 0 3 398.272 3.040 10 0 GGAEHN C[C@@H](O)[C@@H](NCCC(=O)Nc1cccc(Br)c1)c1ccccc1 ZINC000663376991 567502712 /nfs/dbraw/zinc/50/27/12/567502712.db2.gz XPHDZHZLPQWSMY-FZKQIMNGSA-N 0 3 377.282 3.489 10 0 GGAEHN OC1CCN(Cc2ccc(NCc3ccc(Br)cn3)cc2)CC1 ZINC000643286503 567504102 /nfs/dbraw/zinc/50/41/02/567504102.db2.gz AHQBIMGGRDYVFH-UHFFFAOYSA-N 0 3 376.298 3.413 10 0 GGAEHN CN(C)CCOc1ccccc1C(=O)NCc1cc(Br)ccc1F ZINC000551408422 567504221 /nfs/dbraw/zinc/50/42/21/567504221.db2.gz FNODBCMOKHTIMB-UHFFFAOYSA-N 0 3 395.272 3.459 10 0 GGAEHN CCOC(=O)C1CCC(O)(CNCc2sc(C)cc2Br)CC1 ZINC000594733091 567504357 /nfs/dbraw/zinc/50/43/57/567504357.db2.gz QZQJDHOTAGNKHL-UHFFFAOYSA-N 0 3 390.343 3.393 10 0 GGAEHN Cn1nc2c(c1CN[C@@H]1CCN(c3cccc(Br)c3)C1)CCCC2 ZINC000643321502 567504931 /nfs/dbraw/zinc/50/49/31/567504931.db2.gz WYLJLUUTCQMLQI-OAHLLOKOSA-N 0 3 389.341 3.430 10 0 GGAEHN CC(C)N1CC[C@H](NC(=O)C(N)C(F)(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000570680066 567505461 /nfs/dbraw/zinc/50/54/61/567505461.db2.gz IYPYZTIPMZQXGH-BFHYXJOUSA-N 0 3 381.801 3.009 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)N[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000437728694 567506316 /nfs/dbraw/zinc/50/63/16/567506316.db2.gz FDBQCPGSMWMXTJ-JKIFEVAISA-N 0 3 386.323 3.259 10 0 GGAEHN C[C@@H]1CN(C(=O)NCc2cc(F)cc(Br)c2)CCN(C2CC2)C1 ZINC000457958983 567508408 /nfs/dbraw/zinc/50/84/08/567508408.db2.gz NMEMMVHCUTYRGC-LBPRGKRZSA-N 0 3 384.293 3.214 10 0 GGAEHN CC(C)Oc1ccc([C@H](CNC(=O)[C@H]2C[C@]2(C)Br)N(C)C)cc1 ZINC000529392700 567511567 /nfs/dbraw/zinc/51/15/67/567511567.db2.gz PCLDCYRKERNJSG-RYRKJORJSA-N 0 3 383.330 3.366 10 0 GGAEHN CCCOc1c(Br)cc(CN2CC[C@@H](F)[C@H](N)C2)cc1OC ZINC000663506189 567512240 /nfs/dbraw/zinc/51/22/40/567512240.db2.gz IWOUYWXCNASCRP-ZIAGYGMSSA-N 0 3 375.282 3.118 10 0 GGAEHN CCOc1cc(CN2CC[C@@H](F)[C@H](N)C2)cc(Br)c1OC(F)F ZINC000663506218 567512701 /nfs/dbraw/zinc/51/27/01/567512701.db2.gz JZGVNSQFCKEJIZ-VXGBXAGGSA-N 0 3 397.235 3.320 10 0 GGAEHN CS[C@H]1CN(C(=O)Nc2cccc(Br)c2)C[C@@H]1N1CCCC1 ZINC000437914904 567515182 /nfs/dbraw/zinc/51/51/82/567515182.db2.gz AJEYNYDSCBFJTK-GJZGRUSLSA-N 0 3 384.343 3.493 10 0 GGAEHN CS[C@@H]1CN(C(=O)Nc2cccc(Br)c2)C[C@@H]1N1CCCC1 ZINC000437914906 567515572 /nfs/dbraw/zinc/51/55/72/567515572.db2.gz AJEYNYDSCBFJTK-LSDHHAIUSA-N 0 3 384.343 3.493 10 0 GGAEHN C[C@H]1CCCN(CCNC(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000503986842 567516066 /nfs/dbraw/zinc/51/60/66/567516066.db2.gz OIBUJQCRPURZJL-NSHDSACASA-N 0 3 375.257 3.118 10 0 GGAEHN CC1CCN(CCNC(=O)Cc2c(F)ccc(Br)c2F)CC1 ZINC000503975811 567516807 /nfs/dbraw/zinc/51/68/07/567516807.db2.gz YTCSBDSSROLMOC-UHFFFAOYSA-N 0 3 375.257 3.118 10 0 GGAEHN Brc1cnc(C2CC2)nc1NCC1(N2CCCC2)CCOCC1 ZINC000663548019 567516974 /nfs/dbraw/zinc/51/69/74/567516974.db2.gz YFTILIZRZIMJAH-UHFFFAOYSA-N 0 3 381.318 3.173 10 0 GGAEHN O=C(Cc1c(F)ccc(Br)c1F)NCCN1CCCCCC1 ZINC000503964644 567516993 /nfs/dbraw/zinc/51/69/93/567516993.db2.gz SPYXWGAPRWBYHD-UHFFFAOYSA-N 0 3 375.257 3.262 10 0 GGAEHN COC(=O)c1ccc(CNCCCc2c(C)nn(C)c2C)c(Br)c1 ZINC000551557903 567517418 /nfs/dbraw/zinc/51/74/18/567517418.db2.gz BGHKIDYTUBUJCV-UHFFFAOYSA-N 0 3 394.313 3.308 10 0 GGAEHN C[C@@H](CN1CCCCC1)NC(=O)Cc1c(F)ccc(Br)c1F ZINC000503992944 567517500 /nfs/dbraw/zinc/51/75/00/567517500.db2.gz WLOOEJAAJHGZLL-NSHDSACASA-N 0 3 375.257 3.260 10 0 GGAEHN CC(C)(C)[C@H](O)C[C@@H](CO)NCc1ccc(OC(F)F)c(Br)c1 ZINC000551569418 567518587 /nfs/dbraw/zinc/51/85/87/567518587.db2.gz RIHMBWPYRARVJE-SMDDNHRTSA-N 0 3 396.272 3.298 10 0 GGAEHN COCC[C@H](COC)NCc1cn(-c2ccc(Br)cc2)nc1C ZINC000570861321 567519247 /nfs/dbraw/zinc/51/92/47/567519247.db2.gz FBNRRZJMONZTIW-MRXNPFEDSA-N 0 3 382.302 3.084 10 0 GGAEHN COc1cc(Br)ccc1CN1CCC[C@H](N2CCOCC2)CC1 ZINC000570866240 567519395 /nfs/dbraw/zinc/51/93/95/567519395.db2.gz KTMBHKXVDBHIDY-KRWDZBQOSA-N 0 3 383.330 3.144 10 0 GGAEHN CN(c1nnc(-c2cc(F)ccc2Br)n1C)[C@H]1CCN(C2CC2)C1 ZINC000570888897 567521323 /nfs/dbraw/zinc/52/13/23/567521323.db2.gz MDVFQISVDQUUQR-ZDUSSCGKSA-N 0 3 394.292 3.057 10 0 GGAEHN CN(c1nnc(-c2cc(F)ccc2Br)n1C)[C@@H]1CCN(C2CC2)C1 ZINC000570888896 567521450 /nfs/dbraw/zinc/52/14/50/567521450.db2.gz MDVFQISVDQUUQR-CYBMUJFWSA-N 0 3 394.292 3.057 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)Nc1cc(Br)ccc1N1CCCC1 ZINC000479283688 567521768 /nfs/dbraw/zinc/52/17/68/567521768.db2.gz IFTZDMMATQKUOJ-AWEZNQCLSA-N 0 3 381.318 3.265 10 0 GGAEHN O=C(N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1)N1CCN2CCC1CC2 ZINC000551607700 567523720 /nfs/dbraw/zinc/52/37/20/567523720.db2.gz WPHIWCZMHOEMOB-AWEZNQCLSA-N 0 3 383.323 3.062 10 0 GGAEHN C[C@H](Cc1cnccn1)NCc1cc(Cl)ccc1I ZINC000594918910 567524843 /nfs/dbraw/zinc/52/48/43/567524843.db2.gz VDGKWEANUIIDPF-SNVBAGLBSA-N 0 3 387.652 3.455 10 0 GGAEHN O=C(N[C@H]1C[C@H](c2ccc(F)c(Br)c2)C1)N1CCN2CCC1CC2 ZINC000551647972 567526096 /nfs/dbraw/zinc/52/60/96/567526096.db2.gz NASOUVACNLFANC-HDJSIYSDSA-N 0 3 396.304 3.324 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)[C@H](CN)c1ccccc1 ZINC000570962307 567527180 /nfs/dbraw/zinc/52/71/80/567527180.db2.gz VLZOFIIPFKMXHX-BLLLJJGKSA-N 0 3 377.282 3.377 10 0 GGAEHN CN(C(=O)N[C@@H]1C[C@H]1c1ccc(Br)cc1)[C@@H]1CCN(C2CC2)C1 ZINC000438361270 567529062 /nfs/dbraw/zinc/52/90/62/567529062.db2.gz WFOAQWGKHSNZNB-IXDOHACOSA-N 0 3 378.314 3.183 10 0 GGAEHN Cc1nc(-c2ccc(CNC(=O)N[C@@H]3CCN(CC4CC4)C3)s2)cs1 ZINC000594955300 567529530 /nfs/dbraw/zinc/52/95/30/567529530.db2.gz RLUXYKRQHXJKJQ-CQSZACIVSA-N 0 3 376.551 3.464 10 0 GGAEHN CN1CCN([C@H]2CC[C@@H](NC(=O)c3cc4cc(Cl)sc4[nH]3)CC2)CC1 ZINC000644062928 567529652 /nfs/dbraw/zinc/52/96/52/567529652.db2.gz YNHSPMAOXRSCTB-OKILXGFUSA-N 0 3 380.945 3.171 10 0 GGAEHN COC1CC(CCNCc2c(F)ccc(I)c2F)C1 ZINC000594967733 567530822 /nfs/dbraw/zinc/53/08/22/567530822.db2.gz UZJHBEMUSRDQQY-UHFFFAOYSA-N 0 3 381.204 3.474 10 0 GGAEHN Cc1ccc(S(=O)(=O)C[C@@H](C)NCc2cc(-n3ccnc3)cs2)cc1 ZINC000479393763 567532062 /nfs/dbraw/zinc/53/20/62/567532062.db2.gz MXVWCXKUKJRSIX-OAHLLOKOSA-N 0 3 375.519 3.194 10 0 GGAEHN FC(F)Cn1cc(CNCCc2ccc(I)cc2)cn1 ZINC000594993871 567532378 /nfs/dbraw/zinc/53/23/78/567532378.db2.gz HOVYWTOPCRDOQP-UHFFFAOYSA-N 0 3 391.203 3.085 10 0 GGAEHN Cn1ncc(C2CC2)c1CNCCc1ccc(I)cc1 ZINC000594995697 567532789 /nfs/dbraw/zinc/53/27/89/567532789.db2.gz TXZKQVSTZWTLRP-UHFFFAOYSA-N 0 3 381.261 3.234 10 0 GGAEHN CN(C)c1ccncc1CNCCc1ccc(I)cc1 ZINC000594995938 567532898 /nfs/dbraw/zinc/53/28/98/567532898.db2.gz MFZVJLWKVCHVDZ-UHFFFAOYSA-N 0 3 381.261 3.085 10 0 GGAEHN Cc1cc(NC(=O)c2cc[nH]c(=O)c2Br)ccc1OCCN(C)C ZINC000458226423 567533522 /nfs/dbraw/zinc/53/35/22/567533522.db2.gz ZLRFASIBHYFACB-UHFFFAOYSA-N 0 3 394.269 3.051 10 0 GGAEHN COc1ncc(C(=O)NCC2CCN(Cc3cccs3)CC2)cc1Cl ZINC000551779878 567534069 /nfs/dbraw/zinc/53/40/69/567534069.db2.gz KQCBUDRLXOSPGW-UHFFFAOYSA-N 0 3 379.913 3.447 10 0 GGAEHN COC(=O)CC(C)(C)C[C@@H](C)NCCS(=O)(=O)c1ccc(Cl)cc1 ZINC000595007586 567534879 /nfs/dbraw/zinc/53/48/79/567534879.db2.gz MSVUROPYPYJXHB-CYBMUJFWSA-N 0 3 375.918 3.071 10 0 GGAEHN C[C@H](CCN[C@@H]1CCc2ccc(I)cc21)[S@](C)=O ZINC000595021782 567535824 /nfs/dbraw/zinc/53/58/24/567535824.db2.gz GBALYKTZZHRAPX-RUHJCQMXSA-N 0 3 377.291 3.025 10 0 GGAEHN O=C(CN[C@@H]1CCCSCC1)Nc1ccc(I)cc1 ZINC000595038038 567537028 /nfs/dbraw/zinc/53/70/28/567537028.db2.gz FTUODMFNCAXRKX-GFCCVEGCSA-N 0 3 390.290 3.105 10 0 GGAEHN C[C@@H](CSCCF)N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 ZINC000595034238 567537361 /nfs/dbraw/zinc/53/73/61/567537361.db2.gz WHCHNUSSVVPOOA-JSGCOSHPSA-N 0 3 378.435 3.487 10 0 GGAEHN C[C@@H](NCC(=O)Nc1ccc(I)cc1)C(C)(C)C(F)F ZINC000595038322 567537615 /nfs/dbraw/zinc/53/76/15/567537615.db2.gz JLNBLFFSMHALPS-SECBINFHSA-N 0 3 396.219 3.499 10 0 GGAEHN Cc1cc(NC(=O)[C@H]2CNCCC2(F)F)nn1-c1ccc(Cl)c(Cl)c1 ZINC000644152943 567537989 /nfs/dbraw/zinc/53/79/89/567537989.db2.gz IBQJKWYHNDMOQN-LLVKDONJSA-N 0 3 389.233 3.093 10 0 GGAEHN CCOc1cc(C[NH2+]CCc2ccc(OC)nc2)cc(Br)c1[O-] ZINC000529661617 567538116 /nfs/dbraw/zinc/53/81/16/567538116.db2.gz LDUAPSIUKYQOGY-UHFFFAOYSA-N 0 3 381.270 3.289 10 0 GGAEHN C[NH+](C)CCc1ccccc1NC(=O)Cc1ccc(Br)cc1[O-] ZINC000504643588 567542783 /nfs/dbraw/zinc/54/27/83/567542783.db2.gz ZJOJRWNPMJBJOQ-UHFFFAOYSA-N 0 3 377.282 3.440 10 0 GGAEHN CN1CCC[C@H](CNC(=O)N2CC(F)(F)C(F)(F)C2)[C@H]1c1cccs1 ZINC000458425748 567546037 /nfs/dbraw/zinc/54/60/37/567546037.db2.gz LRRVXGBVZKJZQZ-YPMHNXCESA-N 0 3 379.423 3.427 10 0 GGAEHN CN1CCC[C@@H](CNC(=O)N2CC(F)(F)C(F)(F)C2)[C@H]1c1cccs1 ZINC000458425745 567546218 /nfs/dbraw/zinc/54/62/18/567546218.db2.gz LRRVXGBVZKJZQZ-AAEUAGOBSA-N 0 3 379.423 3.427 10 0 GGAEHN CC[C@@H]1CN(C(=O)c2cn(-c3ccc(Br)cc3)nc2C)C[C@H](C)N1 ZINC000620902049 567548898 /nfs/dbraw/zinc/54/88/98/567548898.db2.gz JGYXUTLFYCUNSA-SWLSCSKDSA-N 0 3 391.313 3.156 10 0 GGAEHN CC[C@H](N[C@H](C)Cn1cc(Br)ccc1=O)c1c(C)nn(C)c1C ZINC000438827847 567548990 /nfs/dbraw/zinc/54/89/90/567548990.db2.gz KLAVOMMELMCTFW-ABAIWWIYSA-N 0 3 381.318 3.091 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1ccc(Br)c(F)c1 ZINC000620915307 567550293 /nfs/dbraw/zinc/55/02/93/567550293.db2.gz HXBHIMQUSDQBHV-AWEZNQCLSA-N 0 3 399.304 3.304 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1cc(F)ccc1Br ZINC000620914299 567550672 /nfs/dbraw/zinc/55/06/72/567550672.db2.gz MYBVWNGMYQMMJE-AWEZNQCLSA-N 0 3 399.304 3.304 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1cc(Br)cs1 ZINC000620915378 567550920 /nfs/dbraw/zinc/55/09/20/567550920.db2.gz JMRXUWXIGIEHFB-ZDUSSCGKSA-N 0 3 387.343 3.226 10 0 GGAEHN O=S(=O)(c1cccs1)N1CC[C@H](CNCc2cnc(C3CCC3)s2)C1 ZINC000552015836 567550938 /nfs/dbraw/zinc/55/09/38/567550938.db2.gz YZVGLZZGGCHAGQ-CYBMUJFWSA-N 0 3 397.591 3.273 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1csc(Br)c1 ZINC000620914566 567551037 /nfs/dbraw/zinc/55/10/37/567551037.db2.gz RIYJKZMJVQEOQN-CYBMUJFWSA-N 0 3 387.343 3.226 10 0 GGAEHN O=C(COc1cc(Cl)cc(Br)c1)NC1CCN(C2CC2)CC1 ZINC000664162716 567556052 /nfs/dbraw/zinc/55/60/52/567556052.db2.gz YXMBDXIRFLQHBG-UHFFFAOYSA-N 0 3 387.705 3.224 10 0 GGAEHN CCN(C(=O)NCC1(c2ccccc2Br)CC1)[C@@H]1CCN(C)C1 ZINC000664208663 567558078 /nfs/dbraw/zinc/55/80/78/567558078.db2.gz NGDOSCKGVOQVQB-CQSZACIVSA-N 0 3 380.330 3.216 10 0 GGAEHN Cc1cc(Br)cc(C)c1N1CCC[C@H](N[C@H]2CN(C)C[C@H]2C)C1=O ZINC000552095843 567558148 /nfs/dbraw/zinc/55/81/48/567558148.db2.gz GEMQNXDPCGRZNM-PVAVHDDUSA-N 0 3 394.357 3.101 10 0 GGAEHN CC1(C)CN([C@@H](CNC[C@H](O)C(F)(F)F)c2ccc(Cl)cc2)CCO1 ZINC000644545384 567558322 /nfs/dbraw/zinc/55/83/22/567558322.db2.gz RATGDSKHERAYTJ-GJZGRUSLSA-N 0 3 380.838 3.005 10 0 GGAEHN CSc1cc(NCc2ccc(CN3CC[C@H](O)C3)cc2)nc(SC)n1 ZINC000664236329 567558738 /nfs/dbraw/zinc/55/87/38/567558738.db2.gz KBMPCBODDOQLNF-HNNXBMFYSA-N 0 3 376.551 3.099 10 0 GGAEHN Brc1cnn(CCN[C@@H]2CCCc3nn(-c4ccccc4)cc32)c1 ZINC000552099780 567558718 /nfs/dbraw/zinc/55/87/18/567558718.db2.gz SXPUDGPXDIFITJ-QGZVFWFLSA-N 0 3 386.297 3.499 10 0 GGAEHN O=C(c1cscc1Br)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000552109095 567559189 /nfs/dbraw/zinc/55/91/89/567559189.db2.gz DNSWDVJIUKRESS-CYBMUJFWSA-N 0 3 387.343 3.228 10 0 GGAEHN CC[C@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccc(OC(F)F)cc1 ZINC000552097154 567559470 /nfs/dbraw/zinc/55/94/70/567559470.db2.gz UZJURAKHSDOJPH-HOCLYGCPSA-N 0 3 376.469 3.143 10 0 GGAEHN Cc1nc(NCc2ccc(CN3CC[C@@H](O)C3)cc2)ccc1Br ZINC000664234749 567559669 /nfs/dbraw/zinc/55/96/69/567559669.db2.gz AEZPAEOBOHDSHO-MRXNPFEDSA-N 0 3 376.298 3.331 10 0 GGAEHN CC1(C)CCCN(CCNC(=O)c2cc(Br)cc3[nH]cnc32)C1 ZINC000505106555 567559682 /nfs/dbraw/zinc/55/96/82/567559682.db2.gz ALNWXXZHECUPET-UHFFFAOYSA-N 0 3 379.302 3.177 10 0 GGAEHN COc1cc(C(=O)NC[C@H]2CCN2C2CCCC2)cc(Br)c1OC ZINC000530025026 567561215 /nfs/dbraw/zinc/56/12/15/567561215.db2.gz CBGLBIPDZOTOCQ-CQSZACIVSA-N 0 3 397.313 3.213 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCC1)c1ccc(I)cc1 ZINC000530031372 567561311 /nfs/dbraw/zinc/56/13/11/567561311.db2.gz HOPUICLZIHVXJK-OAHLLOKOSA-N 0 3 384.261 3.038 10 0 GGAEHN O=C(COc1ccc(Br)cc1F)NC[C@H]1CCN1C1CCCC1 ZINC000530025062 567561422 /nfs/dbraw/zinc/56/14/22/567561422.db2.gz GRKONKBNVCLCPQ-CQSZACIVSA-N 0 3 385.277 3.100 10 0 GGAEHN CN(C)C[C@H](NC(=O)[C@H]1CCc2nccn2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031459 567561521 /nfs/dbraw/zinc/56/15/21/567561521.db2.gz JWWUSQLLGUSJDF-BBRMVZONSA-N 0 3 381.307 3.171 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCC1)[C@H]1COc2ccc(Br)cc21 ZINC000530022634 567561641 /nfs/dbraw/zinc/56/16/41/567561641.db2.gz IRVXDYVYPCKJMU-HOCLYGCPSA-N 0 3 379.298 3.058 10 0 GGAEHN CCc1cnc(CCNC[C@H](O)COc2cccc(Br)c2)s1 ZINC000644579256 567561762 /nfs/dbraw/zinc/56/17/62/567561762.db2.gz FFAHUBYWLUKFQJ-ZDUSSCGKSA-N 0 3 385.327 3.040 10 0 GGAEHN C[C@]1(C(=O)NC[C@H]2CCN2C2CCCC2)CC1(Br)Br ZINC000530022358 567562268 /nfs/dbraw/zinc/56/22/68/567562268.db2.gz LRENJDUNXUOGKX-DGCLKSJQSA-N 0 3 394.151 3.016 10 0 GGAEHN CN(C)C[C@H](NC(=O)[C@H]1CCn2ccnc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031235 567562285 /nfs/dbraw/zinc/56/22/85/567562285.db2.gz DAGUYTYOTAMQBP-BBRMVZONSA-N 0 3 381.307 3.171 10 0 GGAEHN C[C@@]1(C(=O)NC[C@@H]2CCN2C2CCCC2)CC1(Br)Br ZINC000530022357 567562468 /nfs/dbraw/zinc/56/24/68/567562468.db2.gz LRENJDUNXUOGKX-AAEUAGOBSA-N 0 3 394.151 3.016 10 0 GGAEHN CCN(C[C@H]1CCCN1CC)C(=O)c1cc2c(c(Br)c1)OCO2 ZINC000571431763 567562584 /nfs/dbraw/zinc/56/25/84/567562584.db2.gz FQYUNNLTGPPBBL-CYBMUJFWSA-N 0 3 383.286 3.124 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCC1)c1[nH]nc2ccc(Br)cc21 ZINC000530029513 567562567 /nfs/dbraw/zinc/56/25/67/567562567.db2.gz OKOSQLADEPZKFA-CYBMUJFWSA-N 0 3 377.286 3.072 10 0 GGAEHN COc1ccc(Br)c(CC(=O)NC[C@@H]2CCN2C2CCCC2)c1 ZINC000530023090 567562626 /nfs/dbraw/zinc/56/26/26/567562626.db2.gz LXEAFOVGPXGHSV-HNNXBMFYSA-N 0 3 381.314 3.133 10 0 GGAEHN C[C@H](N[C@H]1CCN(CC(=O)OC(C)(C)C)C1=O)c1ccc(Br)cc1 ZINC000595414198 567562694 /nfs/dbraw/zinc/56/26/94/567562694.db2.gz JBSDODUVVVPFSL-WFASDCNBSA-N 0 3 397.313 3.042 10 0 GGAEHN Cc1cc(C(=O)N2CCN[C@@H](C(C)C)C2)nn1-c1ccc(Br)cc1 ZINC000621154563 567562813 /nfs/dbraw/zinc/56/28/13/567562813.db2.gz NTAIHMMRWFDHAY-QGZVFWFLSA-N 0 3 391.313 3.013 10 0 GGAEHN CN(C)C[C@@H](NC(=O)[C@@H]1CCc2cncn2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031853 567563892 /nfs/dbraw/zinc/56/38/92/567563892.db2.gz CTOLTVONUHJALI-CXAGYDPISA-N 0 3 381.307 3.171 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1cnn(-c2ccc(Br)cc2)c1 ZINC000479855800 567564031 /nfs/dbraw/zinc/56/40/31/567564031.db2.gz ISZTYJWWDJHQGX-CQSZACIVSA-N 0 3 391.313 3.239 10 0 GGAEHN CN(C)C[C@H](NC(=O)[C@@H]1CCc2cncn2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031855 567564099 /nfs/dbraw/zinc/56/40/99/567564099.db2.gz CTOLTVONUHJALI-DYVFJYSZSA-N 0 3 381.307 3.171 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cscc2Br)C[C@H]1N1CCCC1 ZINC000552161475 567565012 /nfs/dbraw/zinc/56/50/12/567565012.db2.gz GKKRSMWHCJGORH-OLZOCXBDSA-N 0 3 375.357 3.162 10 0 GGAEHN Cn1nc2c(c1CNC[C@H](O)COc1ccc(Cl)c(Cl)c1)CCCC2 ZINC000644651853 567569115 /nfs/dbraw/zinc/56/91/15/567569115.db2.gz UQRLGPAOTYNBRM-LBPRGKRZSA-N 0 3 384.307 3.135 10 0 GGAEHN CCN(C(=O)N[C@H](C)Cc1ccc(F)c(Br)c1)[C@@H]1CCN(C)C1 ZINC000664460920 567570145 /nfs/dbraw/zinc/57/01/45/567570145.db2.gz KRGARASZJTZBQA-TZMCWYRMSA-N 0 3 386.309 3.255 10 0 GGAEHN CN(C(=O)N[C@H](c1cncc(Br)c1)C1CC1)[C@H]1CCN(C2CC2)C1 ZINC000505393498 567572472 /nfs/dbraw/zinc/57/24/72/567572472.db2.gz BZWNGSVCKVORDK-IRXDYDNUSA-N 0 3 393.329 3.173 10 0 GGAEHN COC[C@@H](NCC[S@@](=O)c1cc(Cl)ccc1Cl)C1CCOCC1 ZINC000595617604 567573685 /nfs/dbraw/zinc/57/36/85/567573685.db2.gz XGMVLHCJLVQUNJ-IQMFZBJNSA-N 0 3 380.337 3.132 10 0 GGAEHN CN1C[C@@H]2CCN(CC(=O)N3CCC[C@@H]3c3ccc(Cl)c(Cl)c3)[C@@H]2C1 ZINC000644735775 567573750 /nfs/dbraw/zinc/57/37/50/567573750.db2.gz GCYWLUYWDPHKQO-BMGDILEWSA-N 0 3 382.335 3.293 10 0 GGAEHN COC[C@H](NCC[S@](=O)c1cc(Cl)ccc1Cl)C1CCOCC1 ZINC000595617606 567574049 /nfs/dbraw/zinc/57/40/49/567574049.db2.gz XGMVLHCJLVQUNJ-WNSKOXEYSA-N 0 3 380.337 3.132 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)N[C@@H]2C[C@H]2c2cccc(Br)c2)CCN1C ZINC000571600599 567574715 /nfs/dbraw/zinc/57/47/15/567574715.db2.gz QKJRVULWHSNNHN-NKKGCODLSA-N 0 3 380.330 3.429 10 0 GGAEHN O=C(Nc1cnc2c(Br)cccn12)[C@@H]1CCCN1C1CCCC1 ZINC000552296513 567574793 /nfs/dbraw/zinc/57/47/93/567574793.db2.gz KXKGVOVFJYCDKU-AWEZNQCLSA-N 0 3 377.286 3.442 10 0 GGAEHN CSC1(CNC(=O)NCC(F)(F)c2cccc(F)c2)CCN(C)CC1 ZINC000595637821 567575132 /nfs/dbraw/zinc/57/51/32/567575132.db2.gz XBVQEVDQTXDNRF-UHFFFAOYSA-N 0 3 375.460 3.044 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)NCCc1ccc(Br)s1 ZINC000571639229 567578286 /nfs/dbraw/zinc/57/82/86/567578286.db2.gz KZWFENKEAFDRDA-HNNXBMFYSA-N 0 3 394.338 3.321 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)CCCSc2ccc(Br)cc2)C1 ZINC000644812067 567578662 /nfs/dbraw/zinc/57/86/62/567578662.db2.gz CUMAPMFORNWAMW-BBRMVZONSA-N 0 3 383.355 3.484 10 0 GGAEHN CC[C@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccccc1OC(F)F ZINC000552333720 567578769 /nfs/dbraw/zinc/57/87/69/567578769.db2.gz MWKQBIYYCIGPEE-HIFRSBDPSA-N 0 3 376.469 3.143 10 0 GGAEHN Cc1cc(Br)cc(C)c1N1CCC[C@H](N[C@@H]2CCCOC2)C1=O ZINC000552333621 567579094 /nfs/dbraw/zinc/57/90/94/567579094.db2.gz KFEVWUYCKAEIKU-CVEARBPZSA-N 0 3 381.314 3.330 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Br)C(=O)N1CC[C@@H]2CN(C)C[C@H]21 ZINC000644811325 567579224 /nfs/dbraw/zinc/57/92/24/567579224.db2.gz BBGPJJVKYOHXBV-MISXGVKJSA-N 0 3 387.705 3.032 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3csc(-c4cc(Br)cs4)n3)[C@@H]2C1 ZINC000644812096 567579571 /nfs/dbraw/zinc/57/95/71/567579571.db2.gz CBVWBGKZJNKVLI-BXKDBHETSA-N 0 3 398.351 3.410 10 0 GGAEHN CC(C)(CN[C@H]1CCCOc2ccc(Br)cc21)N1CCOCC1 ZINC000480080044 567579824 /nfs/dbraw/zinc/57/98/24/567579824.db2.gz FWCPJPCIDLGEFS-INIZCTEOSA-N 0 3 383.330 3.363 10 0 GGAEHN Brc1cc(CNc2ccc3c(c2)OCCNC3)cc2c1OCCO2 ZINC000530181250 567580231 /nfs/dbraw/zinc/58/02/31/567580231.db2.gz JDKBRLZPBKLZHC-UHFFFAOYSA-N 0 3 391.265 3.314 10 0 GGAEHN Brc1cc2c(cc1CNc1ccc3c(c1)OCCNC3)OCO2 ZINC000530180935 567580719 /nfs/dbraw/zinc/58/07/19/567580719.db2.gz FNZXQDKKBHSUHU-UHFFFAOYSA-N 0 3 377.238 3.272 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3cc(C(F)(F)F)ccc3Br)[C@H]2C1 ZINC000644821004 567581178 /nfs/dbraw/zinc/58/11/78/567581178.db2.gz GPHWWPUORRHVGT-RNCFNFMXSA-N 0 3 377.204 3.244 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)c3ccc(Br)c(OC(F)(F)F)c3)[C@@H]2C1 ZINC000644814668 567581208 /nfs/dbraw/zinc/58/12/08/567581208.db2.gz LNQUBBQLFFRCBN-CMPLNLGQSA-N 0 3 393.203 3.124 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)c2cc(Br)cc(C(F)(F)F)c2)C1 ZINC000644813356 567581340 /nfs/dbraw/zinc/58/13/40/567581340.db2.gz BEGSXNXPKLXSBE-ZANVPECISA-N 0 3 377.204 3.244 10 0 GGAEHN CN1CCC[C@@]2(CCN(C(=O)Cc3c(F)ccc(Br)c3F)C2)C1 ZINC000505537916 567581767 /nfs/dbraw/zinc/58/17/67/567581767.db2.gz HPPCZELGZDQIKR-QGZVFWFLSA-N 0 3 387.268 3.214 10 0 GGAEHN CN(C)C[C@H](c1ccc(Cl)c(Cl)c1)N1C(=O)N[C@@H](CC(F)(F)F)C1=O ZINC000530215381 567584582 /nfs/dbraw/zinc/58/45/82/567584582.db2.gz WJWFSQNCUPDEPB-NWDGAFQWSA-N 0 3 398.212 3.469 10 0 GGAEHN Cc1cscc1NC(=O)C(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1 ZINC000439431907 567584728 /nfs/dbraw/zinc/58/47/28/567584728.db2.gz AIIHMJSZYYQPTA-XJKSGUPXSA-N 0 3 377.535 3.256 10 0 GGAEHN O=C1N[C@@H](c2ccc(Br)cc2)C(=O)N1C[C@H]1CCN1C1CCCC1 ZINC000530212580 567584870 /nfs/dbraw/zinc/58/48/70/567584870.db2.gz LEMOXJMQIGDAIO-CVEARBPZSA-N 0 3 392.297 3.059 10 0 GGAEHN CN1CCC[C@@]2(CCN(C(=O)c3c[nH]c4cccc(Br)c34)C2)C1 ZINC000505587500 567585117 /nfs/dbraw/zinc/58/51/17/567585117.db2.gz MPPBPLIDKPEQCP-GOSISDBHSA-N 0 3 376.298 3.488 10 0 GGAEHN CN1CCC[C@]2(CCN(C(=O)c3c[nH]c4cccc(Br)c34)C2)C1 ZINC000505587501 567585791 /nfs/dbraw/zinc/58/57/91/567585791.db2.gz MPPBPLIDKPEQCP-SFHVURJKSA-N 0 3 376.298 3.488 10 0 GGAEHN O=C(NCC(F)(F)c1ccc(Br)cc1)N1CCN2CCC1CC2 ZINC000621506809 567589407 /nfs/dbraw/zinc/58/94/07/567589407.db2.gz CCINGMVITZERHI-UHFFFAOYSA-N 0 3 388.256 3.031 10 0 GGAEHN O=C(NC/C=C\c1ccc(Br)cc1)N1CC[C@H](N2CC=CC2)C1 ZINC000458958323 567590205 /nfs/dbraw/zinc/59/02/05/567590205.db2.gz ACVMTKAHNWBDBX-LIMHQNJXSA-N 0 3 376.298 3.118 10 0 GGAEHN CCN(C(=O)N[C@H]1CCOc2c(Br)cccc21)[C@H]1CCN(C)C1 ZINC000664823751 567592331 /nfs/dbraw/zinc/59/23/31/567592331.db2.gz JUZQTKYSURQUKT-WFASDCNBSA-N 0 3 382.302 3.008 10 0 GGAEHN CCN(C(=O)N[C@H](c1cncc(Br)c1)C1CC1)[C@@H]1CCN(C)C1 ZINC000664849561 567594179 /nfs/dbraw/zinc/59/41/79/567594179.db2.gz BVHLKXQFUIFCSB-CVEARBPZSA-N 0 3 381.318 3.031 10 0 GGAEHN CCOc1c(Br)cc(CNCC[C@@H](O)C(F)(F)F)cc1OC ZINC000571926017 567599735 /nfs/dbraw/zinc/59/97/35/567599735.db2.gz RNQFYEXYGODECK-GFCCVEGCSA-N 0 3 386.208 3.259 10 0 GGAEHN CCN(C(=O)NCCC(=O)Nc1cc(Cl)cc(Cl)c1)[C@@H]1CCN(C)C1 ZINC000664968595 567602536 /nfs/dbraw/zinc/60/25/36/567602536.db2.gz RTPKGOOQJNAPAN-OAHLLOKOSA-N 0 3 387.311 3.058 10 0 GGAEHN CCN(C(=O)NCCc1ccc(Br)cc1Cl)[C@H]1CCN(C)C1 ZINC000664971900 567603798 /nfs/dbraw/zinc/60/37/98/567603798.db2.gz VYINZPGJMQBGBM-AWEZNQCLSA-N 0 3 388.737 3.381 10 0 GGAEHN C[C@H](NC(=O)N1CCOC2(CCN(C)CC2)C1)c1ccc(Br)cc1 ZINC000645117051 567606634 /nfs/dbraw/zinc/60/66/34/567606634.db2.gz DRPZUZOBUGRQNY-AWEZNQCLSA-N 0 3 396.329 3.016 10 0 GGAEHN O=C(Nc1cccc(Br)c1)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000665075063 567607727 /nfs/dbraw/zinc/60/77/27/567607727.db2.gz IROQNHBMBODHLG-VXGBXAGGSA-N 0 3 382.176 3.372 10 0 GGAEHN O=C(Nc1cccc(Br)c1)C(C[C@H]1COCCO1)C(F)(F)F ZINC000665075062 567607892 /nfs/dbraw/zinc/60/78/92/567607892.db2.gz IROQNHBMBODHLG-RYUDHWBXSA-N 0 3 382.176 3.372 10 0 GGAEHN C[C@H](CN[C@H](c1ccc(Br)cc1)C(F)F)CN1CCN(C)CC1 ZINC000621751668 567608265 /nfs/dbraw/zinc/60/82/65/567608265.db2.gz LGAAISJNESQWBJ-CZUORRHYSA-N 0 3 390.316 3.228 10 0 GGAEHN C[C@@H](CN[C@@H](c1ccc(Br)cc1)C(F)F)CN1CCN(C)CC1 ZINC000621751666 567609137 /nfs/dbraw/zinc/60/91/37/567609137.db2.gz LGAAISJNESQWBJ-BBRMVZONSA-N 0 3 390.316 3.228 10 0 GGAEHN NC(=O)c1cnc(NC2CC(N3CCC(C(F)(F)F)CC3)C2)c(Cl)c1 ZINC000530535812 567609749 /nfs/dbraw/zinc/60/97/49/567609749.db2.gz PSHNCHAECPKORD-UHFFFAOYSA-N 0 3 376.810 3.051 10 0 GGAEHN C[C@@H](CCN1CCN(C)CC1)N[C@@H](c1ccc(Br)cc1)C(F)F ZINC000621760693 567610285 /nfs/dbraw/zinc/61/02/85/567610285.db2.gz PYLSASPSTASJQZ-BBRMVZONSA-N 0 3 390.316 3.371 10 0 GGAEHN CN1CCN(CCN[C@@H](c2ccc(Br)cc2)C(F)F)CC1(C)C ZINC000621761874 567610668 /nfs/dbraw/zinc/61/06/68/567610668.db2.gz OTCXEVULKSJJCN-HNNXBMFYSA-N 0 3 390.316 3.371 10 0 GGAEHN CCOc1c(Cl)cccc1CC(=O)N1C[C@@H](SC)[C@H](N2CCCC2)C1 ZINC000480572861 567612150 /nfs/dbraw/zinc/61/21/50/567612150.db2.gz BAZNDHDUARANMI-IAGOWNOFSA-N 0 3 382.957 3.319 10 0 GGAEHN CS[C@H]1CN(C(=O)Cc2cccc(Br)c2C)C[C@@H]1N1CCCC1 ZINC000480575029 567612363 /nfs/dbraw/zinc/61/23/63/567612363.db2.gz FESDNPIPGBVBHT-IRXDYDNUSA-N 0 3 397.382 3.338 10 0 GGAEHN CCOc1c(Cl)cccc1CC(=O)N1C[C@@H](N2CCCC2)[C@@H](SC)C1 ZINC000480572863 567612486 /nfs/dbraw/zinc/61/24/86/567612486.db2.gz BAZNDHDUARANMI-SJORKVTESA-N 0 3 382.957 3.319 10 0 GGAEHN O=S(=O)(CCCN[C@H]1CCN(c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000645221302 567612542 /nfs/dbraw/zinc/61/25/42/567612542.db2.gz MMZSVGLGPKFSMV-KRWDZBQOSA-N 0 3 378.925 3.372 10 0 GGAEHN CCCN(C(=O)N[C@H]1CCOc2ccc(Br)cc21)[C@@H]1CCN(C)C1 ZINC000645204627 567613088 /nfs/dbraw/zinc/61/30/88/567613088.db2.gz LSZCZCGGJDHELF-ZBFHGGJFSA-N 0 3 396.329 3.398 10 0 GGAEHN COc1ccc(Br)cc1C1(NC(=O)N[C@H]2CCN(C)[C@@H](C)C2)CC1 ZINC000645323788 567617795 /nfs/dbraw/zinc/61/77/95/567617795.db2.gz VCRSMUHKGIKIBF-JSGCOSHPSA-N 0 3 396.329 3.229 10 0 GGAEHN COc1ccc(Br)cc1C1(NC(=O)N[C@H]2CCN(C)[C@H](C)C2)CC1 ZINC000645323789 567617812 /nfs/dbraw/zinc/61/78/12/567617812.db2.gz VCRSMUHKGIKIBF-OCCSQVGLSA-N 0 3 396.329 3.229 10 0 GGAEHN COc1ccc(Br)cc1C1(NC(=O)N[C@@H]2CCN(C)[C@@H](C)C2)CC1 ZINC000645323784 567618178 /nfs/dbraw/zinc/61/81/78/567618178.db2.gz VCRSMUHKGIKIBF-GXTWGEPZSA-N 0 3 396.329 3.229 10 0 GGAEHN CN(C(=O)c1cc(=O)[nH]c2c(Br)cccc12)[C@H]1CCN(C2CC2)C1 ZINC000530694089 567619032 /nfs/dbraw/zinc/61/90/32/567619032.db2.gz VGJDPFODQBNKSY-LBPRGKRZSA-N 0 3 390.281 3.012 10 0 GGAEHN CCOc1cc(C[NH2+]CCCC(=O)N(CC)CC)cc(Br)c1[O-] ZINC000459379500 567621050 /nfs/dbraw/zinc/62/10/50/567621050.db2.gz SGYKUCRWJDZRSK-UHFFFAOYSA-N 0 3 387.318 3.292 10 0 GGAEHN Cc1nc2ccccn2c(=O)c1CCN1CCc2c(Br)cccc2C1 ZINC000572207112 567621212 /nfs/dbraw/zinc/62/12/12/567621212.db2.gz SLORFZFMPFFVLT-UHFFFAOYSA-N 0 3 398.304 3.366 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)N[C@@H](CCO)c1ccccc1Br ZINC000665361098 567622413 /nfs/dbraw/zinc/62/24/13/567622413.db2.gz IVXXDUHUJHQPSD-CJNGLKHVSA-N 0 3 398.345 3.045 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)N[C@@H](CCO)c1ccccc1Br ZINC000665361097 567622674 /nfs/dbraw/zinc/62/26/74/567622674.db2.gz IVXXDUHUJHQPSD-BBRMVZONSA-N 0 3 398.345 3.045 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1 ZINC000665362480 567622816 /nfs/dbraw/zinc/62/28/16/567622816.db2.gz FGEVARBHLMKLEJ-AWEZNQCLSA-N 0 3 388.339 3.370 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)N[C@H](CCO)c1ccccc1Br ZINC000665361100 567623049 /nfs/dbraw/zinc/62/30/49/567623049.db2.gz IVXXDUHUJHQPSD-XJKSGUPXSA-N 0 3 398.345 3.045 10 0 GGAEHN O=C(NCc1cc(Cl)ccc1Br)N1CC[C@@H](N2CC=CC2)C1 ZINC000572238675 567624230 /nfs/dbraw/zinc/62/42/30/567624230.db2.gz WVEWXEJMRCNOAC-CQSZACIVSA-N 0 3 384.705 3.258 10 0 GGAEHN CCOc1cc(C[NH2+]CCc2cccc(OC)n2)cc(Br)c1[O-] ZINC000459447548 567625998 /nfs/dbraw/zinc/62/59/98/567625998.db2.gz QSBUNTOCLCBZHO-UHFFFAOYSA-N 0 3 381.270 3.289 10 0 GGAEHN CCCN(C(=O)NCc1ccc(Br)cc1OC)[C@H]1CCN(C)C1 ZINC000645453979 567626230 /nfs/dbraw/zinc/62/62/30/567626230.db2.gz ZCBNWASLGDRBIT-HNNXBMFYSA-N 0 3 384.318 3.083 10 0 GGAEHN COc1ccc(Br)cc1C1(NC(=O)NCC2(N(C)C)CCC2)CC1 ZINC000645458647 567627732 /nfs/dbraw/zinc/62/77/32/567627732.db2.gz ZMPPOBWHDPHABM-UHFFFAOYSA-N 0 3 396.329 3.230 10 0 GGAEHN Cc1c(Br)cncc1C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000665535501 567627756 /nfs/dbraw/zinc/62/77/56/567627756.db2.gz VCGOZAIQUYUGBB-HNNXBMFYSA-N 0 3 376.298 3.055 10 0 GGAEHN Cc1c(Br)cncc1C(=O)NCCCN(C)Cc1ccccc1 ZINC000665540429 567627788 /nfs/dbraw/zinc/62/77/88/567627788.db2.gz KBSNJJSLJWLTFE-UHFFFAOYSA-N 0 3 376.298 3.404 10 0 GGAEHN CC(C)[C@H](NCC(F)(F)F)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000665537294 567627857 /nfs/dbraw/zinc/62/78/57/567627857.db2.gz LKNXEVVGNKAMJL-HIFRSBDPSA-N 0 3 377.476 3.178 10 0 GGAEHN O=C(NC[C@]1(O)CCN(Cc2ccccc2)C1)c1cc(Cl)sc1Cl ZINC000440502012 567631244 /nfs/dbraw/zinc/63/12/44/567631244.db2.gz GLZDZWIXOWRRIQ-QGZVFWFLSA-N 0 3 385.316 3.422 10 0 GGAEHN O=C(CN1CCCc2c(Cl)cc(Cl)cc21)NC1CCN(C2CC2)CC1 ZINC000459517048 567632497 /nfs/dbraw/zinc/63/24/97/567632497.db2.gz FJAAZVATIOZXKF-UHFFFAOYSA-N 0 3 382.335 3.489 10 0 GGAEHN C[C@H]1CN(CC(C)(C)O)CCN1c1ccc(Br)c(C(F)(F)F)n1 ZINC000553211696 567635016 /nfs/dbraw/zinc/63/50/16/567635016.db2.gz CIYGNHICOVNZLO-JTQLQIEISA-N 0 3 396.251 3.144 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)N[C@@H]1CCCc3sc(Cl)cc31)CCO2 ZINC000645514734 567635560 /nfs/dbraw/zinc/63/55/60/567635560.db2.gz GLYBORJTDDWEIM-CQSZACIVSA-N 0 3 383.945 3.285 10 0 GGAEHN CCOc1cc(CN2CCC[C@@H]3C[N@H+](C)CC[C@H]32)cc(Br)c1[O-] ZINC000459550641 567636070 /nfs/dbraw/zinc/63/60/70/567636070.db2.gz KKHXLWMFJHXOHO-GDBMZVCRSA-N 0 3 383.330 3.470 10 0 GGAEHN CCOc1cc(CN2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)cc(Br)c1[O-] ZINC000459550641 567636075 /nfs/dbraw/zinc/63/60/75/567636075.db2.gz KKHXLWMFJHXOHO-GDBMZVCRSA-N 0 3 383.330 3.470 10 0 GGAEHN O[C@H]1CCC[C@@H]1N1CCN(c2nccc3cc(Br)ccc32)CC1 ZINC000665698150 567636330 /nfs/dbraw/zinc/63/63/30/567636330.db2.gz WNVQUHYWQXYWGE-IRXDYDNUSA-N 0 3 376.298 3.033 10 0 GGAEHN COc1ccc(CCC(=O)NC2CCN(C3CC3)CC2)c(Br)c1 ZINC000665803069 567639132 /nfs/dbraw/zinc/63/91/32/567639132.db2.gz YVVBGVIESODNME-UHFFFAOYSA-N 0 3 381.314 3.133 10 0 GGAEHN CCOc1cc(CN2CC[C@@]3(C2)CCC[N@H+](C)C3)cc(Br)c1[O-] ZINC000459597112 567641099 /nfs/dbraw/zinc/64/10/99/567641099.db2.gz VAYOFWJNNAWEHW-SFHVURJKSA-N 0 3 383.330 3.471 10 0 GGAEHN CCOc1cc(CN2CC[C@@]3(C2)CCC[N@@H+](C)C3)cc(Br)c1[O-] ZINC000459597112 567641106 /nfs/dbraw/zinc/64/11/06/567641106.db2.gz VAYOFWJNNAWEHW-SFHVURJKSA-N 0 3 383.330 3.471 10 0 GGAEHN O=C(C(C[C@@H]1COCCO1)C(F)(F)F)N1CCCSc2ccccc21 ZINC000665927603 567644694 /nfs/dbraw/zinc/64/46/94/567644694.db2.gz WRYNYDKGKFIYON-CHWSQXEVSA-N 0 3 375.412 3.499 10 0 GGAEHN CCN(C(=O)Nc1cccc(I)c1)[C@@H]1CCN(CC)C1 ZINC000596630851 567645382 /nfs/dbraw/zinc/64/53/82/567645382.db2.gz APVAQVDZKQDFAP-CQSZACIVSA-N 0 3 387.265 3.239 10 0 GGAEHN CCN(C(=O)Nc1ccc(I)cc1)[C@H]1CCN(CC)C1 ZINC000596627726 567645593 /nfs/dbraw/zinc/64/55/93/567645593.db2.gz GJLRMAALZOPVRO-AWEZNQCLSA-N 0 3 387.265 3.239 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)CSCc2cc(-c3cccs3)on2)CN1C1CC1 ZINC000440925708 567649626 /nfs/dbraw/zinc/64/96/26/567649626.db2.gz NDLFAGDYELJAET-OLZOCXBDSA-N 0 3 377.535 3.378 10 0 GGAEHN CN(CCNS(=O)(=O)c1ccc(CC(F)(F)F)cc1)C1CCCCC1 ZINC000481018094 567651512 /nfs/dbraw/zinc/65/15/12/567651512.db2.gz DMIZAQFSNVCBNW-UHFFFAOYSA-N 0 3 378.460 3.334 10 0 GGAEHN COc1ccc2c(c1)OCC[C@H]2N[C@H](C)Cn1cc(Br)ccc1=O ZINC000666093946 567654388 /nfs/dbraw/zinc/65/43/88/567654388.db2.gz VBUYAWWFSHQOEQ-MLGOLLRUSA-N 0 3 393.281 3.121 10 0 GGAEHN COc1cccc2c1OCC[C@H]2N[C@@H](C)Cn1cc(Br)ccc1=O ZINC000666100630 567654701 /nfs/dbraw/zinc/65/47/01/567654701.db2.gz PGZDHPDUKVRQOU-SWLSCSKDSA-N 0 3 393.281 3.121 10 0 GGAEHN COc1ccc([C@H](CO)C[NH2+]Cc2cc(Br)c([O-])c(OC)c2)cc1 ZINC000459729853 567656747 /nfs/dbraw/zinc/65/67/47/567656747.db2.gz HDJCWFKPSCLQAQ-AWEZNQCLSA-N 0 3 396.281 3.038 10 0 GGAEHN Brc1ccc2ncc(CNCC[C@@H]3COc4ccccc4O3)n2c1 ZINC000481085015 567656814 /nfs/dbraw/zinc/65/68/14/567656814.db2.gz AQUXQYOHXDLKQQ-OAHLLOKOSA-N 0 3 388.265 3.417 10 0 GGAEHN C[C@H](NC(=O)CN1CCC[C@H]([C@@H]2CCOC2)C1)c1ccc(Br)cc1 ZINC000441201925 567657725 /nfs/dbraw/zinc/65/77/25/567657725.db2.gz HBZAEFXLNCRKKH-BHYGNILZSA-N 0 3 395.341 3.375 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNS(=O)(=O)Cc1cccc(Br)c1 ZINC000553477886 567657836 /nfs/dbraw/zinc/65/78/36/567657836.db2.gz CRVJDTXGPFLEGT-ZIAGYGMSSA-N 0 3 389.359 3.131 10 0 GGAEHN Cc1nn(C)c(C)c1CCCNCc1cn2ccc(Br)cc2n1 ZINC000572685873 567658032 /nfs/dbraw/zinc/65/80/32/567658032.db2.gz MWCQRMYZXDATDY-UHFFFAOYSA-N 0 3 376.302 3.170 10 0 GGAEHN O=C(CN1CCC[C@@H]([C@H]2CCOC2)C1)NCCc1cccc(Cl)c1Cl ZINC000441283193 567659013 /nfs/dbraw/zinc/65/90/13/567659013.db2.gz WJQIFXJXJCTASX-CVEARBPZSA-N 0 3 385.335 3.401 10 0 GGAEHN CCN(C(=O)Nc1cccc(C(=O)OC)c1Br)[C@H]1CCN(CC)C1 ZINC000596872321 567659489 /nfs/dbraw/zinc/65/94/89/567659489.db2.gz GFEDZTFFUOJOST-LBPRGKRZSA-N 0 3 398.301 3.184 10 0 GGAEHN C[C@H]1CCCN(CCNC(=O)N[C@@H]2CCOc3c(Br)cccc32)C1 ZINC000507100470 567660027 /nfs/dbraw/zinc/66/00/27/567660027.db2.gz HHOBGIZTQSITPB-XJKSGUPXSA-N 0 3 396.329 3.304 10 0 GGAEHN CN(Cc1ccccc1Br)C(=O)CN1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000441290101 567660554 /nfs/dbraw/zinc/66/05/54/567660554.db2.gz UCCQASQMPGKCRS-WBVHZDCISA-N 0 3 395.341 3.156 10 0 GGAEHN COC(=O)c1cccc(NC(=O)NC[C@@H]2CCN2C(C)(C)C)c1Br ZINC000596873073 567661449 /nfs/dbraw/zinc/66/14/49/567661449.db2.gz QIHOYOILAUNEMJ-NSHDSACASA-N 0 3 398.301 3.230 10 0 GGAEHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)NC[C@]1(N(C)C)CCSC1 ZINC000481184298 567661425 /nfs/dbraw/zinc/66/14/25/567661425.db2.gz BFFNLFFPKLDRRH-GOSISDBHSA-N 0 3 383.583 3.208 10 0 GGAEHN Cc1ccc2c(c1Br)CN(C(=O)Nc1cnn(CCN(C)C)c1)C2 ZINC000666239182 567661769 /nfs/dbraw/zinc/66/17/69/567661769.db2.gz SIZLMFIXUKQMJC-UHFFFAOYSA-N 0 3 392.301 3.063 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@H]1CC[C@@H](OC)C1)c1ccc(Br)cn1 ZINC000622860458 567662400 /nfs/dbraw/zinc/66/24/00/567662400.db2.gz ZYCNCHXOUVYJBN-GOEBONIOSA-N 0 3 398.345 3.334 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@@H](OC)C1CCC1)c1ccc(Br)cn1 ZINC000622860295 567662458 /nfs/dbraw/zinc/66/24/58/567662458.db2.gz UOPNLNGUTDORAY-KRWDZBQOSA-N 0 3 398.345 3.334 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@@H]1CC[C@H](OC)C1)c1ccc(Br)cn1 ZINC000622860460 567662473 /nfs/dbraw/zinc/66/24/73/567662473.db2.gz ZYCNCHXOUVYJBN-ZBFHGGJFSA-N 0 3 398.345 3.334 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@H]1CC[C@H](OC)C1)c1ccc(Br)cn1 ZINC000622860459 567662550 /nfs/dbraw/zinc/66/25/50/567662550.db2.gz ZYCNCHXOUVYJBN-HOCLYGCPSA-N 0 3 398.345 3.334 10 0 GGAEHN COc1cc(CN[C@@]2(CO)CCCc3ccccc32)cc(Br)c1O ZINC000441351536 567662882 /nfs/dbraw/zinc/66/28/82/567662882.db2.gz DAQOBEIWHHPJNO-LJQANCHMSA-N 0 3 392.293 3.477 10 0 GGAEHN C[C@H]1CN(c2ccc(Br)c(C(F)(F)F)n2)CCN1CC(C)(C)O ZINC000553532380 567663176 /nfs/dbraw/zinc/66/31/76/567663176.db2.gz SIRMSIKKCGWJSO-JTQLQIEISA-N 0 3 396.251 3.144 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)CCOc2cccc(Cl)c2Cl)CCSC1 ZINC000481221151 567663514 /nfs/dbraw/zinc/66/35/14/567663514.db2.gz XYSWMOANWPLUHV-MRXNPFEDSA-N 0 3 377.337 3.316 10 0 GGAEHN CCN(C(=O)Nc1cc(C)cc(I)c1)[C@H]1CCN(C)C1 ZINC000596913597 567664720 /nfs/dbraw/zinc/66/47/20/567664720.db2.gz KBEAYPMVTXACTO-AWEZNQCLSA-N 0 3 387.265 3.158 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000507218786 567666690 /nfs/dbraw/zinc/66/66/90/567666690.db2.gz MIFKGTZOBVNZHU-DOMZBBRYSA-N 0 3 382.302 3.056 10 0 GGAEHN CN(C)C[C@@H]1CN(C(=O)Cc2cscc2Br)c2ccccc2O1 ZINC000645787642 567666994 /nfs/dbraw/zinc/66/69/94/567666994.db2.gz SPWOSCWTQSJGFN-CYBMUJFWSA-N 0 3 395.322 3.409 10 0 GGAEHN CCN(C(=O)Nc1nc(SCc2ccccc2)ns1)[C@@H]1CCN(C)C1 ZINC000666349063 567667464 /nfs/dbraw/zinc/66/74/64/567667464.db2.gz CHBSOJAGUMCYCJ-CQSZACIVSA-N 0 3 377.539 3.388 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2ccc(Br)c(F)c2)C[C@H]1N1CCCC1 ZINC000460101423 567671986 /nfs/dbraw/zinc/67/19/86/567671986.db2.gz FFMFHGLKNCOUGD-HUUCEWRRSA-N 0 3 387.318 3.240 10 0 GGAEHN CS[C@H]1CN(C(=O)c2ccc(Br)c(F)c2)C[C@H]1N1CCCC1 ZINC000460101412 567672110 /nfs/dbraw/zinc/67/21/10/567672110.db2.gz FFMFHGLKNCOUGD-CABCVRRESA-N 0 3 387.318 3.240 10 0 GGAEHN CC[C@@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccc(Br)cc1 ZINC000507268282 567672994 /nfs/dbraw/zinc/67/29/94/567672994.db2.gz QEBOJIWFTIMODG-JKSUJKDBSA-N 0 3 389.359 3.304 10 0 GGAEHN CCN1CCCN(C(=O)N[C@@H]2CSCc3ccc(Br)cc32)CC1 ZINC000666402074 567674713 /nfs/dbraw/zinc/67/47/13/567674713.db2.gz UMCNTZHJWKICFE-MRXNPFEDSA-N 0 3 398.370 3.474 10 0 GGAEHN CN1CCCN(C(=O)N[C@@H]2CSCc3ccc(Br)cc32)CC1 ZINC000666405414 567675903 /nfs/dbraw/zinc/67/59/03/567675903.db2.gz XVSUBPFLHKHKHJ-OAHLLOKOSA-N 0 3 384.343 3.084 10 0 GGAEHN CN(C)[C@H]1CCCN(C(=O)N[C@@H]2CSCc3ccc(Br)cc32)C1 ZINC000666402688 567676579 /nfs/dbraw/zinc/67/65/79/567676579.db2.gz GWWCWRMLTSTOQJ-GOEBONIOSA-N 0 3 398.370 3.473 10 0 GGAEHN CCn1c(-c2cccc(Br)c2)nnc1N(C)[C@@H]1CCN(C2CC2)C1 ZINC000460175471 567676697 /nfs/dbraw/zinc/67/66/97/567676697.db2.gz IGOAMSZDPKKZSK-MRXNPFEDSA-N 0 3 390.329 3.400 10 0 GGAEHN C[C@@H]1CCCN(CCNC(=O)c2c(F)c(F)c(Br)c(F)c2F)C1 ZINC000666428043 567676769 /nfs/dbraw/zinc/67/67/69/567676769.db2.gz HHEVMLNBIVIGDF-MRVPVSSYSA-N 0 3 397.210 3.467 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1cscc1C(F)(F)F ZINC000622992738 567677240 /nfs/dbraw/zinc/67/72/40/567677240.db2.gz XHDDLIKVIJJDKI-GFCCVEGCSA-N 0 3 376.444 3.482 10 0 GGAEHN CN1CCN([C@H]2CC[C@@H](NC(=O)c3cscc3C(F)(F)F)CC2)CC1 ZINC000623023618 567679959 /nfs/dbraw/zinc/67/99/59/567679959.db2.gz PLCQINBTCIQKON-BETUJISGSA-N 0 3 375.460 3.055 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@@]1(C)CCCO1)c1ccc(Br)cn1 ZINC000573005543 567680594 /nfs/dbraw/zinc/68/05/94/567680594.db2.gz SOSCJJSPZCKRBD-QGZVFWFLSA-N 0 3 384.318 3.088 10 0 GGAEHN CCn1c(-c2ccc(F)cc2Br)nnc1N1CCCN(CC)CC1 ZINC000460248017 567681019 /nfs/dbraw/zinc/68/10/19/567681019.db2.gz ROTZFUKVWRRKPX-UHFFFAOYSA-N 0 3 396.308 3.399 10 0 GGAEHN CC(C)C[C@@H](C)C[C@H](C)NCc1ccc(S(=O)(=O)N2CCOCC2)s1 ZINC000507496352 567682625 /nfs/dbraw/zinc/68/26/25/567682625.db2.gz OHEDFGQJWXOYFX-CVEARBPZSA-N 0 3 388.599 3.319 10 0 GGAEHN CCn1c(CN[C@H](C)[C@@H]2C[C@H]2C(=O)OC)nc2cc(Br)ccc21 ZINC000597112681 567683662 /nfs/dbraw/zinc/68/36/62/567683662.db2.gz HMKZWLARBJBWFF-KGYLQXTDSA-N 0 3 380.286 3.106 10 0 GGAEHN Cc1ncc(CNC2CCN(Cc3ccc(Br)cc3)CC2)cn1 ZINC000531884711 567685289 /nfs/dbraw/zinc/68/52/89/567685289.db2.gz DFFGUXLFZQBDRB-UHFFFAOYSA-N 0 3 375.314 3.302 10 0 GGAEHN CCN(C(=O)Nc1cc(OC)c(Br)c(OC)c1)[C@@H]1CCN(C)C1 ZINC000666565452 567686184 /nfs/dbraw/zinc/68/61/84/567686184.db2.gz OXBXKPAUGLCKKG-GFCCVEGCSA-N 0 3 386.290 3.024 10 0 GGAEHN O=S(=O)(c1c(Cl)ccc(F)c1F)N1CCCC[C@@H](N2CCCC2)C1 ZINC000553812906 567687562 /nfs/dbraw/zinc/68/75/62/567687562.db2.gz AVXHVYNXOLOQAE-GFCCVEGCSA-N 0 3 378.872 3.257 10 0 GGAEHN CN(C)c1c(Cl)cccc1NC(=O)C(C[C@H]1COCCO1)C(F)(F)F ZINC000666613931 567689992 /nfs/dbraw/zinc/68/99/92/567689992.db2.gz IYYLSOHMEDREER-QWRGUYRKSA-N 0 3 380.794 3.329 10 0 GGAEHN CCC1(C)CCC(NCc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1 ZINC000531940617 567690133 /nfs/dbraw/zinc/69/01/33/567690133.db2.gz ABCAPONFMBMXKJ-UHFFFAOYSA-N 0 3 386.583 3.218 10 0 GGAEHN Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N1CCC[C@](O)(CN(C)C)C1 ZINC000646022732 567690172 /nfs/dbraw/zinc/69/01/72/567690172.db2.gz BPUKDQSSFCZJQZ-KRWDZBQOSA-N 0 3 399.969 3.362 10 0 GGAEHN Cc1cc(Br)c(CNC(=O)N2CC[C@]3(C2)CCCN(C)C3)s1 ZINC000666638336 567690608 /nfs/dbraw/zinc/69/06/08/567690608.db2.gz CIZUUFRFWRUGNR-MRXNPFEDSA-N 0 3 386.359 3.446 10 0 GGAEHN Cc1cc(Br)c(CNC(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)s1 ZINC000666640883 567691063 /nfs/dbraw/zinc/69/10/63/567691063.db2.gz YRWDTAAFZNHYPA-JSGCOSHPSA-N 0 3 386.359 3.445 10 0 GGAEHN Cc1cc(Br)c(CNC(=O)N2CCN(C3CC3)C[C@H](C)C2)s1 ZINC000666638959 567691182 /nfs/dbraw/zinc/69/11/82/567691182.db2.gz RWWLXTJMAJOCAR-NSHDSACASA-N 0 3 386.359 3.445 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N1CCN(C2CCC2)C[C@@H](C)C1 ZINC000553864962 567693302 /nfs/dbraw/zinc/69/33/02/567693302.db2.gz FWTXZNQPFAQSGR-CQSZACIVSA-N 0 3 395.341 3.333 10 0 GGAEHN CC[C@H](NC[C@](C)(O)CCC(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481652497 567693507 /nfs/dbraw/zinc/69/35/07/567693507.db2.gz AOTDGBJQDUGDJQ-FUHWJXTLSA-N 0 3 390.977 3.476 10 0 GGAEHN CC1(C)CC[C@@H](NCC(=O)N2CCOCC2)c2cc(Br)ccc21 ZINC000481672438 567694635 /nfs/dbraw/zinc/69/46/35/567694635.db2.gz ZODRKVCRRUESJE-MRXNPFEDSA-N 0 3 381.314 3.010 10 0 GGAEHN CC[C@H]([NH2+]CC1CCC(OC)CC1)c1ccc(Cl)c(S(=O)(=O)[N-]C)c1 ZINC000481675242 567694897 /nfs/dbraw/zinc/69/48/97/567694897.db2.gz HHDRFTYNUWUXRB-PGEKIEPBSA-N 0 3 388.961 3.494 10 0 GGAEHN CCN(CC)[C@@H](CNc1ncncc1Br)c1cccc(OC)c1 ZINC000481699284 567697020 /nfs/dbraw/zinc/69/70/20/567697020.db2.gz UXHXFOOWSWAJPB-INIZCTEOSA-N 0 3 379.302 3.165 10 0 GGAEHN Cc1ccc(NC(=O)N2CCOC3(CCN(C)CC3)C2)cc1Br ZINC000646203631 567699452 /nfs/dbraw/zinc/69/94/52/567699452.db2.gz QYTSXCSPJYULFH-UHFFFAOYSA-N 0 3 382.302 3.086 10 0 GGAEHN C[C@H](CN[C@H](c1cc(F)cc(Br)c1)C1CC1)CS(C)(=O)=O ZINC000481736694 567699764 /nfs/dbraw/zinc/69/97/64/567699764.db2.gz CBIRTGAPEKCTAX-BMIGLBTASA-N 0 3 378.307 3.310 10 0 GGAEHN C[C@H](CN[C@@H](c1cc(F)cc(Br)c1)C1CC1)CS(C)(=O)=O ZINC000481736701 567700145 /nfs/dbraw/zinc/70/01/45/567700145.db2.gz CBIRTGAPEKCTAX-MEBBXXQBSA-N 0 3 378.307 3.310 10 0 GGAEHN Cc1cc(Br)cc(C)c1NC(=O)N1CCOC2(CCN(C)CC2)C1 ZINC000646227714 567701192 /nfs/dbraw/zinc/70/11/92/567701192.db2.gz RFCZJIXMBGQJFC-UHFFFAOYSA-N 0 3 396.329 3.394 10 0 GGAEHN CCCCN1CCCC[C@H]1CNS(=O)(=O)c1cnccc1C(F)(F)F ZINC000442746220 567703789 /nfs/dbraw/zinc/70/37/89/567703789.db2.gz YIOKMZCIYQBEAC-ZDUSSCGKSA-N 0 3 379.448 3.033 10 0 GGAEHN COc1ccc(Br)c(CC(=O)Nc2ccc3c(c2F)CCNC3)c1 ZINC000573316911 567704749 /nfs/dbraw/zinc/70/47/49/567704749.db2.gz NLBCRSHGAIUREK-UHFFFAOYSA-N 0 3 393.256 3.424 10 0 GGAEHN CCN(C(=O)Nc1cc(Br)c(OC)cc1OC)[C@H]1CCN(C)C1 ZINC000666808212 567705444 /nfs/dbraw/zinc/70/54/44/567705444.db2.gz AWWVEBQREBJTOJ-NSHDSACASA-N 0 3 386.290 3.024 10 0 GGAEHN CNC(=O)CCCNCc1cc(Br)c(C)cc1Br ZINC000623380948 567705750 /nfs/dbraw/zinc/70/57/50/567705750.db2.gz WVIBSJGHGJTFBN-UHFFFAOYSA-N 0 3 378.108 3.136 10 0 GGAEHN O=C(NC1CCN(C2CC2)CC1)N1CCc2cc(F)cc(Br)c2C1 ZINC000623390360 567705959 /nfs/dbraw/zinc/70/59/59/567705959.db2.gz JYUZBSFZSNLPKL-UHFFFAOYSA-N 0 3 396.304 3.283 10 0 GGAEHN C[C@H](N[C@@H]1CN(Cc2ccccc2)C[C@H]1C)c1ncc(Br)cn1 ZINC000573344262 567705905 /nfs/dbraw/zinc/70/59/05/567705905.db2.gz QAHIBVHWVDISRG-JKIFEVAISA-N 0 3 375.314 3.410 10 0 GGAEHN O=C(NCCc1ccc(Br)s1)NC[C@H]1CCN1C1CCCC1 ZINC000623382493 567706652 /nfs/dbraw/zinc/70/66/52/567706652.db2.gz IARUPBBGDOUXOH-CYBMUJFWSA-N 0 3 386.359 3.369 10 0 GGAEHN CC[NH+](CC)[C@@H](C[N-]S(=O)(=O)c1cnccc1C(F)(F)F)CC(C)C ZINC000442766547 567706940 /nfs/dbraw/zinc/70/69/40/567706940.db2.gz WVMGESWVKXJROL-CYBMUJFWSA-N 0 3 381.464 3.135 10 0 GGAEHN CC[NH+](CC)[C@H](C[N-]S(=O)(=O)c1cnccc1C(F)(F)F)CC(C)C ZINC000442766548 567706973 /nfs/dbraw/zinc/70/69/73/567706973.db2.gz WVMGESWVKXJROL-ZDUSSCGKSA-N 0 3 381.464 3.135 10 0 GGAEHN CO[C@H](C)CCNCc1cc(Cl)cc(Cl)c1OCCN1CCOCC1 ZINC000623396378 567707400 /nfs/dbraw/zinc/70/74/00/567707400.db2.gz QILZGFLYVUHMNH-CQSZACIVSA-N 0 3 391.339 3.219 10 0 GGAEHN CN(C)[C@@H]1CCCN(C(=O)N[C@H]2CCOc3c(Br)cccc32)C1 ZINC000507806613 567707349 /nfs/dbraw/zinc/70/73/49/567707349.db2.gz CVMCEHGCJNTEGC-DOMZBBRYSA-N 0 3 382.302 3.008 10 0 GGAEHN CCN1CCCN(C(=O)N[C@@H]2CCOc3c(Br)cccc32)CC1 ZINC000507810113 567708047 /nfs/dbraw/zinc/70/80/47/567708047.db2.gz TVRNCMNUSPOERJ-OAHLLOKOSA-N 0 3 382.302 3.010 10 0 GGAEHN CCN1CCCN(C(=O)N[C@H]2CCOc3c(Br)cccc32)CC1 ZINC000507810111 567708555 /nfs/dbraw/zinc/70/85/55/567708555.db2.gz TVRNCMNUSPOERJ-HNNXBMFYSA-N 0 3 382.302 3.010 10 0 GGAEHN O=S1(=O)CCC[C@@H](CN[C@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000554085904 567708856 /nfs/dbraw/zinc/70/88/56/567708856.db2.gz HSYVGKFSEMCPFU-QFBILLFUSA-N 0 3 378.925 3.433 10 0 GGAEHN Cc1nc(-c2ccc(CNC(=O)N[C@@H]3CN(C4CC4)C[C@H]3C)s2)cs1 ZINC000532320212 567710062 /nfs/dbraw/zinc/71/00/62/567710062.db2.gz BBYGWLSJUBNBNG-IAQYHMDHSA-N 0 3 376.551 3.462 10 0 GGAEHN Cc1cc(Br)cc(NC(=O)N2CCOC3(CCN(C)CC3)C2)c1 ZINC000646367082 567712185 /nfs/dbraw/zinc/71/21/85/567712185.db2.gz IZUGKGDTENOMEQ-UHFFFAOYSA-N 0 3 382.302 3.086 10 0 GGAEHN Fc1cccc(CNCCc2cn3c(n2)SCC3)c1OCC(F)(F)F ZINC000623494273 567716182 /nfs/dbraw/zinc/71/61/82/567716182.db2.gz KBJZYFFVHGRIPE-UHFFFAOYSA-N 0 3 375.391 3.401 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)c1cc(Cl)ccc1Br ZINC000646443229 567717087 /nfs/dbraw/zinc/71/70/87/567717087.db2.gz DKYHGWOZFQJEDW-GJZGRUSLSA-N 0 3 387.705 3.038 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1cc(Cl)ccc1Br ZINC000646443231 567717107 /nfs/dbraw/zinc/71/71/07/567717107.db2.gz DKYHGWOZFQJEDW-LSDHHAIUSA-N 0 3 387.705 3.038 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1cc(Cl)cc(C(F)(F)F)c1 ZINC000646449724 567718528 /nfs/dbraw/zinc/71/85/28/567718528.db2.gz QNMXVKTVCGIWMM-CABCVRRESA-N 0 3 376.806 3.294 10 0 GGAEHN C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)N1CCOC[C@H]1[C@H]1CCCN1C ZINC000646456740 567718599 /nfs/dbraw/zinc/71/85/99/567718599.db2.gz XOHWOZHHXCNVDR-VUCTXSBTSA-N 0 3 387.307 3.082 10 0 GGAEHN CC[C@@H]1CCCCN1CCNC(=O)Cc1cc(Br)ccc1OC ZINC000461058255 567718764 /nfs/dbraw/zinc/71/87/64/567718764.db2.gz VCLBLUAWRNBWSO-MRXNPFEDSA-N 0 3 383.330 3.381 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1cc(Br)ccc1Cl ZINC000646449520 567718862 /nfs/dbraw/zinc/71/88/62/567718862.db2.gz OGOOMVWUCRONRR-LSDHHAIUSA-N 0 3 387.705 3.038 10 0 GGAEHN C[C@@H]1C[C@H]1N1C[C@H](NCc2ccc(OC(F)F)c(Br)c2)CC1=O ZINC000507953927 567718853 /nfs/dbraw/zinc/71/88/53/567718853.db2.gz WCWNITXYBKNYCM-IRUJWGPZSA-N 0 3 389.240 3.149 10 0 GGAEHN C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)N1CCOC[C@@H]1[C@H]1CCCN1C ZINC000646456739 567718955 /nfs/dbraw/zinc/71/89/55/567718955.db2.gz XOHWOZHHXCNVDR-JCURWCKSSA-N 0 3 387.307 3.082 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)c1cc(Cl)cc(C(F)(F)F)c1 ZINC000646449726 567719168 /nfs/dbraw/zinc/71/91/68/567719168.db2.gz QNMXVKTVCGIWMM-HUUCEWRRSA-N 0 3 376.806 3.294 10 0 GGAEHN C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CCOC[C@@H]1[C@@H]1CCCN1C ZINC000646449956 567719222 /nfs/dbraw/zinc/71/92/22/567719222.db2.gz SDYUIESRPKTTMM-AFAVFJNCSA-N 0 3 387.307 3.082 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1cc(Br)ccc1Cl ZINC000646449517 567719242 /nfs/dbraw/zinc/71/92/42/567719242.db2.gz OGOOMVWUCRONRR-CABCVRRESA-N 0 3 387.705 3.038 10 0 GGAEHN Cc1sc(Br)c(C(=O)N2CCOC[C@H]2[C@H]2CCCN2C)c1C ZINC000646445999 567719388 /nfs/dbraw/zinc/71/93/88/567719388.db2.gz XLZQBTUJFRKWFD-OLZOCXBDSA-N 0 3 387.343 3.063 10 0 GGAEHN Cc1nc(-c2cccs2)sc1C(=O)N1CCOC[C@H]1[C@H]1CCCN1C ZINC000646454807 567719448 /nfs/dbraw/zinc/71/94/48/567719448.db2.gz LKLVIBSPLXULIS-KGLIPLIRSA-N 0 3 377.535 3.115 10 0 GGAEHN O=C([C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12)N1CCN(c2ccncc2)CC1 ZINC000623533948 567719441 /nfs/dbraw/zinc/71/94/41/567719441.db2.gz OLWOHWAMVYZDNP-QXAKKESOSA-N 0 3 398.304 3.079 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)c1cc(F)ccc1I ZINC000597859838 567719583 /nfs/dbraw/zinc/71/95/83/567719583.db2.gz ZBIGZFPPGDZWQP-LLVKDONJSA-N 0 3 390.240 3.033 10 0 GGAEHN CCCN1CCC(CNS(=O)(=O)c2cc(Br)ccc2C)CC1 ZINC000507972595 567720193 /nfs/dbraw/zinc/72/01/93/567720193.db2.gz HEPOLLXULPUBEG-UHFFFAOYSA-N 0 3 389.359 3.158 10 0 GGAEHN CO[C@H](CNCc1c[nH]nc1-c1ccc(Br)s1)[C@@H]1CCOC1 ZINC000623562004 567721827 /nfs/dbraw/zinc/72/18/27/567721827.db2.gz DZYRNDHIULJLNX-ZYHUDNBSSA-N 0 3 386.315 3.042 10 0 GGAEHN Cc1cc(Br)c(CNCC[C@@]2(O)CCOC2)cc1Br ZINC000623560053 567721874 /nfs/dbraw/zinc/72/18/74/567721874.db2.gz UIPVEZULRUATBI-CQSZACIVSA-N 0 3 393.119 3.151 10 0 GGAEHN Cc1nn2c(CNCCN3CCc4c(Cl)cccc4C3)c(C)nc2s1 ZINC000442986900 567722073 /nfs/dbraw/zinc/72/20/73/567722073.db2.gz BMJRZYRQZNPSPB-UHFFFAOYSA-N 0 3 375.929 3.209 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NCCN1[C@H](C)CCC[C@@H]1C ZINC000461118698 567722453 /nfs/dbraw/zinc/72/24/53/567722453.db2.gz NNOVOPMUOCMLFW-OKILXGFUSA-N 0 3 383.330 3.379 10 0 GGAEHN CCCN1CCC(CNS(=O)(=O)c2ccc(F)c(C(F)(F)F)c2)CC1 ZINC000508026725 567722486 /nfs/dbraw/zinc/72/24/86/567722486.db2.gz DXETYCFTBMWGJQ-UHFFFAOYSA-N 0 3 382.423 3.245 10 0 GGAEHN CCN(C(=O)Nc1ccc2nccnc2c1Br)[C@@H]1CCN(CC)C1 ZINC000667080062 567722637 /nfs/dbraw/zinc/72/26/37/567722637.db2.gz IXSUONZXMOPVAA-GFCCVEGCSA-N 0 3 392.301 3.340 10 0 GGAEHN CC[C@H](C)N[C@H](CNC(=O)Nc1ccnc(C)c1Br)c1ccco1 ZINC000554346353 567722856 /nfs/dbraw/zinc/72/28/56/567722856.db2.gz BOUFTVPTPOGBNM-SMDDNHRTSA-N 0 3 395.301 3.418 10 0 GGAEHN CN(C)CCN(C[C@H]1CCCO1)C(=O)[C@@H]1CCc2cc(Br)ccc21 ZINC000573567933 567723091 /nfs/dbraw/zinc/72/30/91/567723091.db2.gz RPSRXXXUXRFDOZ-SJLPKXTDSA-N 0 3 395.341 3.048 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)Nc1ccc2nccnc2c1Br ZINC000667080519 567723803 /nfs/dbraw/zinc/72/38/03/567723803.db2.gz UNYSWQHJDICIHJ-LLVKDONJSA-N 0 3 392.301 3.387 10 0 GGAEHN C[C@H](N[C@H](CO)c1cccc(Br)c1)c1cccc(-n2ccnn2)c1 ZINC000554370870 567723816 /nfs/dbraw/zinc/72/38/16/567723816.db2.gz CAUIUZBMGWSOOP-SCLBCKFNSA-N 0 3 387.281 3.414 10 0 GGAEHN CN(CC(=O)Nc1ccc(Br)cc1Cl)[C@@H]1CCN(C2CC2)C1 ZINC000554364629 567724605 /nfs/dbraw/zinc/72/46/05/567724605.db2.gz KZOGNGOVJWPFMY-CYBMUJFWSA-N 0 3 386.721 3.210 10 0 GGAEHN Cc1ccc(I)c(C(=O)N[C@H]2CCN(C(C)(C)C)C2)c1 ZINC000597923130 567725012 /nfs/dbraw/zinc/72/50/12/567725012.db2.gz LTYJDUOEIZMGPX-LBPRGKRZSA-N 0 3 386.277 3.202 10 0 GGAEHN COCCCN1CCC(NC(=O)NCc2csc(C(F)(F)F)c2)CC1 ZINC000623632308 567726957 /nfs/dbraw/zinc/72/69/57/567726957.db2.gz UOPHEAOCAHSHAW-UHFFFAOYSA-N 0 3 379.448 3.067 10 0 GGAEHN C[C@H](NC[C@@H](CO)c1cccnc1)c1ccccc1I ZINC000554403577 567727194 /nfs/dbraw/zinc/72/71/94/567727194.db2.gz XKNHHOKBBHPFKW-JSGCOSHPSA-N 0 3 382.245 3.113 10 0 GGAEHN CCOc1ccc(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)nc1 ZINC000623644867 567727896 /nfs/dbraw/zinc/72/78/96/567727896.db2.gz CJIFPAVYNMCTTJ-IBGZPJMESA-N 0 3 391.309 3.252 10 0 GGAEHN OC[C@]1(NCc2nc3c(s2)CCC3)CCc2cc(Br)ccc2C1 ZINC000623644923 567728009 /nfs/dbraw/zinc/72/80/09/567728009.db2.gz GSFMJMKNEMBQAE-SFHVURJKSA-N 0 3 393.350 3.404 10 0 GGAEHN OC[C@]1(NCc2cn3ccccc3n2)CCc2cc(Br)ccc2C1 ZINC000623643975 567728025 /nfs/dbraw/zinc/72/80/25/567728025.db2.gz IUEUGIKYEXHTPQ-IBGZPJMESA-N 0 3 386.293 3.106 10 0 GGAEHN CN(C)[C@]1(CNC(=O)Nc2cnc(-c3ccc(Cl)s3)nc2)CCSC1 ZINC000646543179 567727985 /nfs/dbraw/zinc/72/79/85/567727985.db2.gz JFAHRTFFOKKNNX-INIZCTEOSA-N 0 3 397.957 3.417 10 0 GGAEHN CC(C)n1cc(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)cn1 ZINC000623644230 567728086 /nfs/dbraw/zinc/72/80/86/567728086.db2.gz QONOKEBSVDUHNG-SFHVURJKSA-N 0 3 378.314 3.236 10 0 GGAEHN CCCn1cc(CN[C@]2(CO)CCc3cc(Br)ccc3C2)cn1 ZINC000623645196 567728095 /nfs/dbraw/zinc/72/80/95/567728095.db2.gz RPVIBQMOTWBUKB-GOSISDBHSA-N 0 3 378.314 3.065 10 0 GGAEHN OC[C@@]1(NCc2cnc(C3CC3)nc2)CCc2cc(Br)ccc2C1 ZINC000623645371 567728184 /nfs/dbraw/zinc/72/81/84/567728184.db2.gz ZJJMWIMCUQUTGF-LJQANCHMSA-N 0 3 388.309 3.126 10 0 GGAEHN OC[C@]1(NCc2cnc3ccccn23)CCc2cc(Br)ccc2C1 ZINC000623643754 567728301 /nfs/dbraw/zinc/72/83/01/567728301.db2.gz AMSXKACBEUWYCT-IBGZPJMESA-N 0 3 386.293 3.106 10 0 GGAEHN CCc1ncc(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)s1 ZINC000623645149 567728325 /nfs/dbraw/zinc/72/83/25/567728325.db2.gz PVGKIRIDUJEAJC-KRWDZBQOSA-N 0 3 381.339 3.478 10 0 GGAEHN CCN(C(=O)c1ccc(I)c(Cl)c1)[C@H]1CCN(C)C1 ZINC000597945039 567729065 /nfs/dbraw/zinc/72/90/65/567729065.db2.gz GVRGOLPNNBLJCR-NSHDSACASA-N 0 3 392.668 3.111 10 0 GGAEHN CCN(C(=O)c1ccc(Cl)c(I)c1)[C@@H]1CCN(C)C1 ZINC000597947248 567728839 /nfs/dbraw/zinc/72/88/39/567728839.db2.gz WSGZCUAZGSBGKJ-LLVKDONJSA-N 0 3 392.668 3.111 10 0 GGAEHN COc1ncc(Br)cc1CNCc1ccc(OCCN(C)C)cc1 ZINC000623664808 567728997 /nfs/dbraw/zinc/72/89/97/567728997.db2.gz PADNGNMNHCWUHY-UHFFFAOYSA-N 0 3 394.313 3.083 10 0 GGAEHN CCN(C(=O)Nc1ccn(-c2ccc(Br)cc2)n1)[C@@H]1CCN(C)C1 ZINC000667145889 567729593 /nfs/dbraw/zinc/72/95/93/567729593.db2.gz AICQQDVYBYTKBH-OAHLLOKOSA-N 0 3 392.301 3.193 10 0 GGAEHN Cc1ncsc1-c1ccc(CN[C@@H]2CCCC[C@H]2NS(C)(=O)=O)cc1 ZINC000623671764 567730447 /nfs/dbraw/zinc/73/04/47/567730447.db2.gz RJRHLBPZBOWTCM-IAGOWNOFSA-N 0 3 379.551 3.069 10 0 GGAEHN Cc1ccc2c(c1Br)CN(C(=O)Nc1ccnn1CCN(C)C)C2 ZINC000667151628 567730738 /nfs/dbraw/zinc/73/07/38/567730738.db2.gz QKPCSNPPAWKXIY-UHFFFAOYSA-N 0 3 392.301 3.063 10 0 GGAEHN COc1cc(Br)ccc1[C@@H]1CCCN1C(=O)NC[C@H]1CCCN1C ZINC000623716672 567733215 /nfs/dbraw/zinc/73/32/15/567733215.db2.gz WBPCSYRLUUMNGJ-ZBFHGGJFSA-N 0 3 396.329 3.398 10 0 GGAEHN O=C(NCC/C=C\c1ccc(Br)cc1)N[C@@H]1CCN(C2CC2)C1 ZINC000623719177 567733561 /nfs/dbraw/zinc/73/35/61/567733561.db2.gz KBOFIGMQOYQRLI-SSCKWRJFSA-N 0 3 378.314 3.388 10 0 GGAEHN CC(C)(CNCc1ccc(Br)c(F)c1F)C(=O)N1CCCC1 ZINC000623745300 567734900 /nfs/dbraw/zinc/73/49/00/567734900.db2.gz PGRMTDZVKMSOPV-UHFFFAOYSA-N 0 3 375.257 3.466 10 0 GGAEHN C[C@H](NC[C@@H]1CN(Cc2ccncc2)CCO1)c1ccc(Br)s1 ZINC000623782142 567738005 /nfs/dbraw/zinc/73/80/05/567738005.db2.gz KIALYYLOEQMQCH-DZGCQCFKSA-N 0 3 396.354 3.457 10 0 GGAEHN Cc1cc(Br)ccc1CNC[C@@H]1CN(Cc2ccncc2)CCO1 ZINC000623781028 567738079 /nfs/dbraw/zinc/73/80/79/567738079.db2.gz FJKZFCACFUAZMG-LJQANCHMSA-N 0 3 390.325 3.143 10 0 GGAEHN O=C(NCCN1CCC2(CCCCC2)CC1)c1cc[nH]c(=O)c1Br ZINC000554615265 567738615 /nfs/dbraw/zinc/73/86/15/567738615.db2.gz KJHFWBSBNRVLQQ-UHFFFAOYSA-N 0 3 396.329 3.326 10 0 GGAEHN C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)NCCNC(=O)c1ccco1 ZINC000623855314 567741683 /nfs/dbraw/zinc/74/16/83/567741683.db2.gz WMMWUAJAHQWJGT-SNVBAGLBSA-N 0 3 375.778 3.297 10 0 GGAEHN Cc1ccc(Br)cc1[C@@H](C)NCCS(=O)(=O)NC(C)(C)C ZINC000623877531 567744312 /nfs/dbraw/zinc/74/43/12/567744312.db2.gz DXKIKRNHFNMHHS-GFCCVEGCSA-N 0 3 377.348 3.126 10 0 GGAEHN O=S(=O)(c1ccccc1)N1CC[C@H](NCc2cccc(Br)c2)C1 ZINC000554721620 567745646 /nfs/dbraw/zinc/74/56/46/567745646.db2.gz DPXKLYBLRFPLEW-INIZCTEOSA-N 0 3 395.322 3.002 10 0 GGAEHN CC(=O)c1cc(Br)ccc1OCC(=O)N[C@@H](CC(C)C)CN(C)C ZINC000508385338 567745940 /nfs/dbraw/zinc/74/59/40/567745940.db2.gz ITEXMPGFGVJLGR-HNNXBMFYSA-N 0 3 399.329 3.123 10 0 GGAEHN CO[C@H]1CC[C@H](C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)C1 ZINC000667427344 567746235 /nfs/dbraw/zinc/74/62/35/567746235.db2.gz CGOJRHXMTRCOHA-RDJZCZTQSA-N 0 3 383.330 3.154 10 0 GGAEHN COCc1nc2n(n1)C[C@H](N[C@@H](C)c1cc(Br)ccc1C)CC2 ZINC000623920077 567746400 /nfs/dbraw/zinc/74/64/00/567746400.db2.gz ZWKLHZBHOKEMEU-GXTWGEPZSA-N 0 3 379.302 3.161 10 0 GGAEHN Cc1cc(N2CC[C@@H](N[C@@H](C)c3cc(Br)ccc3C)C2=O)n(C)n1 ZINC000623918167 567746522 /nfs/dbraw/zinc/74/65/22/567746522.db2.gz JRJHOXRFKTYWJK-XJKSGUPXSA-N 0 3 391.313 3.256 10 0 GGAEHN Cc1ccc(Br)cc1[C@@H](C)N[C@H]1CCCN(c2ccn(C)n2)C1=O ZINC000623918599 567746917 /nfs/dbraw/zinc/74/69/17/567746917.db2.gz WITYJBBVHIUHKB-CJNGLKHVSA-N 0 3 391.313 3.337 10 0 GGAEHN Cc1cc(N2CC[C@H](N[C@H](C)c3cc(Br)ccc3C)C2=O)n(C)n1 ZINC000623918165 567747050 /nfs/dbraw/zinc/74/70/50/567747050.db2.gz JRJHOXRFKTYWJK-CJNGLKHVSA-N 0 3 391.313 3.256 10 0 GGAEHN Cc1ccc(Br)cc1[C@H](C)N[C@H]1CCCN(c2ccn(C)n2)C1=O ZINC000623918598 567747146 /nfs/dbraw/zinc/74/71/46/567747146.db2.gz WITYJBBVHIUHKB-BBRMVZONSA-N 0 3 391.313 3.337 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)C3(c4ccc(Br)cc4)CCCC3)[C@@H]2C1 ZINC000646913398 567747918 /nfs/dbraw/zinc/74/79/18/567747918.db2.gz FPKAXIOJHHPOLU-WMLDXEAASA-N 0 3 377.326 3.423 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)C3(c4ccc(Br)cc4)CCCC3)[C@@H]2C1 ZINC000646913397 567747993 /nfs/dbraw/zinc/74/79/93/567747993.db2.gz FPKAXIOJHHPOLU-RHSMWYFYSA-N 0 3 377.326 3.423 10 0 GGAEHN Cc1cc(CC(C)(C)C(=O)N2CC[C@H]3CN(C)C[C@H]32)ccc1Br ZINC000646920268 567748186 /nfs/dbraw/zinc/74/81/86/567748186.db2.gz QISGVOQIPZSZSU-DOTOQJQBSA-N 0 3 379.342 3.489 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)c2[nH]c3ccc(Br)cc3c2Cl)C1 ZINC000646915669 567748614 /nfs/dbraw/zinc/74/86/14/567748614.db2.gz SHVICHALBNYUTR-ZANVPECISA-N 0 3 382.689 3.360 10 0 GGAEHN Cc1ccc(Br)cc1[C@H](C)N[C@@H]1C[C@@H](C)N(c2cnn(C)c2)C1=O ZINC000623939313 567749034 /nfs/dbraw/zinc/74/90/34/567749034.db2.gz MHFCTNVDXJDWQY-IIYDPXPESA-N 0 3 391.313 3.336 10 0 GGAEHN C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)NC[C@H]1CCCCS1(=O)=O ZINC000623958425 567749073 /nfs/dbraw/zinc/74/90/73/567749073.db2.gz LYPOVZYWDNFLCJ-ZYHUDNBSSA-N 0 3 384.851 3.242 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3ccc(Br)cc3C(F)(F)F)[C@H]2C1 ZINC000646937718 567749153 /nfs/dbraw/zinc/74/91/53/567749153.db2.gz QYRNLLCUPSHMGW-RNCFNFMXSA-N 0 3 377.204 3.244 10 0 GGAEHN Cc1cc(C(=O)N2CC[C@@H]3CN(C)C[C@H]32)nn1-c1ccc(Cl)c(Cl)c1 ZINC000646934951 567749685 /nfs/dbraw/zinc/74/96/85/567749685.db2.gz YDDYVJKEUQBRNV-SJKOYZFVSA-N 0 3 379.291 3.264 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)Cc3csc(Cc4cccc(Cl)c4)n3)[C@H]2C1 ZINC000646943409 567751245 /nfs/dbraw/zinc/75/12/45/567751245.db2.gz IPGWOHZERNNPHC-PBHICJAKSA-N 0 3 375.925 3.092 10 0 GGAEHN O[C@@]1(CNc2ncc(Br)cc2F)CCN(Cc2ccccc2)C1 ZINC000623990208 567751762 /nfs/dbraw/zinc/75/17/62/567751762.db2.gz XEZUANPQUAXPCK-QGZVFWFLSA-N 0 3 380.261 3.032 10 0 GGAEHN C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@H](C)C1(S(C)(=O)=O)CC1 ZINC000623982481 567752110 /nfs/dbraw/zinc/75/21/10/567752110.db2.gz WCVIUJHDVJRBKB-NXEZZACHSA-N 0 3 384.851 3.240 10 0 GGAEHN C[C@@H](c1ccccc1Br)N(C)CC(=O)NC1CCN(C2CC2)CC1 ZINC000533099958 567752190 /nfs/dbraw/zinc/75/21/90/567752190.db2.gz HLHSMDNTJMNRRV-AWEZNQCLSA-N 0 3 394.357 3.185 10 0 GGAEHN COCC[C@@](C)(O)CNCc1cnc(-c2ccc(Br)cc2)s1 ZINC000533106175 567752200 /nfs/dbraw/zinc/75/22/00/567752200.db2.gz BLMRYVTWWRQVNC-MRXNPFEDSA-N 0 3 385.327 3.450 10 0 GGAEHN COCC[C@](C)(O)CNCc1cnc(-c2ccc(Br)cc2)s1 ZINC000533106174 567752523 /nfs/dbraw/zinc/75/25/23/567752523.db2.gz BLMRYVTWWRQVNC-INIZCTEOSA-N 0 3 385.327 3.450 10 0 GGAEHN OC[C@@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1ncc(Br)cc1F ZINC000623989078 567752628 /nfs/dbraw/zinc/75/26/28/567752628.db2.gz IUFQRZVLYLQGDJ-YOEHRIQHSA-N 0 3 394.288 3.278 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)[C@@H]1CCCN1CC(F)(F)F)c1ccsc1 ZINC000461905904 567753043 /nfs/dbraw/zinc/75/30/43/567753043.db2.gz WBGJJGDIXYMSCA-GJZGRUSLSA-N 0 3 377.476 3.274 10 0 GGAEHN C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)NCCC(C)(C)S(C)(=O)=O ZINC000624000803 567753376 /nfs/dbraw/zinc/75/33/76/567753376.db2.gz MADRXUOHQWFANK-SNVBAGLBSA-N 0 3 386.867 3.488 10 0 GGAEHN C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@@H]1C[C@H]2CCCCN2C1=O ZINC000623998033 567753594 /nfs/dbraw/zinc/75/35/94/567753594.db2.gz FITOVPOLLSAFPW-IXPVHAAZSA-N 0 3 375.822 3.428 10 0 GGAEHN CCS(=O)(=O)C1(CN[C@H](C)Cc2ncc(C(F)(F)F)cc2Cl)CC1 ZINC000624016149 567754682 /nfs/dbraw/zinc/75/46/82/567754682.db2.gz PBQLWNMCSHMNBA-SNVBAGLBSA-N 0 3 384.851 3.242 10 0 GGAEHN C[C@H](CN1CCCCC1)NC(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000624040329 567756441 /nfs/dbraw/zinc/75/64/41/567756441.db2.gz PDACXJXUCXFURE-ZYRRHWMLSA-N 0 3 377.326 3.325 10 0 GGAEHN CCOc1cc(C[NH2+]CCCOC[C@H]2CCCO2)cc(Br)c1[O-] ZINC000508615184 567757024 /nfs/dbraw/zinc/75/70/24/567757024.db2.gz MVDULSITMZXWOC-CQSZACIVSA-N 0 3 388.302 3.229 10 0 GGAEHN COc1ncc(Br)cc1CN[C@@H]1CCC[C@@H](c2ccnn2C)C1 ZINC000624134441 567761922 /nfs/dbraw/zinc/76/19/22/567761922.db2.gz VCCKLNUDTGRYCN-IUODEOHRSA-N 0 3 379.302 3.402 10 0 GGAEHN C[C@H](N[C@H]1C[C@H](C(N)=O)C1)c1ccc(Br)cc1Br ZINC000624129821 567761984 /nfs/dbraw/zinc/76/19/84/567761984.db2.gz YMVINOVVOHCMHK-NRPADANISA-N 0 3 376.092 3.126 10 0 GGAEHN CN1CC[C@@]2(CCN(C(=O)Nc3ccc(-c4ccc(Cl)s4)nn3)C2)C1 ZINC000667677655 567764300 /nfs/dbraw/zinc/76/43/00/567764300.db2.gz YQBMPLUSCBPMTJ-QGZVFWFLSA-N 0 3 377.901 3.418 10 0 GGAEHN CN(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)[C@@H]1CCN(C2CC2)C1 ZINC000533303240 567764481 /nfs/dbraw/zinc/76/44/81/567764481.db2.gz YCCYKDJWCLMBEU-CYBMUJFWSA-N 0 3 375.822 3.466 10 0 GGAEHN Fc1cc(CNC2CCN(C[C@@H]3CCCO3)CC2)c(F)cc1Br ZINC000624160765 567764952 /nfs/dbraw/zinc/76/49/52/567764952.db2.gz KFJXVSWFPDTMNG-AWEZNQCLSA-N 0 3 389.284 3.460 10 0 GGAEHN CCn1nccc1CCN[C@@H](C)c1cc2c(cc1Br)OCCO2 ZINC000555050204 567765454 /nfs/dbraw/zinc/76/54/54/567765454.db2.gz UHSIZKZNNWEBQO-LBPRGKRZSA-N 0 3 380.286 3.330 10 0 GGAEHN CN(C)[C@]1(CNC(=O)Nc2ccc(-c3ccc(Cl)s3)nn2)CCSC1 ZINC000667680373 567765900 /nfs/dbraw/zinc/76/59/00/567765900.db2.gz FOUAMSMUDUXBAR-INIZCTEOSA-N 0 3 397.957 3.417 10 0 GGAEHN NC(=O)[C@H]1CCC[C@H](NCc2cc(OC(F)F)ccc2Br)C1 ZINC000647185314 567768395 /nfs/dbraw/zinc/76/83/95/567768395.db2.gz XURULDYEZCIMBI-ONGXEEELSA-N 0 3 377.229 3.184 10 0 GGAEHN CC[C@@H](CNCc1ccc(S(N)(=O)=O)cc1F)Oc1ccccc1Cl ZINC000647189657 567769777 /nfs/dbraw/zinc/76/97/77/567769777.db2.gz HXQNUQUEWCEQKO-ZDUSSCGKSA-N 0 3 386.876 3.074 10 0 GGAEHN C[C@@H](NC[C@H]1CN(Cc2ccncc2)CCO1)c1cc(Br)cs1 ZINC000624263855 567771066 /nfs/dbraw/zinc/77/10/66/567771066.db2.gz PIIOIYNHWMIMNY-CJNGLKHVSA-N 0 3 396.354 3.457 10 0 GGAEHN CNC(=O)[C@@H](CNCc1ccc(SC)s1)Cc1ccc(OC)c(F)c1 ZINC000647222016 567771629 /nfs/dbraw/zinc/77/16/29/567771629.db2.gz RVWJFYLDIVNGCX-CYBMUJFWSA-N 0 3 382.526 3.312 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)Nc1cccc2c1CCNC2 ZINC000667746414 567772014 /nfs/dbraw/zinc/77/20/14/567772014.db2.gz ZHQWDGYBWSIRBK-UHFFFAOYSA-N 0 3 390.281 3.425 10 0 GGAEHN Cc1noc([C@H]2OCC[C@H]2N[C@@H](C)Cc2ccc(Br)cc2F)n1 ZINC000624303408 567772220 /nfs/dbraw/zinc/77/22/20/567772220.db2.gz BTDSGTBLRFEZNC-AMFBXLIHSA-N 0 3 384.249 3.330 10 0 GGAEHN O=S1(=O)C[C@H](CN[C@@H]2CCc3cccc(Cl)c3C2)Oc2ccccc21 ZINC000647223631 567772903 /nfs/dbraw/zinc/77/29/03/567772903.db2.gz IMQJIWJNXYYTMJ-CABCVRRESA-N 0 3 377.893 3.022 10 0 GGAEHN CC(C)(CNCc1cc(OC(F)F)ccc1Br)[C@]1(O)CCOC1 ZINC000647248045 567773865 /nfs/dbraw/zinc/77/38/65/567773865.db2.gz WMMXESDGUISBBM-INIZCTEOSA-N 0 3 394.256 3.318 10 0 GGAEHN CC(C)(CNCc1cc(OC(F)F)ccc1Br)[C@@]1(O)CCOC1 ZINC000647248046 567774402 /nfs/dbraw/zinc/77/44/02/567774402.db2.gz WMMXESDGUISBBM-MRXNPFEDSA-N 0 3 394.256 3.318 10 0 GGAEHN Cc1cc(Br)ccc1CN(C)C(=O)Nc1cnc2c(c1)CNCC2 ZINC000667805038 567774728 /nfs/dbraw/zinc/77/47/28/567774728.db2.gz VVGKKXCQRHUKMP-UHFFFAOYSA-N 0 3 389.297 3.462 10 0 GGAEHN C[C@@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@@H]1CCN(C2CCC2)C1=O ZINC000624345203 567775080 /nfs/dbraw/zinc/77/50/80/567775080.db2.gz ZCJIJOCHEJYBIH-IINYFYTJSA-N 0 3 375.822 3.428 10 0 GGAEHN CC(=O)NCc1ccc(C(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)s1 ZINC000555232105 567775257 /nfs/dbraw/zinc/77/52/57/567775257.db2.gz PWBSWGJVFRDVIC-MRXNPFEDSA-N 0 3 379.913 3.070 10 0 GGAEHN C[C@@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@H]1CCN(C2CCC2)C1=O ZINC000624345202 567775362 /nfs/dbraw/zinc/77/53/62/567775362.db2.gz ZCJIJOCHEJYBIH-HZMBPMFUSA-N 0 3 375.822 3.428 10 0 GGAEHN COc1cc(C)c(S(=O)(=O)N2CCCc3cccc(CN)c32)cc1Cl ZINC000624389424 567777394 /nfs/dbraw/zinc/77/73/94/567777394.db2.gz ABDOGQKASRAFOW-UHFFFAOYSA-N 0 3 380.897 3.257 10 0 GGAEHN Cc1ccc(S(=O)(=O)N2CCCc3cccc(CN)c32)c(Br)c1 ZINC000624388150 567777499 /nfs/dbraw/zinc/77/74/99/567777499.db2.gz NPUJECSRNDFIBI-UHFFFAOYSA-N 0 3 395.322 3.358 10 0 GGAEHN Cc1cc(Br)ccc1S(=O)(=O)N1CCCc2cccc(CN)c21 ZINC000624389490 567777531 /nfs/dbraw/zinc/77/75/31/567777531.db2.gz CEJHOMWEXHXBHX-UHFFFAOYSA-N 0 3 395.322 3.358 10 0 GGAEHN NCc1cccc2c1N(S(=O)(=O)c1ccccc1Br)CCC2 ZINC000624388440 567777717 /nfs/dbraw/zinc/77/77/17/567777717.db2.gz XORYJWHWUVHFDK-UHFFFAOYSA-N 0 3 381.295 3.049 10 0 GGAEHN NCc1cccc2c1N(S(=O)(=O)c1ccc(F)cc1Br)CCC2 ZINC000624389267 567777869 /nfs/dbraw/zinc/77/78/69/567777869.db2.gz VZIYZSWJAFOAPJ-UHFFFAOYSA-N 0 3 399.285 3.188 10 0 GGAEHN C[C@@]1(CNS(=O)(=O)CCc2cccs2)CCCN1Cc1ccccc1 ZINC000443895982 567778972 /nfs/dbraw/zinc/77/89/72/567778972.db2.gz LJUMHCPNXCUWLZ-IBGZPJMESA-N 0 3 378.563 3.265 10 0 GGAEHN CC(C)(CN[C@@H]1CCCOc2ccc(Br)cc21)[C@@]1(O)CCOC1 ZINC000647340230 567779589 /nfs/dbraw/zinc/77/95/89/567779589.db2.gz GKGPBQGLFMKOPJ-CRAIPNDOSA-N 0 3 384.314 3.430 10 0 GGAEHN CC(C)(CN[C@H](c1ccc(Br)cc1)[C@@H]1CCCO1)[C@@]1(O)CCOC1 ZINC000647340684 567779833 /nfs/dbraw/zinc/77/98/33/567779833.db2.gz NCOHNRZEADDKNH-YQVWRLOYSA-N 0 3 398.341 3.436 10 0 GGAEHN CC(C)(CN[C@@H]1CCCOc2ccc(Br)cc21)[C@]1(O)CCOC1 ZINC000647340232 567780215 /nfs/dbraw/zinc/78/02/15/567780215.db2.gz GKGPBQGLFMKOPJ-QAPCUYQASA-N 0 3 384.314 3.430 10 0 GGAEHN CC(C)(CN[C@@H]1CCCOc2c(Br)cccc21)[C@]1(O)CCOC1 ZINC000647340352 567780299 /nfs/dbraw/zinc/78/02/99/567780299.db2.gz IEODEPSEQXXNPO-QAPCUYQASA-N 0 3 384.314 3.430 10 0 GGAEHN Cc1nc2ccc(Br)cc2c(N2CCN(c3nccnn3)CC2)c1C ZINC000624443851 567780656 /nfs/dbraw/zinc/78/06/56/567780656.db2.gz WRJUDDUVEIYZFQ-UHFFFAOYSA-N 0 3 399.296 3.126 10 0 GGAEHN COc1ccc(Br)c(CN[C@@H]2CCCN(c3cc(C)nn3C)C2)c1 ZINC000444007128 567785784 /nfs/dbraw/zinc/78/57/84/567785784.db2.gz CKUZOEAJQWGLIT-OAHLLOKOSA-N 0 3 393.329 3.258 10 0 GGAEHN CC[C@@H](Cc1cccc(Br)c1)C(=O)NCCNc1ccncc1 ZINC000533813326 567788388 /nfs/dbraw/zinc/78/83/88/567788388.db2.gz FTVQXMXEUMNYIG-HNNXBMFYSA-N 0 3 376.298 3.063 10 0 GGAEHN O=C(c1cc(Br)cc(N2CCCC2)c1)N1CC[C@@H](N2CCCC2)C1 ZINC000668009352 567789248 /nfs/dbraw/zinc/78/92/48/567789248.db2.gz UKVVADZNKIDDGV-QGZVFWFLSA-N 0 3 392.341 3.360 10 0 GGAEHN Cc1ccc(S(=O)(=O)NCCNCc2ccc3nc(C)sc3c2)s1 ZINC000555584809 567790092 /nfs/dbraw/zinc/79/00/92/567790092.db2.gz AQOTYDHNGWGYHU-UHFFFAOYSA-N 0 3 381.548 3.043 10 0 GGAEHN CN(C)[C@@H]1CCCN(C(=O)c2c(F)c(F)c(Br)c(F)c2F)C1 ZINC000668022840 567790411 /nfs/dbraw/zinc/79/04/11/567790411.db2.gz RMLUQEIIRBWDIV-SSDOTTSWSA-N 0 3 383.183 3.172 10 0 GGAEHN COc1ccc(CCNCc2cnn(CC(F)(F)F)c2)c(Cl)c1OC ZINC000555595920 567790916 /nfs/dbraw/zinc/79/09/16/567790916.db2.gz CVYBFIFVQSMMPX-UHFFFAOYSA-N 0 3 377.794 3.448 10 0 GGAEHN COc1nc(NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)ncc1Br ZINC000444083215 567791123 /nfs/dbraw/zinc/79/11/23/567791123.db2.gz KEYQFUJQIDLBIT-FZMZJTMJSA-N 0 3 397.342 3.226 10 0 GGAEHN CCSc1ccc(CC(=O)N[C@H]2CCN(C3CC3)C2)c(Br)c1 ZINC000624611864 567791253 /nfs/dbraw/zinc/79/12/53/567791253.db2.gz DLJISJCXCDZWLS-ZDUSSCGKSA-N 0 3 383.355 3.457 10 0 GGAEHN COc1nc(NC[C@H]2CCCN(C)[C@@H]2c2cccs2)ncc1Br ZINC000444083216 567791305 /nfs/dbraw/zinc/79/13/05/567791305.db2.gz KEYQFUJQIDLBIT-RISCZKNCSA-N 0 3 397.342 3.226 10 0 GGAEHN Cc1ccsc1[C@H](CO)NC[C@H](O)COc1ccc(Cl)cc1Cl ZINC000555589686 567791552 /nfs/dbraw/zinc/79/15/52/567791552.db2.gz CCWSDQCBEQXAMJ-JSGCOSHPSA-N 0 3 376.305 3.426 10 0 GGAEHN C[NH+](C)CC1CCC([N-]S(=O)(=O)c2ccc(C(F)(F)F)cc2F)CC1 ZINC000444091516 567791998 /nfs/dbraw/zinc/79/19/98/567791998.db2.gz PWSJZMQEDOGJEO-UHFFFAOYSA-N 0 3 382.423 3.243 10 0 GGAEHN COc1cc(C)c(CNCCCS(=O)(=O)c2ccc(Cl)cc2)c(C)n1 ZINC000555645434 567793528 /nfs/dbraw/zinc/79/35/28/567793528.db2.gz ZITBQFHYRPVXOK-UHFFFAOYSA-N 0 3 382.913 3.314 10 0 GGAEHN Cn1cc([C@@H](NC[C@@H](O)COc2cccc(Br)c2)C(C)(C)C)cn1 ZINC000574712873 567793739 /nfs/dbraw/zinc/79/37/39/567793739.db2.gz KOLRLOWQAKVHGM-NVXWUHKLSA-N 0 3 396.329 3.299 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1ccc(Br)c(Cl)c1F ZINC000444166386 567794940 /nfs/dbraw/zinc/79/49/40/567794940.db2.gz BQCKGWIMBZTPPX-JTQLQIEISA-N 0 3 393.684 3.082 10 0 GGAEHN CN(C)CCOc1cc(NC(=O)Cc2ccc(Br)s2)ccn1 ZINC000574779193 567796441 /nfs/dbraw/zinc/79/64/41/567796441.db2.gz HKDSZQKMQFWXKC-UHFFFAOYSA-N 0 3 384.299 3.027 10 0 GGAEHN COC[C@@H](CC1CCOCC1)N[C@H]1COc2cc(F)c(Br)cc21 ZINC000668107562 567796791 /nfs/dbraw/zinc/79/67/91/567796791.db2.gz GCAVJODHCIVFBH-WBMJQRKESA-N 0 3 388.277 3.443 10 0 GGAEHN CN1CC[C@H](NC(=O)COc2cccc(Br)c2)[C@H]1c1ccccc1 ZINC000534022056 567797199 /nfs/dbraw/zinc/79/71/99/567797199.db2.gz UVQFXKONDNNGSW-PKOBYXMFSA-N 0 3 389.293 3.390 10 0 GGAEHN CS[C@H]1CN(C(=O)C(C)(C)c2cccc(Br)c2)C[C@H]1N(C)C ZINC000534093232 567799275 /nfs/dbraw/zinc/79/92/75/567799275.db2.gz SFEXEBBQPLIWDU-CABCVRRESA-N 0 3 385.371 3.231 10 0 GGAEHN CS[C@@H]1CN(C(=O)C(C)(C)c2cccc(Br)c2)C[C@@H]1N(C)C ZINC000534093235 567799581 /nfs/dbraw/zinc/79/95/81/567799581.db2.gz SFEXEBBQPLIWDU-LSDHHAIUSA-N 0 3 385.371 3.231 10 0 GGAEHN CC(C)Cn1ncc(NC(=O)NC[C@]2(N(C)C)CCSC2)c1C(F)F ZINC000534090587 567799769 /nfs/dbraw/zinc/79/97/69/567799769.db2.gz NGHIXSFUJNDKKI-MRXNPFEDSA-N 0 3 375.489 3.036 10 0 GGAEHN COC[C@H](CC1CCOCC1)N[C@H](CO)c1ccc(Br)c(F)c1 ZINC000668188667 567799935 /nfs/dbraw/zinc/79/99/35/567799935.db2.gz LAGRBKGASPCSBN-WMLDXEAASA-N 0 3 390.293 3.043 10 0 GGAEHN C[C@@H](CCNCc1c[nH]nc1-c1ccc(Br)s1)[S@@](C)=O ZINC000598968433 567800726 /nfs/dbraw/zinc/80/07/26/567800726.db2.gz NEAJSFHZPDGJRM-GWNMQOMSSA-N 0 3 376.345 3.147 10 0 GGAEHN C[C@H](CCNCc1c[nH]nc1-c1ccc(Br)s1)[S@@](C)=O ZINC000598968431 567800796 /nfs/dbraw/zinc/80/07/96/567800796.db2.gz NEAJSFHZPDGJRM-GSDQLPOLSA-N 0 3 376.345 3.147 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)CSc1cc(Cl)ccc1Cl ZINC000647822533 567802698 /nfs/dbraw/zinc/80/26/98/567802698.db2.gz VGIMKJJDSOCESM-CABCVRRESA-N 0 3 389.348 3.407 10 0 GGAEHN CC[C@H](N[C@H]1CCN(C2CCC2)C1=O)c1ccc(I)cc1 ZINC000599093294 567805191 /nfs/dbraw/zinc/80/51/91/567805191.db2.gz OJICRMWNSDSLSP-HOTGVXAUSA-N 0 3 398.288 3.485 10 0 GGAEHN CCOC(=O)[C@@H]1CC[C@@H](NCc2cc(Br)cnc2OC)C[C@@H]1C ZINC000599069663 567805246 /nfs/dbraw/zinc/80/52/46/567805246.db2.gz GMEZHIUHNMBEGP-NILFDRSVSA-N 0 3 385.302 3.310 10 0 GGAEHN Cn1cc([C@H](NCCOc2ccccc2Br)C2(CO)CCC2)cn1 ZINC000647944799 567808154 /nfs/dbraw/zinc/80/81/54/567808154.db2.gz NEUKFNLIYBOZLX-KRWDZBQOSA-N 0 3 394.313 3.055 10 0 GGAEHN Cn1cc([C@@H](NCCOc2ccccc2Br)C2(CO)CCC2)cn1 ZINC000647944800 567808217 /nfs/dbraw/zinc/80/82/17/567808217.db2.gz NEUKFNLIYBOZLX-QGZVFWFLSA-N 0 3 394.313 3.055 10 0 GGAEHN C[C@@H](NC[C@@H]1CS(=O)(=O)c2ccccc21)c1cncc(Br)c1 ZINC000575003001 567808260 /nfs/dbraw/zinc/80/82/60/567808260.db2.gz ASWFJZZAUWPTAA-DGCLKSJQSA-N 0 3 381.295 3.066 10 0 GGAEHN C[C@H](Cc1cc(Br)ccc1F)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000534381635 567809080 /nfs/dbraw/zinc/80/90/80/567809080.db2.gz BSAVIROZXPYTNZ-CJNGLKHVSA-N 0 3 396.304 3.175 10 0 GGAEHN C[C@@H](Cc1cc(Br)ccc1F)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000534381634 567809254 /nfs/dbraw/zinc/80/92/54/567809254.db2.gz BSAVIROZXPYTNZ-BBRMVZONSA-N 0 3 396.304 3.175 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)c1cc(Br)cc2[nH]c(=O)[nH]c21 ZINC000668430650 567810074 /nfs/dbraw/zinc/81/00/74/567810074.db2.gz LOZWBIVKAUXFGB-QWRGUYRKSA-N 0 3 395.301 3.024 10 0 GGAEHN COc1cc(Br)c(Cl)cc1C(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000575047580 567810691 /nfs/dbraw/zinc/81/06/91/567810691.db2.gz XFNDPTHKXKGKIV-LLVKDONJSA-N 0 3 387.705 3.420 10 0 GGAEHN CN1CCC[C@H](CNC(=O)c2cc(Br)cc(N3CCCC3)c2)C1 ZINC000668463481 567810706 /nfs/dbraw/zinc/81/07/06/567810706.db2.gz QZZMIRCUEPCGAA-CQSZACIVSA-N 0 3 380.330 3.121 10 0 GGAEHN C[C@@H]1C(=O)N(CCN(C)C)CN1Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000648065573 567812746 /nfs/dbraw/zinc/81/27/46/567812746.db2.gz IKESHKJYLFIWAM-CYBMUJFWSA-N 0 3 378.929 3.015 10 0 GGAEHN CC1(OCC(=O)Nc2cc(C(F)(F)F)ccc2SCC(F)F)CNC1 ZINC000648087452 567813476 /nfs/dbraw/zinc/81/34/76/567813476.db2.gz LIGZUQOYJPIJRY-UHFFFAOYSA-N 0 3 384.370 3.380 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1C[C@@H](C)C(O)[C@H](C)C1 ZINC000668554289 567813511 /nfs/dbraw/zinc/81/35/11/567813511.db2.gz MXEZIJCZARHGHT-CHWSQXEVSA-N 0 3 378.314 3.392 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1C[C@@H](C)C(O)[C@H](C)C1 ZINC000668553849 567813804 /nfs/dbraw/zinc/81/38/04/567813804.db2.gz HVLSHAVYSWQSEH-CHWSQXEVSA-N 0 3 378.314 3.392 10 0 GGAEHN O[C@@]1(C2CC2)CCCN(Cc2cnn(-c3ccc(Br)cc3)c2)C1 ZINC000668556487 567813862 /nfs/dbraw/zinc/81/38/62/567813862.db2.gz UYCXFAMPJBTZBI-SFHVURJKSA-N 0 3 376.298 3.372 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)N[C@@H]1CC[C@H](C)S(=O)(=O)C1 ZINC000668560778 567813897 /nfs/dbraw/zinc/81/38/97/567813897.db2.gz HJYRWECDWADDGN-UHIISALHSA-N 0 3 378.307 3.075 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1C[C@@H]2COC[C@]2(C)C1 ZINC000668597163 567814120 /nfs/dbraw/zinc/81/41/20/567814120.db2.gz RNQJCJHAFZCKHG-QAPCUYQASA-N 0 3 376.298 3.412 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1C[C@@H]2COC[C@@]2(C)C1 ZINC000668596267 567814305 /nfs/dbraw/zinc/81/43/05/567814305.db2.gz FMJMYYAEQKVNQW-CRAIPNDOSA-N 0 3 376.298 3.412 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1C[C@H]2COC[C@@]2(C)C1 ZINC000668596268 567814371 /nfs/dbraw/zinc/81/43/71/567814371.db2.gz FMJMYYAEQKVNQW-MAUKXSAKSA-N 0 3 376.298 3.412 10 0 GGAEHN Nc1c(Br)cc(Br)cc1CN[C@@H]1C[C@H](O)C12CCC2 ZINC000668623084 567815137 /nfs/dbraw/zinc/81/51/37/567815137.db2.gz ITMUHQQMZVTNNT-NEPJUHHUSA-N 0 3 390.119 3.187 10 0 GGAEHN Cn1nc2cc(Br)ccc2c1C(=O)N1CCc2ccccc2[C@H]1CN ZINC000648199244 567815325 /nfs/dbraw/zinc/81/53/25/567815325.db2.gz LYNBHVRGMHCSLF-QGZVFWFLSA-N 0 3 399.292 3.034 10 0 GGAEHN O=C(N[C@H]1CCN2CCCC[C@@H]12)c1cc2c(cncc2Br)s1 ZINC000648244937 567816034 /nfs/dbraw/zinc/81/60/34/567816034.db2.gz JVDDNBKVHPTXPO-STQMWFEESA-N 0 3 380.311 3.415 10 0 GGAEHN CN(C)Cc1ccc(CNC(=O)Nc2ccc(-c3nnnn3C3CC3)cc2)cc1 ZINC000048331631 570238323 /nfs/dbraw/zinc/23/83/23/570238323.db2.gz PVVRFYFJVCLVAD-UHFFFAOYSA-N 0 3 391.479 3.058 10 0 GGAEHN CCC(=O)N1c2ccccc2C[C@H]1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000015773570 570241031 /nfs/dbraw/zinc/24/10/31/570241031.db2.gz MZQAFOQGOZDRCN-QFIPXVFZSA-N 0 3 391.515 3.135 10 0 GGAEHN COCC1CC[NH+](Cc2ccc(-c3nc(-c4ccncc4)cc(=O)[n-]3)cc2)CC1 ZINC000048501572 570252566 /nfs/dbraw/zinc/25/25/66/570252566.db2.gz OKWXKWAWPDTCAY-UHFFFAOYSA-N 0 3 390.487 3.357 10 0 GGAEHN O=C(NCC1CCN(Cc2ccccc2F)CC1)N[C@@H]1COc2ccccc2C1 ZINC000015787346 570254127 /nfs/dbraw/zinc/25/41/27/570254127.db2.gz AQDSTIAXQSWVCH-FQEVSTJZSA-N 0 3 397.494 3.341 10 0 GGAEHN CCCN1CCN(CCCNc2ncnc3onc(-c4ccc(F)cc4)c32)CC1 ZINC000020574473 570268818 /nfs/dbraw/zinc/26/88/18/570268818.db2.gz LDAKHCMBLSIYCY-UHFFFAOYSA-N 0 3 398.486 3.254 10 0 GGAEHN O=C(c1cc(-c2cn[nH]c2)nc2cc(Cl)ccc21)N1CCN2CCC[C@H]2C1 ZINC000020726864 570276912 /nfs/dbraw/zinc/27/69/12/570276912.db2.gz IZDNJWQYVQHOOB-HNNXBMFYSA-N 0 3 381.867 3.199 10 0 GGAEHN O=C(c1cc(-c2cn[nH]c2)nc2cc(Cl)ccc21)N1CCN2CCC[C@@H]2C1 ZINC000020726860 570277031 /nfs/dbraw/zinc/27/70/31/570277031.db2.gz IZDNJWQYVQHOOB-OAHLLOKOSA-N 0 3 381.867 3.199 10 0 GGAEHN CN(C(=O)c1cc(C(F)(F)F)n[nH]1)[C@@H]1CCCN(CCc2ccccc2)C1 ZINC000020996591 570286867 /nfs/dbraw/zinc/28/68/67/570286867.db2.gz FGMNJDCNKBNTDQ-OAHLLOKOSA-N 0 3 380.414 3.208 10 0 GGAEHN CN(CCC(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2)Cc1cccs1 ZINC000012928896 570298962 /nfs/dbraw/zinc/29/89/62/570298962.db2.gz RUNGNDMZOOUBGE-UHFFFAOYSA-N 0 3 375.538 3.365 10 0 GGAEHN CCOC(=O)c1cc2c(cc1F)[C@H](N)C[C@@]1(CCN(C(=O)OC(C)(C)C)C1)O2 ZINC000725259951 570307495 /nfs/dbraw/zinc/30/74/95/570307495.db2.gz KWAKFVYOJIZAFV-FOIQADDNSA-N 0 3 394.443 3.164 10 0 GGAEHN CCOC(=O)c1cc(F)c2c(c1)O[C@@]1(CCN(C(=O)OC(C)(C)C)C1)C[C@@H]2N ZINC000725260141 570307808 /nfs/dbraw/zinc/30/78/08/570307808.db2.gz NFPVMUMJLAQTFF-XOBRGWDASA-N 0 3 394.443 3.164 10 0 GGAEHN CCOC(=O)c1ccc2c(c1)[C@@H](N)C[C@]1(CCN(C(=O)OC(C)(C)C)C1)O2 ZINC000725260157 570308543 /nfs/dbraw/zinc/30/85/43/570308543.db2.gz NMGAJQMNJMWMFJ-YWZLYKJASA-N 0 3 376.453 3.025 10 0 GGAEHN CCOC(=O)c1ccc2c(c1)O[C@]1(CCN(C(=O)OC(C)(C)C)C1)C[C@H]2N ZINC000725260525 570310066 /nfs/dbraw/zinc/31/00/66/570310066.db2.gz RNRWPNQWSSYDHZ-FOIQADDNSA-N 0 3 376.453 3.025 10 0 GGAEHN CCC[C@@]1(N2CCN(CCOC)CC2)CCCN(C(=O)OC(C)(C)C)CC1 ZINC000725265669 570323208 /nfs/dbraw/zinc/32/32/08/570323208.db2.gz SIVDYHJQVIOQPD-OAQYLSRUSA-N 0 3 383.577 3.210 10 0 GGAEHN CN(C)CCn1c2cc(NC(=O)C[C@H]3CCOc4ccccc43)ccc2oc1=O ZINC000117635490 570330371 /nfs/dbraw/zinc/33/03/71/570330371.db2.gz PKGIZKCRTPJQAS-OAHLLOKOSA-N 0 3 395.459 3.051 10 0 GGAEHN COCCn1c(C)cc(O)c([C@@H](c2ccc(OC)cc2)N2CCCCC2)c1=O ZINC000020604635 570331770 /nfs/dbraw/zinc/33/17/70/570331770.db2.gz UKXNQBWEXOYXIV-OAQYLSRUSA-N 0 3 386.492 3.093 10 0 GGAEHN CN(C)CCNC(=O)c1cn2cc(-c3ccc(C(F)(F)F)cc3)ccc2n1 ZINC000034831146 570335238 /nfs/dbraw/zinc/33/52/38/570335238.db2.gz JFXAEHOQJWBJFY-UHFFFAOYSA-N 0 3 376.382 3.312 10 0 GGAEHN Cc1ccc(NC(=O)N2CCC(CC(=O)NCCN3CCCCC3)CC2)cc1 ZINC000035399213 570349740 /nfs/dbraw/zinc/34/97/40/570349740.db2.gz JNUZRVSMFVKVMS-UHFFFAOYSA-N 0 3 386.540 3.231 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)CC1CCN(C(=O)Nc2ccccc2)CC1 ZINC000035399206 570349765 /nfs/dbraw/zinc/34/97/65/570349765.db2.gz WNNSTVKQOQPONV-GOSISDBHSA-N 0 3 386.540 3.311 10 0 GGAEHN O=C(NCCN1CCCC1)c1nc2ccccc2c(Nc2ccc(F)cc2)n1 ZINC000035430183 570358465 /nfs/dbraw/zinc/35/84/65/570358465.db2.gz LYJROMZSUGQEPE-UHFFFAOYSA-N 0 3 379.439 3.338 10 0 GGAEHN CCNC(=O)NC(=O)[C@@H](NCCCn1ccc2ccccc21)c1ccccc1 ZINC000023818319 570373173 /nfs/dbraw/zinc/37/31/73/570373173.db2.gz YSECDBIWUICZDL-FQEVSTJZSA-N 0 3 378.476 3.208 10 0 GGAEHN Cc1nc(C)n(C[C@@H]2CCCN(C[C@@H]3CO[C@@H](c4ccc(Cl)cc4)O3)C2)n1 ZINC000222028632 570374576 /nfs/dbraw/zinc/37/45/76/570374576.db2.gz GMGJUBWBSBPKGX-NSISKUIASA-N 0 3 390.915 3.375 10 0 GGAEHN CCN(CC)S(=O)(=O)c1ccc(-c2ccc(CNC[C@@H]3CCCO3)o2)cc1 ZINC000024773704 570393015 /nfs/dbraw/zinc/39/30/15/570393015.db2.gz DQOMVGFPAIIUFU-KRWDZBQOSA-N 0 3 392.521 3.246 10 0 GGAEHN O=C(CCN1CCC[C@@H](C(F)(F)F)C1)Nc1ccc(N2CCOCC2)cc1 ZINC000024841658 570396076 /nfs/dbraw/zinc/39/60/76/570396076.db2.gz NQQAJZJFBTTZAX-OAHLLOKOSA-N 0 3 385.430 3.126 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)[C@H](C)NC(=O)Nc1ccccc1)c1ccccc1 ZINC000032983780 570398615 /nfs/dbraw/zinc/39/86/15/570398615.db2.gz QPAUDEDFTOUKCY-PXNSSMCTSA-N 0 3 382.508 3.396 10 0 GGAEHN COc1ccc2c(c1)CCc1c(C(=O)N3CCN(C4CCCCC4)CC3)n[nH]c1-2 ZINC000033265832 570403775 /nfs/dbraw/zinc/40/37/75/570403775.db2.gz HDPXJQJGMVMZHS-UHFFFAOYSA-N 0 3 394.519 3.274 10 0 GGAEHN C[C@@H](C(=O)Nc1ccc2ccccc2c1)N1CCC[C@@H](CN2CCN(C)CC2)C1 ZINC000222020283 570406026 /nfs/dbraw/zinc/40/60/26/570406026.db2.gz PQCGSWLXBDABCF-PMACEKPBSA-N 0 3 394.563 3.126 10 0 GGAEHN CCC(C)(C)NCC(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)C[C@H](C)C2)cc1 ZINC000013005426 570415252 /nfs/dbraw/zinc/41/52/52/570415252.db2.gz ZBSYGJDMFHNMDO-IYBDPMFKSA-N 0 3 395.569 3.070 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)NCc1ccc(C(=O)OC)cc1)c1ccccc1 ZINC000027334688 570433069 /nfs/dbraw/zinc/43/30/69/570433069.db2.gz BGHUWDMSYRIHSJ-FQEVSTJZSA-N 0 3 383.492 3.356 10 0 GGAEHN COCC(=O)N(C[C@@H]1CN(Cc2ccc[nH]2)C[C@H]1c1ccccc1OC)C(C)C ZINC000247988453 570434127 /nfs/dbraw/zinc/43/41/27/570434127.db2.gz JONTVLQYLHESRM-GHTZIAJQSA-N 0 3 399.535 3.122 10 0 GGAEHN Cc1ccc(-c2noc(CCC(=O)N[C@@H](CN(C)C)c3ccccc3)n2)cc1 ZINC000028084817 570451155 /nfs/dbraw/zinc/45/11/55/570451155.db2.gz CRCYCOFEYNBCBD-IBGZPJMESA-N 0 3 378.476 3.397 10 0 GGAEHN CCc1sc(C(=O)NCC(=O)N2CCCN(Cc3ccccc3)CC2)cc1C ZINC000029094264 570468332 /nfs/dbraw/zinc/46/83/32/570468332.db2.gz BPTLAFLGOIMXLY-UHFFFAOYSA-N 0 3 399.560 3.083 10 0 GGAEHN CC(C)CNC(=O)[C@@H]1Cc2ccccc2N2CCN(CCc3ccccc3)C[C@H]12 ZINC000035894171 570474361 /nfs/dbraw/zinc/47/43/61/570474361.db2.gz OQSNJTBOUXXRGX-ISKFKSNPSA-N 0 3 391.559 3.364 10 0 GGAEHN c1nc(COc2ccc(CNCc3ccc(N4CCOCC4)nc3)cc2)cs1 ZINC000030636513 570493057 /nfs/dbraw/zinc/49/30/57/570493057.db2.gz MCIYABPQFHQWLR-UHFFFAOYSA-N 0 3 396.516 3.244 10 0 GGAEHN Cc1cccc(CN2CCCN(c3ccc(C(=O)NCCN(C)C)cc3)C2=O)c1 ZINC000035180827 570550065 /nfs/dbraw/zinc/55/00/65/570550065.db2.gz NBTKUDNUOPIUEJ-UHFFFAOYSA-N 0 3 394.519 3.119 10 0 GGAEHN Cc1ccc(CN2CCCN(c3cccc(C(=O)NCCN(C)C)c3)C2=O)cc1 ZINC000035180915 570550092 /nfs/dbraw/zinc/55/00/92/570550092.db2.gz CEEMQDZDNPLPSH-UHFFFAOYSA-N 0 3 394.519 3.119 10 0 GGAEHN COc1ccc(-c2c(C(=O)NCCN3CCCCC3)nc3ccccn32)cc1 ZINC000097939326 570614050 /nfs/dbraw/zinc/61/40/50/570614050.db2.gz SXJZHBWHCIQCSE-UHFFFAOYSA-N 0 3 378.476 3.226 10 0 GGAEHN CCN(Cc1ccncc1)[C@H]1CCCN(C(=O)CSc2nc(C)cs2)C1 ZINC000012448063 570667348 /nfs/dbraw/zinc/66/73/48/570667348.db2.gz CLNZTLFXRGITAW-KRWDZBQOSA-N 0 3 390.578 3.452 10 0 GGAEHN CN(C)CCNC(=O)c1cccc([C@H]2CCCN(C(=O)Nc3ccccc3)C2)c1 ZINC000033035685 570672072 /nfs/dbraw/zinc/67/20/72/570672072.db2.gz UAYDJAFUHVQKRS-FQEVSTJZSA-N 0 3 394.519 3.390 10 0 GGAEHN O=C(N[C@H]1CCCN(CCc2ccccc2)C1)c1cc2ccccc2oc1=O ZINC000012592599 570688179 /nfs/dbraw/zinc/68/81/79/570688179.db2.gz LMRWELLROFQSET-IBGZPJMESA-N 0 3 376.456 3.230 10 0 GGAEHN Cn1cc([C@@H]2NC(=O)CC[C@H]2NCc2ccc(Cl)c(C(F)(F)F)c2)cn1 ZINC000275538199 570696016 /nfs/dbraw/zinc/69/60/16/570696016.db2.gz MMXYHCDJLGIYPR-ZBFHGGJFSA-N 0 3 386.805 3.202 10 0 GGAEHN CCCN1CCN(c2ncnc3sc(C(=O)NC4CCCC4)c(C)c32)CC1 ZINC000033048412 570699648 /nfs/dbraw/zinc/69/96/48/570699648.db2.gz QYFVMXIGNIOAPV-UHFFFAOYSA-N 0 3 387.553 3.204 10 0 GGAEHN CCN1CCN(c2ccc(NC(=O)c3cnc4ccccc4n3)cc2C)CC1 ZINC000012805886 570718967 /nfs/dbraw/zinc/71/89/67/570718967.db2.gz SXDSSIKWGCPWFF-UHFFFAOYSA-N 0 3 375.476 3.332 10 0 GGAEHN COc1ccc(NC(=O)c2ccnc(N3CCN[C@@H](c4ccccc4)C3)c2)cc1 ZINC000065255900 570754374 /nfs/dbraw/zinc/75/43/74/570754374.db2.gz DUNKQKGOZNFAAF-OAQYLSRUSA-N 0 3 388.471 3.493 10 0 GGAEHN O=C(NCCc1cccs1)c1ccnc(N2CCN[C@H](c3ccccc3)C2)c1 ZINC000065255949 570754686 /nfs/dbraw/zinc/75/46/86/570754686.db2.gz OKCYXXOFPWJJCV-FQEVSTJZSA-N 0 3 392.528 3.267 10 0 GGAEHN O=C(NCCc1cccs1)c1ccnc(N2CCN[C@@H](c3ccccc3)C2)c1 ZINC000065255950 570754793 /nfs/dbraw/zinc/75/47/93/570754793.db2.gz OKCYXXOFPWJJCV-HXUWFJFHSA-N 0 3 392.528 3.267 10 0 GGAEHN COc1ccccc1NC(=O)c1cccc(N2CCN[C@H](c3ccccc3)C2)n1 ZINC000065256235 570755241 /nfs/dbraw/zinc/75/52/41/570755241.db2.gz PNELSKLEOIEYAF-FQEVSTJZSA-N 0 3 388.471 3.493 10 0 GGAEHN Cc1ccc(CNC(=O)c2cccc(N3CCN[C@H](c4ccccc4)C3)n2)cc1 ZINC000065256257 570755255 /nfs/dbraw/zinc/75/52/55/570755255.db2.gz MQVDNKOAPUWGMS-QFIPXVFZSA-N 0 3 386.499 3.471 10 0 GGAEHN COc1cc(CNC[C@H]2CCCO2)ccc1OCC(=O)Nc1ccc(C)cc1 ZINC000013731375 570783340 /nfs/dbraw/zinc/78/33/40/570783340.db2.gz FDFUHTXFNMGFGN-LJQANCHMSA-N 0 3 384.476 3.290 10 0 GGAEHN Cc1oc2c(c1C(=O)NCCN1CCCC1)CN(Cc1ccc(C)cc1)CC2 ZINC000065289690 570785209 /nfs/dbraw/zinc/78/52/09/570785209.db2.gz ZGHKWLCKGGIASE-UHFFFAOYSA-N 0 3 381.520 3.280 10 0 GGAEHN O=C(c1ccoc1)N1CCC(N[C@@H](C(=O)N2CCCCC2)c2ccccc2)CC1 ZINC000096794836 570785509 /nfs/dbraw/zinc/78/55/09/570785509.db2.gz AGDKPDYVZXPTAI-OAQYLSRUSA-N 0 3 395.503 3.228 10 0 GGAEHN CN(C)C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1 ZINC000032779415 570807831 /nfs/dbraw/zinc/80/78/31/570807831.db2.gz PDSAYRGGCMGBTH-QFIPXVFZSA-N 0 3 380.536 3.253 10 0 GGAEHN CC(=O)N[C@H](CC(=O)N[C@@H](CN(C)C)c1ccccc1)c1ccc(Cl)cc1 ZINC000032781284 570809069 /nfs/dbraw/zinc/80/90/69/570809069.db2.gz XTFPDZIBEDPKLF-UXHICEINSA-N 0 3 387.911 3.326 10 0 GGAEHN CC(=O)N[C@H](CC(=O)N[C@H](CN(C)C)c1ccccc1)c1ccc(Cl)cc1 ZINC000032781283 570809138 /nfs/dbraw/zinc/80/91/38/570809138.db2.gz XTFPDZIBEDPKLF-WOJBJXKFSA-N 0 3 387.911 3.326 10 0 GGAEHN COC(=O)c1cccc(OC[C@H](O)CN(C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000014242189 570836518 /nfs/dbraw/zinc/83/65/18/570836518.db2.gz RMACAFQRMAQOTG-QGZVFWFLSA-N 0 3 397.393 3.364 10 0 GGAEHN NC(=O)c1cc(N2CCCN(Cc3ccc(F)cc3)CC2)nc2ccccc21 ZINC000032829222 570843936 /nfs/dbraw/zinc/84/39/36/570843936.db2.gz DPZGHPIKYGCCNQ-UHFFFAOYSA-N 0 3 378.451 3.185 10 0 GGAEHN Cc1c(NC(=O)CCN(C)Cc2ccc(F)cc2)c(=O)n(-c2ccccc2)n1C ZINC000032870790 570868581 /nfs/dbraw/zinc/86/85/81/570868581.db2.gz FWLGIFSWCCIANL-UHFFFAOYSA-N 0 3 396.466 3.084 10 0 GGAEHN CCOC(=O)c1ccc(OC[C@@H](O)CN(C)[C@H](C)c2ccc(F)cc2)cc1 ZINC000103453699 570885369 /nfs/dbraw/zinc/88/53/69/570885369.db2.gz TUVLYSBOWWNEJR-BEFAXECRSA-N 0 3 375.440 3.435 10 0 GGAEHN CCCn1ccc2sc(C)c(C(=O)NCCN3CCCCCC3)c2c1=O ZINC000097124442 570897470 /nfs/dbraw/zinc/89/74/70/570897470.db2.gz UVQTZHKPVVECJU-UHFFFAOYSA-N 0 3 375.538 3.387 10 0 GGAEHN Cn1ccnc1[C@H](O)C1CCN(C[C@](C)(O)c2cccc(C(F)(F)F)c2)CC1 ZINC000089895892 570918601 /nfs/dbraw/zinc/91/86/01/570918601.db2.gz HRQHKFVPHVCDEA-MJGOQNOKSA-N 0 3 397.441 3.092 10 0 GGAEHN Cn1ccnc1[C@@H](O)C1CCN(C[C@](C)(O)c2cccc(C(F)(F)F)c2)CC1 ZINC000089895888 570918622 /nfs/dbraw/zinc/91/86/22/570918622.db2.gz HRQHKFVPHVCDEA-HKUYNNGSSA-N 0 3 397.441 3.092 10 0 GGAEHN COCCn1c(C)cc(O)c([C@@H](c2ccccc2F)N2CCC(C)CC2)c1=O ZINC000016993430 570923040 /nfs/dbraw/zinc/92/30/40/570923040.db2.gz MYAAATZEKSTUNH-OAQYLSRUSA-N 0 3 388.483 3.469 10 0 GGAEHN C[C@H](C(=O)N1[C@H](C)CCC[C@H]1C)N1CCC(C(=O)NCc2ccccc2)CC1 ZINC000016396467 570924251 /nfs/dbraw/zinc/92/42/51/570924251.db2.gz FHFCRYKRHKSARB-GUDVDZBRSA-N 0 3 385.552 3.193 10 0 GGAEHN CN(C)[C@H](CNC(=O)CCc1nc(-c2ccc(F)cc2)no1)c1ccccc1 ZINC000016599819 570928794 /nfs/dbraw/zinc/92/87/94/570928794.db2.gz DMJCFVVZXBWQFL-GOSISDBHSA-N 0 3 382.439 3.227 10 0 GGAEHN COc1cccc(CC(=O)N2CCOc3ccc(CN4CCCC4)cc3C2)c1 ZINC000014880881 570951602 /nfs/dbraw/zinc/95/16/02/570951602.db2.gz KEPUKOHGFICXJW-UHFFFAOYSA-N 0 3 380.488 3.255 10 0 GGAEHN O=C(NCCN1CCCC1)c1ccc(-c2nc(-c3ccc(F)cc3)no2)cc1 ZINC000033278978 570953482 /nfs/dbraw/zinc/95/34/82/570953482.db2.gz BNGGDENOLQSJSM-UHFFFAOYSA-N 0 3 380.423 3.368 10 0 GGAEHN O=C(Nc1cccc(CN[C@@H]2CCN(CCc3ccccc3)C2)c1)[C@H]1CCCO1 ZINC000107068675 570970231 /nfs/dbraw/zinc/97/02/31/570970231.db2.gz PJFXGOHPGYQHIS-DHIUTWEWSA-N 0 3 393.531 3.211 10 0 GGAEHN COCCN1CCC(CNC(=O)c2cnn(CCC(C)C)c2C(C)C)CC1 ZINC000252505824 570977854 /nfs/dbraw/zinc/97/78/54/570977854.db2.gz VUAKCYNFZKQYBJ-UHFFFAOYSA-N 0 3 378.561 3.141 10 0 GGAEHN CC(=O)N1CCc2[nH]cnc2C12CCN(Cc1[nH]c3ccccc3c1C)CC2 ZINC000091602469 571017035 /nfs/dbraw/zinc/01/70/35/571017035.db2.gz ODNWUVJBCPWYEU-UHFFFAOYSA-N 0 3 377.492 3.095 10 0 GGAEHN CC(=O)N1CCc2nc[nH]c2C12CCN(Cc1[nH]c3ccccc3c1C)CC2 ZINC000091602469 571017040 /nfs/dbraw/zinc/01/70/40/571017040.db2.gz ODNWUVJBCPWYEU-UHFFFAOYSA-N 0 3 377.492 3.095 10 0 GGAEHN Cn1cc(NC(=O)NC2CCN(Cc3ccccc3)CC2)c2ccccc2c1=O ZINC000015680503 571045003 /nfs/dbraw/zinc/04/50/03/571045003.db2.gz YNUQYILAENNQPQ-UHFFFAOYSA-N 0 3 390.487 3.325 10 0 GGAEHN O=C(Nc1cc(-c2cccs2)[nH]n1)C(C[C@H]1COCCO1)C(F)(F)F ZINC000616333085 651896281 /nfs/dbraw/zinc/89/62/81/651896281.db2.gz SUUXCBAOMOVQPA-VHSXEESVSA-N 0 3 375.372 3.061 10 0 GGAEHN COC(=O)COc1cccc(NC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000054412470 1406727565 /nfs/dbraw/zinc/72/75/65/1406727565.db2.gz FIWJYQJBSUZZRW-LPHOPBHVSA-N 0 3 397.475 3.195 10 0 GGAEHN C[C@@H](C(=O)N1CCN(c2ccccc2)CC1)N1CCC(c2ccc(O)cc2)CC1 ZINC000055103204 1406885604 /nfs/dbraw/zinc/88/56/04/1406885604.db2.gz GXECYWNSIDKREC-IBGZPJMESA-N 0 3 393.531 3.309 10 0 GGAEHN CC(=O)Nc1ccc(CNCc2cc3c(c(Br)c2)OCO3)cc1 ZINC000055472727 1406975774 /nfs/dbraw/zinc/97/57/74/1406975774.db2.gz BWLPPTYLFWGKPW-UHFFFAOYSA-N 0 3 377.238 3.426 10 0 GGAEHN Cc1cccc2c1cnn2C(=O)CCC(=O)N1CCN(C2CCCCC2)CC1 ZINC000020386014 1399346048 /nfs/dbraw/zinc/34/60/48/1399346048.db2.gz XADQSSWJYPKUQV-UHFFFAOYSA-N 0 3 382.508 3.242 10 0 GGAEHN CCOC(=O)C1=C(CN2C[C@H](C)C[C@@H](C)C2)NC(=O)N[C@@H]1c1ccc(C)cc1 ZINC000020560268 1399349618 /nfs/dbraw/zinc/34/96/18/1399349618.db2.gz JOAZBEZPXLZMIT-JXXFODFXSA-N 0 3 385.508 3.144 10 0 GGAEHN Fc1ccc(CN2CCC(CNc3nn4nnnc4c4ccccc43)CC2)cc1 ZINC000021777333 1399409156 /nfs/dbraw/zinc/40/91/56/1399409156.db2.gz ONPSNYDDCJGVSA-UHFFFAOYSA-N 0 3 391.454 3.136 10 0 GGAEHN CCc1ccc(NC(=O)N2CCN(c3cc(N4CCCC4)nc(C)n3)CC2)cc1 ZINC000021795092 1399409796 /nfs/dbraw/zinc/40/97/96/1399409796.db2.gz XHXUTUAETVWETN-UHFFFAOYSA-N 0 3 394.523 3.302 10 0 GGAEHN C[C@@H](NC[C@H](O)COc1cccc2ccccc21)c1ccc(S(C)(=O)=O)cc1 ZINC000025695368 1399830802 /nfs/dbraw/zinc/83/08/02/1399830802.db2.gz QAZWFTXDIOKNHV-APWZRJJASA-N 0 3 399.512 3.334 10 0 GGAEHN C[C@H](NC[C@H](O)COc1cccc2ccccc21)c1ccc(S(C)(=O)=O)cc1 ZINC000025695371 1399830806 /nfs/dbraw/zinc/83/08/06/1399830806.db2.gz QAZWFTXDIOKNHV-LPHOPBHVSA-N 0 3 399.512 3.334 10 0 GGAEHN CCN1CCN(Cc2ccc(CNC(=S)Nc3ccccc3C#N)cc2)CC1 ZINC000044184420 1403897043 /nfs/dbraw/zinc/89/70/43/1403897043.db2.gz LHBWYAMKTIPYFU-UHFFFAOYSA-N 0 3 393.560 3.182 10 0 GGAEHN O=C(NCCCN1CCN(Cc2ccccc2)CC1)[C@H]1C[C@H]1c1ccc(F)cc1 ZINC000047459955 1404844110 /nfs/dbraw/zinc/84/41/10/1404844110.db2.gz FHOWTHMXBFPESC-GOTSBHOMSA-N 0 3 395.522 3.253 10 0 GGAEHN COc1ccc([C@@H](C)NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(OC)c1 ZINC000047964804 1405012992 /nfs/dbraw/zinc/01/29/92/1405012992.db2.gz FMSOIKYGJNYJAU-AEFFLSMTSA-N 0 3 383.492 3.339 10 0 GGAEHN COc1cc(CN[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)cc(OC)c1 ZINC000048744802 1405278927 /nfs/dbraw/zinc/27/89/27/1405278927.db2.gz DJFOZPFIGWEZJV-HNNXBMFYSA-N 0 3 384.476 3.212 10 0 GGAEHN COc1ccc(CNCc2cccc(OCC(=O)N(C)C)c2)cc1OC(F)F ZINC000048745673 1405279877 /nfs/dbraw/zinc/27/98/77/1405279877.db2.gz GKAOBHFKFZAOPY-UHFFFAOYSA-N 0 3 394.418 3.053 10 0 GGAEHN COc1ccccc1[C@@H](CNCc1cnc(N2CCCC2)nc1)N1CCCCC1 ZINC000048777531 1405287587 /nfs/dbraw/zinc/28/75/87/1405287587.db2.gz AWRKVOOLTIAMLN-OAQYLSRUSA-N 0 3 395.551 3.402 10 0 GGAEHN Cc1ccc([C@@H](CNC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)N(C)C)cc1 ZINC000049407832 1405378455 /nfs/dbraw/zinc/37/84/55/1405378455.db2.gz FVQRDIOWFIWPCH-IFMALSPDSA-N 0 3 393.531 3.384 10 0 GGAEHN C[C@H](C(=O)NCCc1ccc2c(c1)OCCO2)N(C)CCCc1ccccc1 ZINC000052802879 1406176370 /nfs/dbraw/zinc/17/63/70/1406176370.db2.gz IFHIQGOKQBSKQN-GOSISDBHSA-N 0 3 382.504 3.070 10 0 GGAEHN O=C(NC[C@H](c1ccccc1)N1CCCC1)[C@H]1CCC(=O)N1c1ccccc1 ZINC000062355639 1408242572 /nfs/dbraw/zinc/24/25/72/1408242572.db2.gz WUQODCSZYGQOGM-NHCUHLMSSA-N 0 3 377.488 3.135 10 0 GGAEHN COC(=O)CCN(CC(=O)NCCc1cccc(Cl)c1Cl)CC(C)C ZINC000064558675 1408578225 /nfs/dbraw/zinc/57/82/25/1408578225.db2.gz COOLCTDYXCTERH-UHFFFAOYSA-N 0 3 389.323 3.173 10 0 GGAEHN CCCOc1ccc(CNCc2cccnc2N2CCN(C)CC2)cc1OCC ZINC000066877115 1408939909 /nfs/dbraw/zinc/93/99/09/1408939909.db2.gz AFQFNPKECQJUPR-UHFFFAOYSA-N 0 3 398.551 3.311 10 0 GGAEHN c1cc(-c2nc(CNC[C@]3(N4CCOCC4)CCSC3)cs2)cs1 ZINC000067218321 1409046238 /nfs/dbraw/zinc/04/62/38/1409046238.db2.gz HAKMQEVYKHABFQ-QGZVFWFLSA-N 0 3 381.592 3.169 10 0 GGAEHN CCCOc1cc(CN[C@H](C)c2ccc(S(=O)(=O)NC)cc2)ccc1OC ZINC000067248028 1409051927 /nfs/dbraw/zinc/05/19/27/1409051927.db2.gz GWBLGEYFRBBOMA-OAHLLOKOSA-N 0 3 392.521 3.243 10 0 GGAEHN O[C@@H](CNCc1ccccc1OCc1ccccn1)COc1ccc(F)cc1 ZINC000067252325 1409053177 /nfs/dbraw/zinc/05/31/77/1409053177.db2.gz ACZMJCFCIRIGKI-FQEVSTJZSA-N 0 3 382.435 3.329 10 0 GGAEHN Cc1cccc(OC[C@@H](O)CNCc2ccccc2OCc2ccccn2)c1 ZINC000067253996 1409053627 /nfs/dbraw/zinc/05/36/27/1409053627.db2.gz GYNQYEBUUJNZIT-NRFANRHFSA-N 0 3 378.472 3.499 10 0 GGAEHN O=C(NC[C@H]1CCCO1)c1cccc(CNCc2ccc(-n3cccn3)cc2)c1 ZINC000067979436 1409269261 /nfs/dbraw/zinc/26/92/61/1409269261.db2.gz HJBUHEGFIZRXRJ-JOCHJYFZSA-N 0 3 390.487 3.071 10 0 GGAEHN C[C@H](c1ccccc1)N(C)C(=O)NCc1cccc(CN2CCN(C)CC2)c1 ZINC000076425270 1409888558 /nfs/dbraw/zinc/88/85/58/1409888558.db2.gz IABQLTUKXMAKGW-LJQANCHMSA-N 0 3 380.536 3.337 10 0 GGAEHN CC[C@@H]1CN(C(=O)CNC(=O)C2CCCC2)[C@@H](CC)CN1Cc1ccccc1 ZINC000078869887 1409939053 /nfs/dbraw/zinc/93/90/53/1409939053.db2.gz PRGBXSCJCNYYSE-RTWAWAEBSA-N 0 3 385.552 3.194 10 0 GGAEHN COc1cc(C(=O)N[C@@H]2CN(C3CC3)C[C@@H]2C)ccc1OCc1c(C)noc1C ZINC000079099497 1409957599 /nfs/dbraw/zinc/95/75/99/1409957599.db2.gz LQJDSGAJZLCDSC-ORAYPTAESA-N 0 3 399.491 3.092 10 0 GGAEHN NC(=O)c1ccc(CNCc2ccc(OC(F)F)c(Br)c2)cc1 ZINC000092559656 1410172802 /nfs/dbraw/zinc/17/28/02/1410172802.db2.gz CEMATDWBHZGYTL-UHFFFAOYSA-N 0 3 385.208 3.439 10 0 GGAEHN O=C(NC1CCN(Cc2ccccc2N2CCOCC2)CC1)C1CCCCC1 ZINC000092644816 1410182940 /nfs/dbraw/zinc/18/29/40/1410182940.db2.gz LDZPLUKCAZMXEM-UHFFFAOYSA-N 0 3 385.552 3.184 10 0 GGAEHN Cc1nccn1-c1ccc([C@@H](C)NCC(=O)Nc2cccc3nsnc32)cc1 ZINC000095462675 1410312414 /nfs/dbraw/zinc/31/24/14/1410312414.db2.gz QPIJNJRBPGSOHQ-CYBMUJFWSA-N 0 3 392.488 3.475 10 0 GGAEHN Cc1cc(CNC[C@@H](Cc2ccc(F)cc2)C(N)=O)c(OC(F)F)cc1C ZINC000095464344 1410312844 /nfs/dbraw/zinc/31/28/44/1410312844.db2.gz SZGHIMCJRUPIGA-MRXNPFEDSA-N 0 3 380.410 3.478 10 0 GGAEHN CCOC(=O)C1=C(CN(C)C2CCCCCC2)NC(=O)N[C@@H]1c1ccc(C)o1 ZINC000095948204 1410316878 /nfs/dbraw/zinc/31/68/78/1410316878.db2.gz UWJGYRWRHQHFRQ-LJQANCHMSA-N 0 3 389.496 3.414 10 0 GGAEHN Cn1cc(CN2CCC3(C[C@@H](CC(=O)NC4CC4)c4ccccc43)CC2)cn1 ZINC000096052976 1410322505 /nfs/dbraw/zinc/32/25/05/1410322505.db2.gz OACRJRBLYOUSFQ-GOSISDBHSA-N 0 3 378.520 3.110 10 0 GGAEHN CC(=O)Nc1ccc(/C=C\C(=O)NCCCN2CCc3ccccc3C2)cc1 ZINC000096158007 1410325308 /nfs/dbraw/zinc/32/53/08/1410325308.db2.gz DUNJHJOXTFAIRJ-XFXZXTDPSA-N 0 3 377.488 3.223 10 0 GGAEHN Cc1ccc(-n2c(CC(=O)NCCN3CCCCC3)c3[nH]cccc-3c2=O)cc1 ZINC000096386978 1410330500 /nfs/dbraw/zinc/33/05/00/1410330500.db2.gz RCJAZHWLQJBTOB-HXUWFJFHSA-N 0 3 392.503 3.084 10 0 GGAEHN O=C(C1CCN(Cc2cccc(F)c2)CC1)N1CCN(c2ccccc2)CC1 ZINC000096626069 1410335043 /nfs/dbraw/zinc/33/50/43/1410335043.db2.gz VEDWJJCHJYEWKX-UHFFFAOYSA-N 0 3 381.495 3.387 10 0 GGAEHN O=C(CN1CCC(NCc2c(Cl)nc3ccccn32)CC1)Nc1ccccc1 ZINC000098163018 1410435656 /nfs/dbraw/zinc/43/56/56/1410435656.db2.gz DQDYDVZIGWTMQY-UHFFFAOYSA-N 0 3 397.910 3.180 10 0 GGAEHN CC(=O)Nc1ccc([O-])c(C(=O)N2CCC[N@H+](CCCc3ccccc3)CC2)c1 ZINC000101682627 1410490202 /nfs/dbraw/zinc/49/02/02/1410490202.db2.gz HSWUAFDQSOYPJK-UHFFFAOYSA-N 0 3 395.503 3.131 10 0 GGAEHN CC(=O)Nc1ccc([O-])c(C(=O)N2CCC[N@@H+](CCCc3ccccc3)CC2)c1 ZINC000101682627 1410490210 /nfs/dbraw/zinc/49/02/10/1410490210.db2.gz HSWUAFDQSOYPJK-UHFFFAOYSA-N 0 3 395.503 3.131 10 0 GGAEHN CCCN(C(=O)NCCc1cnn(C)c1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000101793907 1410503436 /nfs/dbraw/zinc/50/34/36/1410503436.db2.gz DOXHEQORVFRHPK-OAQYLSRUSA-N 0 3 383.540 3.049 10 0 GGAEHN O[C@@H](CNCc1cnn(-c2ccc(Cl)cc2)c1)COc1ccc(F)c(F)c1 ZINC000105499322 1411073029 /nfs/dbraw/zinc/07/30/29/1411073029.db2.gz CMSVYUDNXBLFFL-INIZCTEOSA-N 0 3 393.821 3.333 10 0 GGAEHN COc1cccc([C@H](O)CN2CCC(c3nc(-c4ccccn4)no3)CC2)c1 ZINC000115540633 1412704680 /nfs/dbraw/zinc/70/46/80/1412704680.db2.gz CAXMZRLTMMPRFO-LJQANCHMSA-N 0 3 380.448 3.053 10 0 GGAEHN COc1cccc([C@H](O)CN2CCC(CN(C)C(=O)OC(C)(C)C)CC2)c1 ZINC000115542064 1412704720 /nfs/dbraw/zinc/70/47/20/1412704720.db2.gz MJFLXLAFAZLVIR-LJQANCHMSA-N 0 3 378.513 3.308 10 0 GGAEHN CN(C)C[C@H]1CN(C(=O)NCC(C)(C)c2ccc(Cl)c(Cl)c2)CCO1 ZINC000117041357 1412985632 /nfs/dbraw/zinc/98/56/32/1412985632.db2.gz QLIANVULBTZWJG-AWEZNQCLSA-N 0 3 388.339 3.243 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)Nc3ccc(-n4ccnc4)cc3)cc2)CC1 ZINC000118766119 1413217420 /nfs/dbraw/zinc/21/74/20/1413217420.db2.gz MRGNATKXKLSRFK-UHFFFAOYSA-N 0 3 375.476 3.267 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)Nc3nc4c(s3)C(=O)CCC4)cc2)CC1 ZINC000118784019 1413220543 /nfs/dbraw/zinc/22/05/43/1413220543.db2.gz NTHQDIXKYMMFQY-UHFFFAOYSA-N 0 3 384.505 3.056 10 0 GGAEHN C[C@@H]1CN(Cc2ccc(CNCc3ccc4c(c3)OCCO4)cc2)C[C@@H](C)O1 ZINC000119683093 1413530199 /nfs/dbraw/zinc/53/01/99/1413530199.db2.gz CJPADUVPXZIXRT-QZTJIDSGSA-N 0 3 382.504 3.357 10 0 GGAEHN COc1ccc(CN2CC[C@@H](N3CCOCC3)C2)cc1OCc1ccccc1 ZINC000120950551 1413957451 /nfs/dbraw/zinc/95/74/51/1413957451.db2.gz FBKBCXQHRZTRQT-OAQYLSRUSA-N 0 3 382.504 3.181 10 0 GGAEHN Cc1nccn1-c1ccc(CNCc2ccc(OC[C@@H]3CCCO3)cc2)cn1 ZINC000121177450 1414034580 /nfs/dbraw/zinc/03/45/80/1414034580.db2.gz BNONSQWJSXEXCI-NRFANRHFSA-N 0 3 378.476 3.423 10 0 GGAEHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@@H](C)[C@H]3CCOC3)c2)cc1 ZINC000121696470 1414226787 /nfs/dbraw/zinc/22/67/87/1414226787.db2.gz FFJTWDQEDQLISI-RDJZCZTQSA-N 0 3 390.505 3.011 10 0 GGAEHN COc1cc(CNCc2ccc(CN3CCCC3=O)cc2)cc(OC)c1OC ZINC000122058428 1414351658 /nfs/dbraw/zinc/35/16/58/1414351658.db2.gz FZUFAUOYJMZCAG-UHFFFAOYSA-N 0 3 384.476 3.125 10 0 GGAEHN CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000122966597 1414608875 /nfs/dbraw/zinc/60/88/75/1414608875.db2.gz FGNUDKIPEDUEEZ-LJQANCHMSA-N 0 3 395.503 3.335 10 0 GGAEHN CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000122966597 1414608881 /nfs/dbraw/zinc/60/88/81/1414608881.db2.gz FGNUDKIPEDUEEZ-LJQANCHMSA-N 0 3 395.503 3.335 10 0 GGAEHN C[C@H](NCc1cc2ccccc2[nH]c1=O)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000123349501 1414703278 /nfs/dbraw/zinc/70/32/78/1414703278.db2.gz BUBAFJXTGBEGRM-HNNXBMFYSA-N 0 3 391.471 3.449 10 0 GGAEHN OCCC[C@@H](NCc1c[nH]nc1-c1ccc2c(c1)OCCO2)c1ccccc1 ZINC000124352486 1414947370 /nfs/dbraw/zinc/94/73/70/1414947370.db2.gz CNMYGTLKOPCKDR-LJQANCHMSA-N 0 3 379.460 3.451 10 0 GGAEHN CS[C@H](CO)[C@H](C)NCc1cn(-c2ccc(Br)cc2)nc1C ZINC000125771505 1415275998 /nfs/dbraw/zinc/27/59/98/1415275998.db2.gz FEGRKUZIJZZRKI-BLLLJJGKSA-N 0 3 384.343 3.145 10 0 GGAEHN CS[C@H](CO)[C@@H](C)NCc1cn(-c2ccc(Br)cc2)nc1C ZINC000125771764 1415276783 /nfs/dbraw/zinc/27/67/83/1415276783.db2.gz FEGRKUZIJZZRKI-MLGOLLRUSA-N 0 3 384.343 3.145 10 0 GGAEHN c1ccc(OCCN2CCOCC2)c(CNCc2cccc3cccnc32)c1 ZINC000126747521 1415545632 /nfs/dbraw/zinc/54/56/32/1415545632.db2.gz CEKKXJINFTUSKY-UHFFFAOYSA-N 0 3 377.488 3.236 10 0 GGAEHN COc1ccc(Br)c(CNC[C@H]2CCN(CC(F)(F)F)C2)c1 ZINC000126859442 1415587519 /nfs/dbraw/zinc/58/75/19/1415587519.db2.gz AUEXRIIRUFEEQU-LLVKDONJSA-N 0 3 381.236 3.432 10 0 GGAEHN CCCOc1c(CNCc2ccc(N3CCN(C)CC3)nc2)cccc1OCC ZINC000128401871 1415979534 /nfs/dbraw/zinc/97/95/34/1415979534.db2.gz CQBIQKBEQTXWKB-UHFFFAOYSA-N 0 3 398.551 3.311 10 0 GGAEHN Cc1nccn1CCCN(C)[C@@H](C)C(=O)N(C)Cc1c(F)cccc1Cl ZINC000130703697 1416429177 /nfs/dbraw/zinc/42/91/77/1416429177.db2.gz FRMUIVODFVBGMN-AWEZNQCLSA-N 0 3 380.895 3.353 10 0 GGAEHN O=C(Nc1ccc(CNCc2ccc3c(c2)OCCO3)cc1)c1cccnc1 ZINC000131501899 1416567446 /nfs/dbraw/zinc/56/74/46/1416567446.db2.gz CLEGKNALPKTILP-UHFFFAOYSA-N 0 3 375.428 3.395 10 0 GGAEHN CN1CCN(c2ncc(CN[C@H](c3ccccc3F)C3CCCC3)cn2)CC1 ZINC000134405195 1417065283 /nfs/dbraw/zinc/06/52/83/1417065283.db2.gz CCNNMYXGLFWUMK-NRFANRHFSA-N 0 3 383.515 3.389 10 0 GGAEHN CN(C)C(=O)COc1ccccc1CNC[C@@H](O)c1cc2ccccc2s1 ZINC000151341613 1417930667 /nfs/dbraw/zinc/93/06/67/1417930667.db2.gz FIHZAVITVLLHPA-QGZVFWFLSA-N 0 3 384.501 3.192 10 0 GGAEHN CNS(=O)(=O)Cc1ccc(CNCc2ccc(Br)cc2C)cc1 ZINC000151413051 1417956468 /nfs/dbraw/zinc/95/64/68/1417956468.db2.gz GVNGBRJLULKSGM-UHFFFAOYSA-N 0 3 397.338 3.097 10 0 GGAEHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CC[C@@H](Oc2ccncc2)C1 ZINC000151558764 1418023736 /nfs/dbraw/zinc/02/37/36/1418023736.db2.gz FBDINENEIWAQNE-NHCUHLMSSA-N 0 3 380.492 3.081 10 0 GGAEHN C[C@H](CNCc1ncccc1C(F)(F)F)N1CCN(c2ccccc2)CC1 ZINC000152143983 1418156771 /nfs/dbraw/zinc/15/67/71/1418156771.db2.gz AIGNPRKUDCVXRJ-MRXNPFEDSA-N 0 3 378.442 3.401 10 0 GGAEHN CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)N[C@@H](C)c2ccc(OC(C)C)cc2)C1 ZINC000179526808 1429410032 /nfs/dbraw/zinc/41/00/32/1429410032.db2.gz ANYWBGZEAOVDLW-JENIJYKNSA-N 0 3 390.524 3.315 10 0 GGAEHN Fc1cccc([C@@H](CNCc2ncccc2C(F)(F)F)N2CCOCC2)c1 ZINC000152367038 1422084779 /nfs/dbraw/zinc/08/47/79/1422084779.db2.gz GFPMUKYJZSDOST-GOSISDBHSA-N 0 3 383.389 3.403 10 0 GGAEHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCCCNC(=O)OC(C)(C)C ZINC000152716723 1422222249 /nfs/dbraw/zinc/22/22/49/1422222249.db2.gz HCZDMGURWWRJEI-HKUYNNGSSA-N 0 3 389.540 3.318 10 0 GGAEHN COc1ccc([C@H](CNC(=O)N[C@H](CCO)c2ccccc2)N2CCCC2)cc1 ZINC000152757754 1422238527 /nfs/dbraw/zinc/23/85/27/1422238527.db2.gz BWAKXRXFFKPRTL-YADHBBJMSA-N 0 3 397.519 3.255 10 0 GGAEHN Cc1cn2c(CNC[C@H](O)c3cc(Cl)c4c(c3)OCCO4)c(C)nc2s1 ZINC000152984642 1422317546 /nfs/dbraw/zinc/31/75/46/1422317546.db2.gz BUDKJURLKHIIPB-HNNXBMFYSA-N 0 3 393.896 3.260 10 0 GGAEHN COc1cc(CN[C@H]2CCN(C(=O)CCc3ccccc3)C2)cc(OC)c1OC ZINC000153995721 1422822768 /nfs/dbraw/zinc/82/27/68/1422822768.db2.gz IBSLNWSNDFGDAZ-IBGZPJMESA-N 0 3 398.503 3.036 10 0 GGAEHN Cc1nc(-c2ccc3c(c2)CCN3C(=O)CN(C)CC2CCOCC2)cs1 ZINC000156160031 1423700555 /nfs/dbraw/zinc/70/05/55/1423700555.db2.gz HLGMQGDIPJVVDS-UHFFFAOYSA-N 0 3 385.533 3.366 10 0 GGAEHN CCOC(=O)c1cc(CC)sc1NC(=O)[C@@H](C)N(C)CC1CCOCC1 ZINC000156180257 1423709299 /nfs/dbraw/zinc/70/92/99/1423709299.db2.gz HBUXQXVXRCETSY-CYBMUJFWSA-N 0 3 382.526 3.173 10 0 GGAEHN CC(C)(C)OC(=O)N1CCC[C@H](N[C@H](CO)c2cccc(Br)c2)C1 ZINC000156741426 1423857811 /nfs/dbraw/zinc/85/78/11/1423857811.db2.gz YQLIGGJUIOOURO-JKSUJKDBSA-N 0 3 399.329 3.472 10 0 GGAEHN COC(=O)c1ccc(C)c(NC(=O)[C@H](C)N2CCN(C3CCCCC3)CC2)c1 ZINC000162879558 1424898674 /nfs/dbraw/zinc/89/86/74/1424898674.db2.gz FHNVEUGHPDFPCR-KRWDZBQOSA-N 0 3 387.524 3.059 10 0 GGAEHN COc1ccc(CN2CC[C@H](C3CCN(C(C)=O)CC3)C2)c(Cl)c1OC ZINC000169781518 1425256205 /nfs/dbraw/zinc/25/62/05/1425256205.db2.gz YPQKPFUSZVVLHD-INIZCTEOSA-N 0 3 380.916 3.438 10 0 GGAEHN CNC(=O)N1CCC([C@H]2CCN(Cc3ccc(OC)c(OC)c3Cl)C2)CC1 ZINC000169781630 1425256263 /nfs/dbraw/zinc/25/62/63/1425256263.db2.gz LYWAGXGASWIEBC-HNNXBMFYSA-N 0 3 395.931 3.231 10 0 GGAEHN CN(C(=O)OC(C)(C)C)C1CCN(C[C@@H](O)COc2ccc(Cl)cc2)CC1 ZINC000170959926 1425417647 /nfs/dbraw/zinc/41/76/47/1425417647.db2.gz QWMAHLKUTUGIMZ-QGZVFWFLSA-N 0 3 398.931 3.411 10 0 GGAEHN C[C@@H](N[C@H](C)c1ccc(-n2cccn2)cc1)C(=O)NC(=O)Nc1ccccc1 ZINC000174374983 1427126952 /nfs/dbraw/zinc/12/69/52/1427126952.db2.gz FIFXMTWURYYHPB-HZPDHXFCSA-N 0 3 377.448 3.260 10 0 GGAEHN C[C@@H](N[C@@H](C)C(=O)NC(=O)Nc1ccccc1F)c1ccc(-n2cccn2)cc1 ZINC000174375201 1427127047 /nfs/dbraw/zinc/12/70/47/1427127047.db2.gz GFSIBDVFWKMTHP-CABCVRRESA-N 0 3 395.438 3.399 10 0 GGAEHN Cc1ccc(C(=O)N(C)C)cc1NC(=O)N1CCN([C@@H]2C[C@H]3CC[C@@H]2C3)CC1 ZINC000175196576 1427593836 /nfs/dbraw/zinc/59/38/36/1427593836.db2.gz GWBQBDGKMQBQQL-SQGPQFPESA-N 0 3 384.524 3.035 10 0 GGAEHN Cc1cccc(NC(=O)NC(=O)CN[C@@H](C)c2ccc(-n3cccn3)cc2)c1C ZINC000180834556 1430063136 /nfs/dbraw/zinc/06/31/36/1430063136.db2.gz FWMFIWBBMGHBBO-KRWDZBQOSA-N 0 3 391.475 3.488 10 0 GGAEHN C[C@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)C(=O)NC(=O)NCC(F)(F)F ZINC000180903334 1430099024 /nfs/dbraw/zinc/09/90/24/1430099024.db2.gz HSBDDZAHWLXNKE-STQMWFEESA-N 0 3 394.397 3.176 10 0 GGAEHN Cn1cc([C@H](NCCCN2C(=O)COc3ccccc32)c2cccc(F)c2)cn1 ZINC000180919254 1430114332 /nfs/dbraw/zinc/11/43/32/1430114332.db2.gz CGXWGVNQZTWVIN-JOCHJYFZSA-N 0 3 394.450 3.054 10 0 GGAEHN CC(=O)c1oc2ccccc2c1NC(=O)[C@@H](C)N[C@H](CC(N)=O)C1CCCCC1 ZINC000182077450 1430407428 /nfs/dbraw/zinc/40/74/28/1430407428.db2.gz ICJQLXRHNDUZOK-CXAGYDPISA-N 0 3 399.491 3.376 10 0 GGAEHN CN1CCN(CCC(C)(C)NC(=O)[C@H]2C[C@H]2c2ccc3ccccc3c2)CC1 ZINC000184199961 1430855436 /nfs/dbraw/zinc/85/54/36/1430855436.db2.gz HMQBTJZZIJGPIC-VXKWHMMOSA-N 0 3 379.548 3.476 10 0 GGAEHN COc1cccc(CN2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)[C@H]3C2)c1OC ZINC000184239562 1430860813 /nfs/dbraw/zinc/86/08/13/1430860813.db2.gz GQRIOBMWLZOXPG-XIRDDKMYSA-N 0 3 376.497 3.439 10 0 GGAEHN CC[C@@H](NCc1cccc(N2CCCS2(=O)=O)c1)c1ccc2c(c1)CCO2 ZINC000185295602 1431102541 /nfs/dbraw/zinc/10/25/41/1431102541.db2.gz DTFCCRCOLLTSIS-HXUWFJFHSA-N 0 3 386.517 3.402 10 0 GGAEHN COc1ccc(C[C@H](C)C[NH2+][C@H](c2nc(-c3nc[n-]n3)no2)C(C)C)cc1F ZINC000185306942 1431107923 /nfs/dbraw/zinc/10/79/23/1431107923.db2.gz CVJIXAKMVRKPML-LRDDRELGSA-N 0 3 388.447 3.168 10 0 GGAEHN COC(=O)c1ccc(CN2C[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)[C@H]3C2)cc1F ZINC000186027313 1431313663 /nfs/dbraw/zinc/31/36/63/1431313663.db2.gz RGUYATHVHRIYPM-QILLFSRXSA-N 0 3 392.471 3.347 10 0 GGAEHN COC(=O)c1ccc(CN2C[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)[C@H]3C2)s1 ZINC000186033431 1431315339 /nfs/dbraw/zinc/31/53/39/1431315339.db2.gz BMGWOFFHHCPJGU-AEGPPILISA-N 0 3 380.510 3.270 10 0 GGAEHN COc1ccc(OC)c(CN2C[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)[C@H]3C2)c1 ZINC000186037252 1431316764 /nfs/dbraw/zinc/31/67/64/1431316764.db2.gz QWRTZHPYSCICAT-JCGIZDLHSA-N 0 3 376.497 3.439 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)NCc2cc(F)cc(F)c2)C1 ZINC000190690097 1432443461 /nfs/dbraw/zinc/44/34/61/1432443461.db2.gz CHBBJZOISOJYHS-CQSZACIVSA-N 0 3 394.491 3.393 10 0 GGAEHN O=S1(=O)CCCN1c1cccc(CNCc2ccc(OCC3CC3)cc2)c1 ZINC000191602487 1432690535 /nfs/dbraw/zinc/69/05/35/1432690535.db2.gz GFFYTJHFARUFEC-UHFFFAOYSA-N 0 3 386.517 3.305 10 0 GGAEHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)Nc1ccc2c(c1)CCO2 ZINC000195363146 1433322889 /nfs/dbraw/zinc/32/28/89/1433322889.db2.gz AFTCIASGRCAPTN-UHFFFAOYSA-N 0 3 375.419 3.495 10 0 GGAEHN CC1CCN([C@@H](CNC(=O)[C@@H]2Cc3ccccc3CN2)c2cccs2)CC1 ZINC000236727949 1433377246 /nfs/dbraw/zinc/37/72/46/1433377246.db2.gz CMMJCEUMRGWZLR-PMACEKPBSA-N 0 3 383.561 3.352 10 0 GGAEHN CC1CCN([C@@H](CNC(=O)[C@H]2Cc3ccccc3CN2)c2cccs2)CC1 ZINC000236728238 1433377266 /nfs/dbraw/zinc/37/72/66/1433377266.db2.gz CMMJCEUMRGWZLR-UXHICEINSA-N 0 3 383.561 3.352 10 0 GGAEHN CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc3c(c(Br)c2)OCO3)C1 ZINC000236770828 1433378301 /nfs/dbraw/zinc/37/83/01/1433378301.db2.gz AJFJZWQSPRNERJ-GFCCVEGCSA-N 0 3 399.285 3.277 10 0 GGAEHN Cc1nn(C)c(OCC(F)(F)F)c1CNC[C@H](c1cccs1)N(C)C ZINC000237007087 1433385675 /nfs/dbraw/zinc/38/56/75/1433385675.db2.gz AHQIGCYCWASYND-CYBMUJFWSA-N 0 3 376.448 3.124 10 0 GGAEHN COc1ccccc1[C@@H](CNC(=O)[C@@H]1Cc2ccccc2CN1)N1CCCCC1 ZINC000237202194 1433392131 /nfs/dbraw/zinc/39/21/31/1433392131.db2.gz GOGRHACESMCQAL-FCHUYYIVSA-N 0 3 393.531 3.053 10 0 GGAEHN COc1ccc([C@@H](CNC(=O)[C@H]2Cc3ccccc3CN2)N2CCCCC2)cc1 ZINC000237320944 1433397102 /nfs/dbraw/zinc/39/71/02/1433397102.db2.gz CEXNWWCOMMSGCJ-DHIUTWEWSA-N 0 3 393.531 3.053 10 0 GGAEHN COc1ccc([C@H](CNCc2c(Cl)nc3ccccn32)N(C)C)cc1OC ZINC000237332712 1433397660 /nfs/dbraw/zinc/39/76/60/1433397660.db2.gz DQJHRNHASOAIFH-HNNXBMFYSA-N 0 3 388.899 3.397 10 0 GGAEHN Cc1nn(C)c(OCC(F)(F)F)c1CNC[C@@H](C)N1CCc2ccccc21 ZINC000237524915 1433408207 /nfs/dbraw/zinc/40/82/07/1433408207.db2.gz FOPLZENAXXWLBN-CYBMUJFWSA-N 0 3 382.430 3.210 10 0 GGAEHN COCCOC[C@@H]1CCN([C@H](C)C(=O)N[C@@H](C)c2cccc3ccccc32)C1 ZINC000245436053 1433467566 /nfs/dbraw/zinc/46/75/66/1433467566.db2.gz DDMPIJLSUFZACG-IPMKNSEASA-N 0 3 384.520 3.390 10 0 GGAEHN CC(=O)N1CC[C@H](CN(C)[C@H](C)C(=O)N[C@H](C)c2cccc3ccccc32)C1 ZINC000246036191 1433560113 /nfs/dbraw/zinc/56/01/13/1433560113.db2.gz AEIZZZFQFIYQBX-ZHALLVOQSA-N 0 3 381.520 3.206 10 0 GGAEHN Cc1cccc(NC[C@@H]2CCN(CC(=O)N[C@H](c3ccccc3)C3CC3)C2)n1 ZINC000246200542 1433581126 /nfs/dbraw/zinc/58/11/26/1433581126.db2.gz XMAJWYWMJLFZPP-FDDCHVKYSA-N 0 3 378.520 3.391 10 0 GGAEHN COC(=O)c1ccc(CN2C[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)[C@@H]3C2)s1 ZINC000248556393 1433808208 /nfs/dbraw/zinc/80/82/08/1433808208.db2.gz BMGWOFFHHCPJGU-NWANDNLSSA-N 0 3 380.510 3.270 10 0 GGAEHN COc1c(C)cnc(CN2C[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)[C@H]3C2)c1C ZINC000248598641 1433810428 /nfs/dbraw/zinc/81/04/28/1433810428.db2.gz NENDYIDOMYQCIY-YESZJQIVSA-N 0 3 375.513 3.442 10 0 GGAEHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)N[C@H]1C[C@@H]1c1cccc(F)c1 ZINC000248656304 1433814131 /nfs/dbraw/zinc/81/41/31/1433814131.db2.gz DMMJVWQFNWINNW-VSKRKVRLSA-N 0 3 397.494 3.272 10 0 GGAEHN CC(C)(C)OC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C[C@H](O)COCc1ccco1 ZINC000249392840 1433842522 /nfs/dbraw/zinc/84/25/22/1433842522.db2.gz AJFWVKJUCWOJJW-DKKFBQAASA-N 0 3 379.497 3.132 10 0 GGAEHN C[C@H](CS(=O)(=O)c1ccccc1)N[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1C ZINC000250109536 1433854454 /nfs/dbraw/zinc/85/44/54/1433854454.db2.gz SQQXZACDPSRJNE-JZXOWHBKSA-N 0 3 396.553 3.084 10 0 GGAEHN CCO[C@H](O)[C@@H]1N[C@H](c2ccc(Cl)cc2)C([N+](=O)[O-])[C@H]1c1ccccc1 ZINC000252627425 1433863585 /nfs/dbraw/zinc/86/35/85/1433863585.db2.gz RTTHNEXNTOBPTG-VHPHOLNESA-N 0 3 376.840 3.137 10 0 GGAEHN Cc1ccc(NC(=O)[C@H]2CCCN(Cc3ccncc3)CCC(=O)NCC2)cc1 ZINC000257175706 1433893479 /nfs/dbraw/zinc/89/34/79/1433893479.db2.gz BKIOVUPDTJLHMP-FQEVSTJZSA-N 0 3 394.519 3.137 10 0 GGAEHN O=C(Cc1cccnc1)N1CCC(N2C[C@H](OCC3CC3)C23CCCCC3)CC1 ZINC000257180272 1433893857 /nfs/dbraw/zinc/89/38/57/1433893857.db2.gz KLQNOBDROAQBHO-QFIPXVFZSA-N 0 3 397.563 3.429 10 0 GGAEHN COc1ccc(-c2n[nH]cc2CN2CCC3(CC2)CCC(=O)N(C)CC3)cc1 ZINC000257193708 1433894701 /nfs/dbraw/zinc/89/47/01/1433894701.db2.gz RYYINNGXZJJKFS-UHFFFAOYSA-N 0 3 382.508 3.310 10 0 GGAEHN CC(C)OCCN1CCC(NC(=O)NCc2cc(-c3ccccc3)no2)CC1 ZINC000267047844 1434402970 /nfs/dbraw/zinc/40/29/70/1434402970.db2.gz FVNKLVRSCSXYRT-UHFFFAOYSA-N 0 3 386.496 3.030 10 0 GGAEHN C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)Nc1ccc(=O)n(CCN(C)C)c1 ZINC000270067723 1434698986 /nfs/dbraw/zinc/69/89/86/1434698986.db2.gz GKIKFOLNFQSRAE-GFCCVEGCSA-N 0 3 398.290 3.123 10 0 GGAEHN CN(C)CCn1cc(NC(=O)c2ccc(C3SCCS3)cc2)ccc1=O ZINC000270070196 1434699266 /nfs/dbraw/zinc/69/92/66/1434699266.db2.gz GRTRKRJGDXRUGX-UHFFFAOYSA-N 0 3 389.546 3.141 10 0 GGAEHN Cc1nn(-c2ccccn2)c(C)c1CNc1ccccc1CN1CCC(O)CC1 ZINC000282712648 1435857464 /nfs/dbraw/zinc/85/74/64/1435857464.db2.gz BLDWGHDLUZBEDC-UHFFFAOYSA-N 0 3 391.519 3.453 10 0 GGAEHN COc1ccccc1-c1ncc(CN[C@](C)(CO)Cc2ccccc2F)cn1 ZINC000631234280 1126101636 /nfs/dbraw/zinc/10/16/36/1126101636.db2.gz FZDPDKRZBJMKIS-QFIPXVFZSA-N 0 3 381.451 3.375 10 0 GGAEHN COc1ccccc1C[C@](C)(CO)NCc1cnc(-c2ccccc2OC)nc1 ZINC000631235801 1126101932 /nfs/dbraw/zinc/10/19/32/1126101932.db2.gz SJRJHMINBIBIBX-HSZRJFAPSA-N 0 3 393.487 3.244 10 0 GGAEHN COc1ccccc1-c1ncc(CN[C@@](C)(CO)Cc2ccc(F)cc2)cn1 ZINC000631236699 1126102062 /nfs/dbraw/zinc/10/20/62/1126102062.db2.gz HZRYAOYMKHVAFF-JOCHJYFZSA-N 0 3 381.451 3.375 10 0 GGAEHN OC[C@@]1(NCc2cnc([C@H]3CCCO3)s2)CCCN(Cc2ccccc2)C1 ZINC000677322552 1126105375 /nfs/dbraw/zinc/10/53/75/1126105375.db2.gz PTPHDKQCESSRBZ-TZIWHRDSSA-N 0 3 387.549 3.111 10 0 GGAEHN OC[C@@]1(NCc2cnc([C@@H]3CCCO3)s2)CCCN(Cc2ccccc2)C1 ZINC000677322551 1126105383 /nfs/dbraw/zinc/10/53/83/1126105383.db2.gz PTPHDKQCESSRBZ-PZJWPPBQSA-N 0 3 387.549 3.111 10 0 GGAEHN C[C@](CO)(Cc1ccc(Br)cc1)NCc1cc2c(cc[nH]c2=O)o1 ZINC000865715153 1126114871 /nfs/dbraw/zinc/11/48/71/1126114871.db2.gz KKSZQHACRWVOEK-GOSISDBHSA-N 0 3 391.265 3.379 10 0 GGAEHN CCOc1ccc(CN[C@](C)(CO)Cc2ccc(Br)cc2)nc1 ZINC001198219685 1126154980 /nfs/dbraw/zinc/15/49/80/1126154980.db2.gz RFIXBVMACKUDNO-SFHVURJKSA-N 0 3 379.298 3.326 10 0 GGAEHN COC(=O)c1cc(CN[C@@H](Cc2ccccc2)[C@H](O)C(F)(F)F)ccc1C ZINC001308035467 1126162287 /nfs/dbraw/zinc/16/22/87/1126162287.db2.gz QJUXDOQESXIZCS-ROUUACIJSA-N 0 3 381.394 3.406 10 0 GGAEHN Cc1cccc2nc(CN[C@@](C)(CO)Cc3ccc(Br)cc3)cn21 ZINC001308117843 1126163551 /nfs/dbraw/zinc/16/35/51/1126163551.db2.gz NIFYBFRUTVXPPO-LJQANCHMSA-N 0 3 388.309 3.489 10 0 GGAEHN Cc1cccc2nc(CN[C@](C)(CO)Cc3ccc(Br)cc3)cn21 ZINC001308117842 1126163565 /nfs/dbraw/zinc/16/35/65/1126163565.db2.gz NIFYBFRUTVXPPO-IBGZPJMESA-N 0 3 388.309 3.489 10 0 GGAEHN C[C@@](CO)(Cc1ccccc1F)NCc1cccc(C(=O)NCc2ccco2)c1 ZINC001560183322 1126209119 /nfs/dbraw/zinc/20/91/19/1126209119.db2.gz MHNFZOWJQVGIOT-QHCPKHFHSA-N 0 3 396.462 3.432 10 0 GGAEHN COC(=O)c1ccc2[nH]c(CN[C@](C)(CO)Cc3ccc(Cl)cc3)nc2c1 ZINC001648469587 1126251014 /nfs/dbraw/zinc/25/10/14/1126251014.db2.gz KSCUWFBGBAQSFQ-FQEVSTJZSA-N 0 3 387.867 3.086 10 0 GGAEHN COc1cc(C)nc(CN[C@@](C)(CO)Cc2ccc(Br)cc2)c1 ZINC001655736801 1126256127 /nfs/dbraw/zinc/25/61/27/1126256127.db2.gz UGUGTBMMKXXIQU-GOSISDBHSA-N 0 3 379.298 3.244 10 0 GGAEHN CN1C(=O)[C@@H](c2ccccc2)CC12CCN(Cc1ccc3c(c1)OCO3)CC2 ZINC000426381774 530046278 /nfs/dbraw/zinc/04/62/78/530046278.db2.gz SDTLAAHBZSQDAX-LJQANCHMSA-N 0 3 378.472 3.396 10 0 GGAEHN COc1ccc(Br)cc1CN[C@H]1CCCN(c2cccnn2)C1 ZINC000107303914 206245652 /nfs/dbraw/zinc/24/56/52/206245652.db2.gz MKCKVWJMCMSASJ-HNNXBMFYSA-N 0 3 377.286 3.006 10 0 GGAEHN CCN1CCC[C@@H](CN(C)C(=O)COC2CCCCC2)[C@@H]1c1cnn(C)c1 ZINC000328638865 206236667 /nfs/dbraw/zinc/23/66/67/206236667.db2.gz WQTARASEHOJJPK-LAUBAEHRSA-N 0 3 376.545 3.001 10 0 GGAEHN CCN1CCC[C@@H](CN(C)Cc2cn(C)nc2C(C)(C)C)[C@@H]1c1cnn(C)c1 ZINC000328637364 206236792 /nfs/dbraw/zinc/23/67/92/206236792.db2.gz OPIVWDZVFCYSHU-FXAWDEMLSA-N 0 3 386.588 3.356 10 0 GGAEHN CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)N[C@@H]2CCCN(C3CCCCC3)C2)C1 ZINC000221834829 206259237 /nfs/dbraw/zinc/25/92/37/206259237.db2.gz UVALKUHHBLZHRP-MGVFRVJLSA-N 0 3 383.602 3.163 10 0 GGAEHN CC(=O)N[C@H](CC(=O)NC[C@H]1CCCN(Cc2cccs2)C1)c1ccccc1 ZINC000359996521 206277313 /nfs/dbraw/zinc/27/73/13/206277313.db2.gz RISQIIQEGABPIX-WIYYLYMNSA-N 0 3 399.560 3.344 10 0 GGAEHN COc1ccc2c(CN3CCC(c4nnc5ccccn54)CC3)cc(=O)oc2c1 ZINC000067442949 206281219 /nfs/dbraw/zinc/28/12/19/206281219.db2.gz PUKBTZXSPYRBJA-UHFFFAOYSA-N 0 3 390.443 3.224 10 0 GGAEHN CCNCC(=O)Nc1[nH]c2ccc(Cl)cc2c1S(=O)(=O)c1ccccc1 ZINC000035088418 206305001 /nfs/dbraw/zinc/30/50/01/206305001.db2.gz MRVXPRGWNHWYSL-UHFFFAOYSA-N 0 3 391.880 3.202 10 0 GGAEHN O=C(O[C@H]1CN2CCC1CC2)N1C[C@H](O)c2ccccc2[C@@H]1c1ccccc1 ZINC000013674440 206989442 /nfs/dbraw/zinc/98/94/42/206989442.db2.gz LRNNBJBAUXSVMH-FKBYEOEOSA-N 0 3 378.472 3.356 10 0 world GGAEHN CCOC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@@H]2c2ccc(OC)cc2)cc1 ZINC000014200932 207015548 /nfs/dbraw/zinc/01/55/48/207015548.db2.gz ZZRPTXNTVANOOK-SIKLNZKXSA-N 0 3 399.487 3.449 10 0 GGAEHN CCOC(=O)c1ccc(OC[C@@H](O)CN(C)[C@@H](C)c2ccc(F)cc2)cc1 ZINC000014242193 207017414 /nfs/dbraw/zinc/01/74/14/207017414.db2.gz TUVLYSBOWWNEJR-KXBFYZLASA-N 0 3 375.440 3.435 10 0 GGAEHN COC(=O)c1cccc(OC[C@@H](O)CN(C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000014242188 207017908 /nfs/dbraw/zinc/01/79/08/207017908.db2.gz RMACAFQRMAQOTG-KRWDZBQOSA-N 0 3 397.393 3.364 10 0 GGAEHN CCN1C(=O)N(CCC(C)C)C2(CCN(Cc3ccccc3OC)CC2)C1=O ZINC000014543167 207023858 /nfs/dbraw/zinc/02/38/58/207023858.db2.gz OVCRJZQNKZYXNM-UHFFFAOYSA-N 0 3 387.524 3.360 10 0 GGAEHN CC(C)Cn1nc(C(=O)N(C)C)c2c1CC[C@@H](NCc1ccc(F)c(F)c1)C2 ZINC000014542001 207023900 /nfs/dbraw/zinc/02/39/00/207023900.db2.gz STYGYZMAJGDJOH-OAHLLOKOSA-N 0 3 390.478 3.166 10 0 GGAEHN CC(C)CCN1C(=O)N(C(C)C)C(=O)C12CCN(Cc1ccc(O)cc1)CC2 ZINC000014742009 207028199 /nfs/dbraw/zinc/02/81/99/207028199.db2.gz HCFYIWYDIXVEAJ-UHFFFAOYSA-N 0 3 387.524 3.446 10 0 GGAEHN C[C@H]1CN(CC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)Cc2ccccc2O1 ZINC000015003709 207040879 /nfs/dbraw/zinc/04/08/79/207040879.db2.gz BMVVTZGCQKKFLJ-SIKLNZKXSA-N 0 3 393.531 3.050 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1cnn(-c2ccc(F)cc2)c1-n1cccc1 ZINC000015681538 207055627 /nfs/dbraw/zinc/05/56/27/207055627.db2.gz RZGZITFUVGUXTN-QGZVFWFLSA-N 0 3 395.482 3.406 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1cnn(-c2ccc(F)cc2)c1-n1cccc1 ZINC000015681539 207056123 /nfs/dbraw/zinc/05/61/23/207056123.db2.gz RZGZITFUVGUXTN-KRWDZBQOSA-N 0 3 395.482 3.406 10 0 GGAEHN Cc1cc(-c2ccc(C)c(S(=O)(=O)NCCCN3CCC[C@@H](C)C3)c2)on1 ZINC000015730270 207057349 /nfs/dbraw/zinc/05/73/49/207057349.db2.gz XJZIZHPJUDHUOX-OAHLLOKOSA-N 0 3 391.537 3.359 10 0 GGAEHN COCCNC(=O)NC(=O)CN[C@@H](c1ccc(C2CCCCC2)cc1)C(C)C ZINC000015523733 207051312 /nfs/dbraw/zinc/05/13/12/207051312.db2.gz HJRBSASQTFVOMG-OAQYLSRUSA-N 0 3 389.540 3.493 10 0 GGAEHN CN(CCCNC(=O)c1nn(C)c2c1COc1ccccc1-2)Cc1ccccc1 ZINC000015674169 207054397 /nfs/dbraw/zinc/05/43/97/207054397.db2.gz RLLMEFDQBFLYRG-UHFFFAOYSA-N 0 3 390.487 3.231 10 0 GGAEHN O=C(NCC1CCN(Cc2ccccc2F)CC1)[C@@H]1COc2ccccc2C1 ZINC000015786168 207062192 /nfs/dbraw/zinc/06/21/92/207062192.db2.gz CREFFSQRQQRTGC-FQEVSTJZSA-N 0 3 382.479 3.405 10 0 GGAEHN O=C(NCCN1CCC(Cc2ccccc2)CC1)[C@H]1COc2ccccc2C1 ZINC000015786155 207062265 /nfs/dbraw/zinc/06/22/65/207062265.db2.gz FMDSKGHNWGZKPL-JOCHJYFZSA-N 0 3 378.516 3.309 10 0 GGAEHN COCCn1c(C)cc(O)c([C@H](c2ccccc2F)N2CCC(C)CC2)c1=O ZINC000016993427 207081326 /nfs/dbraw/zinc/08/13/26/207081326.db2.gz MYAAATZEKSTUNH-NRFANRHFSA-N 0 3 388.483 3.469 10 0 GGAEHN COc1cc(CNCc2ccc(CN3CCOCC3)cc2)cc(Cl)c1OC ZINC000017318301 207090310 /nfs/dbraw/zinc/09/03/10/207090310.db2.gz KICYCEGJUAMZMU-UHFFFAOYSA-N 0 3 390.911 3.479 10 0 GGAEHN OCC[C@@H]1CN(Cc2ccnc3ccccc23)CCN1CCc1ccccc1 ZINC000020109804 207179100 /nfs/dbraw/zinc/17/91/00/207179100.db2.gz DKERNBWJVJSNFE-JOCHJYFZSA-N 0 3 375.516 3.346 10 0 GGAEHN CC(C)(C)OC(=O)N1CCN([C@@H](CN)c2cccc(Br)c2)CC1 ZINC000020179319 207183097 /nfs/dbraw/zinc/18/30/97/207183097.db2.gz FRNQPXVVNNGPCD-HNNXBMFYSA-N 0 3 384.318 3.002 10 0 GGAEHN O=C(CCc1ccncc1)N1CC[C@@H](C2CCN(Cc3cccnc3)CC2)C1 ZINC000020362850 207189934 /nfs/dbraw/zinc/18/99/34/207189934.db2.gz BDUISGAGULMHMX-JOCHJYFZSA-N 0 3 378.520 3.170 10 0 GGAEHN CCCN1CCN(CCCNC(=O)c2cc3c(s2)-c2ccccc2OC3)CC1 ZINC000020355780 207189957 /nfs/dbraw/zinc/18/99/57/207189957.db2.gz LVQVNYCSSRNFLN-UHFFFAOYSA-N 0 3 399.560 3.455 10 0 GGAEHN COc1cc(Cl)cc(CNCCN2CCOCC2)c1OCc1ccccc1 ZINC000020477785 207196602 /nfs/dbraw/zinc/19/66/02/207196602.db2.gz OUCGACKATVNLBU-UHFFFAOYSA-N 0 3 390.911 3.349 10 0 GGAEHN CCOC(=O)C1=C(CN(C)C2CCCCC2)NC(=O)N[C@@H]1c1cccs1 ZINC000020559077 207203050 /nfs/dbraw/zinc/20/30/50/207203050.db2.gz BPBAVFVJPUWKTB-QGZVFWFLSA-N 0 3 377.510 3.184 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)c1cnn(-c2ccc(C)cc2)c1-n1cccc1 ZINC000020933678 207221117 /nfs/dbraw/zinc/22/11/17/207221117.db2.gz QYQXEQJCNFCOBI-IBGZPJMESA-N 0 3 377.492 3.186 10 0 GGAEHN CCN(Cc1ccncc1)[C@H]1CCCN(Cc2ccc(N3CCNC3=O)cc2)C1 ZINC000020997898 207222767 /nfs/dbraw/zinc/22/27/67/207222767.db2.gz KHNAUVWEYPGNPW-QFIPXVFZSA-N 0 3 393.535 3.098 10 0 GGAEHN COCCn1c(C)cc(O)c([C@@H](c2ccc(F)cc2)N2CCC(C)CC2)c1=O ZINC000021097902 207225848 /nfs/dbraw/zinc/22/58/48/207225848.db2.gz PZCOMTAOICELNI-OAQYLSRUSA-N 0 3 388.483 3.469 10 0 GGAEHN Cc1ccccc1C(=O)N1CCC(C(=O)NC[C@@H](c2ccccc2)N(C)C)CC1 ZINC000021869708 207239812 /nfs/dbraw/zinc/23/98/12/207239812.db2.gz MWARJZVCAYOXOG-QFIPXVFZSA-N 0 3 393.531 3.266 10 0 GGAEHN COc1ccc(-c2nc3ccccc3c(NCCCN3CCN(C)CC3)n2)cc1 ZINC000022937859 207266073 /nfs/dbraw/zinc/26/60/73/207266073.db2.gz RXBYSUHEAACKGY-UHFFFAOYSA-N 0 3 391.519 3.355 10 0 GGAEHN Cc1ccc(-c2noc(CCC(=O)NCc3ccc(CN(C)C)cc3)n2)cc1 ZINC000024067448 207287298 /nfs/dbraw/zinc/28/72/98/207287298.db2.gz ZYNKIGDAZLSJCX-UHFFFAOYSA-N 0 3 378.476 3.356 10 0 GGAEHN C[N@H+](CCn1cccn1)Cc1cccc(-c2nc(-c3ccoc3)cc(=O)[n-]2)c1 ZINC000023619320 207280637 /nfs/dbraw/zinc/28/06/37/207280637.db2.gz KCZDCOXBBAACAD-UHFFFAOYSA-N 0 3 375.432 3.025 10 0 GGAEHN C[N@@H+](CCn1cccn1)Cc1cccc(-c2nc(-c3ccoc3)cc(=O)[n-]2)c1 ZINC000023619320 207280641 /nfs/dbraw/zinc/28/06/41/207280641.db2.gz KCZDCOXBBAACAD-UHFFFAOYSA-N 0 3 375.432 3.025 10 0 GGAEHN NC(=O)C1CCN(Cn2c3ccccc3nc2SCc2ccccc2)CC1 ZINC000025784682 207305659 /nfs/dbraw/zinc/30/56/59/207305659.db2.gz AKLXCAHVKXGUKQ-UHFFFAOYSA-N 0 3 380.517 3.483 10 0 GGAEHN O=C(CNC(=O)c1ccccc1Cl)NC[C@H](c1cccs1)N1CCCC1 ZINC000027605978 207329226 /nfs/dbraw/zinc/32/92/26/207329226.db2.gz NYWSVGCYXKHUGM-MRXNPFEDSA-N 0 3 391.924 3.085 10 0 GGAEHN Cc1ccc(-c2noc(CCC(=O)N[C@H](CN(C)C)c3ccccc3)n2)cc1 ZINC000028084811 207335077 /nfs/dbraw/zinc/33/50/77/207335077.db2.gz CRCYCOFEYNBCBD-LJQANCHMSA-N 0 3 378.476 3.397 10 0 GGAEHN O=C(CNC(=O)c1ccccc1Cl)NC[C@@H](c1cccs1)N1CCCC1 ZINC000027605982 207328173 /nfs/dbraw/zinc/32/81/73/207328173.db2.gz NYWSVGCYXKHUGM-INIZCTEOSA-N 0 3 391.924 3.085 10 0 GGAEHN CC(=O)Nc1ccc(/C=C/C(=O)NCCCN2CCc3ccccc3C2)cc1 ZINC000032400906 207395554 /nfs/dbraw/zinc/39/55/54/207395554.db2.gz DUNJHJOXTFAIRJ-FMIVXFBMSA-N 0 3 377.488 3.223 10 0 GGAEHN CCc1ccc([C@H]2CCc3nc(C(=O)NCCN4CCCCC4)cn3C2)cc1 ZINC000034899370 207477769 /nfs/dbraw/zinc/47/77/69/207477769.db2.gz LMWSLWHZCWPERS-FQEVSTJZSA-N 0 3 380.536 3.391 10 0 GGAEHN CN(C)c1ccncc1NC(=O)[C@]12CCC(=O)N1c1cc(Cl)ccc1S2 ZINC000095351006 208159387 /nfs/dbraw/zinc/15/93/87/208159387.db2.gz PUAOAKZTMRIDRY-GOSISDBHSA-N 0 3 388.880 3.369 10 0 GGAEHN CN(C)c1ccncc1NC(=O)[C@@]12CCC(=O)N1c1cc(Cl)ccc1S2 ZINC000095351005 208156970 /nfs/dbraw/zinc/15/69/70/208156970.db2.gz PUAOAKZTMRIDRY-SFHVURJKSA-N 0 3 388.880 3.369 10 0 GGAEHN O=C(Nc1cnn(CCN2CCCCC2)c1)[C@H]1SCCc2sccc21 ZINC000095459047 208185784 /nfs/dbraw/zinc/18/57/84/208185784.db2.gz JLEVPJXNYGAZRC-KRWDZBQOSA-N 0 3 376.551 3.400 10 0 GGAEHN CCOC(=O)C1=C(CN[C@@H]2CCCC[C@@H]2C)NC(=O)N[C@H]1c1cccs1 ZINC000095950758 208242943 /nfs/dbraw/zinc/24/29/43/208242943.db2.gz OIPNTTZDLKGVMK-AHIWAGSCSA-N 0 3 377.510 3.088 10 0 GGAEHN CC(C)CNC(=O)c1cccc(CN2CCC(c3nnc4ccccn43)CC2)c1 ZINC000095958662 208243514 /nfs/dbraw/zinc/24/35/14/208243514.db2.gz AUVNYAPFTKNRLQ-UHFFFAOYSA-N 0 3 391.519 3.495 10 0 GGAEHN CC(C)NC(=O)O[C@H]1CCCN(CC2CCN(C(=O)OC(C)(C)C)CC2)C1 ZINC000095929885 208240093 /nfs/dbraw/zinc/24/00/93/208240093.db2.gz FLBIJCZXYAFYKW-KRWDZBQOSA-N 0 3 383.533 3.233 10 0 GGAEHN CCCCCC(CCCCC)[NH2+]CC[N-]S(=O)(=O)c1sc(=O)[nH]c1C ZINC000095943590 208240628 /nfs/dbraw/zinc/24/06/28/208240628.db2.gz FDZBMKCIKYNHNT-UHFFFAOYSA-N 0 3 391.603 3.142 10 0 GGAEHN CN1CCC(n2nc(-c3ccccn3)nc2[C@H]2COc3ccccc3C2)CC1 ZINC000096160658 208277808 /nfs/dbraw/zinc/27/78/08/208277808.db2.gz GZVSSMPEASXUDF-QGZVFWFLSA-N 0 3 375.476 3.326 10 0 GGAEHN O=C(Nc1ccc(Cc2nnc3ccccn32)cc1)NC1CCN(C2CC2)CC1 ZINC000095958307 208245209 /nfs/dbraw/zinc/24/52/09/208245209.db2.gz OCCLRHAXUZZZQX-UHFFFAOYSA-N 0 3 390.491 3.068 10 0 GGAEHN CN1CC[C@@H]2CCN(Cc3nc(=O)c4cc(-c5ccccc5)sc4[nH]3)[C@@H]2C1 ZINC000095996038 208249947 /nfs/dbraw/zinc/24/99/47/208249947.db2.gz HWCUUHJCJHLCJJ-RHSMWYFYSA-N 0 3 380.517 3.178 10 0 GGAEHN C[C@H](CNC(=O)CCN(C)c1ccncc1)Oc1ccccc1Br ZINC000095997723 208252010 /nfs/dbraw/zinc/25/20/10/208252010.db2.gz HOLCPBBXWNLDGZ-CQSZACIVSA-N 0 3 392.297 3.254 10 0 GGAEHN O=C(Cc1c2[nH]cccc-2c(=O)n1-c1ccccc1)NCCN1CCCCCC1 ZINC000096386893 208312332 /nfs/dbraw/zinc/31/23/32/208312332.db2.gz UGMBFWKEYNRUEZ-FQEVSTJZSA-N 0 3 392.503 3.165 10 0 GGAEHN Cc1nc(CN)ccc1C(=O)Nc1nc2cc3c(cc2s1)OC(F)(F)O3 ZINC000097032466 208334344 /nfs/dbraw/zinc/33/43/44/208334344.db2.gz JNJNFJKOCQSILE-UHFFFAOYSA-N 0 3 378.360 3.032 10 0 GGAEHN COc1ccc([C@@H](CNC[C@@H](O)COc2c(C)ccc(C)c2C)N(C)C)cc1 ZINC000096662926 208321205 /nfs/dbraw/zinc/32/12/05/208321205.db2.gz HMUSVDFDDZBJJF-IFMALSPDSA-N 0 3 386.536 3.253 10 0 GGAEHN Cc1cnccc1CN(C)Cc1ccc(OC[C@@H](O)CN2CCCCC2)cc1 ZINC000096835296 208322710 /nfs/dbraw/zinc/32/27/10/208322710.db2.gz VXLKCGGFNCZGTP-QFIPXVFZSA-N 0 3 383.536 3.248 10 0 GGAEHN O=C(c1ccoc1)N1CCC(N[C@H](C(=O)N2CCCCC2)c2ccccc2)CC1 ZINC000096794835 208324055 /nfs/dbraw/zinc/32/40/55/208324055.db2.gz AGDKPDYVZXPTAI-NRFANRHFSA-N 0 3 395.503 3.228 10 0 GGAEHN COc1ccccc1CNC[C@H]1Cn2cc(-c3ccccc3OC)nc2CO1 ZINC000096296297 209013157 /nfs/dbraw/zinc/01/31/57/209013157.db2.gz HDPYUFZEIOYESX-KRWDZBQOSA-N 0 3 379.460 3.256 10 0 GGAEHN O=C(NC[C@H]1CCCN(Cc2cccs2)C1)c1cnn(CC(F)(F)F)c1 ZINC000239672818 209017731 /nfs/dbraw/zinc/01/77/31/209017731.db2.gz BVLGZDNMELFORT-CYBMUJFWSA-N 0 3 386.443 3.149 10 0 GGAEHN CCNC(=O)[C@@H]1C[C@H](NCc2cccc(F)c2)CN1Cc1ccc(Cl)cc1 ZINC000299788521 209088800 /nfs/dbraw/zinc/08/88/00/209088800.db2.gz QKGFDBXYHOLTPF-PMACEKPBSA-N 0 3 389.902 3.348 10 0 GGAEHN CCN1CCN(c2ccc(NC(=O)c3ccc4c(c3)OCCO4)cc2C)CC1 ZINC000007987793 221019959 /nfs/dbraw/zinc/01/99/59/221019959.db2.gz VJVNKIIELOBCIZ-UHFFFAOYSA-N 0 3 381.476 3.160 10 0 GGAEHN CCN1CCN(c2ccc(NC(=O)CCCc3nc(C(C)C)no3)cc2)CC1 ZINC000040130745 132398512 /nfs/dbraw/zinc/39/85/12/132398512.db2.gz YHMXZRYEIWTONK-UHFFFAOYSA-N 0 3 385.512 3.296 10 0 GGAEHN COc1ccccc1N1CCN(C(=O)C2=CCN(Cc3ccccc3)CC2)CC1 ZINC000064817934 136157791 /nfs/dbraw/zinc/15/77/91/136157791.db2.gz DJWISDNCUYURHZ-UHFFFAOYSA-N 0 3 391.515 3.176 10 0 GGAEHN Cc1cccc(CNC(=O)c2ccc(N3CCN[C@@H](c4ccccc4)C3)nc2)c1 ZINC000065256115 136162120 /nfs/dbraw/zinc/16/21/20/136162120.db2.gz AVBKRLQJMQMOEN-JOCHJYFZSA-N 0 3 386.499 3.471 10 0 GGAEHN CCN1CCN(c2cc(CN[C@H](C)c3ccccc3-n3cccn3)ccn2)CC1 ZINC000095407530 136179024 /nfs/dbraw/zinc/17/90/24/136179024.db2.gz JPYOEWODUICNCI-LJQANCHMSA-N 0 3 390.535 3.260 10 0 GGAEHN O=C(Nc1cnccc1N1CCCCC1)C1=NN(Cc2ccccc2)C(=O)CC1 ZINC000095958984 136182747 /nfs/dbraw/zinc/18/27/47/136182747.db2.gz PAFKDWIBYWITRV-UHFFFAOYSA-N 0 3 391.475 3.189 10 0 GGAEHN Cc1noc2ncnc(NCCCN3CCN(c4cccc(C)c4)[C@H](C)C3)c12 ZINC000020575193 136202963 /nfs/dbraw/zinc/20/29/63/136202963.db2.gz QDJAIQOXMWSEMU-MRXNPFEDSA-N 0 3 380.496 3.247 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000117480524 564227165 /nfs/dbraw/zinc/22/71/65/564227165.db2.gz VSWZAEVYELVILV-NSHDSACASA-N 0 3 377.373 3.489 10 0 GGAEHN CN(C)C[C@@H](NC(=O)c1ccc(I)cc1)c1ccccc1 ZINC000042301984 564445098 /nfs/dbraw/zinc/44/50/98/564445098.db2.gz GKMJCMAIAMFMOI-MRXNPFEDSA-N 0 3 394.256 3.324 10 0 GGAEHN O=C(NC[C@H](O)CN1CCCCC1)Nc1ccc(Br)cc1Cl ZINC000043420315 564458056 /nfs/dbraw/zinc/45/80/56/564458056.db2.gz HKVKZFVPQZFCIL-LBPRGKRZSA-N 0 3 390.709 3.071 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1c(F)cccc1I ZINC000123945655 564466389 /nfs/dbraw/zinc/46/63/89/564466389.db2.gz WOZPZQILSNAOKT-LLVKDONJSA-N 0 3 390.240 3.035 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)c1cc(Cl)ccc1I ZINC000219407399 565901721 /nfs/dbraw/zinc/90/17/21/565901721.db2.gz NGVVAJFBHSMWJX-LLVKDONJSA-N 0 3 392.668 3.111 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)c1cc(Br)sc1Br ZINC000229043723 565926365 /nfs/dbraw/zinc/92/63/65/565926365.db2.gz LDSNUSQTRLVLEB-MRVPVSSYSA-N 0 3 396.148 3.439 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)c2cc(Br)sc2Br)C1 ZINC000116749130 564215969 /nfs/dbraw/zinc/21/59/69/564215969.db2.gz WBRWYKSPTBOLQR-ZETCQYMHSA-N 0 3 382.121 3.049 10 0 GGAEHN CCN1CCC[C@H](NC(=O)c2cc(Cl)ccc2I)C1 ZINC000117706030 564230259 /nfs/dbraw/zinc/23/02/59/564230259.db2.gz SECTVFIMOYAEST-NSHDSACASA-N 0 3 392.668 3.159 10 0 GGAEHN C[C@@]1(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1(Cl)Cl ZINC000115158290 564186844 /nfs/dbraw/zinc/18/68/44/564186844.db2.gz XVEWZKYVCMZUGY-WMZOPIPTSA-N 0 3 385.335 3.132 10 0 GGAEHN CCOCCCN1CC[C@H](NS(=O)(=O)c2cccc(Cl)c2C)[C@H](C)C1 ZINC000115591898 564196499 /nfs/dbraw/zinc/19/64/99/564196499.db2.gz CXWDQKSIHFSDQX-PBHICJAKSA-N 0 3 388.961 3.064 10 0 GGAEHN CN(C)C[C@H]1CN(C(=O)c2ccccc2SCc2cccs2)CCO1 ZINC000116794152 564217014 /nfs/dbraw/zinc/21/70/14/564217014.db2.gz PPSFSXDCNLTBGH-HNNXBMFYSA-N 0 3 376.547 3.443 10 0 GGAEHN CC(C)C[C@H](CN(C)C)NC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000117480527 564227806 /nfs/dbraw/zinc/22/78/06/564227806.db2.gz VSWZAEVYELVILV-LLVKDONJSA-N 0 3 377.373 3.489 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1 ZINC000119253575 564261797 /nfs/dbraw/zinc/26/17/97/564261797.db2.gz FJARZDFSIGWKCV-XJKSGUPXSA-N 0 3 398.288 3.156 10 0 GGAEHN C[C@@H]1C[C@@H](C)CN(CC(=O)N(C)CC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000013056182 564273578 /nfs/dbraw/zinc/27/35/78/564273578.db2.gz QJVKAERWPJKSHR-CHWSQXEVSA-N 0 3 386.323 3.368 10 0 GGAEHN COc1ccc(C(=O)[C@H]2CCCN(C3CSCCSC3)C2)cc1OC ZINC000013594046 564277484 /nfs/dbraw/zinc/27/74/84/564277484.db2.gz BILTUKQTNXCODY-HNNXBMFYSA-N 0 3 381.563 3.447 10 0 GGAEHN C[C@@H](NCCOc1ccc(S(N)(=O)=O)cc1)c1ccc(Cl)c(Cl)c1 ZINC000119675364 564282770 /nfs/dbraw/zinc/28/27/70/564282770.db2.gz NFYXLQMAXCFQGD-LLVKDONJSA-N 0 3 389.304 3.370 10 0 GGAEHN C[C@H](NCCOc1ccc(S(N)(=O)=O)cc1)c1ccc(Cl)c(Cl)c1 ZINC000119675237 564282985 /nfs/dbraw/zinc/28/29/85/564282985.db2.gz NFYXLQMAXCFQGD-NSHDSACASA-N 0 3 389.304 3.370 10 0 GGAEHN C[C@@H](N[C@@H]1CCN(c2ncccc2Cl)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000120028846 564300812 /nfs/dbraw/zinc/30/08/12/564300812.db2.gz PLYPKEUMIIJYLJ-UKRRQHHQSA-N 0 3 379.913 3.068 10 0 GGAEHN CN(C)CCn1ccc(NC(=O)c2cc(F)c(Br)cc2Cl)n1 ZINC000475442399 564308719 /nfs/dbraw/zinc/30/87/19/564308719.db2.gz LJODEUAVWDVATA-UHFFFAOYSA-N 0 3 389.656 3.252 10 0 GGAEHN CC(C)C[C@H](CN(C)C)NC(=O)c1ccc(F)cc1I ZINC000120245685 564312211 /nfs/dbraw/zinc/31/22/11/564312211.db2.gz YHWIISDCIXRNTJ-GFCCVEGCSA-N 0 3 392.256 3.136 10 0 GGAEHN CC[C@@H]1CN(CC2=Cc3cc(Br)ccc3OC2)CCN1C[C@@H](C)O ZINC000120743567 564334895 /nfs/dbraw/zinc/33/48/95/564334895.db2.gz FIONXEZLYHWOOH-RDTXWAMCSA-N 0 3 395.341 3.002 10 0 GGAEHN CN(Cc1ccc2c(c1)OCO2)C[C@H](O)COc1cccc(Br)c1 ZINC000025368691 564337560 /nfs/dbraw/zinc/33/75/60/564337560.db2.gz VCXGRFACMQGGAE-HNNXBMFYSA-N 0 3 394.265 3.050 10 0 GGAEHN CN(Cc1ccc2c(c1)OCO2)C[C@@H](O)COc1cccc(Br)c1 ZINC000025368687 564337652 /nfs/dbraw/zinc/33/76/52/564337652.db2.gz VCXGRFACMQGGAE-OAHLLOKOSA-N 0 3 394.265 3.050 10 0 GGAEHN CC[C@H]1CN(CC2=Cc3cc(Br)ccc3OC2)CCN1CCOC ZINC000120957088 564345130 /nfs/dbraw/zinc/34/51/30/564345130.db2.gz XWSRXAMKLRYTDQ-SFHVURJKSA-N 0 3 395.341 3.268 10 0 GGAEHN CC[C@@H]1CN(CC2=Cc3cc(Br)ccc3OC2)CCN1CCOC ZINC000120956930 564345387 /nfs/dbraw/zinc/34/53/87/564345387.db2.gz XWSRXAMKLRYTDQ-GOSISDBHSA-N 0 3 395.341 3.268 10 0 GGAEHN Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)c(Br)n1 ZINC000121586733 564376011 /nfs/dbraw/zinc/37/60/11/564376011.db2.gz AALDSHODNQDSOO-HNNXBMFYSA-N 0 3 376.298 3.055 10 0 GGAEHN C[C@@H](NC[C@@H](O)COc1cccc(Br)c1)c1ccc2c(c1)OCO2 ZINC000030535970 564382638 /nfs/dbraw/zinc/38/26/38/564382638.db2.gz XDRYRFKVZQHXHP-IUODEOHRSA-N 0 3 394.265 3.268 10 0 GGAEHN COCc1c(Br)cccc1NC(=O)N[C@H]1CN(C(C)C)C[C@@H]1C ZINC000121892626 564391383 /nfs/dbraw/zinc/39/13/83/564391383.db2.gz VEJLCQYCBBJVGM-LRDDRELGSA-N 0 3 384.318 3.446 10 0 GGAEHN COc1ccc(CCC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1Br ZINC000122792510 564427713 /nfs/dbraw/zinc/42/77/13/564427713.db2.gz DBOXILBSCXYPAQ-DZGCQCFKSA-N 0 3 383.330 3.331 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)COc2ccc(Br)cc2Cl)CCN1C ZINC000122835853 564428887 /nfs/dbraw/zinc/42/88/87/564428887.db2.gz PGINIWWQLYZYBW-AAEUAGOBSA-N 0 3 389.721 3.422 10 0 GGAEHN CCCOc1c(Br)cc(Br)cc1CNC[C@@H](C)O ZINC000040743863 564429508 /nfs/dbraw/zinc/42/95/08/564429508.db2.gz DDIVXVBOYCFEPZ-SECBINFHSA-N 0 3 381.108 3.471 10 0 GGAEHN C[C@@H](CN1CCCCC1)NC(=O)c1c(F)cccc1I ZINC000122917705 564431305 /nfs/dbraw/zinc/43/13/05/564431305.db2.gz RDFJRUBXKYZXNH-NSHDSACASA-N 0 3 390.240 3.035 10 0 GGAEHN C[C@H](CN1CCCCC1)NC(=O)c1c(F)cccc1I ZINC000122918000 564431361 /nfs/dbraw/zinc/43/13/61/564431361.db2.gz RDFJRUBXKYZXNH-LLVKDONJSA-N 0 3 390.240 3.035 10 0 GGAEHN Cc1cccc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1I ZINC000123056296 564437648 /nfs/dbraw/zinc/43/76/48/564437648.db2.gz MUNDJIDMKXAXAR-OLZOCXBDSA-N 0 3 386.277 3.154 10 0 GGAEHN C[C@H]1C[C@H](N(C)Cc2nc(-c3cccc(Br)c3)no2)CCN1C ZINC000123224718 564443207 /nfs/dbraw/zinc/44/32/07/564443207.db2.gz VWRPDPOCSYGJAQ-SWLSCSKDSA-N 0 3 379.302 3.414 10 0 GGAEHN CCN1CCN(CCCCNC(=O)NCc2ccc(Cl)cc2Cl)CC1 ZINC000042997155 564452120 /nfs/dbraw/zinc/45/21/20/564452120.db2.gz RZTVJEUTTDMYSA-UHFFFAOYSA-N 0 3 387.355 3.210 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)c2ccc(-n3cc(Br)cn3)cc2)CCN1C ZINC000123847325 564463368 /nfs/dbraw/zinc/46/33/68/564463368.db2.gz FHBVTSMQCDDYRE-CXAGYDPISA-N 0 3 391.313 3.190 10 0 GGAEHN C[C@H]1C[C@@H](N(C)Cc2nc(-c3ccc(Br)s3)no2)CCN1C ZINC000123928836 564466756 /nfs/dbraw/zinc/46/67/56/564466756.db2.gz FCVXGRNGTFDDMJ-QWRGUYRKSA-N 0 3 385.331 3.475 10 0 GGAEHN CCCC(=O)N[C@H]1CCCN(CCC(=O)Nc2cccc(Br)c2)C1 ZINC000124358996 564479913 /nfs/dbraw/zinc/47/99/13/564479913.db2.gz WVEKMZIIVANXNP-INIZCTEOSA-N 0 3 396.329 3.158 10 0 GGAEHN CCN1CCO[C@@H](CNCc2ccc(Br)c(Br)c2)C1 ZINC000124561614 564485604 /nfs/dbraw/zinc/48/56/04/564485604.db2.gz IRSKBMYCQACNPS-LBPRGKRZSA-N 0 3 392.135 3.022 10 0 GGAEHN CC(C(=O)NCC1CCCCC1)S(=O)(=O)Cc1csc(C(C)(C)C)n1 ZINC000046184853 564497812 /nfs/dbraw/zinc/49/78/12/564497812.db2.gz MSBCHECPOMAEKF-CYBMUJFWSA-N 0 3 386.583 3.440 10 0 GGAEHN CC(C(=O)N[C@H]1CCCC[C@H]1C)S(=O)(=O)Cc1csc(C(C)(C)C)n1 ZINC000046184785 564498264 /nfs/dbraw/zinc/49/82/64/564498264.db2.gz ALSRLUHUPHEWDQ-NFAWXSAZSA-N 0 3 386.583 3.439 10 0 GGAEHN CN1CCN([C@H]2CCCCN(C(=O)Nc3ccc(Br)cc3)C2)CC1 ZINC000124968259 564498923 /nfs/dbraw/zinc/49/89/23/564498923.db2.gz NUSMTJVHWDFRTK-KRWDZBQOSA-N 0 3 395.345 3.083 10 0 GGAEHN Cn1cc([C@H]2CCN(CCC(=O)Nc3cccc(Br)c3)C2)cn1 ZINC000125033519 564500733 /nfs/dbraw/zinc/50/07/33/564500733.db2.gz GMRRGWHVYFLTPM-ZDUSSCGKSA-N 0 3 377.286 3.001 10 0 GGAEHN COc1cc(C(=O)NCCN2CCCC[C@H]2C)cc(OC)c1Br ZINC000046859791 564508720 /nfs/dbraw/zinc/50/87/20/564508720.db2.gz HELZJVWLPHBSDT-GFCCVEGCSA-N 0 3 385.302 3.071 10 0 GGAEHN Brc1ccc(Cc2nc(CN3CCN4CCCC[C@@H]4C3)no2)cc1 ZINC000125299204 564510273 /nfs/dbraw/zinc/51/02/73/564510273.db2.gz RPLBWUVLGOVAFJ-MRXNPFEDSA-N 0 3 391.313 3.093 10 0 GGAEHN C[C@@H](CNC(=O)c1ccc(Cl)cc1I)N1CCCC1 ZINC000048128676 564531480 /nfs/dbraw/zinc/53/14/80/564531480.db2.gz RTQGLPFYIACGAW-JTQLQIEISA-N 0 3 392.668 3.159 10 0 GGAEHN CCN1CCC(NC(=O)[C@@H](Oc2ccc(Br)cc2)C(C)C)CC1 ZINC000051283389 564563251 /nfs/dbraw/zinc/56/32/51/564563251.db2.gz FDHWTFXRSIEWHD-KRWDZBQOSA-N 0 3 383.330 3.453 10 0 GGAEHN O=C(CCNC1(c2ccc(Br)cc2)CCOCC1)NC1CCCC1 ZINC000052833991 564577716 /nfs/dbraw/zinc/57/77/16/564577716.db2.gz OLKQYPYIJSTWGB-UHFFFAOYSA-N 0 3 395.341 3.493 10 0 GGAEHN COC[C@H](O)CN[C@H](c1ccccc1)c1ccc(OC)c(Br)c1 ZINC000127917100 564600825 /nfs/dbraw/zinc/60/08/25/564600825.db2.gz OIDLAWSUDZARCS-CRAIPNDOSA-N 0 3 380.282 3.144 10 0 GGAEHN COC[C@H](O)CN[C@@H](c1ccccc1)c1ccc(OC)c(Br)c1 ZINC000127916852 564601003 /nfs/dbraw/zinc/60/10/03/564601003.db2.gz OIDLAWSUDZARCS-QAPCUYQASA-N 0 3 380.282 3.144 10 0 GGAEHN O=C(CN[C@@H]1CCCC[C@@H]1n1cccn1)Nc1ccccc1Br ZINC000129119008 564638486 /nfs/dbraw/zinc/63/84/86/564638486.db2.gz LATXKGVYBKMDRM-CVEARBPZSA-N 0 3 377.286 3.358 10 0 GGAEHN O=S(=O)(Cc1ccc(Cl)cc1Cl)N1CCN(c2ccncc2)CC1 ZINC000129251036 564642929 /nfs/dbraw/zinc/64/29/29/564642929.db2.gz TTWOXXXSHWHHAF-UHFFFAOYSA-N 0 3 386.304 3.040 10 0 GGAEHN Cc1nn(CC(=O)NC[C@H]2CCCN(C)[C@@H]2c2cccs2)c(C)c1Cl ZINC000129790373 564661224 /nfs/dbraw/zinc/66/12/24/564661224.db2.gz BCFJNIFSBBJZHE-KDOFPFPSSA-N 0 3 380.945 3.414 10 0 GGAEHN COC(=O)c1ccc(C(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)s1 ZINC000130029480 564667984 /nfs/dbraw/zinc/66/79/84/564667984.db2.gz HRIWTCGPEOKXTE-BLLLJJGKSA-N 0 3 378.519 3.409 10 0 GGAEHN CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2ccc([O-])c(Br)c2)[C@H](C)C1 ZINC000130237591 564674314 /nfs/dbraw/zinc/67/43/14/564674314.db2.gz YLWHCYXCOVTYLX-IUODEOHRSA-N 0 3 384.318 3.026 10 0 GGAEHN CC[N@H+]1CC[C@@H](N(C)C(=O)NCc2ccc([O-])c(Br)c2)[C@H](C)C1 ZINC000130237591 564674316 /nfs/dbraw/zinc/67/43/16/564674316.db2.gz YLWHCYXCOVTYLX-IUODEOHRSA-N 0 3 384.318 3.026 10 0 GGAEHN CN1CCC[C@@H](NC(=O)NCC2(c3ccc(Br)cc3)CCC2)C1 ZINC000057859801 564676442 /nfs/dbraw/zinc/67/64/42/564676442.db2.gz IMKAKMJLWYGKJM-MRXNPFEDSA-N 0 3 380.330 3.264 10 0 GGAEHN CN1CCC[C@H](NC(=O)NCC2(c3ccc(Br)cc3)CCC2)C1 ZINC000057859792 564676708 /nfs/dbraw/zinc/67/67/08/564676708.db2.gz IMKAKMJLWYGKJM-INIZCTEOSA-N 0 3 380.330 3.264 10 0 GGAEHN CCOC(=O)CC1CCN(C[C@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000130376704 564679215 /nfs/dbraw/zinc/67/92/15/564679215.db2.gz GMZWWBRVFMHVED-AWEZNQCLSA-N 0 3 390.307 3.398 10 0 GGAEHN CCC[C@H](C(=O)NCC1(c2ccc(Br)cc2)CCOCC1)N(C)C ZINC000130685226 564689266 /nfs/dbraw/zinc/68/92/66/564689266.db2.gz QJMWBRWYKFJXPF-QGZVFWFLSA-N 0 3 397.357 3.344 10 0 GGAEHN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCCN(C2CC2)CC1 ZINC000061603925 564707364 /nfs/dbraw/zinc/70/73/64/564707364.db2.gz TZHYDOJHTDMCDP-UHFFFAOYSA-N 0 3 389.297 3.150 10 0 GGAEHN Cc1cc(Br)cc2cc(C(=O)NC[C@@H](O)CN3CCCCC3)oc21 ZINC000131437247 564712120 /nfs/dbraw/zinc/71/21/20/564712120.db2.gz BMJQTDBZHFVRGD-OAHLLOKOSA-N 0 3 395.297 3.080 10 0 GGAEHN CC(C)(CN[C@@H]1CCCSC1)S(=O)(=O)c1ccc(Br)cc1 ZINC000131533317 564714806 /nfs/dbraw/zinc/71/48/06/564714806.db2.gz OHSJJNYWVBFLPD-CYBMUJFWSA-N 0 3 392.384 3.487 10 0 GGAEHN CN(C)CCn1cc(NC(=O)CCC(=O)c2cc(Cl)sc2Cl)cn1 ZINC000131729893 564722097 /nfs/dbraw/zinc/72/20/97/564722097.db2.gz ZAEJZUDKSFDPQN-UHFFFAOYSA-N 0 3 389.308 3.415 10 0 GGAEHN CC(C)N1C[C@@H](C)[C@@H](NC(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)C1 ZINC000132320348 564740599 /nfs/dbraw/zinc/74/05/99/564740599.db2.gz PAODHZHFKVWCCX-MNOVXSKESA-N 0 3 375.357 3.241 10 0 GGAEHN CN(CCNC(=O)CSCc1ccc(Br)cc1F)C1CC1 ZINC000065124821 564740957 /nfs/dbraw/zinc/74/09/57/564740957.db2.gz MHRWBKQEMMOUQS-UHFFFAOYSA-N 0 3 375.307 3.032 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)CSCc1ccc(Br)cc1F ZINC000065308521 564743097 /nfs/dbraw/zinc/74/30/97/564743097.db2.gz WXLRVHGXOIOPEI-CQSZACIVSA-N 0 3 389.334 3.422 10 0 GGAEHN C[C@@H]1CN(CCCCNC(=O)Nc2cccc(Br)c2)C[C@H](C)O1 ZINC000132645274 564748938 /nfs/dbraw/zinc/74/89/38/564748938.db2.gz FXEMLSFKQQUKPV-OKILXGFUSA-N 0 3 384.318 3.460 10 0 GGAEHN C[C@@H]1CN(C2CCN(CC(=O)Nc3cc(Cl)ccc3Cl)CC2)CCO1 ZINC000066561860 564769495 /nfs/dbraw/zinc/76/94/95/564769495.db2.gz QWORNBPUFRQDLW-CYBMUJFWSA-N 0 3 386.323 3.117 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)c1ccc(CNC(C)=O)s1)c1ccsc1 ZINC000067163605 564785795 /nfs/dbraw/zinc/78/57/95/564785795.db2.gz XVFTYXZYCBLWNA-INIZCTEOSA-N 0 3 379.551 3.259 10 0 GGAEHN O=c1ccc2c([nH]1)CCC[C@H]2NCc1cc2c(c(Br)c1)OCO2 ZINC000067504590 564793914 /nfs/dbraw/zinc/79/39/14/564793914.db2.gz MHJZSXVULPYFCS-CYBMUJFWSA-N 0 3 377.238 3.033 10 0 GGAEHN O=c1ccc2c([nH]1)CCC[C@@H]2NCc1cc2c(c(Br)c1)OCO2 ZINC000067504591 564794113 /nfs/dbraw/zinc/79/41/13/564794113.db2.gz MHJZSXVULPYFCS-ZDUSSCGKSA-N 0 3 377.238 3.033 10 0 GGAEHN COc1c(Br)cc(Br)cc1CN[C@H]1CCO[C@H]1C ZINC000134244316 564797260 /nfs/dbraw/zinc/79/72/60/564797260.db2.gz BMHDJVZIYHDEGN-UFBFGSQYSA-N 0 3 379.092 3.487 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)[C@H](C)NC(=O)c1cccc(Cl)c1Cl ZINC000068224106 564812069 /nfs/dbraw/zinc/81/20/69/564812069.db2.gz GDUYUZMJFSDDAG-STQMWFEESA-N 0 3 388.339 3.204 10 0 GGAEHN CC(C)C[C@H](CN(C)C)NC(=O)[C@H](C)NC(=O)c1cccc(Cl)c1Cl ZINC000068224108 564812080 /nfs/dbraw/zinc/81/20/80/564812080.db2.gz GDUYUZMJFSDDAG-QWHCGFSZSA-N 0 3 388.339 3.204 10 0 GGAEHN O[C@H](COC[C@H]1CCCO1)CN1CCC(Sc2ccc(Cl)cc2)CC1 ZINC000134854991 564817456 /nfs/dbraw/zinc/81/74/56/564817456.db2.gz WVEMGUMYQMHSBR-DLBZAZTESA-N 0 3 385.957 3.453 10 0 GGAEHN CN(C)CCN(Cc1ccccn1)c1ncnc2ccc(Br)cc21 ZINC000135497251 564833262 /nfs/dbraw/zinc/83/32/62/564833262.db2.gz DYUFESLDJUIJFL-UHFFFAOYSA-N 0 3 386.297 3.356 10 0 GGAEHN Cc1ncc(CS(=O)(=O)C(C)C(=O)N(Cc2ccccc2)C(C)C)s1 ZINC000069217558 564836201 /nfs/dbraw/zinc/83/62/01/564836201.db2.gz BWHVGQPCZWGMEQ-CQSZACIVSA-N 0 3 380.535 3.192 10 0 GGAEHN CN(C[C@H](O)COc1c(Cl)cccc1Cl)[C@H]1CCCc2c1cnn2C ZINC000135589967 564836263 /nfs/dbraw/zinc/83/62/63/564836263.db2.gz ABNBLMGETLKHJH-LRDDRELGSA-N 0 3 384.307 3.476 10 0 GGAEHN COCc1nc(C)c(C(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)s1 ZINC000135694037 564838410 /nfs/dbraw/zinc/83/84/10/564838410.db2.gz BYJFDHCDJNTEFS-BBRMVZONSA-N 0 3 379.551 3.472 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)Nc2cc(I)ccc2Cl)C1 ZINC000136359096 564849263 /nfs/dbraw/zinc/84/92/63/564849263.db2.gz LPYJUIFCSNZCNQ-JTQLQIEISA-N 0 3 393.656 3.112 10 0 GGAEHN O=C(NCCNCc1cc(-c2ccccc2)n[nH]1)c1cccc(Br)c1 ZINC000136134426 564845603 /nfs/dbraw/zinc/84/56/03/564845603.db2.gz KNJGDWOCZPGEHS-UHFFFAOYSA-N 0 3 399.292 3.359 10 0 GGAEHN CCC[C@H](C(=O)N1CCN(C(=O)c2c(Cl)cccc2Cl)CC1)N(C)C ZINC000137698062 564864065 /nfs/dbraw/zinc/86/40/65/564864065.db2.gz CGPSWVRZTCKOOA-OAHLLOKOSA-N 0 3 386.323 3.008 10 0 GGAEHN CCC[NH+]1CCC(CNC(=O)NCc2ccc([O-])c(Br)c2)CC1 ZINC000138164045 564864885 /nfs/dbraw/zinc/86/48/85/564864885.db2.gz BQKMLSOSRGIZMB-UHFFFAOYSA-N 0 3 384.318 3.076 10 0 GGAEHN CN(CCNc1cc(Br)cc(F)c1C(N)=O)Cc1ccc(F)cc1 ZINC000091733172 564871494 /nfs/dbraw/zinc/87/14/94/564871494.db2.gz HIUFYCCTGYLVAR-UHFFFAOYSA-N 0 3 398.251 3.370 10 0 GGAEHN CN(C)[C@H](CNc1cc(Br)cc(F)c1C(N)=O)c1cccs1 ZINC000092826926 564882278 /nfs/dbraw/zinc/88/22/78/564882278.db2.gz VKMXOSMJRIUOOG-GFCCVEGCSA-N 0 3 386.290 3.463 10 0 GGAEHN OCCCOC1CCN(CC2=Cc3cc(Br)ccc3OC2)CC1 ZINC000093694754 564888850 /nfs/dbraw/zinc/88/88/50/564888850.db2.gz ZKXHRRYFADEKJV-UHFFFAOYSA-N 0 3 382.298 3.088 10 0 GGAEHN CN(Cc1ccc(-n2cncn2)cc1)[C@H](CO)c1cccc(Br)c1 ZINC000093815632 564890502 /nfs/dbraw/zinc/89/05/02/564890502.db2.gz GFHATDWNJSFUPX-GOSISDBHSA-N 0 3 387.281 3.195 10 0 GGAEHN CC[C@@H]1C[C@@H](C)CC[C@@H]1NCc1ccc(S(=O)(=O)N2CCOCC2)s1 ZINC000093942246 564894595 /nfs/dbraw/zinc/89/45/95/564894595.db2.gz SVHIWTZTIOZEMJ-UXLLHSPISA-N 0 3 386.583 3.073 10 0 GGAEHN Cc1ccc(NCCCNC(=O)c2n[nH]c3ccc(Br)cc32)nc1 ZINC000531250202 564905464 /nfs/dbraw/zinc/90/54/64/564905464.db2.gz GKTUDQYISGAOCY-UHFFFAOYSA-N 0 3 388.269 3.261 10 0 GGAEHN CC(C)C[C@H](CN(C)C)NC(=O)NCCc1ccc(Br)s1 ZINC000097413815 564907036 /nfs/dbraw/zinc/90/70/36/564907036.db2.gz JXFLVNJUWNTQHP-GFCCVEGCSA-N 0 3 376.364 3.329 10 0 GGAEHN OCc1ccc(CN[C@@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)o1 ZINC000151194991 564908991 /nfs/dbraw/zinc/90/89/91/564908991.db2.gz RSKQZZNFPIIJKQ-LLVKDONJSA-N 0 3 375.778 3.208 10 0 GGAEHN CCCN1CCC(CNS(=O)(=O)c2cc3c(c(Cl)c2)O[C@@H](C)C3)CC1 ZINC000097590803 564909342 /nfs/dbraw/zinc/90/93/42/564909342.db2.gz QODDNYLCSJRPEL-ZDUSSCGKSA-N 0 3 386.945 3.064 10 0 GGAEHN O[C@H](CSc1ccc(Br)cn1)CN1CCc2ccccc2C1 ZINC000098144705 564913960 /nfs/dbraw/zinc/91/39/60/564913960.db2.gz YTRJURYQXDATFG-INIZCTEOSA-N 0 3 379.323 3.355 10 0 GGAEHN CCCC(=O)N[C@@H]1CCCN(CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000101563544 564917341 /nfs/dbraw/zinc/91/73/41/564917341.db2.gz RNFWHHJTGAZUFU-MRXNPFEDSA-N 0 3 396.329 3.158 10 0 GGAEHN Cc1ccc(I)c(C(=O)NC[C@H](CC(C)C)N(C)C)c1 ZINC000101686160 564920862 /nfs/dbraw/zinc/92/08/62/564920862.db2.gz GOZQAPJSFNQMSQ-ZDUSSCGKSA-N 0 3 388.293 3.306 10 0 GGAEHN CCCN1CCC[C@@H]1C(=O)NCCC(=O)Nc1ccc(Br)cc1C ZINC000101881916 564923121 /nfs/dbraw/zinc/92/31/21/564923121.db2.gz CPSIQFDVAFCACR-MRXNPFEDSA-N 0 3 396.329 3.077 10 0 GGAEHN O=C(NCCNCC1=Cc2cc(Br)ccc2OC1)c1ccccc1 ZINC000102425369 564929231 /nfs/dbraw/zinc/92/92/31/564929231.db2.gz FLWDNVHDZBBYAJ-UHFFFAOYSA-N 0 3 387.277 3.245 10 0 GGAEHN CCOc1ccc(Br)cc1NC(=O)Nc1cnn(CCN(C)C)c1 ZINC000102801931 564935904 /nfs/dbraw/zinc/93/59/04/564935904.db2.gz LYKKXCDVYQBWRE-UHFFFAOYSA-N 0 3 396.289 3.250 10 0 GGAEHN O=S(=O)(c1cc(C(F)(F)F)ccc1F)N1CCC(N2CCCC2)CC1 ZINC000103155516 564943671 /nfs/dbraw/zinc/94/36/71/564943671.db2.gz QOVFVYQXFZNTEM-UHFFFAOYSA-N 0 3 380.407 3.093 10 0 GGAEHN CCCC[C@@H]1CCC[C@H]1NCc1ccc(S(=O)(=O)N2CCOCC2)s1 ZINC000152145213 564948320 /nfs/dbraw/zinc/94/83/20/564948320.db2.gz OLHPUFJVMHMTPV-NVXWUHKLSA-N 0 3 386.583 3.218 10 0 GGAEHN CCCC[C@@H]1CCC[C@@H]1NCc1ccc(S(=O)(=O)N2CCOCC2)s1 ZINC000152145054 564948400 /nfs/dbraw/zinc/94/84/00/564948400.db2.gz OLHPUFJVMHMTPV-WBVHZDCISA-N 0 3 386.583 3.218 10 0 GGAEHN O=C(Nc1ccc(Br)cn1)[C@@H]1CCCN(CCc2ccccn2)C1 ZINC000103469105 564948847 /nfs/dbraw/zinc/94/88/47/564948847.db2.gz ABYMTMJSZVPLND-CQSZACIVSA-N 0 3 389.297 3.132 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)NCc2ccc(Br)cc2C(F)(F)F)C1 ZINC000152311402 564954712 /nfs/dbraw/zinc/95/47/12/564954712.db2.gz URTZKCFDPPXPIB-LBPRGKRZSA-N 0 3 394.235 3.313 10 0 GGAEHN CC1(C)C[C@H]1C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000152828898 564973942 /nfs/dbraw/zinc/97/39/42/564973942.db2.gz CBRHUTHTEQEEDE-KRWDZBQOSA-N 0 3 395.341 3.455 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(Cl)cc1Br ZINC000152894786 564976228 /nfs/dbraw/zinc/97/62/28/564976228.db2.gz JTAOBUCCKSTKPL-GFCCVEGCSA-N 0 3 390.709 3.335 10 0 GGAEHN CC[C@@H]1CN(CCC(=O)Nc2c(Cl)cccc2Cl)CCN1C[C@@H](C)O ZINC000106102750 564977905 /nfs/dbraw/zinc/97/79/05/564977905.db2.gz SYDREPRJGHLYFJ-ZIAGYGMSSA-N 0 3 388.339 3.099 10 0 GGAEHN CC[C@H]1CN(CCC(=O)Nc2c(Cl)cccc2Cl)CCN1CCOC ZINC000106114525 564977998 /nfs/dbraw/zinc/97/79/98/564977998.db2.gz KJCXHKWRFRHIEB-AWEZNQCLSA-N 0 3 388.339 3.365 10 0 GGAEHN CC[C@@H](c1ccc(Br)cc1)N1CCN(CC2(O)CCOCC2)CC1 ZINC000153023740 564981673 /nfs/dbraw/zinc/98/16/73/564981673.db2.gz BWJHSRDIIQBJIX-SFHVURJKSA-N 0 3 397.357 3.059 10 0 GGAEHN CC[C@H](c1ccc(Br)cc1)N1CCN(CC2(O)CCOCC2)CC1 ZINC000153023851 564982313 /nfs/dbraw/zinc/98/23/13/564982313.db2.gz BWJHSRDIIQBJIX-GOSISDBHSA-N 0 3 397.357 3.059 10 0 GGAEHN CC(C)c1n[nH]c(C(=O)N[C@@H](CN(C)C)c2ccccc2)c1Br ZINC000106902132 564991726 /nfs/dbraw/zinc/99/17/26/564991726.db2.gz CNEDEYNODABPOP-ZDUSSCGKSA-N 0 3 379.302 3.328 10 0 GGAEHN O[C@H](COc1ccc(Br)cc1)CN1CCC(C2CCOCC2)CC1 ZINC000153563464 565000665 /nfs/dbraw/zinc/00/06/65/565000665.db2.gz ZAOCNRRFAYOBMK-SFHVURJKSA-N 0 3 398.341 3.327 10 0 GGAEHN COC(=O)c1cc(Br)ccc1NC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000153551405 565000818 /nfs/dbraw/zinc/00/08/18/565000818.db2.gz JYGYOEMVNSNISP-AAEUAGOBSA-N 0 3 398.301 3.182 10 0 GGAEHN CN(C(=O)c1cc(Cl)sc1Cl)C1CCN(CCn2cccn2)CC1 ZINC000109292622 565024089 /nfs/dbraw/zinc/02/40/89/565024089.db2.gz PKWRUGHCRBLQKV-UHFFFAOYSA-N 0 3 387.336 3.488 10 0 GGAEHN C[C@H](CNC(=O)N1CC[C@H](N(C)C)C1)Sc1ccc(Br)cc1 ZINC000109404858 565025262 /nfs/dbraw/zinc/02/52/62/565025262.db2.gz MGFSJEOPFHMOSG-OCCSQVGLSA-N 0 3 386.359 3.275 10 0 GGAEHN C[C@@H](CNC(=O)N1CC[C@H](N(C)C)C1)Sc1ccc(Br)cc1 ZINC000109404857 565025503 /nfs/dbraw/zinc/02/55/03/565025503.db2.gz MGFSJEOPFHMOSG-JSGCOSHPSA-N 0 3 386.359 3.275 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N1CC[C@@H](N2CCCC2)C1 ZINC000110517563 565041561 /nfs/dbraw/zinc/04/15/61/565041561.db2.gz CSXJIVAAHMKMNV-OAHLLOKOSA-N 0 3 390.325 3.409 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)[C@H]1CCCN1c1nccs1)c1ccsc1 ZINC000110629051 565043491 /nfs/dbraw/zinc/04/34/91/565043491.db2.gz QBVFMUJBZGXXSA-HZPDHXFCSA-N 0 3 378.567 3.373 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)NC[C@@H](C)N(C)C1CC1 ZINC000110698390 565043940 /nfs/dbraw/zinc/04/39/40/565043940.db2.gz ZVNYMXPBYWSGSA-GFCCVEGCSA-N 0 3 378.314 3.311 10 0 GGAEHN Brc1cccc(-c2c[nH]c(CNCCCCN3CCOCC3)n2)c1 ZINC000111383308 565053991 /nfs/dbraw/zinc/05/39/91/565053991.db2.gz WTWQTAIRWFTGIZ-UHFFFAOYSA-N 0 3 393.329 3.041 10 0 GGAEHN C[C@@H]1CCCN1C1CCN(c2ccccc2S(=O)(=O)C(F)(F)F)CC1 ZINC000154898658 565056186 /nfs/dbraw/zinc/05/61/86/565056186.db2.gz AETNVXQAGZFYBO-CYBMUJFWSA-N 0 3 376.444 3.433 10 0 GGAEHN CCc1nc2n(n1)C[C@@H](N[C@@H](C)C(=O)Nc1cccc(Cl)c1Cl)CC2 ZINC000112550596 565064470 /nfs/dbraw/zinc/06/44/70/565064470.db2.gz VSTOLIUKPCVLRV-QWRGUYRKSA-N 0 3 382.295 3.079 10 0 GGAEHN CCc1nc2n(n1)C[C@@H](N[C@@H](C)C(=O)Nc1ccc(Cl)c(Cl)c1)CC2 ZINC000112551006 565064626 /nfs/dbraw/zinc/06/46/26/565064626.db2.gz ULVIPARLXUALDF-JQWIXIFHSA-N 0 3 382.295 3.079 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(Br)sc2C)[C@H](C)C1 ZINC000155280332 565065701 /nfs/dbraw/zinc/06/57/01/565065701.db2.gz WHYQOXWYKLQIEJ-PWSUYJOCSA-N 0 3 395.388 3.170 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(Br)sc2C)[C@H](C)C1 ZINC000155280456 565065714 /nfs/dbraw/zinc/06/57/14/565065714.db2.gz WHYQOXWYKLQIEJ-ZYHUDNBSSA-N 0 3 395.388 3.170 10 0 GGAEHN C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1 ZINC000113228545 565068405 /nfs/dbraw/zinc/06/84/05/565068405.db2.gz RQQXLRUDVINRML-TZMCWYRMSA-N 0 3 379.291 3.488 10 0 GGAEHN C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(-c2ccc(Br)cc2)n[nH]1 ZINC000113223256 565068438 /nfs/dbraw/zinc/06/84/38/565068438.db2.gz XIWREZOFVRXUNL-IUODEOHRSA-N 0 3 389.297 3.148 10 0 GGAEHN C[C@H]1CN2CCC[C@@H]2CN1Cc1nc(-c2cccc(Br)c2)no1 ZINC000113268796 565068769 /nfs/dbraw/zinc/06/87/69/565068769.db2.gz SJCBLYREPBXKDP-SWLSCSKDSA-N 0 3 377.286 3.168 10 0 GGAEHN C[C@H]1CN2CCC[C@@H]2CN1Cc1nc(-c2cc(Br)cs2)no1 ZINC000113266954 565068865 /nfs/dbraw/zinc/06/88/65/565068865.db2.gz DYHFLPLHINMCNH-CMPLNLGQSA-N 0 3 383.315 3.229 10 0 GGAEHN O[C@H](CNCc1ccc(Br)c(F)c1)CN1CCc2ccccc2C1 ZINC000155822538 565071888 /nfs/dbraw/zinc/07/18/88/565071888.db2.gz YPNMTGJXVKTMFH-QGZVFWFLSA-N 0 3 393.300 3.097 10 0 GGAEHN CN(C)CCOc1ccc(NC(=O)C(=O)c2ccc(Br)cc2)cc1 ZINC000114241500 565073192 /nfs/dbraw/zinc/07/31/92/565073192.db2.gz CQBHCYQTYHPUPF-UHFFFAOYSA-N 0 3 391.265 3.211 10 0 GGAEHN CN(C)CCc1ccc(NC(=O)C(=O)c2ccc(Br)cc2)cc1 ZINC000114263887 565073392 /nfs/dbraw/zinc/07/33/92/565073392.db2.gz YKFLYTNEDZSAAE-UHFFFAOYSA-N 0 3 375.266 3.375 10 0 GGAEHN CN(C)[C@@H](CNC(=O)Cc1ccc(Br)s1)Cc1ccccc1 ZINC000114315147 565073666 /nfs/dbraw/zinc/07/36/66/565073666.db2.gz JRHUWZIASMENBE-CQSZACIVSA-N 0 3 381.339 3.342 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)Cc2c[nH]c3cccc(Br)c23)CCN1C ZINC000155994343 565073692 /nfs/dbraw/zinc/07/36/92/565073692.db2.gz QXOMTPKKFHNTOT-OCCSQVGLSA-N 0 3 378.314 3.414 10 0 GGAEHN CN(C)CCOc1ccccc1CNC(=O)Cc1ccc(Br)s1 ZINC000114321395 565073921 /nfs/dbraw/zinc/07/39/21/565073921.db2.gz UIFRGTPWAJUNDV-UHFFFAOYSA-N 0 3 397.338 3.310 10 0 GGAEHN CN(C)CCOc1ccc(CNC(=O)Cc2ccc(Br)s2)cc1 ZINC000114327493 565074018 /nfs/dbraw/zinc/07/40/18/565074018.db2.gz ZYXGOLRNAHXOES-UHFFFAOYSA-N 0 3 397.338 3.310 10 0 GGAEHN C[C@H](NC(=O)Nc1ccn(CCN(C)C)n1)c1cccc(Br)c1 ZINC000156230852 565075909 /nfs/dbraw/zinc/07/59/09/565075909.db2.gz PCZSNNCACQLYQI-LBPRGKRZSA-N 0 3 380.290 3.090 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cccc(C)c2Br)[C@H](C)C1 ZINC000156348681 565081181 /nfs/dbraw/zinc/08/11/81/565081181.db2.gz TXQNIXSQHXOCOZ-ZIAGYGMSSA-N 0 3 389.359 3.108 10 0 GGAEHN Cc1nc(C(F)(F)F)c(CN2CCCC[C@@H](N3CCN(C)CC3)C2)s1 ZINC000183615881 565082301 /nfs/dbraw/zinc/08/23/01/565082301.db2.gz RSAVGPHZZCGMLL-CQSZACIVSA-N 0 3 376.492 3.072 10 0 GGAEHN CCC[C@@H](C)NC(=O)C(C)S(=O)(=O)Cc1sc(C)nc1C(F)(F)F ZINC000183711671 565089641 /nfs/dbraw/zinc/08/96/41/565089641.db2.gz OYYFEKRRWBICME-BDAKNGLRSA-N 0 3 386.461 3.078 10 0 GGAEHN CCC(CC)NC(=O)C(C)S(=O)(=O)Cc1sc(C)nc1C(F)(F)F ZINC000183709144 565089721 /nfs/dbraw/zinc/08/97/21/565089721.db2.gz FKYOETZGUZEBDA-QMMMGPOBSA-N 0 3 386.461 3.078 10 0 GGAEHN CCCCCNC(=O)C(C)S(=O)(=O)Cc1sc(C)nc1C(F)(F)F ZINC000183708553 565089955 /nfs/dbraw/zinc/08/99/55/565089955.db2.gz WNOMCMPGKRNMKQ-VIFPVBQESA-N 0 3 386.461 3.080 10 0 GGAEHN CCC(C)(C)NC(=O)C(C)S(=O)(=O)Cc1sc(C)nc1C(F)(F)F ZINC000183715009 565090793 /nfs/dbraw/zinc/09/07/93/565090793.db2.gz TWNFTVLAEHCQAI-QMMMGPOBSA-N 0 3 386.461 3.078 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)N[C@@H]2CCOc3ccc(Br)cc32)CCN1C ZINC000266833210 565092849 /nfs/dbraw/zinc/09/28/49/565092849.db2.gz ZQFQRFNXAUQALZ-IVMMDQJWSA-N 0 3 396.329 3.397 10 0 GGAEHN CC[C@@H]1CN(CCC(=O)Nc2ccccc2Br)C[C@]2(CCOC2)O1 ZINC000369545695 565096694 /nfs/dbraw/zinc/09/66/94/565096694.db2.gz JEZBJWLLYJKZMH-KDOFPFPSSA-N 0 3 397.313 3.048 10 0 GGAEHN CN(Cc1ccc(Br)c(F)c1)C1CCN(c2cnccn2)CC1 ZINC000370043584 565125503 /nfs/dbraw/zinc/12/55/03/565125503.db2.gz SQCLMTYTABADSL-UHFFFAOYSA-N 0 3 379.277 3.479 10 0 GGAEHN CN(C)CCN(Cc1cccc(O)c1)C(=O)Cc1ccc(Br)s1 ZINC000157291111 565126255 /nfs/dbraw/zinc/12/62/55/565126255.db2.gz KRXZQARGJXLVLB-UHFFFAOYSA-N 0 3 397.338 3.349 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)Cc1c[nH]c2cccc(Br)c12 ZINC000157289415 565127078 /nfs/dbraw/zinc/12/70/78/565127078.db2.gz UOFTZGIOZMNPDE-AWEZNQCLSA-N 0 3 378.314 3.416 10 0 GGAEHN O=C(Nc1ccc([S@](=O)C(F)(F)F)cc1)N1CC[C@H](N2CCCC2)C1 ZINC000370136905 565128954 /nfs/dbraw/zinc/12/89/54/565128954.db2.gz VWGFDDAMQXOHLJ-CANCMXDXSA-N 0 3 375.416 3.016 10 0 GGAEHN O=C(Nc1ccc([S@@](=O)C(F)(F)F)cc1)N1CC[C@@H](N2CCCC2)C1 ZINC000370136907 565128994 /nfs/dbraw/zinc/12/89/94/565128994.db2.gz VWGFDDAMQXOHLJ-YMXBGEKHSA-N 0 3 375.416 3.016 10 0 GGAEHN C[C@](O)(CN1CCC(n2ccnc2)CC1)c1ccc(Br)cc1F ZINC000292765302 565132820 /nfs/dbraw/zinc/13/28/20/565132820.db2.gz JEPOINUHYJGSRL-KRWDZBQOSA-N 0 3 382.277 3.329 10 0 GGAEHN Cc1nc([C@H]2CCCN(C[C@](C)(O)c3ccc(Br)cc3F)C2)n[nH]1 ZINC000292774491 565133135 /nfs/dbraw/zinc/13/31/35/565133135.db2.gz KALLMIRCRCHBNX-SJCJKPOMSA-N 0 3 397.292 3.102 10 0 GGAEHN Cc1n[nH]c([C@H]2CCCN(C[C@](C)(O)c3ccc(Br)cc3F)C2)n1 ZINC000292774491 565133137 /nfs/dbraw/zinc/13/31/37/565133137.db2.gz KALLMIRCRCHBNX-SJCJKPOMSA-N 0 3 397.292 3.102 10 0 GGAEHN Cc1nc([C@H]2CCCN(C[C@@](C)(O)c3ccc(Br)cc3F)C2)n[nH]1 ZINC000292774496 565134193 /nfs/dbraw/zinc/13/41/93/565134193.db2.gz KALLMIRCRCHBNX-YVEFUNNKSA-N 0 3 397.292 3.102 10 0 GGAEHN Cc1n[nH]c([C@H]2CCCN(C[C@@](C)(O)c3ccc(Br)cc3F)C2)n1 ZINC000292774496 565134194 /nfs/dbraw/zinc/13/41/94/565134194.db2.gz KALLMIRCRCHBNX-YVEFUNNKSA-N 0 3 397.292 3.102 10 0 GGAEHN CN1CCC(CC(=O)N[C@H](CO)c2ccc(Cl)cc2C(F)(F)F)CC1 ZINC000292797935 565134448 /nfs/dbraw/zinc/13/44/48/565134448.db2.gz HTVIXCMOUVJKBI-OAHLLOKOSA-N 0 3 378.822 3.240 10 0 GGAEHN CCC[C@@H](C(=O)N1CCO[C@@H](c2ccc(F)c(Br)c2)C1)N(C)C ZINC000184493578 565139780 /nfs/dbraw/zinc/13/97/80/565139780.db2.gz OWIFTSXIQANQIQ-JKSUJKDBSA-N 0 3 387.293 3.218 10 0 GGAEHN CCc1nn(C)c(Cl)c1CNC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1 ZINC000370584378 565150472 /nfs/dbraw/zinc/15/04/72/565150472.db2.gz PJDUDAQUCPFRGP-UHFFFAOYSA-N 0 3 384.311 3.012 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1cc(F)c(Br)cc1C ZINC000184836311 565160395 /nfs/dbraw/zinc/16/03/95/565160395.db2.gz LADNGLGUXAPBFY-GFCCVEGCSA-N 0 3 388.281 3.129 10 0 GGAEHN O=c1ccc2c([nH]1)CCC[C@@H]2NCc1cc(Br)c2c(c1)OCCO2 ZINC000268813298 565168849 /nfs/dbraw/zinc/16/88/49/565168849.db2.gz JRQHDJBURXRWLR-AWEZNQCLSA-N 0 3 391.265 3.488 10 0 GGAEHN CNC(=O)C1CCC(N[C@@H](C)c2ccccc2I)CC1 ZINC000268868434 565170731 /nfs/dbraw/zinc/17/07/31/565170731.db2.gz CSQDXINMANEDJU-HIFPTAJRSA-N 0 3 386.277 3.247 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)c2csc(-c3ccc(Br)s3)n2)C1 ZINC000158675188 565177356 /nfs/dbraw/zinc/17/73/56/565177356.db2.gz OVEFZMSHUQRGNC-SECBINFHSA-N 0 3 386.340 3.410 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3ccc(C4SCCS4)cc3)[C@H]2C1 ZINC000293996399 565194200 /nfs/dbraw/zinc/19/42/00/565194200.db2.gz WXQJJYIGXCNTES-DLBZAZTESA-N 0 3 378.563 3.100 10 0 GGAEHN CN(C)CCn1cc(NC(=O)CCCc2ccccc2Br)cn1 ZINC000159119905 565195104 /nfs/dbraw/zinc/19/51/04/565195104.db2.gz NWWGOAXSORWTKF-UHFFFAOYSA-N 0 3 379.302 3.169 10 0 GGAEHN C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)Nc1cnn(CCN(C)C)c1 ZINC000159116693 565195622 /nfs/dbraw/zinc/19/56/22/565195622.db2.gz XMLYBMFLLRMIMK-LBPRGKRZSA-N 0 3 397.292 3.164 10 0 GGAEHN CCCN(CC(=O)Nc1cc(Cl)ccc1Cl)CC1(O)CCOCC1 ZINC000269721989 565197646 /nfs/dbraw/zinc/19/76/46/565197646.db2.gz UFMDGRSZMOYRNL-UHFFFAOYSA-N 0 3 375.296 3.185 10 0 GGAEHN CN(C)CCn1nccc1NC(=O)c1cc(F)c(Br)cc1Cl ZINC000294234188 565203801 /nfs/dbraw/zinc/20/38/01/565203801.db2.gz XBLCPFJYNGJDJU-UHFFFAOYSA-N 0 3 389.656 3.252 10 0 GGAEHN CCSc1ccc(Cl)cc1C(=O)Nc1ccc(=O)n(CCN(C)C)c1 ZINC000270057857 565208199 /nfs/dbraw/zinc/20/81/99/565208199.db2.gz DSOXYVLKEHKWIJ-UHFFFAOYSA-N 0 3 379.913 3.428 10 0 GGAEHN C[C@@H](NCc1cc(Br)cc(Br)c1N)[C@H]1CCCO1 ZINC000185776402 565220721 /nfs/dbraw/zinc/22/07/21/565220721.db2.gz LPYVAKVJMKDZRK-PRHODGIISA-N 0 3 378.108 3.451 10 0 GGAEHN NC(=O)[C@H](N[C@H]1CCOC2(CCSCC2)C1)c1cccc(Br)c1 ZINC000270598870 565223875 /nfs/dbraw/zinc/22/38/75/565223875.db2.gz KQJGNWKMLOMLEQ-LSDHHAIUSA-N 0 3 399.354 3.010 10 0 GGAEHN COc1cc(Br)c(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1OC ZINC000294876877 565233494 /nfs/dbraw/zinc/23/34/94/565233494.db2.gz HTNQTRLMHPHSFC-VXGBXAGGSA-N 0 3 385.302 3.021 10 0 GGAEHN CCN1CCC[C@H]1CN[C@@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186083188 565238266 /nfs/dbraw/zinc/23/82/66/565238266.db2.gz ZAZNCEYABBINNF-ROUUACIJSA-N 0 3 375.314 3.402 10 0 GGAEHN CCN1CCC[C@H](N[C@@H](c2ccc(Br)cc2)c2cncnc2)C1 ZINC000186124894 565242380 /nfs/dbraw/zinc/24/23/80/565242380.db2.gz WZQHIMYZZSFSLX-ROUUACIJSA-N 0 3 375.314 3.402 10 0 GGAEHN CCN1CCC[C@@H](N[C@@H](c2ccc(Br)cc2)c2cncnc2)C1 ZINC000186124916 565242471 /nfs/dbraw/zinc/24/24/71/565242471.db2.gz WZQHIMYZZSFSLX-MSOLQXFVSA-N 0 3 375.314 3.402 10 0 GGAEHN O=C(CCN1CCC[C@@H](c2ccncn2)C1)Nc1ccccc1Br ZINC000372578017 565246538 /nfs/dbraw/zinc/24/65/38/565246538.db2.gz JCJNJEIVBSCDAJ-CQSZACIVSA-N 0 3 389.297 3.447 10 0 GGAEHN Brc1ccc([C@H](N[C@H]2CCc3n[nH]cc3C2)c2cncnc2)cc1 ZINC000186287580 565252321 /nfs/dbraw/zinc/25/23/21/565252321.db2.gz LKVHLNARCSGWND-WMZOPIPTSA-N 0 3 384.281 3.199 10 0 GGAEHN CCOC(=O)c1nn(C)cc1CNCC1(c2ccccc2Br)CC1 ZINC000186366651 565257495 /nfs/dbraw/zinc/25/74/95/565257495.db2.gz AMOFQYFHZJZTRH-UHFFFAOYSA-N 0 3 392.297 3.181 10 0 GGAEHN CCO[C@@H]1C[C@@H](N[C@@H](CO)c2cccc(Br)c2)C12CCOCC2 ZINC000186422342 565261006 /nfs/dbraw/zinc/26/10/06/565261006.db2.gz XQCYTWRIYNCULO-GVDBMIGSSA-N 0 3 384.314 3.046 10 0 GGAEHN COc1nc(C)c(Br)cc1C(=O)N1CCCC[C@H](N2CCCC2)C1 ZINC000186471990 565261825 /nfs/dbraw/zinc/26/18/25/565261825.db2.gz RJYWMLQSCOWUHA-AWEZNQCLSA-N 0 3 396.329 3.252 10 0 GGAEHN COc1cccc(N2CC[C@@H](CNCc3cncc(Br)c3)C2)c1 ZINC000186615976 565272473 /nfs/dbraw/zinc/27/24/73/565272473.db2.gz UNXMDTDDQHMKGN-AWEZNQCLSA-N 0 3 376.298 3.469 10 0 GGAEHN Fc1ccc2c(c1Br)CC[C@H]2NC[C@H]1COC2(CCOCC2)O1 ZINC000295551423 565272553 /nfs/dbraw/zinc/27/25/53/565272553.db2.gz YIVDDLKNYKIAKI-XHDPSFHLSA-N 0 3 386.261 3.087 10 0 GGAEHN COc1c(Br)cc(Br)cc1CNC(C)(C)[C@@H](C)O ZINC000161140685 565274853 /nfs/dbraw/zinc/27/48/53/565274853.db2.gz WFTGJHYWEJUEBR-MRVPVSSYSA-N 0 3 381.108 3.469 10 0 GGAEHN Cc1csc(CCC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)n1 ZINC000373416133 565283665 /nfs/dbraw/zinc/28/36/65/565283665.db2.gz FUYKZIYCVRKUOW-UHFFFAOYSA-N 0 3 375.460 3.306 10 0 GGAEHN COCc1ccsc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000373430188 565285392 /nfs/dbraw/zinc/28/53/92/565285392.db2.gz ZQSUXJNUPJGEED-UHFFFAOYSA-N 0 3 376.444 3.430 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N(C)CC1(N(C)C)CCC1 ZINC000186845976 565289797 /nfs/dbraw/zinc/28/97/97/565289797.db2.gz RETUVKBDLOUEQQ-UHFFFAOYSA-N 0 3 384.318 3.083 10 0 GGAEHN CC(C)(C)C(=O)N1CCC(CN[C@H](CO)c2cccc(Br)c2)CC1 ZINC000161715318 565291184 /nfs/dbraw/zinc/29/11/84/565291184.db2.gz HOCIFOWESIAPHT-QGZVFWFLSA-N 0 3 397.357 3.357 10 0 GGAEHN COc1c(Br)cccc1CN(C)[C@H]1CCCN(c2cccnn2)C1 ZINC000186939660 565296439 /nfs/dbraw/zinc/29/64/39/565296439.db2.gz ZYDCYFRGDYPJBQ-HNNXBMFYSA-N 0 3 391.313 3.349 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1F)N[C@@H](C)C(=O)NCc1ccco1 ZINC000161985181 565300284 /nfs/dbraw/zinc/30/02/84/565300284.db2.gz CDIVZNKHCZVDTI-RYUDHWBXSA-N 0 3 383.261 3.407 10 0 GGAEHN Cc1ccc(I)c(C(=O)N(C)CC2(N(C)C)CCC2)c1 ZINC000187022614 565303040 /nfs/dbraw/zinc/30/30/40/565303040.db2.gz PLBQYMKEBZYXLI-UHFFFAOYSA-N 0 3 386.277 3.156 10 0 GGAEHN COc1c(Br)cccc1CN[C@H]1CCc2nnc(C(C)C)n2C1 ZINC000187177871 565314791 /nfs/dbraw/zinc/31/47/91/565314791.db2.gz VNSVJWAKKGKSHG-ZDUSSCGKSA-N 0 3 379.302 3.277 10 0 GGAEHN CN1CCC(CC(=O)N2CCO[C@H](c3ccc(Br)cc3)C2)CC1 ZINC000273295955 565315556 /nfs/dbraw/zinc/31/55/56/565315556.db2.gz YUXAHKRVIWKRFM-KRWDZBQOSA-N 0 3 381.314 3.081 10 0 GGAEHN COc1c(Br)cccc1CN[C@H]1CCCN(c2cccnn2)C1 ZINC000187217646 565317022 /nfs/dbraw/zinc/31/70/22/565317022.db2.gz VTPZVDUJFGWDIV-AWEZNQCLSA-N 0 3 377.286 3.006 10 0 GGAEHN COc1c(Br)cccc1CN[C@H]1CCc2nc(C(C)C)nn2C1 ZINC000187219221 565317415 /nfs/dbraw/zinc/31/74/15/565317415.db2.gz VGMHQFRBLCELBJ-ZDUSSCGKSA-N 0 3 379.302 3.277 10 0 GGAEHN CC[C@@H]1CN(Cc2cc(Br)cc3cccnc32)CCN1C[C@@H](C)O ZINC000162557583 565320736 /nfs/dbraw/zinc/32/07/36/565320736.db2.gz NGZWVYIEKRSVQC-RDTXWAMCSA-N 0 3 392.341 3.274 10 0 GGAEHN CC(C)[C@H]1CCCC[C@H]1NCC(=O)Nc1cc(S(C)(=O)=O)ccc1Cl ZINC000162598140 565321941 /nfs/dbraw/zinc/32/19/41/565321941.db2.gz CZAGRJBEWYLFII-GDBMZVCRSA-N 0 3 386.945 3.486 10 0 GGAEHN CC(C)[C@@H]1CCCC[C@H]1NCC(=O)Nc1cc(S(C)(=O)=O)ccc1Cl ZINC000162598062 565322312 /nfs/dbraw/zinc/32/23/12/565322312.db2.gz CZAGRJBEWYLFII-GOEBONIOSA-N 0 3 386.945 3.486 10 0 GGAEHN Cc1ccc(S(=O)(=O)C[C@@H](C)N[C@@H]2CCOC3(CCSCC3)C2)cc1 ZINC000273539675 565325090 /nfs/dbraw/zinc/32/50/90/565325090.db2.gz YCVSZTSQXSPXRQ-IAGOWNOFSA-N 0 3 383.579 3.192 10 0 GGAEHN Cc1ccc(S(=O)(=O)C[C@H](C)N[C@H]2CCOC3(CCSCC3)C2)cc1 ZINC000273540800 565325113 /nfs/dbraw/zinc/32/51/13/565325113.db2.gz YCVSZTSQXSPXRQ-IRXDYDNUSA-N 0 3 383.579 3.192 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N1CCCC12CCN(C)CC2 ZINC000374304024 565331347 /nfs/dbraw/zinc/33/13/47/565331347.db2.gz YKZWNVIFWZFYHO-UHFFFAOYSA-N 0 3 381.314 3.087 10 0 GGAEHN C[C@H](c1ccc(CN2CCC[C@H](CNS(C)(=O)=O)C2)cc1)C(F)(F)F ZINC000296862271 565340697 /nfs/dbraw/zinc/34/06/97/565340697.db2.gz VEUOVOVJRINQCJ-UKRRQHHQSA-N 0 3 378.460 3.114 10 0 GGAEHN C[C@H](N[C@H]1CCCN(c2ncccn2)C1)c1cc(Br)ncc1F ZINC000273915775 565345854 /nfs/dbraw/zinc/34/58/54/565345854.db2.gz YNRUGEUNLHSVKG-RYUDHWBXSA-N 0 3 380.265 3.093 10 0 GGAEHN CS[C@@H]1CN(CC(=O)Nc2c(Cl)cccc2Cl)C[C@H]1N1CCCC1 ZINC000273934074 565346809 /nfs/dbraw/zinc/34/68/09/565346809.db2.gz CLGNONGHVYFEMX-HUUCEWRRSA-N 0 3 388.364 3.444 10 0 GGAEHN CS[C@@H]1CN(CC(=O)Nc2cccc(Cl)c2Cl)C[C@@H]1N1CCCC1 ZINC000273966792 565349182 /nfs/dbraw/zinc/34/91/82/565349182.db2.gz GHKFNIPYIUAQQR-LSDHHAIUSA-N 0 3 388.364 3.444 10 0 GGAEHN O[C@H]1[C@@H](CNCc2cc(Br)cc3c2OCC3)CCC12CCOCC2 ZINC000374672266 565350563 /nfs/dbraw/zinc/35/05/63/565350563.db2.gz CFMAXPVIIZOCHI-KDOFPFPSSA-N 0 3 396.325 3.041 10 0 GGAEHN CS(=O)(=O)C1(CN[C@@H]2CCc3c2ccc(F)c3Br)CCC1 ZINC000297065499 565353737 /nfs/dbraw/zinc/35/37/37/565353737.db2.gz ZFEGROWJAPBMSR-CYBMUJFWSA-N 0 3 376.291 3.132 10 0 GGAEHN O=C(N[C@@H](c1nccs1)C(F)(F)F)N1CCN(C2CCCCC2)CC1 ZINC000297085999 565355199 /nfs/dbraw/zinc/35/51/99/565355199.db2.gz VHKHZBSKMNODDY-ZDUSSCGKSA-N 0 3 376.448 3.406 10 0 GGAEHN C[C@@H](NCC(=O)N1N=C(c2cccs2)C[C@@H]1c1cccs1)[C@H](C)CO ZINC000274104642 565357365 /nfs/dbraw/zinc/35/73/65/565357365.db2.gz VCVTWRFKIKNTRO-UMVBOHGHSA-N 0 3 377.535 3.094 10 0 GGAEHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)NCc1ccc(Br)cc1OC ZINC000187844526 565359227 /nfs/dbraw/zinc/35/92/27/565359227.db2.gz PWBUVYADJUBLCX-CVEARBPZSA-N 0 3 396.329 3.226 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N1CCC[C@@H]2CN(C)CC[C@H]21 ZINC000187846849 565359658 /nfs/dbraw/zinc/35/96/58/565359658.db2.gz VPOQUHGLIMLZAT-GDBMZVCRSA-N 0 3 396.329 3.083 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N(CCN(C)C)C1CCCC1 ZINC000187856731 565360678 /nfs/dbraw/zinc/36/06/78/565360678.db2.gz YSBNDAWLMLEPAS-UHFFFAOYSA-N 0 3 398.345 3.474 10 0 GGAEHN CC(C(=O)N1CCc2sccc2C1)S(=O)(=O)Cc1cccc(Cl)c1 ZINC000375009667 565364717 /nfs/dbraw/zinc/36/47/17/565364717.db2.gz YYNUUIXPDYHJHY-GFCCVEGCSA-N 0 3 383.922 3.290 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)Nc2cnc(Cl)c(Br)c2)CCN1C ZINC000274327935 565367800 /nfs/dbraw/zinc/36/78/00/565367800.db2.gz DKEKPAASJVRWIP-ONGXEEELSA-N 0 3 375.698 3.444 10 0 GGAEHN CCOc1cc(C[NH2+]CC2(COC)CCOCC2)cc(Br)c1[O-] ZINC000297499499 565374294 /nfs/dbraw/zinc/37/42/94/565374294.db2.gz UUYHTBWXTONWAC-UHFFFAOYSA-N 0 3 388.302 3.086 10 0 GGAEHN Ic1cccc(CNCc2cccnc2-n2ccnc2)c1 ZINC000375196833 565375146 /nfs/dbraw/zinc/37/51/46/565375146.db2.gz XOMQOEJPRSDTIW-UHFFFAOYSA-N 0 3 390.228 3.162 10 0 GGAEHN O=S1(=O)CCC[C@H](CN2CCC[C@H]2Cc2ccc(Br)cc2)C1 ZINC000375360440 565383482 /nfs/dbraw/zinc/38/34/82/565383482.db2.gz HWJZGGHJMOCHQV-WBVHZDCISA-N 0 3 386.355 3.281 10 0 GGAEHN O=C1CCCN1C[C@H](O)CN[C@@H](CC1CC1)c1cc(F)cc(Br)c1 ZINC000188188479 565387374 /nfs/dbraw/zinc/38/73/74/565387374.db2.gz VDBGNLZQBCUNJM-SJORKVTESA-N 0 3 399.304 3.002 10 0 GGAEHN O=C1CCCN1C[C@H](O)CN[C@H](CC1CC1)c1cc(F)cc(Br)c1 ZINC000188188455 565387407 /nfs/dbraw/zinc/38/74/07/565387407.db2.gz VDBGNLZQBCUNJM-IAGOWNOFSA-N 0 3 399.304 3.002 10 0 GGAEHN COCc1nc2n(n1)CCC[C@H]2N[C@H](C)Cc1ccc(Br)cc1 ZINC000188248748 565390605 /nfs/dbraw/zinc/39/06/05/565390605.db2.gz OIYRTSWQKJAHJT-IUODEOHRSA-N 0 3 379.302 3.243 10 0 GGAEHN CN1CCO[C@@H](CN[C@@H](c2ccccc2)c2ccc(Br)cc2)C1 ZINC000188268550 565391706 /nfs/dbraw/zinc/39/17/06/565391706.db2.gz ICRTYELWIXRIGJ-OALUTQOASA-N 0 3 375.310 3.459 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1C(=O)N1CC[C@H](N(C)C)C1 ZINC000170865466 565395511 /nfs/dbraw/zinc/39/55/11/565395511.db2.gz RWTBKZGVIMRYPD-INIZCTEOSA-N 0 3 391.313 3.028 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)c2ccc(COc3cccc(Br)c3)o2)C1 ZINC000170865397 565396010 /nfs/dbraw/zinc/39/60/10/565396010.db2.gz YCEJJROWEZKLNO-AWEZNQCLSA-N 0 3 393.281 3.397 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)c2ccc(Oc3ccc(Br)cc3)nc2)C1 ZINC000170865276 565396263 /nfs/dbraw/zinc/39/62/63/565396263.db2.gz YKEVIWPEGJYQPX-HNNXBMFYSA-N 0 3 390.281 3.413 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)c2cccnc2Oc2ccc(Br)cc2)C1 ZINC000170866332 565397528 /nfs/dbraw/zinc/39/75/28/565397528.db2.gz MKXYUEVJVFIYBO-CQSZACIVSA-N 0 3 390.281 3.413 10 0 GGAEHN COCCCN1CCC(NC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)CC1 ZINC000171126623 565411622 /nfs/dbraw/zinc/41/16/22/565411622.db2.gz PRTBMRWOVGAEQJ-ZDUSSCGKSA-N 0 3 389.323 3.378 10 0 GGAEHN Cc1c(I)cccc1C(=O)NCc1ccc2c(c1)CNC2 ZINC000188672293 565416442 /nfs/dbraw/zinc/41/64/42/565416442.db2.gz GKGPFLNOVCAAGU-UHFFFAOYSA-N 0 3 392.240 3.133 10 0 GGAEHN Cc1cccc(C(=O)NCc2ccc3c(c2)CNC3)c1I ZINC000188687957 565418071 /nfs/dbraw/zinc/41/80/71/565418071.db2.gz KGPAVNYJZWUKCE-UHFFFAOYSA-N 0 3 392.240 3.133 10 0 GGAEHN CC(C)(C)N1CC[C@@H](NCCS(C)(=O)=O)[C@H]1c1ccc(Cl)c(F)c1 ZINC000298535751 565419011 /nfs/dbraw/zinc/41/90/11/565419011.db2.gz MQIQKQKVBVHWHQ-HZPDHXFCSA-N 0 3 376.925 3.027 10 0 GGAEHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cnc(Cl)c(F)c1 ZINC000376143479 565424041 /nfs/dbraw/zinc/42/40/41/565424041.db2.gz UFUIHKZTCDHVBL-UHFFFAOYSA-N 0 3 379.785 3.409 10 0 GGAEHN C[C@@H]1CN(Cc2ccc(Br)c(F)c2)CC[C@H]1N1CCN(C)CC1 ZINC000376202801 565425911 /nfs/dbraw/zinc/42/59/11/565425911.db2.gz FQBTYZPWHDKKQH-RDTXWAMCSA-N 0 3 384.337 3.046 10 0 GGAEHN C[C@H]1CN(Cc2ccc(Br)c(F)c2)CC[C@@H]1N1CCN(C)CC1 ZINC000376202800 565426447 /nfs/dbraw/zinc/42/64/47/565426447.db2.gz FQBTYZPWHDKKQH-KSSFIOAISA-N 0 3 384.337 3.046 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N1CCN2CCC1CC2 ZINC000188863510 565427619 /nfs/dbraw/zinc/42/76/19/565427619.db2.gz BMEXGAAGXFABEO-UHFFFAOYSA-N 0 3 376.298 3.019 10 0 GGAEHN CC[C@@H]1CN(CCOc2cc(F)cc(Br)c2)CCN1CCOC ZINC000188956669 565435350 /nfs/dbraw/zinc/43/53/50/565435350.db2.gz LYWSSCSJKKTEHH-MRXNPFEDSA-N 0 3 389.309 3.010 10 0 GGAEHN O[C@@H](CN[C@@H](c1cccc(Br)c1)C1CCOCC1)C(F)(F)F ZINC000276177004 565438526 /nfs/dbraw/zinc/43/85/26/565438526.db2.gz UHSDGSLCYYRZBP-UONOGXRCSA-N 0 3 382.220 3.430 10 0 GGAEHN CN1CC[C@@H]2[C@H](CCCN2C(=O)C2(c3ccccc3Br)CC2)C1 ZINC000189034017 565439100 /nfs/dbraw/zinc/43/91/00/565439100.db2.gz HUACGBKGYZOPNM-RHSMWYFYSA-N 0 3 377.326 3.423 10 0 GGAEHN COc1cc(C[NH2+][C@H](CO)Cc2cccc(C)c2)cc(Br)c1[O-] ZINC000189026667 565439232 /nfs/dbraw/zinc/43/92/32/565439232.db2.gz AMODHGSDGPBJNU-HNNXBMFYSA-N 0 3 380.282 3.165 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2ccc(OC)c(OC)c2Cl)n1 ZINC000276253022 565442773 /nfs/dbraw/zinc/44/27/73/565442773.db2.gz SJWFROYOWNTUCS-UHFFFAOYSA-N 0 3 384.885 3.323 10 0 GGAEHN CN1CC[C@H](NC(=O)Nc2ccncc2Br)[C@@H]1c1ccccc1 ZINC000276386376 565447399 /nfs/dbraw/zinc/44/73/99/565447399.db2.gz MJBLYMNPTALLKZ-HOTGVXAUSA-N 0 3 375.270 3.411 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N(C)CC1CCN(C)CC1 ZINC000171742954 565448123 /nfs/dbraw/zinc/44/81/23/565448123.db2.gz RHIVGBDIRQBDKI-CQSZACIVSA-N 0 3 382.346 3.363 10 0 GGAEHN O=C(c1n[nH]c2ccc(Br)cc21)N1CCC[C@H]1CN1CCCCC1 ZINC000171776205 565450693 /nfs/dbraw/zinc/45/06/93/565450693.db2.gz OWMMUBFRXMFAQZ-AWEZNQCLSA-N 0 3 391.313 3.416 10 0 GGAEHN O=C(NC[C@@H]1CN2CCC[C@H]2CO1)Nc1cc(Cl)ccc1C(F)(F)F ZINC000376742824 565452295 /nfs/dbraw/zinc/45/22/95/565452295.db2.gz JFLHKZFRDQCVLZ-NWDGAFQWSA-N 0 3 377.794 3.344 10 0 GGAEHN O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)Nc1cc(Cl)ccc1C(F)(F)F ZINC000376742826 565452347 /nfs/dbraw/zinc/45/23/47/565452347.db2.gz JFLHKZFRDQCVLZ-VXGBXAGGSA-N 0 3 377.794 3.344 10 0 GGAEHN COc1ccc([C@@H](C)NC(=O)N2CCN3CCC[C@@H]3C2)cc1Br ZINC000171899231 565456758 /nfs/dbraw/zinc/45/67/58/565456758.db2.gz OMTOZPUJDZYZQI-TZMCWYRMSA-N 0 3 382.302 3.008 10 0 GGAEHN Cc1ccc(-n2ncc(N3CCN4CCC[C@@H]4C3)c(Cl)c2=O)cc1Cl ZINC000171939256 565458239 /nfs/dbraw/zinc/45/82/39/565458239.db2.gz RELJTWBRRMBBKW-CQSZACIVSA-N 0 3 379.291 3.132 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)c1ccc(CN(C)C)cc1 ZINC000189322566 565458664 /nfs/dbraw/zinc/45/86/64/565458664.db2.gz HOQIVFLUKUMNCW-UHFFFAOYSA-N 0 3 377.282 3.449 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)NC[C@H](C)N(C)C1CC1 ZINC000189362340 565460944 /nfs/dbraw/zinc/46/09/44/565460944.db2.gz WOAJKCRQZWPEFI-NWDGAFQWSA-N 0 3 384.318 3.301 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)NC[C@@H](C)N(C)C1CC1 ZINC000189362319 565461741 /nfs/dbraw/zinc/46/17/41/565461741.db2.gz WOAJKCRQZWPEFI-NEPJUHHUSA-N 0 3 384.318 3.301 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)NC[C@H]1CCCN(C)C1 ZINC000189489978 565468401 /nfs/dbraw/zinc/46/84/01/565468401.db2.gz MPXBTBGQUBWEAB-CHWSQXEVSA-N 0 3 384.318 3.160 10 0 GGAEHN CN1CCCN(c2ccc3nnc(-c4cc(Cl)cc(Cl)c4)n3n2)CC1 ZINC000301150418 565468497 /nfs/dbraw/zinc/46/84/97/565468497.db2.gz MNDYNSJGQHOJSP-UHFFFAOYSA-N 0 3 377.279 3.240 10 0 GGAEHN Cc1ccc(NC(=O)[C@H](C)N2CCCN(C3CC3)CC2)c(Br)c1 ZINC000172346872 565479923 /nfs/dbraw/zinc/47/99/23/565479923.db2.gz DYJGIRCYIPDPPP-AWEZNQCLSA-N 0 3 380.330 3.255 10 0 GGAEHN CCN1CCN(C[C@H](C)CNC(=O)c2c(Cl)cc(F)cc2Cl)CC1 ZINC000277177485 565481430 /nfs/dbraw/zinc/48/14/30/565481430.db2.gz DPMSYWKWYFDXFJ-GFCCVEGCSA-N 0 3 376.303 3.136 10 0 GGAEHN Cn1ncc(NC[C@H]2CCCN(C)[C@@H]2c2cccs2)c(Br)c1=O ZINC000301403116 565484179 /nfs/dbraw/zinc/48/41/79/565484179.db2.gz DORNWIBWOYNBJL-ABAIWWIYSA-N 0 3 397.342 3.099 10 0 GGAEHN O=C(CN1CCCN(C2CC2)CC1)Nc1c(Cl)cccc1C(F)(F)F ZINC000172541192 565490573 /nfs/dbraw/zinc/49/05/73/565490573.db2.gz ZDQPLABZGCCHLQ-UHFFFAOYSA-N 0 3 375.822 3.467 10 0 GGAEHN OC[C@H](NCCOCC(F)(F)C(F)(F)F)c1cccc(Br)c1 ZINC000189882102 565494305 /nfs/dbraw/zinc/49/43/05/565494305.db2.gz MYYQLIDBSUHAIY-NSHDSACASA-N 0 3 392.162 3.286 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000189887105 565494570 /nfs/dbraw/zinc/49/45/70/565494570.db2.gz YJGBZAHXJACVNS-DYEKYZERSA-N 0 3 396.329 3.443 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@H]1C[C@H](C)N(C2CC2)C1 ZINC000189887127 565494723 /nfs/dbraw/zinc/49/47/23/565494723.db2.gz YJGBZAHXJACVNS-OBJOEFQTSA-N 0 3 396.329 3.443 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N[C@@H](CN(C)C)c1ccccc1 ZINC000172703464 565499709 /nfs/dbraw/zinc/49/97/09/565499709.db2.gz GUTZDXBWPYBCQV-KRWDZBQOSA-N 0 3 391.309 3.419 10 0 GGAEHN CC[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc(CC(F)(F)F)cc1 ZINC000190023111 565503321 /nfs/dbraw/zinc/50/33/21/565503321.db2.gz GUAAHRZCNRELMQ-HUUCEWRRSA-N 0 3 376.444 3.039 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)c2ncnc3ccc(I)cc32)CCN1C ZINC000172765335 565503880 /nfs/dbraw/zinc/50/38/80/565503880.db2.gz BHBNHBRJHABPEW-YPMHNXCESA-N 0 3 396.276 3.153 10 0 GGAEHN Cc1nc2ccc(Br)cc2c(N2C[C@H]3OCCN(C)[C@@H]3C2)c1C ZINC000301687359 565504729 /nfs/dbraw/zinc/50/47/29/565504729.db2.gz XHUVYFQNNIASBI-IAGOWNOFSA-N 0 3 376.298 3.133 10 0 GGAEHN Brc1ccccc1-c1nnc(CN2CCN3CCCC[C@@H]3C2)o1 ZINC000172805717 565505389 /nfs/dbraw/zinc/50/53/89/565505389.db2.gz JWRSKVCJTBJUJM-CYBMUJFWSA-N 0 3 377.286 3.169 10 0 GGAEHN Cc1cc(F)ccc1[C@@H](O)CN1CCC(n2cc(Br)cn2)CC1 ZINC000377932232 565505512 /nfs/dbraw/zinc/50/55/12/565505512.db2.gz NNNLONMGZBAQKJ-KRWDZBQOSA-N 0 3 382.277 3.464 10 0 GGAEHN C[C@H]1CN(C(=O)c2cc(Cl)sc2Cl)CC[C@@H]1N1CCN(C)CC1 ZINC000378322003 565521592 /nfs/dbraw/zinc/52/15/92/565521592.db2.gz ZPEQVGMOUUQHIC-AAEUAGOBSA-N 0 3 376.353 3.153 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2c(C3CC3)nc3sccn23)n1 ZINC000190341766 565522861 /nfs/dbraw/zinc/52/28/61/565522861.db2.gz GNMXZVLYQHGUIU-UHFFFAOYSA-N 0 3 376.507 3.239 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2cc(Cl)c3c(c2)OCCO3)n1 ZINC000190348613 565524597 /nfs/dbraw/zinc/52/45/97/565524597.db2.gz YVQHKHLEDJPXIN-UHFFFAOYSA-N 0 3 382.869 3.077 10 0 GGAEHN O=C(CCc1nc2cc(Br)ccc2s1)N1CCN2CCC[C@@H]2C1 ZINC000173098199 565527126 /nfs/dbraw/zinc/52/71/26/565527126.db2.gz WJMIPSCEMHENMT-CYBMUJFWSA-N 0 3 394.338 3.298 10 0 GGAEHN O=C(CN[C@H](c1ccccc1)[C@H]1CCOC1)Nc1ccc(Br)cn1 ZINC000378504948 565531772 /nfs/dbraw/zinc/53/17/72/565531772.db2.gz CLAGEHJUOVYCKL-KBXCAEBGSA-N 0 3 390.281 3.150 10 0 GGAEHN CCc1nn(C)c(Cl)c1CN1CC[C@@H](CN(C)Cc2scnc2C)C1 ZINC000190464362 565534496 /nfs/dbraw/zinc/53/44/96/565534496.db2.gz KUHLJJPOVOWBPB-AWEZNQCLSA-N 0 3 381.977 3.355 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)Nc2ccc(Cl)nc2)C1 ZINC000190499126 565536589 /nfs/dbraw/zinc/53/65/89/565536589.db2.gz GNGVDEUDQFDKHE-ZDUSSCGKSA-N 0 3 379.917 3.486 10 0 GGAEHN Cc1ncc(/C=C/C(=O)N2CC[C@@H](CN(C)Cc3scnc3C)C2)s1 ZINC000190515047 565537836 /nfs/dbraw/zinc/53/78/36/565537836.db2.gz FRCOWHBSKVZGTC-RGDDUWESSA-N 0 3 376.551 3.210 10 0 GGAEHN CN1CCN(CCC(C)(C)Nc2ncnc3ccc(Br)cc32)CC1 ZINC000302264204 565538545 /nfs/dbraw/zinc/53/85/45/565538545.db2.gz QLSQAYPNHQYSGK-UHFFFAOYSA-N 0 3 392.345 3.220 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)CSCc2cscn2)C1 ZINC000190541424 565539759 /nfs/dbraw/zinc/53/97/59/565539759.db2.gz IYKINDPMLBTHPX-AWEZNQCLSA-N 0 3 396.607 3.122 10 0 GGAEHN Cc1nc(CC(=O)N2CC[C@H](CN(C)Cc3scnc3C)C2)c(C)s1 ZINC000190549463 565541544 /nfs/dbraw/zinc/54/15/44/565541544.db2.gz PWKGUOBGONNMAV-OAHLLOKOSA-N 0 3 378.567 3.048 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(C)c(C(F)(F)F)c2)[C@H](C)C1 ZINC000173257172 565541974 /nfs/dbraw/zinc/54/19/74/565541974.db2.gz NFWRBMRCLGCOCN-CJNGLKHVSA-N 0 3 378.460 3.365 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(F)cc2C(F)(F)F)[C@H](C)C1 ZINC000173260172 565542021 /nfs/dbraw/zinc/54/20/21/565542021.db2.gz DPKSHJHQHUUFJC-BXUZGUMPSA-N 0 3 382.423 3.195 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2F)[C@H](C)C1 ZINC000173260093 565542086 /nfs/dbraw/zinc/54/20/86/565542086.db2.gz VEJKOOVXBPVYLT-BXUZGUMPSA-N 0 3 382.423 3.195 10 0 GGAEHN COC[C@](C)(O)CN[C@@H](C)c1ccc(Br)cc1Br ZINC000382575254 565542628 /nfs/dbraw/zinc/54/26/28/565542628.db2.gz VJFXVJWQHIKIKZ-TVQRCGJNSA-N 0 3 381.108 3.260 10 0 GGAEHN CSc1cc(C(=O)N2CC[C@@H](CN(C)Cc3scnc3C)C2)ccn1 ZINC000190568940 565542658 /nfs/dbraw/zinc/54/26/58/565542658.db2.gz ONNASJPWGAOATE-AWEZNQCLSA-N 0 3 376.551 3.163 10 0 GGAEHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)c2coc(Br)c2)C1 ZINC000190587751 565544146 /nfs/dbraw/zinc/54/41/46/565544146.db2.gz CSLUEKDWMMPXIE-AWEZNQCLSA-N 0 3 378.270 3.031 10 0 GGAEHN CN(Cc1cccnc1)C[C@H]1CCN(C(=O)c2nc(Cl)ccc2Cl)C1 ZINC000190612505 565545954 /nfs/dbraw/zinc/54/59/54/565545954.db2.gz MCPMNADNSFAHLM-CQSZACIVSA-N 0 3 379.291 3.378 10 0 GGAEHN O=S(=O)([N-][C@@H]1CC[N@H+]2CCCC[C@@H]12)c1c(Cl)cccc1Br ZINC000385913424 565546395 /nfs/dbraw/zinc/54/63/95/565546395.db2.gz HUYUCAXKQWYJDF-OLZOCXBDSA-N 0 3 393.734 3.008 10 0 GGAEHN O=S(=O)([N-][C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1c(Cl)cccc1Br ZINC000385913424 565546390 /nfs/dbraw/zinc/54/63/90/565546390.db2.gz HUYUCAXKQWYJDF-OLZOCXBDSA-N 0 3 393.734 3.008 10 0 GGAEHN Fc1ccc(Br)cc1-c1nnc(N2CCN3CCC[C@H]3C2)s1 ZINC000302615463 565547186 /nfs/dbraw/zinc/54/71/86/565547186.db2.gz FVVWXOWSJQTJHV-NSHDSACASA-N 0 3 383.290 3.391 10 0 GGAEHN CC(C)N(C)CC(=O)N1CCC[C@H]1c1ccc(I)cc1 ZINC000173323347 565547782 /nfs/dbraw/zinc/54/77/82/565547782.db2.gz VYOOITWCXMYILZ-HNNXBMFYSA-N 0 3 386.277 3.295 10 0 GGAEHN Cn1cc([C@@H]2CCCN2CCC(=O)Nc2ccccc2Br)cn1 ZINC000173320503 565547930 /nfs/dbraw/zinc/54/79/30/565547930.db2.gz ROSXDFIDVGVQFX-INIZCTEOSA-N 0 3 377.286 3.348 10 0 GGAEHN Cn1cc([C@H]2CCCN2CCC(=O)Nc2ccccc2Br)cn1 ZINC000173320516 565547990 /nfs/dbraw/zinc/54/79/90/565547990.db2.gz ROSXDFIDVGVQFX-MRXNPFEDSA-N 0 3 377.286 3.348 10 0 GGAEHN CN(Cc1ccccc1)C1(CNCc2c(Br)cnn2C)CCC1 ZINC000387415696 565549390 /nfs/dbraw/zinc/54/93/90/565549390.db2.gz MSUHGXAWZIURBR-UHFFFAOYSA-N 0 3 377.330 3.327 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)Nc2ccc(Cl)cn2)C1 ZINC000190673575 565551420 /nfs/dbraw/zinc/55/14/20/565551420.db2.gz FGUAZHXNJOHTNP-ZDUSSCGKSA-N 0 3 379.917 3.486 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)Nc2ccc(Cl)cn2)C1 ZINC000190673598 565551780 /nfs/dbraw/zinc/55/17/80/565551780.db2.gz FGUAZHXNJOHTNP-CYBMUJFWSA-N 0 3 379.917 3.486 10 0 GGAEHN CN(C)C[C@@H]1CN(c2ccnc3c(Cl)cc(Br)cc23)CCO1 ZINC000302725353 565552330 /nfs/dbraw/zinc/55/23/30/565552330.db2.gz JMKJJXPLJBFEIP-GFCCVEGCSA-N 0 3 384.705 3.418 10 0 GGAEHN Cc1ccc(CN[C@H](C)c2ccc(S(N)(=O)=O)cc2)cc1Br ZINC000389189702 565552705 /nfs/dbraw/zinc/55/27/05/565552705.db2.gz UNTJAULMOBTMRC-GFCCVEGCSA-N 0 3 383.311 3.256 10 0 GGAEHN CCN1CC[C@H](NCc2cc(Br)c(OC)c(Br)c2)C1 ZINC000389281806 565553218 /nfs/dbraw/zinc/55/32/18/565553218.db2.gz UTRUDPBMQQRZTH-NSHDSACASA-N 0 3 392.135 3.404 10 0 GGAEHN CCN1CC[C@H](NC(=O)c2cc(Br)cc(Br)c2)C1 ZINC000389964465 565554753 /nfs/dbraw/zinc/55/47/53/565554753.db2.gz GKXOXAOCOPOVHL-LBPRGKRZSA-N 0 3 376.092 3.036 10 0 GGAEHN OCCN1CCCN(c2ccnc3c(Cl)cc(Br)cc23)CC1 ZINC000302742382 565554738 /nfs/dbraw/zinc/55/47/38/565554738.db2.gz QYPUJQDNKRJGRT-UHFFFAOYSA-N 0 3 384.705 3.155 10 0 GGAEHN C[C@@H](CNC(=O)N[C@@H](C)c1ccc(Cl)c(Cl)c1)CN1CCN(C)CC1 ZINC000173398842 565555512 /nfs/dbraw/zinc/55/55/12/565555512.db2.gz FALMGFPXMKOFOG-KBPBESRZSA-N 0 3 387.355 3.237 10 0 GGAEHN COc1c(Br)cc(CN[C@@H](C)C(C)(C)O)cc1Br ZINC000393970347 565570205 /nfs/dbraw/zinc/57/02/05/565570205.db2.gz GCTMVJWKVPCIOU-QMMMGPOBSA-N 0 3 381.108 3.469 10 0 GGAEHN CCOC(=O)C1CCC(O)(CN(C)Cc2ccc(Br)s2)CC1 ZINC000190799540 565559943 /nfs/dbraw/zinc/55/99/43/565559943.db2.gz BUBVDEACOKSAON-UHFFFAOYSA-N 0 3 390.343 3.427 10 0 GGAEHN Cn1ncc(Br)c1CNC1CCN(Cc2ccc(F)c(F)c2)CC1 ZINC000278470497 565561107 /nfs/dbraw/zinc/56/11/07/565561107.db2.gz ZJDCVWQYRGRKQL-UHFFFAOYSA-N 0 3 399.283 3.215 10 0 GGAEHN COc1ccc([C@H](C)NC(=O)N2CC[C@H](N3CC=CC3)C2)cc1Br ZINC000173558840 565567319 /nfs/dbraw/zinc/56/73/19/565567319.db2.gz DMOHCRZONXHYKG-ZFWWWQNUSA-N 0 3 394.313 3.174 10 0 GGAEHN COc1ccc([C@@H](C)NC(=O)N2CC[C@H](N3CC=CC3)C2)cc1Br ZINC000173558851 565567510 /nfs/dbraw/zinc/56/75/10/565567510.db2.gz DMOHCRZONXHYKG-HIFRSBDPSA-N 0 3 394.313 3.174 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1cc(Br)c(F)cc1C ZINC000190918197 565570095 /nfs/dbraw/zinc/57/00/95/565570095.db2.gz SWSLDIUWSVHMOW-GFCCVEGCSA-N 0 3 388.281 3.129 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1ccn(-c2cccc(Br)c2)n1 ZINC000303292528 565570306 /nfs/dbraw/zinc/57/03/06/565570306.db2.gz LETKBFAXQKUKTA-CQSZACIVSA-N 0 3 391.313 3.239 10 0 GGAEHN COCC[C@@H](COC)NCc1cc(Br)cc(Br)c1 ZINC000394536992 565571401 /nfs/dbraw/zinc/57/14/01/565571401.db2.gz SSZZELOTOFVAHC-ZDUSSCGKSA-N 0 3 381.108 3.353 10 0 GGAEHN CCN1CCC[C@@H](NCc2c(Br)cncc2Br)C1 ZINC000394594867 565572155 /nfs/dbraw/zinc/57/21/55/565572155.db2.gz BRZUEBZABLLMAL-SNVBAGLBSA-N 0 3 377.124 3.181 10 0 GGAEHN Cn1ncc(Br)c1CNC[C@@]1(C)CCCN1Cc1ccccc1 ZINC000397911631 565576880 /nfs/dbraw/zinc/57/68/80/565576880.db2.gz IACAKCXSRDZFHB-GOSISDBHSA-N 0 3 377.330 3.327 10 0 GGAEHN CC(C)(CN1CCCC1)NCc1nnc(-c2ccccc2Br)o1 ZINC000308632976 565577668 /nfs/dbraw/zinc/57/76/68/565577668.db2.gz HRKXQOCLUZHFSV-UHFFFAOYSA-N 0 3 379.302 3.463 10 0 GGAEHN Cn1ncc(Br)c1CNCCc1ccc(Br)s1 ZINC000310315726 565577913 /nfs/dbraw/zinc/57/79/13/565577913.db2.gz XKGZDVVVSKDGBP-UHFFFAOYSA-N 0 3 379.121 3.339 10 0 GGAEHN CNC(=O)CCCN[C@@H](C)c1ccc(Br)cc1Br ZINC000398357202 565578145 /nfs/dbraw/zinc/57/81/45/565578145.db2.gz LHGQIBMWJDUBSQ-VIFPVBQESA-N 0 3 378.108 3.388 10 0 GGAEHN NC[C@H](NC(=O)c1ccc(Br)cc1C(F)(F)F)C(F)(F)F ZINC000401741487 565582067 /nfs/dbraw/zinc/58/20/67/565582067.db2.gz HARCIKLBPJXMHT-QMMMGPOBSA-N 0 3 379.098 3.087 10 0 GGAEHN C[C@@H](NCC[C@@]1(O)CCOC1)c1ccc(Br)cc1Br ZINC000404197931 565582621 /nfs/dbraw/zinc/58/26/21/565582621.db2.gz GLIIXXAAZWTVOF-QMTHXVAHSA-N 0 3 393.119 3.404 10 0 GGAEHN CCC[NH+]1CCC([N-]S(=O)(=O)c2c(Cl)cccc2Br)CC1 ZINC000313954907 565584734 /nfs/dbraw/zinc/58/47/34/565584734.db2.gz ZISDVQPBOXTCDO-UHFFFAOYSA-N 0 3 395.750 3.255 10 0 GGAEHN C[C@H](NC(=O)N(CCN(C)C)C[C@H]1CCCO1)c1cccc(Br)c1 ZINC000173792408 565586015 /nfs/dbraw/zinc/58/60/15/565586015.db2.gz QCUONYLVECBQBQ-WMLDXEAASA-N 0 3 398.345 3.262 10 0 GGAEHN CC[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc(F)cc1C(F)(F)F ZINC000173829878 565590857 /nfs/dbraw/zinc/59/08/57/565590857.db2.gz JVPMVFVTJLLXMY-CHWSQXEVSA-N 0 3 380.407 3.092 10 0 GGAEHN C[C@H](NC(=O)Nc1ccn(CCN(C)C)n1)c1ccccc1Br ZINC000173925200 565599534 /nfs/dbraw/zinc/59/95/34/565599534.db2.gz XHJPIFYXEFKJNZ-LBPRGKRZSA-N 0 3 380.290 3.090 10 0 GGAEHN COc1ccc(CCCNCc2c(Br)c(C)nn2C)cc1OC ZINC000279218599 565601533 /nfs/dbraw/zinc/60/15/33/565601533.db2.gz WZVFVVHEMSEEAQ-UHFFFAOYSA-N 0 3 382.302 3.231 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CC[C@@H](N2CCCC2)C1 ZINC000191432836 565603661 /nfs/dbraw/zinc/60/36/61/565603661.db2.gz CQMFNHKOFFHLQZ-UKRRQHHQSA-N 0 3 396.329 3.398 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CC[C@@H](N2CCCC2)C1 ZINC000191432822 565604057 /nfs/dbraw/zinc/60/40/57/565604057.db2.gz CQMFNHKOFFHLQZ-DZGCQCFKSA-N 0 3 396.329 3.398 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000191446704 565605080 /nfs/dbraw/zinc/60/50/80/565605080.db2.gz BUYFDBOTJZZZRE-HIFRSBDPSA-N 0 3 394.313 3.174 10 0 GGAEHN O=c1cc(CN(Cc2cccc(Br)c2)CC2CC2)[nH]c2ccnn21 ZINC000191450431 565605596 /nfs/dbraw/zinc/60/55/96/565605596.db2.gz CXFCHHWFWDSNCV-UHFFFAOYSA-N 0 3 387.281 3.197 10 0 GGAEHN COc1ccc(Br)c(C(=O)N2CCc3ccccc3[C@@H]2CN)c1 ZINC000321838940 565606398 /nfs/dbraw/zinc/60/63/98/565606398.db2.gz HERUXGHRRDKXEA-KRWDZBQOSA-N 0 3 375.266 3.156 10 0 GGAEHN O=C(CN1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O)Nc1ccc(Br)cc1 ZINC000322656188 565610876 /nfs/dbraw/zinc/61/08/76/565610876.db2.gz ZJADWMRICATEQQ-BBWFWOEESA-N 0 3 381.314 3.403 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000174075739 565611291 /nfs/dbraw/zinc/61/12/91/565611291.db2.gz PJOSKPFZWMAURW-WMLDXEAASA-N 0 3 378.314 3.036 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000174075712 565611612 /nfs/dbraw/zinc/61/16/12/565611612.db2.gz PJOSKPFZWMAURW-YOEHRIQHSA-N 0 3 378.314 3.036 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC1CCN(C(=O)N(C)C)CC1 ZINC000191632685 565617723 /nfs/dbraw/zinc/61/77/23/565617723.db2.gz BLALZCFIGDSPAD-GFCCVEGCSA-N 0 3 384.318 3.254 10 0 GGAEHN O=C(NC[C@H](O)CN1CCCCC1)Nc1cccc(Cl)c1Br ZINC000191725498 565625186 /nfs/dbraw/zinc/62/51/86/565625186.db2.gz YNHGAGFCUDMVOT-NSHDSACASA-N 0 3 390.709 3.071 10 0 GGAEHN C[C@H](Cc1cccc(Br)c1)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000174349095 565630583 /nfs/dbraw/zinc/63/05/83/565630583.db2.gz FPWUBQTUXQWVCO-PBHICJAKSA-N 0 3 378.314 3.036 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)NCCc2cc(Br)ccc2F)CCN1C ZINC000174362839 565630639 /nfs/dbraw/zinc/63/06/39/565630639.db2.gz HAGOJXPLKYSYHE-SWLSCSKDSA-N 0 3 386.309 3.255 10 0 GGAEHN Cc1csc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1I ZINC000191764476 565630681 /nfs/dbraw/zinc/63/06/81/565630681.db2.gz PTKARVCXFWIUBD-GHMZBOCLSA-N 0 3 392.306 3.216 10 0 GGAEHN CCN1CCCC[C@@H]1CNC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000409677382 565632447 /nfs/dbraw/zinc/63/24/47/565632447.db2.gz AIWCOLSIPMKGFL-CZUORRHYSA-N 0 3 396.329 3.446 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)Nc2cccc(I)c2)CCN1C ZINC000174425842 565634740 /nfs/dbraw/zinc/63/47/40/565634740.db2.gz VAOZGKUJIOTQLC-RISCZKNCSA-N 0 3 387.265 3.238 10 0 GGAEHN C[C@H](Cn1cncn1)NCc1ccc(OC(F)(F)F)c(Br)c1 ZINC000279817029 565634828 /nfs/dbraw/zinc/63/48/28/565634828.db2.gz GBMNHUMRIXYUIN-SECBINFHSA-N 0 3 379.180 3.118 10 0 GGAEHN CCCCN(C)CCNC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000409705970 565635551 /nfs/dbraw/zinc/63/55/51/565635551.db2.gz CSZGTWVFBOVSJV-HNNXBMFYSA-N 0 3 384.318 3.304 10 0 GGAEHN COc1ccc(CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1Br ZINC000174572365 565644848 /nfs/dbraw/zinc/64/48/48/565644848.db2.gz RXBKNHJNFCRNSD-GXTWGEPZSA-N 0 3 384.318 3.082 10 0 GGAEHN CN1CCC2(CCCN2C(=O)Cc2c(F)ccc(Br)c2F)CC1 ZINC000409960246 565652644 /nfs/dbraw/zinc/65/26/44/565652644.db2.gz XBFVMPUPNLMWMJ-UHFFFAOYSA-N 0 3 387.268 3.357 10 0 GGAEHN Cc1nc2ccc(Br)cc2c(N2CCCN(CCO)CC2)c1C ZINC000174729582 565654754 /nfs/dbraw/zinc/65/47/54/565654754.db2.gz INBXKRRQDHSJMA-UHFFFAOYSA-N 0 3 378.314 3.119 10 0 GGAEHN CN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000409979139 565654944 /nfs/dbraw/zinc/65/49/44/565654944.db2.gz JYSQRCQIFKDYFW-IAQYHMDHSA-N 0 3 387.268 3.213 10 0 GGAEHN CN1CC[C@H]2[C@H](CCCN2C(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000409979138 565655230 /nfs/dbraw/zinc/65/52/30/565655230.db2.gz JYSQRCQIFKDYFW-ABAIWWIYSA-N 0 3 387.268 3.213 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000410053155 565661058 /nfs/dbraw/zinc/66/10/58/565661058.db2.gz RREAMVUIQODEDI-CZUORRHYSA-N 0 3 396.329 3.446 10 0 GGAEHN CN(C(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O)[C@@H]1CN2CCC1CC2 ZINC000329514706 565668194 /nfs/dbraw/zinc/66/81/94/565668194.db2.gz YFMNKEMUBXAUMR-GDBMZVCRSA-N 0 3 379.913 3.345 10 0 GGAEHN CC(C)c1n[n-]c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C(C)C)c1Br ZINC000174979467 565671002 /nfs/dbraw/zinc/67/10/02/565671002.db2.gz BFTHDLQAWJJEPC-OLZOCXBDSA-N 0 3 383.334 3.383 10 0 GGAEHN CC(C)c1n[n-]c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c1Br ZINC000174979467 565671007 /nfs/dbraw/zinc/67/10/07/565671007.db2.gz BFTHDLQAWJJEPC-OLZOCXBDSA-N 0 3 383.334 3.383 10 0 GGAEHN COC(=O)CCN(CCc1ccccn1)Cc1cccc(Br)c1 ZINC000192328100 565680872 /nfs/dbraw/zinc/68/08/72/565680872.db2.gz PHLLQIDCXINBGN-UHFFFAOYSA-N 0 3 377.282 3.452 10 0 GGAEHN COC(=O)c1cccc(NC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1Br ZINC000192424480 565689613 /nfs/dbraw/zinc/68/96/13/565689613.db2.gz ZITBVENEWJJSGX-RYUDHWBXSA-N 0 3 398.301 3.182 10 0 GGAEHN COC(=O)c1cccc(NC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1Br ZINC000192424475 565689981 /nfs/dbraw/zinc/68/99/81/565689981.db2.gz ZITBVENEWJJSGX-VXGBXAGGSA-N 0 3 398.301 3.182 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cccc(Br)c2C)[C@H](C)C1 ZINC000175305482 565692729 /nfs/dbraw/zinc/69/27/29/565692729.db2.gz UNWJOOVIYWPBBP-DOMZBBRYSA-N 0 3 389.359 3.108 10 0 GGAEHN O[C@@H](CNCc1c(F)cccc1Br)CN1CCc2ccccc2C1 ZINC000192469022 565693582 /nfs/dbraw/zinc/69/35/82/565693582.db2.gz XUGUOXZURNTEIC-INIZCTEOSA-N 0 3 393.300 3.097 10 0 GGAEHN CCN1CCC[C@H]1CN(C)Cc1nc(-c2cc(Br)cs2)no1 ZINC000175356791 565695384 /nfs/dbraw/zinc/69/53/84/565695384.db2.gz CZKDHNONQVGQHW-LBPRGKRZSA-N 0 3 385.331 3.477 10 0 GGAEHN O=C(NC[C@@H](c1cccs1)N1CCCC1)[C@H]1CCCN1c1nccs1 ZINC000192516431 565697208 /nfs/dbraw/zinc/69/72/08/565697208.db2.gz ZGSNLSMRYXGPCM-CABCVRRESA-N 0 3 376.551 3.127 10 0 GGAEHN COc1ccc(Br)c(C(=O)NCCCNCc2cnccc2C)c1 ZINC000280862374 565700279 /nfs/dbraw/zinc/70/02/79/565700279.db2.gz MCBQJPAYEIPTQH-UHFFFAOYSA-N 0 3 392.297 3.071 10 0 GGAEHN CC(C)N1CCC[C@H](NC2(c3ccc(Br)cc3)CCOCC2)C1=O ZINC000192638007 565703170 /nfs/dbraw/zinc/70/31/70/565703170.db2.gz DBTAHRTZCWOZLW-KRWDZBQOSA-N 0 3 395.341 3.444 10 0 GGAEHN C[C@@H]1C[C@@H](NC(=O)N2CCc3cccc(Br)c3C2)CN1C1CC1 ZINC000175556506 565708495 /nfs/dbraw/zinc/70/84/95/565708495.db2.gz MSJIUYOOWYCDFX-TZMCWYRMSA-N 0 3 378.314 3.142 10 0 GGAEHN CSC1(CN[C@@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)CCC1 ZINC000281103018 565711722 /nfs/dbraw/zinc/71/17/22/565711722.db2.gz LDSNPDGMDCHNPA-JTQLQIEISA-N 0 3 393.372 3.033 10 0 GGAEHN CCOC(=O)c1cccc(CNc2cc(N(C)C)c(Br)cn2)n1 ZINC000600168449 565716350 /nfs/dbraw/zinc/71/63/50/565716350.db2.gz KSKYAIWKDYHERZ-UHFFFAOYSA-N 0 3 379.258 3.094 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)N[C@@H]2C[C@H]2c2ccc(Br)cc2)CCN1C ZINC000281181737 565716620 /nfs/dbraw/zinc/71/66/20/565716620.db2.gz FFHQSJJEFWANSG-ISWURRPUSA-N 0 3 380.330 3.429 10 0 GGAEHN CC(C)C(=O)N1CCC(N[C@H](C)C(=O)Nc2cccc(Br)c2)CC1 ZINC000192884662 565717899 /nfs/dbraw/zinc/71/78/99/565717899.db2.gz VWDJPVSVJLTYMK-CYBMUJFWSA-N 0 3 396.329 3.013 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(S(=O)(=O)c2cccc(Cl)c2)C1 ZINC000192931483 565719678 /nfs/dbraw/zinc/71/96/78/565719678.db2.gz SUEGUSVTLPZOEM-AWEZNQCLSA-N 0 3 399.969 3.248 10 0 GGAEHN O=C(CCN[C@H](c1ccc(Cl)cc1)C1CC1)NC(=O)NCC(F)(F)F ZINC000411438345 565730480 /nfs/dbraw/zinc/73/04/80/565730480.db2.gz NCEGIHCFYJAIHZ-AWEZNQCLSA-N 0 3 377.794 3.159 10 0 GGAEHN O=C(CCN[C@H](CO)c1ccsc1)Nc1ccc(Br)cc1F ZINC000411542540 565734443 /nfs/dbraw/zinc/73/44/43/565734443.db2.gz ISOJKUFPCIUKGC-CQSZACIVSA-N 0 3 387.274 3.302 10 0 GGAEHN COc1cc(NC(=O)CCN[C@H](CO)c2ccsc2)c(OC)cc1Cl ZINC000411545463 565734454 /nfs/dbraw/zinc/73/44/54/565734454.db2.gz QVHAPQWLZFLUIX-CQSZACIVSA-N 0 3 384.885 3.071 10 0 GGAEHN C[C@H](CNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1)Oc1ccccc1Br ZINC000175975776 565738126 /nfs/dbraw/zinc/73/81/26/565738126.db2.gz NWFJYSOMKJAKIX-KFWWJZLASA-N 0 3 398.345 3.341 10 0 GGAEHN CC(C)N1CC[C@H](NC[C@@H](C)S(C)(=O)=O)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000411645900 565742131 /nfs/dbraw/zinc/74/21/31/565742131.db2.gz LQTFWXMRGAZVSA-DQYPLSBCSA-N 0 3 376.925 3.026 10 0 GGAEHN CC(C)N1CC[C@H](NC[C@@H](C)S(C)(=O)=O)[C@H]1c1ccc(Cl)c(F)c1 ZINC000411645903 565742582 /nfs/dbraw/zinc/74/25/82/565742582.db2.gz LQTFWXMRGAZVSA-OAUYIBNBSA-N 0 3 376.925 3.026 10 0 GGAEHN C[C@](CO)(NCCC(=O)Nc1ccccc1)c1ccc(Br)cc1 ZINC000411716579 565748042 /nfs/dbraw/zinc/74/80/42/565748042.db2.gz GORXJWRRBIHITM-GOSISDBHSA-N 0 3 377.282 3.275 10 0 GGAEHN C[C@@](CO)(NCCC(=O)Nc1cccc(F)c1)c1ccc(Br)cc1 ZINC000411716572 565748626 /nfs/dbraw/zinc/74/86/26/565748626.db2.gz GMUXZDVBVXDYEQ-SFHVURJKSA-N 0 3 395.272 3.414 10 0 GGAEHN O=C(N[C@@H]1CCOc2c(Br)cccc21)C1CCN(C2CC2)CC1 ZINC000281809437 565749198 /nfs/dbraw/zinc/74/91/98/565749198.db2.gz RNBWEPCZTXVJGC-MRXNPFEDSA-N 0 3 379.298 3.263 10 0 GGAEHN Cc1nc([C@H](C)N2CC[C@H](Cc3cccc(I)c3)C2)n[nH]1 ZINC000411776821 565751328 /nfs/dbraw/zinc/75/13/28/565751328.db2.gz XYZXHZJYVLVXSY-SMDDNHRTSA-N 0 3 396.276 3.343 10 0 GGAEHN CN(C)C[C@H](NC(=O)[C@H]1Cc2cc(Br)ccc2O1)c1ccccc1 ZINC000193472638 565753957 /nfs/dbraw/zinc/75/39/57/565753957.db2.gz QYNREOKQESTWOD-FUHWJXTLSA-N 0 3 389.293 3.172 10 0 GGAEHN CN(C)C[C@H](NC(=O)[C@@H]1Cc2cc(Br)ccc2O1)c1ccccc1 ZINC000193472613 565754465 /nfs/dbraw/zinc/75/44/65/565754465.db2.gz QYNREOKQESTWOD-WMZOPIPTSA-N 0 3 389.293 3.172 10 0 GGAEHN CC(C)N(CCOc1ccc(Cl)cc1Br)C[C@@H]1CCC(=O)N1 ZINC000412076019 565769993 /nfs/dbraw/zinc/76/99/93/565769993.db2.gz KNXOWTGYVLPBFF-ZDUSSCGKSA-N 0 3 389.721 3.470 10 0 GGAEHN COC(=O)[C@]1(C)CCCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000412111391 565770729 /nfs/dbraw/zinc/77/07/29/565770729.db2.gz VWPLUUQCIIWJQS-YVEFUNNKSA-N 0 3 376.280 3.008 10 0 GGAEHN Cc1csc(CS(=O)(=O)C(C)C(=O)N(Cc2ccccc2)C(C)C)n1 ZINC000176445118 565772657 /nfs/dbraw/zinc/77/26/57/565772657.db2.gz LNTOBNFJEYOIQM-HNNXBMFYSA-N 0 3 380.535 3.192 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)c2nnc(C(C)C)s2)C1 ZINC000282418622 565777975 /nfs/dbraw/zinc/77/79/75/565777975.db2.gz LPOCSYAVQWYLJL-ZDUSSCGKSA-N 0 3 379.555 3.021 10 0 GGAEHN Cc1ncsc1CCC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000412304023 565779871 /nfs/dbraw/zinc/77/98/71/565779871.db2.gz ZLWTYUUUYDYDBU-UHFFFAOYSA-N 0 3 375.460 3.306 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)N[C@H]2CCOc3c(Br)cccc32)CCN1C ZINC000282570350 565786444 /nfs/dbraw/zinc/78/64/44/565786444.db2.gz VPGQVDZNUXAYKH-WWGRRREGSA-N 0 3 396.329 3.397 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1ccc(Br)c(C)c1F ZINC000194212654 565801519 /nfs/dbraw/zinc/80/15/19/565801519.db2.gz FFWLFPBDPFMKSB-LBPRGKRZSA-N 0 3 388.281 3.129 10 0 GGAEHN COc1ccc(Br)cc1CNC[C@@H]1CCC2(CCOCC2)[C@H]1O ZINC000282903122 565801788 /nfs/dbraw/zinc/80/17/88/565801788.db2.gz UKHBHFRHKHFXOK-GUYCJALGSA-N 0 3 384.314 3.115 10 0 GGAEHN C[C@H]1CN(C)CC[C@H]1N(C)S(=O)(=O)c1c(Cl)cccc1Br ZINC000282936394 565804053 /nfs/dbraw/zinc/80/40/53/565804053.db2.gz IJELOEHSJZOHJP-GXFFZTMASA-N 0 3 395.750 3.063 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000283011787 565806431 /nfs/dbraw/zinc/80/64/31/565806431.db2.gz ZPZYQQBZZBCPCU-INIZCTEOSA-N 0 3 396.329 3.256 10 0 GGAEHN C[C@H](NC[C@H]1CCC2(CCOCC2)[C@H]1O)c1cc(Br)ncc1F ZINC000283197423 565812987 /nfs/dbraw/zinc/81/29/87/565812987.db2.gz LDECZJGTUADQOC-OZVIIMIRSA-N 0 3 387.293 3.202 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)c1cnn(-c2ccc(Br)cc2)c1 ZINC000176979856 565819293 /nfs/dbraw/zinc/81/92/93/565819293.db2.gz XGZYWRVEBODNNZ-KRWDZBQOSA-N 0 3 391.313 3.191 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)c1sc(C)c(Br)c1OC ZINC000176973495 565819736 /nfs/dbraw/zinc/81/97/36/565819736.db2.gz DSXHCVCZZHJOTR-LLVKDONJSA-N 0 3 375.332 3.384 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)c1cc(OC)c(Br)c(OC)c1 ZINC000176995734 565821482 /nfs/dbraw/zinc/82/14/82/565821482.db2.gz OOGPBFSGWLDHHX-CYBMUJFWSA-N 0 3 385.302 3.023 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N(C)C[C@@H]2CCCN2CC)cc1OC ZINC000177006748 565821573 /nfs/dbraw/zinc/82/15/73/565821573.db2.gz UXBJMSXONZHYNN-AWEZNQCLSA-N 0 3 399.329 3.413 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)c1ccc(COc2ccc(Br)cc2)o1 ZINC000194695510 565831420 /nfs/dbraw/zinc/83/14/20/565831420.db2.gz UPFHFOVHGQUFDV-AWEZNQCLSA-N 0 3 393.281 3.445 10 0 GGAEHN Cc1nn(-c2ccc(C(=O)NC[C@@H]3CCCN3C)cc2)c(C)c1Br ZINC000194705338 565832627 /nfs/dbraw/zinc/83/26/27/565832627.db2.gz KWQCWZISCQWXME-INIZCTEOSA-N 0 3 391.313 3.076 10 0 GGAEHN CCCOc1c(Br)cc(C(=O)NC[C@@H]2CCCN2C)cc1OC ZINC000194746791 565833404 /nfs/dbraw/zinc/83/34/04/565833404.db2.gz OXXVOXRFDVGXFM-ZDUSSCGKSA-N 0 3 385.302 3.071 10 0 GGAEHN C[C@H]1CN(c2nccc3cc(Br)ccc32)CCN1CC(C)(C)O ZINC000413253130 565841683 /nfs/dbraw/zinc/84/16/83/565841683.db2.gz YMHVHYBOJRBEFD-ZDUSSCGKSA-N 0 3 378.314 3.279 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)NCc1cc(Br)ccc1OC ZINC000177451246 565851415 /nfs/dbraw/zinc/85/14/15/565851415.db2.gz RTDFMFBRHGSARR-OAHLLOKOSA-N 0 3 384.318 3.083 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)NCc1ccc(OC)c(Br)c1 ZINC000177462979 565853101 /nfs/dbraw/zinc/85/31/01/565853101.db2.gz FNOVOSJBVPGMJR-CQSZACIVSA-N 0 3 384.318 3.083 10 0 GGAEHN CN(C(=O)NCc1cccc(Br)c1Cl)[C@@H]1CCN(C2CC2)C1 ZINC000413662239 565866972 /nfs/dbraw/zinc/86/69/72/565866972.db2.gz ZEMUUQVMYPNRRE-CYBMUJFWSA-N 0 3 386.721 3.481 10 0 GGAEHN COC(=O)c1ccc(CN2CC[C@H](CN(C)Cc3scnc3C)C2)s1 ZINC000195249215 565869854 /nfs/dbraw/zinc/86/98/54/565869854.db2.gz QCJWBHUMCXASTR-CQSZACIVSA-N 0 3 379.551 3.254 10 0 GGAEHN C[C@@H](N[C@H](CO)c1cccc(Br)c1)C1CN(C(=O)OC(C)(C)C)C1 ZINC000284912387 565876448 /nfs/dbraw/zinc/87/64/48/565876448.db2.gz CQOXEEFNWKRILC-MLGOLLRUSA-N 0 3 399.329 3.328 10 0 GGAEHN CC(C)(CNC(=O)N[C@@H](CO)c1cccc(Br)c1)N1CCCCC1 ZINC000177871568 565879351 /nfs/dbraw/zinc/87/93/51/565879351.db2.gz NCASBGAIFSIAPV-INIZCTEOSA-N 0 3 398.345 3.046 10 0 GGAEHN O=C(CN1CCN([C@H]2C[C@H]3CC[C@@H]2C3)CC1)Nc1ccccc1Br ZINC000177960365 565883260 /nfs/dbraw/zinc/88/32/60/565883260.db2.gz HQNKFTKAZBFKEK-DAYGRLMNSA-N 0 3 392.341 3.194 10 0 GGAEHN Cn1nccc1C1CCN(C[C@@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000195502044 565887671 /nfs/dbraw/zinc/88/76/71/565887671.db2.gz OPUPMPGWLAZWQK-CQSZACIVSA-N 0 3 384.307 3.346 10 0 GGAEHN Cn1nccc1C1CCN(C[C@@H](O)COc2cc(Cl)ccc2Cl)CC1 ZINC000195504018 565888771 /nfs/dbraw/zinc/88/87/71/565888771.db2.gz VXYGQTLYRCATKW-OAHLLOKOSA-N 0 3 384.307 3.346 10 0 GGAEHN CN(Cc1cc(Br)cs1)C(=O)CN1CCC(c2ccn[nH]2)CC1 ZINC000195507343 565889434 /nfs/dbraw/zinc/88/94/34/565889434.db2.gz JVSMPJLXUHNZGK-UHFFFAOYSA-N 0 3 397.342 3.072 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NC[C@H](c1cccc(F)c1)N(C)C ZINC000414052167 565891111 /nfs/dbraw/zinc/89/11/11/565891111.db2.gz KSKWBRMMHDIBBT-SUMWQHHRSA-N 0 3 396.304 3.031 10 0 GGAEHN CCOCc1ccccc1CN[C@H](C)Cn1cc(Br)ccc1=O ZINC000414065757 565891922 /nfs/dbraw/zinc/89/19/22/565891922.db2.gz OXHUBUMSHXLKTM-CQSZACIVSA-N 0 3 379.298 3.326 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NCCOc1ccc(Cl)cc1 ZINC000414070993 565892064 /nfs/dbraw/zinc/89/20/64/565892064.db2.gz LMYVCIPOCHBYBJ-LBPRGKRZSA-N 0 3 385.689 3.321 10 0 GGAEHN CC(=O)Nc1cccc([C@H](C)N[C@H](C)Cn2cc(Br)ccc2=O)c1 ZINC000414063088 565892262 /nfs/dbraw/zinc/89/22/62/565892262.db2.gz MEYSSVHIZDBOGK-OLZOCXBDSA-N 0 3 392.297 3.309 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NCCOCc1ccc(Cl)cc1 ZINC000414094811 565894287 /nfs/dbraw/zinc/89/42/87/565894287.db2.gz HCJVFZQSWWILCS-CYBMUJFWSA-N 0 3 399.716 3.459 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NCc1ccc(OC(C)(C)C)nc1 ZINC000414106260 565895453 /nfs/dbraw/zinc/89/54/53/565895453.db2.gz IJDZFEGOTLZIBH-ZDUSSCGKSA-N 0 3 394.313 3.361 10 0 GGAEHN CO[C@](C)(CN[C@@H](C)Cn1cc(Br)ccc1=O)c1ccccc1 ZINC000414146438 565899156 /nfs/dbraw/zinc/89/91/56/565899156.db2.gz LEYZXDRTQAZYOQ-KBXCAEBGSA-N 0 3 379.298 3.151 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NCc1ccnc(C(F)(F)F)c1 ZINC000414155016 565899414 /nfs/dbraw/zinc/89/94/14/565899414.db2.gz UTVDIPVMMQQSEG-SNVBAGLBSA-N 0 3 390.203 3.203 10 0 GGAEHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC[C@@H](O)Cn1ccnn1 ZINC000414172341 565900707 /nfs/dbraw/zinc/90/07/07/565900707.db2.gz DXCDJLZYYACKAB-IAQYHMDHSA-N 0 3 377.901 3.075 10 0 GGAEHN O=C(c1ccc(Br)cc1Br)N1CCN2CCC[C@H]2C1 ZINC000218774084 565900847 /nfs/dbraw/zinc/90/08/47/565900847.db2.gz XGLKFOHBBVBHKH-NSHDSACASA-N 0 3 388.103 3.132 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)c2cc(Br)cc(Br)c2)C1 ZINC000219671284 565902579 /nfs/dbraw/zinc/90/25/79/565902579.db2.gz FFOZQUZLAJTORN-CYBMUJFWSA-N 0 3 390.119 3.426 10 0 GGAEHN O[C@H](CN[C@@H](c1sccc1Br)C1CCCCC1)Cn1ccnn1 ZINC000414198110 565902881 /nfs/dbraw/zinc/90/28/81/565902881.db2.gz WBAPVBPQCFRCHL-UKRRQHHQSA-N 0 3 399.358 3.374 10 0 GGAEHN O[C@@H](CN[C@H](c1sccc1Br)C1CCCCC1)Cn1ccnn1 ZINC000414198111 565903002 /nfs/dbraw/zinc/90/30/02/565903002.db2.gz WBAPVBPQCFRCHL-ZFWWWQNUSA-N 0 3 399.358 3.374 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NCc1cnccc1C(C)(C)C ZINC000414228465 565905356 /nfs/dbraw/zinc/90/53/56/565905356.db2.gz LYEJKPUTPBOXRS-CYBMUJFWSA-N 0 3 378.314 3.482 10 0 GGAEHN CN(C)C[C@@H]1CN(Cc2csc(-c3ccc(Br)cc3)n2)CCO1 ZINC000178200507 565905507 /nfs/dbraw/zinc/90/55/07/565905507.db2.gz NYYHQNZWNRAAGK-MRXNPFEDSA-N 0 3 396.354 3.335 10 0 GGAEHN CN(C[C@H]1CCN(C)C1)C(=O)c1cc(Br)cc(Br)c1 ZINC000222910861 565906292 /nfs/dbraw/zinc/90/62/92/565906292.db2.gz YVEOYZSMKWQCES-JTQLQIEISA-N 0 3 390.119 3.235 10 0 GGAEHN Cc1ccc([C@H](C)NCc2ccc(S(N)(=O)=O)c(Br)c2)cc1 ZINC000414297788 565908365 /nfs/dbraw/zinc/90/83/65/565908365.db2.gz SNJSTPLGNKSGHX-LBPRGKRZSA-N 0 3 383.311 3.256 10 0 GGAEHN NS(=O)(=O)c1ccc(CN[C@@H](c2ccccc2)C2CC2)cc1Br ZINC000414279382 565908448 /nfs/dbraw/zinc/90/84/48/565908448.db2.gz JEQOEKAMAGJPGR-KRWDZBQOSA-N 0 3 395.322 3.337 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1Cc1cc2c(cc1Br)OCCO2 ZINC000178287354 565910749 /nfs/dbraw/zinc/91/07/49/565910749.db2.gz IJWNXNVKCGGLCF-OAHLLOKOSA-N 0 3 392.297 3.390 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000178292042 565910872 /nfs/dbraw/zinc/91/08/72/565910872.db2.gz HJDAQPBIPPDKAB-CVEARBPZSA-N 0 3 384.307 3.403 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000178292024 565910896 /nfs/dbraw/zinc/91/08/96/565910896.db2.gz HJDAQPBIPPDKAB-HOTGVXAUSA-N 0 3 384.307 3.403 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1Cc1cc2c(cc1Br)OCO2 ZINC000178301886 565912787 /nfs/dbraw/zinc/91/27/87/565912787.db2.gz OXXKXEDXDADJJL-CQSZACIVSA-N 0 3 378.270 3.347 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1Cc1nnc(-c2ccc(Br)o2)o1 ZINC000178332708 565913500 /nfs/dbraw/zinc/91/35/00/565913500.db2.gz VUWLMUZAATWXBW-LBPRGKRZSA-N 0 3 392.257 3.262 10 0 GGAEHN C[C@@H]1Cc2ccccc2[C@@H]1NCc1ccc(S(N)(=O)=O)c(Br)c1 ZINC000414350577 565913596 /nfs/dbraw/zinc/91/35/96/565913596.db2.gz LTKBMBJYZYFMAY-PIGZYNQJSA-N 0 3 395.322 3.120 10 0 GGAEHN CN(C)c1ncc(CNC2(c3ccc(Br)cc3)CCOCC2)n1C ZINC000414355626 565915120 /nfs/dbraw/zinc/91/51/20/565915120.db2.gz CIYBHFAXWWSYCJ-UHFFFAOYSA-N 0 3 393.329 3.044 10 0 GGAEHN C[C@H](NCc1ccc(S(N)(=O)=O)c(Cl)c1)[C@H]1Oc2ccccc2[C@@H]1C ZINC000414364939 565916334 /nfs/dbraw/zinc/91/63/34/565916334.db2.gz NGMOEPWOUBEIPL-PZROIBLQSA-N 0 3 380.897 3.030 10 0 GGAEHN C[C@H](NCc1ccc(S(N)(=O)=O)c(Cl)c1)[C@@H]1Oc2ccccc2[C@H]1C ZINC000414364937 565916460 /nfs/dbraw/zinc/91/64/60/565916460.db2.gz NGMOEPWOUBEIPL-FTLABTOESA-N 0 3 380.897 3.030 10 0 GGAEHN O=C(Nc1cc(Br)ccc1N1CCCC1)N1CCN2CCC[C@@H]2C1 ZINC000178404097 565917178 /nfs/dbraw/zinc/91/71/78/565917178.db2.gz NQCFJEUOYPIWNB-OAHLLOKOSA-N 0 3 393.329 3.361 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2cscc2Br)n1 ZINC000285771034 565925348 /nfs/dbraw/zinc/92/53/48/565925348.db2.gz DKNRADFKHMKJRQ-UHFFFAOYSA-N 0 3 375.313 3.476 10 0 GGAEHN COc1ccc(CNC[C@@H]2CCC3(CCOCC3)[C@H]2O)c(Br)c1 ZINC000285932124 565933494 /nfs/dbraw/zinc/93/34/94/565933494.db2.gz LUMZPICXBQVDRH-YOEHRIQHSA-N 0 3 384.314 3.115 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1CC(=O)Nc1ccc(Br)cc1C ZINC000178748662 565935589 /nfs/dbraw/zinc/93/55/89/565935589.db2.gz ZJNFINPWINJKTG-INIZCTEOSA-N 0 3 391.313 3.366 10 0 GGAEHN Cc1ccc(CN2CC[C@H](Cc3cccc(I)c3)C2)nn1 ZINC000414459124 565936676 /nfs/dbraw/zinc/93/66/76/565936676.db2.gz OEMCSERLXISGAU-OAHLLOKOSA-N 0 3 393.272 3.454 10 0 GGAEHN CC(C)(COc1ncccc1Br)NCc1cnn2ccccc12 ZINC000178826301 565940557 /nfs/dbraw/zinc/94/05/57/565940557.db2.gz CAUJHXNFSZJNPE-UHFFFAOYSA-N 0 3 375.270 3.439 10 0 GGAEHN CC(C)(C)OC(=O)[C@H]1CCN(CCC(=O)Nc2ccccc2Br)C1 ZINC000178835743 565940622 /nfs/dbraw/zinc/94/06/22/565940622.db2.gz LHGWURQGXNDESA-ZDUSSCGKSA-N 0 3 397.313 3.441 10 0 GGAEHN CN(C)C(=O)[C@H]1CCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000414503160 565943041 /nfs/dbraw/zinc/94/30/41/565943041.db2.gz VTQXBRDVUOZHIR-ZDUSSCGKSA-N 0 3 394.338 3.483 10 0 GGAEHN CCOc1cc(CN(C[C@@H]2CCC(=O)N2)C(C)C)cc(Br)c1OC ZINC000414554597 565948073 /nfs/dbraw/zinc/94/80/73/565948073.db2.gz HFJMRVKGYADKTR-AWEZNQCLSA-N 0 3 399.329 3.345 10 0 GGAEHN CCOc1c(Br)cc(CN(C[C@@H]2CCC(=O)N2)C(C)C)cc1OC ZINC000414555494 565948238 /nfs/dbraw/zinc/94/82/38/565948238.db2.gz IKBLTTXHKJSARI-AWEZNQCLSA-N 0 3 399.329 3.345 10 0 GGAEHN OC[C@H]1CCC[C@H](NCc2c(F)ccc(I)c2F)C1 ZINC000414579916 565951012 /nfs/dbraw/zinc/95/10/12/565951012.db2.gz QGTYKXCBOLEMKR-UWVGGRQHSA-N 0 3 381.204 3.210 10 0 GGAEHN COc1ccccc1/C=C/CNCCNC(=O)c1cccc(Br)c1 ZINC000237302406 565956667 /nfs/dbraw/zinc/95/66/67/565956667.db2.gz JCZFMYVMGMUWLI-VMPITWQZSA-N 0 3 389.293 3.491 10 0 GGAEHN CN(C[C@@H]1CCCN(C(=O)CN)C1)[C@@H](c1ccc(Cl)cc1)C(F)(F)F ZINC000414742867 565957851 /nfs/dbraw/zinc/95/78/51/565957851.db2.gz GMKBNKRALAATRN-LRDDRELGSA-N 0 3 377.838 3.073 10 0 GGAEHN O=C(Nc1cc(Cl)ccc1OCC(F)(F)F)N[C@H]1CNCCC1(F)F ZINC000414792774 565961346 /nfs/dbraw/zinc/96/13/46/565961346.db2.gz SGMISESMWVUOLN-NSHDSACASA-N 0 3 387.736 3.400 10 0 GGAEHN CC(C(=O)N(C)[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1)S(C)(=O)=O ZINC000360790257 565961670 /nfs/dbraw/zinc/96/16/70/565961670.db2.gz CWNONTMGDFRCPK-KCPJHIHWSA-N 0 3 377.428 3.233 10 0 GGAEHN CC(C(=O)N(C)[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1)S(C)(=O)=O ZINC000360790256 565961858 /nfs/dbraw/zinc/96/18/58/565961858.db2.gz CWNONTMGDFRCPK-DFBGVHRSSA-N 0 3 377.428 3.233 10 0 GGAEHN CC(C(=O)N(C)[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1)S(C)(=O)=O ZINC000360790258 565962267 /nfs/dbraw/zinc/96/22/67/565962267.db2.gz CWNONTMGDFRCPK-UGFHNGPFSA-N 0 3 377.428 3.233 10 0 GGAEHN COc1cc(Br)c(CNCCCNCc2cccnc2)c(OC)c1 ZINC000414879565 565964207 /nfs/dbraw/zinc/96/42/07/565964207.db2.gz PBMUXDLXLRUZPR-UHFFFAOYSA-N 0 3 394.313 3.131 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN[C@H]1CNCCC1(F)F ZINC000415007979 565969377 /nfs/dbraw/zinc/96/93/77/565969377.db2.gz VGBSHPNBPCKVPH-HNNXBMFYSA-N 0 3 385.256 3.030 10 0 GGAEHN CC(C)OC(=O)c1ccc(Cl)c(NC(=O)N[C@H]2CNCCC2(F)F)c1 ZINC000415118025 565974522 /nfs/dbraw/zinc/97/45/22/565974522.db2.gz DNDFTVHMKHJIRO-ZDUSSCGKSA-N 0 3 375.803 3.024 10 0 GGAEHN COc1ccc(NC(=O)NCCCNCc2cccnc2)cc1Br ZINC000415169963 565976824 /nfs/dbraw/zinc/97/68/24/565976824.db2.gz LCTVIYRBTQULBN-UHFFFAOYSA-N 0 3 393.285 3.154 10 0 GGAEHN C[C@@H]1C[C@@H](N[C@@H]2CCN(C3CCOCC3)C2=O)c2cccc(Br)c21 ZINC000362303196 565977897 /nfs/dbraw/zinc/97/78/97/565977897.db2.gz JPJCYXZDTUKMRZ-CSMYWGQOSA-N 0 3 393.325 3.367 10 0 GGAEHN COc1ccc(Br)cc1C1(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)CC1 ZINC000415206100 565978182 /nfs/dbraw/zinc/97/81/82/565978182.db2.gz AWXCFOKEGSAQCP-HIFRSBDPSA-N 0 3 395.341 3.430 10 0 GGAEHN O=C(Nc1ccc(Cl)cc1OCC(F)(F)F)N[C@@H]1CNCCC1(F)F ZINC000415177545 565978827 /nfs/dbraw/zinc/97/88/27/565978827.db2.gz QUQHNWOOVUETKC-LLVKDONJSA-N 0 3 387.736 3.400 10 0 GGAEHN O=C(NCCCCc1ccc(Cl)s1)C(=O)Nc1ccc2c(c1)CNC2 ZINC000415210925 565979010 /nfs/dbraw/zinc/97/90/10/565979010.db2.gz LEXUQKKSPDDLMI-UHFFFAOYSA-N 0 3 377.897 3.082 10 0 GGAEHN Cc1cc(N2CCC[C@H](NCc3ccc(C)c(Br)c3)C2=O)n(C)n1 ZINC000179426639 565979679 /nfs/dbraw/zinc/97/96/79/565979679.db2.gz QKALQHNSFQLODY-INIZCTEOSA-N 0 3 391.313 3.085 10 0 GGAEHN CC(C)Oc1cc(Br)cc(NC(=O)N[C@H]2CNCCC2(F)F)c1 ZINC000415240502 565980764 /nfs/dbraw/zinc/98/07/64/565980764.db2.gz ADJYEWJTQFAMSG-ZDUSSCGKSA-N 0 3 392.244 3.355 10 0 GGAEHN FC(F)Oc1ccc(Br)cc1CN[C@@H]1CCO[C@@]2(CCOC2)C1 ZINC000362644095 565981218 /nfs/dbraw/zinc/98/12/18/565981218.db2.gz YJCOURVMWRCGHF-CJNGLKHVSA-N 0 3 392.240 3.478 10 0 GGAEHN FC(F)Oc1ccc(Br)cc1CN[C@@H]1CCO[C@]2(CCOC2)C1 ZINC000362644099 565981220 /nfs/dbraw/zinc/98/12/20/565981220.db2.gz YJCOURVMWRCGHF-CZUORRHYSA-N 0 3 392.240 3.478 10 0 GGAEHN Cc1cnc(CCN(C)C[C@H](O)COc2cccc(Br)c2)s1 ZINC000179481256 565983326 /nfs/dbraw/zinc/98/33/26/565983326.db2.gz DRXACGYDNHXTLH-AWEZNQCLSA-N 0 3 385.327 3.128 10 0 GGAEHN Cc1cnc(CCN(C)C[C@@H](O)COc2cccc(Br)c2)s1 ZINC000179481268 565983352 /nfs/dbraw/zinc/98/33/52/565983352.db2.gz DRXACGYDNHXTLH-CQSZACIVSA-N 0 3 385.327 3.128 10 0 GGAEHN CN1CCN(CCCNC(=O)[C@]2(C)CC2(Cl)Cl)[C@H](c2ccccc2)C1 ZINC000242263405 565984364 /nfs/dbraw/zinc/98/43/64/565984364.db2.gz XYXIFIPMTXBTSZ-WMZOPIPTSA-N 0 3 384.351 3.065 10 0 GGAEHN O=C(CCN1CCC[C@@H](c2ccncn2)C1)Nc1ccc(Br)cc1 ZINC000363015278 565987459 /nfs/dbraw/zinc/98/74/59/565987459.db2.gz XMRLJEPVQPFKTP-CQSZACIVSA-N 0 3 389.297 3.447 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)NCCc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000179559568 565988434 /nfs/dbraw/zinc/98/84/34/565988434.db2.gz LKIGKLOCLRYQPY-MRXNPFEDSA-N 0 3 378.929 3.352 10 0 GGAEHN CCC[C@@H](C(=O)N[C@@H](C)c1cc2c(cc1Br)OCCO2)N(C)C ZINC000179562483 565988509 /nfs/dbraw/zinc/98/85/09/565988509.db2.gz QFINEZTVXIPOJP-FZMZJTMJSA-N 0 3 385.302 3.128 10 0 GGAEHN O=C(NCCCNCc1cccnc1)Nc1cc(F)c(Br)cc1F ZINC000415345276 565988760 /nfs/dbraw/zinc/98/87/60/565988760.db2.gz AKIKYLXFUYDTPL-UHFFFAOYSA-N 0 3 399.239 3.424 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cccc(Br)c2C)[C@@H](C)C1 ZINC000245426107 565988789 /nfs/dbraw/zinc/98/87/89/565988789.db2.gz UNWJOOVIYWPBBP-SWLSCSKDSA-N 0 3 389.359 3.108 10 0 GGAEHN CCN1CC[C@@H](N(C)CCS(=O)(=O)c2cc(Cl)ccc2Cl)[C@@H](C)C1 ZINC000245442672 565990567 /nfs/dbraw/zinc/99/05/67/565990567.db2.gz WNKKKCAEURTFFP-XJKSGUPXSA-N 0 3 393.380 3.429 10 0 GGAEHN C[C@H](CN1CCC[C@@H](C(=O)N2CCOCC2)C1)c1cccc(Br)c1 ZINC000245501677 565993122 /nfs/dbraw/zinc/99/31/22/565993122.db2.gz DFAXTLVOPIQQQU-NVXWUHKLSA-N 0 3 395.341 3.123 10 0 GGAEHN COCCOc1c(Cl)cc(NC(=O)N[C@H]2CNCCC2(F)F)cc1Cl ZINC000415401520 565993947 /nfs/dbraw/zinc/99/39/47/565993947.db2.gz HNQHMZYVRARNRJ-LBPRGKRZSA-N 0 3 398.237 3.137 10 0 GGAEHN C[C@H](O)CN1CCN(CCSc2ccnc3cc(Cl)ccc32)C[C@@H]1C ZINC000245553468 565995948 /nfs/dbraw/zinc/99/59/48/565995948.db2.gz FLDYVWYDMKUIDA-GJZGRUSLSA-N 0 3 379.957 3.367 10 0 GGAEHN O[C@H](COc1cccc(Br)c1)CN1CCC[C@H]1c1ccncc1 ZINC000245562379 565995963 /nfs/dbraw/zinc/99/59/63/565995963.db2.gz CPEQSXZHQVXBAW-WMZOPIPTSA-N 0 3 377.282 3.421 10 0 GGAEHN CC(C)N1CC[C@H](N[C@H](C)CS(C)(=O)=O)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245608797 565999012 /nfs/dbraw/zinc/99/90/12/565999012.db2.gz UDTDSJIDGMRIGM-OAUYIBNBSA-N 0 3 376.925 3.026 10 0 GGAEHN C[C@@H]1CN(CC2=Cc3cc(Cl)cc(Cl)c3OC2)C[C@H]1N1CCOCC1 ZINC000245728479 566003318 /nfs/dbraw/zinc/00/33/18/566003318.db2.gz JDWNKPHQDZBLHM-FZKQIMNGSA-N 0 3 383.319 3.422 10 0 GGAEHN Cc1ccc(CN(C)C)cc1NC(=O)c1cnn2cc(Br)cnc12 ZINC000179725738 566004026 /nfs/dbraw/zinc/00/40/26/566004026.db2.gz YYOMHRJIUSMYAC-UHFFFAOYSA-N 0 3 388.269 3.114 10 0 GGAEHN CN1CC[C@H]2[C@@H](CCCN2S(=O)(=O)Cc2ccc(Cl)cc2Cl)C1 ZINC000245738777 566004298 /nfs/dbraw/zinc/00/42/98/566004298.db2.gz REFNORMFFJJEJS-LRDDRELGSA-N 0 3 377.337 3.239 10 0 GGAEHN CN1CCC[C@H]2CN(S(=O)(=O)Cc3ccc(Cl)cc3Cl)CC[C@H]21 ZINC000245782619 566005748 /nfs/dbraw/zinc/00/57/48/566005748.db2.gz YZXLVNSGTVNFNL-BLLLJJGKSA-N 0 3 377.337 3.239 10 0 GGAEHN O=C(NC[C@H]1CCCN(Cc2cccs2)C1)NC[C@H]1CSCCS1 ZINC000245867081 566008850 /nfs/dbraw/zinc/00/88/50/566008850.db2.gz FHCXWRFNYIZXOH-ZBFHGGJFSA-N 0 3 385.624 3.108 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)N1CCOC[C@@H]1CC(F)F)c1ccsc1 ZINC000287280315 566008993 /nfs/dbraw/zinc/00/89/93/566008993.db2.gz VCWRVMRHWNXWHQ-GJZGRUSLSA-N 0 3 375.485 3.197 10 0 GGAEHN O=C(N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F)N[C@H]1CNCCC1(F)F ZINC000415618854 566008943 /nfs/dbraw/zinc/00/89/43/566008943.db2.gz RSVCYPSHVFCNEC-QWRGUYRKSA-N 0 3 389.727 3.379 10 0 GGAEHN O=C(CCN1CCC[C@@H](c2ccncn2)C1)Nc1cccc(Br)c1 ZINC000363550280 566009720 /nfs/dbraw/zinc/00/97/20/566009720.db2.gz ZKYYIGHCNSWODK-CQSZACIVSA-N 0 3 389.297 3.447 10 0 GGAEHN O=C(Nc1ccc(OCC(F)(F)F)c(Cl)c1)N[C@H]1CNCCC1(F)F ZINC000415672438 566011895 /nfs/dbraw/zinc/01/18/95/566011895.db2.gz LJMTWEHWOMWQPB-NSHDSACASA-N 0 3 387.736 3.400 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1[C@H](C)C(=O)Nc1ccc(Br)cc1 ZINC000245953204 566011961 /nfs/dbraw/zinc/01/19/61/566011961.db2.gz PTTFGFTXXSWINK-CXAGYDPISA-N 0 3 391.313 3.446 10 0 GGAEHN C[C@H](NC[C@H]1CC[C@@H](C(=O)N(C)C)O1)c1cc2cc(Br)ccc2o1 ZINC000245936246 566012235 /nfs/dbraw/zinc/01/22/35/566012235.db2.gz TZSRWYZAVIHHKH-PEYYIBSZSA-N 0 3 395.297 3.482 10 0 GGAEHN O=C(Nc1ccc(OCC(F)(F)F)c(Cl)c1)N[C@@H]1CNCCC1(F)F ZINC000415672437 566012248 /nfs/dbraw/zinc/01/22/48/566012248.db2.gz LJMTWEHWOMWQPB-LLVKDONJSA-N 0 3 387.736 3.400 10 0 GGAEHN CN1CC[C@H]2[C@@H](CCCN2C(=O)NCc2cc(F)cc(Br)c2)C1 ZINC000245950459 566012703 /nfs/dbraw/zinc/01/27/03/566012703.db2.gz LBFNIXOOXPCOHW-BBRMVZONSA-N 0 3 384.293 3.214 10 0 GGAEHN CN(C)C(=O)[C@@H]1CC[C@@H](CN[C@H](c2ccc(Br)cc2)C2CC2)O1 ZINC000246011590 566013184 /nfs/dbraw/zinc/01/31/84/566013184.db2.gz IHEADJAEFOTVQA-ULQDDVLXSA-N 0 3 381.314 3.126 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(F)cc2C(F)(F)F)[C@@H](C)C1 ZINC000246065329 566014371 /nfs/dbraw/zinc/01/43/71/566014371.db2.gz DPKSHJHQHUUFJC-SMDDNHRTSA-N 0 3 382.423 3.195 10 0 GGAEHN O=C(Nc1nc2c(cccc2Br)s1)N[C@H]1CNCCC1(F)F ZINC000415712495 566014419 /nfs/dbraw/zinc/01/44/19/566014419.db2.gz VCZDMWXBMMSDDV-VIFPVBQESA-N 0 3 391.241 3.178 10 0 GGAEHN COC(=O)c1cc(NC(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)ccc1Br ZINC000246052405 566015132 /nfs/dbraw/zinc/01/51/32/566015132.db2.gz PXUXTBHAKDSGET-IAQYHMDHSA-N 0 3 398.301 3.086 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(Br)c(C)c2)[C@@H](C)C1 ZINC000246045467 566015160 /nfs/dbraw/zinc/01/51/60/566015160.db2.gz BPZCTKLDXHJDCC-XJKSGUPXSA-N 0 3 389.359 3.108 10 0 GGAEHN CCN1CC[C@H](N[C@H](C)CS(=O)(=O)CC)[C@H]1c1ccc(Cl)c(F)c1 ZINC000246087628 566016133 /nfs/dbraw/zinc/01/61/33/566016133.db2.gz WFNOHUOFPHLQCO-OAUYIBNBSA-N 0 3 376.925 3.027 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(C)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC000246180477 566020319 /nfs/dbraw/zinc/02/03/19/566020319.db2.gz NFWRBMRCLGCOCN-BBRMVZONSA-N 0 3 378.460 3.365 10 0 GGAEHN Brc1csc(-c2noc(CN3CCN4CCCC[C@H]4C3)n2)c1 ZINC000246223251 566021400 /nfs/dbraw/zinc/02/14/00/566021400.db2.gz QOKPVCUFUXRRFX-LBPRGKRZSA-N 0 3 383.315 3.231 10 0 GGAEHN CNCc1ccccc1NC(=O)N[C@@H](CCO)c1ccccc1Br ZINC000415918173 566022495 /nfs/dbraw/zinc/02/24/95/566022495.db2.gz FLDXOBJUXSYLJA-KRWDZBQOSA-N 0 3 392.297 3.414 10 0 GGAEHN C[C@@H](C(=O)Nc1ccc(Cl)cc1C(F)(F)F)N1CCN2CCC[C@H]2C1 ZINC000246236811 566022605 /nfs/dbraw/zinc/02/26/05/566022605.db2.gz CTHZPUNCFMFULI-AAEUAGOBSA-N 0 3 375.822 3.466 10 0 GGAEHN C[C@](CO)(NC(=O)Nc1ccc2c(c1)CNC2)c1ccc(Br)cc1 ZINC000416003244 566024683 /nfs/dbraw/zinc/02/46/83/566024683.db2.gz FDMJDACTOIYXSH-GOSISDBHSA-N 0 3 390.281 3.082 10 0 GGAEHN O[C@H](COC[C@H]1CCCO1)CN1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000246304519 566026020 /nfs/dbraw/zinc/02/60/20/566026020.db2.gz CFGGATKKCTZRGK-NUEKZKHPSA-N 0 3 390.307 3.003 10 0 GGAEHN C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ccn(-c2ccc(Cl)cc2Cl)n1 ZINC000246322161 566026086 /nfs/dbraw/zinc/02/60/86/566026086.db2.gz FMATUTVCIBJDRS-JSGCOSHPSA-N 0 3 379.291 3.488 10 0 GGAEHN C[C@@H]1CN(CCC2CCN(C(=O)[C@@]3(C)CC3(Cl)Cl)CC2)C[C@H](C)O1 ZINC000246362982 566026947 /nfs/dbraw/zinc/02/69/47/566026947.db2.gz NFUFTEMLIXUFID-JKIFEVAISA-N 0 3 377.356 3.308 10 0 GGAEHN CC[C@@H]1CCCCN1CCNC(=O)N[C@H](CO)c1cccc(Br)c1 ZINC000246608429 566034272 /nfs/dbraw/zinc/03/42/72/566034272.db2.gz DJAJCEARBZMTCF-IAGOWNOFSA-N 0 3 398.345 3.046 10 0 GGAEHN CC[C@H](CN[C@@H](C)c1ccc(S(N)(=O)=O)cc1)Oc1ccccc1Cl ZINC000180142630 566036728 /nfs/dbraw/zinc/03/67/28/566036728.db2.gz CGLOIHTYAMVDFK-DZGCQCFKSA-N 0 3 382.913 3.496 10 0 GGAEHN CC[C@@H](CN[C@H](C)c1ccc(S(N)(=O)=O)cc1)Oc1ccccc1Cl ZINC000180142646 566036973 /nfs/dbraw/zinc/03/69/73/566036973.db2.gz CGLOIHTYAMVDFK-HIFRSBDPSA-N 0 3 382.913 3.496 10 0 GGAEHN CC[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc(C)cc1Br ZINC000246693265 566037066 /nfs/dbraw/zinc/03/70/66/566037066.db2.gz YYJSWMSYIRKFAL-KGLIPLIRSA-N 0 3 387.343 3.005 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(Cl)c(OC)cc2Cl)[C@@H](C)C1 ZINC000246711479 566038262 /nfs/dbraw/zinc/03/82/62/566038262.db2.gz ZZGSLPTWRFYGCO-FZMZJTMJSA-N 0 3 395.352 3.353 10 0 GGAEHN C[C@@H](N[C@H]1CCc2c1cccc2Br)c1ccc(S(N)(=O)=O)cc1 ZINC000180165837 566040104 /nfs/dbraw/zinc/04/01/04/566040104.db2.gz KTGUJSXSFOUFOH-DIFFPNOSSA-N 0 3 395.322 3.435 10 0 GGAEHN C[C@H](N[C@H]1CCc2c1cccc2Br)c1ccc(S(N)(=O)=O)cc1 ZINC000180165821 566040351 /nfs/dbraw/zinc/04/03/51/566040351.db2.gz KTGUJSXSFOUFOH-GTNSWQLSSA-N 0 3 395.322 3.435 10 0 GGAEHN O=S(=O)(C[C@@H](O)CN[C@@H](c1ccc(Cl)cc1)C1CC1)c1cccs1 ZINC000180201867 566044205 /nfs/dbraw/zinc/04/42/05/566044205.db2.gz YGDJDSKVFKYERK-DOTOQJQBSA-N 0 3 385.938 3.277 10 0 GGAEHN COc1ccc(CCC(=O)N2CCC[C@H]3CN(C)CC[C@H]32)cc1Br ZINC000246854115 566044712 /nfs/dbraw/zinc/04/47/12/566044712.db2.gz UCDRJCZDYBRWQI-DOTOQJQBSA-N 0 3 395.341 3.333 10 0 GGAEHN O=C(Cc1ccc(Br)s1)NCC1CCN(c2ccncc2)CC1 ZINC000180223515 566044865 /nfs/dbraw/zinc/04/48/65/566044865.db2.gz FKYKQPBUNGSKBU-UHFFFAOYSA-N 0 3 394.338 3.481 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1C[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000246936810 566047134 /nfs/dbraw/zinc/04/71/34/566047134.db2.gz HJDAQPBIPPDKAB-HZPDHXFCSA-N 0 3 384.307 3.403 10 0 GGAEHN C[C@@H]1CN2CCC[C@H]2CN1Cc1nc(-c2cc(Br)cs2)no1 ZINC000246982409 566048292 /nfs/dbraw/zinc/04/82/92/566048292.db2.gz DYHFLPLHINMCNH-PWSUYJOCSA-N 0 3 383.315 3.229 10 0 GGAEHN CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1csc(I)c1 ZINC000247001571 566049234 /nfs/dbraw/zinc/04/92/34/566049234.db2.gz QIDQPZCQUNXJDW-RYUDHWBXSA-N 0 3 390.290 3.052 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)N[C@H](c2cncc(Br)c2)C2CC2)CCN1C ZINC000287955451 566049609 /nfs/dbraw/zinc/04/96/09/566049609.db2.gz VLFGSRJPKFMDGK-DQYPLSBCSA-N 0 3 395.345 3.419 10 0 GGAEHN CCN1CCC[C@H](NC(=O)Nc2cccc(F)c2I)C1 ZINC000180279366 566049984 /nfs/dbraw/zinc/04/99/84/566049984.db2.gz KVJOSGJQXWVHTI-JTQLQIEISA-N 0 3 391.228 3.036 10 0 GGAEHN Cc1sc2ncnc(SCC(=O)N3C[C@H]4CCCN4C[C@H]3C)c2c1C ZINC000247084568 566051345 /nfs/dbraw/zinc/05/13/45/566051345.db2.gz HXKWXWRQRVCOAV-BXUZGUMPSA-N 0 3 376.551 3.095 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1[C@H](C)C(=O)Nc1cccc(Br)c1 ZINC000247056185 566051565 /nfs/dbraw/zinc/05/15/65/566051565.db2.gz NUKTYOULGOBBEG-CXAGYDPISA-N 0 3 391.313 3.446 10 0 GGAEHN CCOCCCN1CC[C@@H](NS(=O)(=O)c2cccc(Cl)c2C)[C@@H](C)C1 ZINC000247079130 566052253 /nfs/dbraw/zinc/05/22/53/566052253.db2.gz CXWDQKSIHFSDQX-WMLDXEAASA-N 0 3 388.961 3.064 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1C[C@@H](O)COc1cc(Cl)ccc1Cl ZINC000247137718 566052959 /nfs/dbraw/zinc/05/29/59/566052959.db2.gz SSWARQJNBDKYHL-HZPDHXFCSA-N 0 3 384.307 3.403 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000247150717 566053605 /nfs/dbraw/zinc/05/36/05/566053605.db2.gz UGSXXXSYJITOEJ-HUUCEWRRSA-N 0 3 384.307 3.403 10 0 GGAEHN C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1[nH]nc(-c2ccccc2)c1Br ZINC000247123489 566053839 /nfs/dbraw/zinc/05/38/39/566053839.db2.gz JCQZNSKVKLHAFE-OCCSQVGLSA-N 0 3 389.297 3.148 10 0 GGAEHN C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)N1CCN2CCC[C@H]2C1 ZINC000247276195 566057976 /nfs/dbraw/zinc/05/79/76/566057976.db2.gz SNGKSWRINBVDOO-JSGCOSHPSA-N 0 3 384.293 3.009 10 0 GGAEHN C[C@H](CC(=O)c1cccc(Br)c1)C(=O)N1C[C@H]2CCCN2C[C@@H]1C ZINC000247298912 566058051 /nfs/dbraw/zinc/05/80/51/566058051.db2.gz GVQGGFUBCDLVSX-JKIFEVAISA-N 0 3 393.325 3.353 10 0 GGAEHN C[C@@H]1CN2CCC[C@H]2CN1Cc1nc(-c2cccc(Br)c2)no1 ZINC000247477864 566061230 /nfs/dbraw/zinc/06/12/30/566061230.db2.gz SJCBLYREPBXKDP-DOMZBBRYSA-N 0 3 377.286 3.168 10 0 GGAEHN C[C@H](CCc1ccc(Br)cc1)NC(=O)N1CCN2CCC[C@H]2C1 ZINC000247470386 566061843 /nfs/dbraw/zinc/06/18/43/566061843.db2.gz GXBKBRNYCUXIOA-PBHICJAKSA-N 0 3 380.330 3.260 10 0 GGAEHN Cc1ccc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1I ZINC000247559666 566062581 /nfs/dbraw/zinc/06/25/81/566062581.db2.gz ZMFKRQOEMUWCFC-GXTWGEPZSA-N 0 3 386.277 3.154 10 0 GGAEHN COc1ccc([C@@H](C)NC(=O)N2CCN3CCC[C@H]3C2)cc1Br ZINC000247505808 566062924 /nfs/dbraw/zinc/06/29/24/566062924.db2.gz OMTOZPUJDZYZQI-OCCSQVGLSA-N 0 3 382.302 3.008 10 0 GGAEHN C[C@H](NC(=O)C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1)c1cccc(Cl)c1Cl ZINC000288241880 566064210 /nfs/dbraw/zinc/06/42/10/566064210.db2.gz QPODXMYGBMSLCL-AVGNSLFASA-N 0 3 386.323 3.112 10 0 GGAEHN C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000247566042 566064399 /nfs/dbraw/zinc/06/43/99/566064399.db2.gz ZZJGXVAUTUJCQS-RWMBFGLXSA-N 0 3 386.323 3.053 10 0 GGAEHN CN(Cc1ccc(Br)s1)C(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C ZINC000364728310 566066543 /nfs/dbraw/zinc/06/65/43/566066543.db2.gz AFSPOAAFXUHOSX-DETPVDSQSA-N 0 3 387.343 3.002 10 0 GGAEHN CN(C)C[C@@H]1CN(C(=O)NC[C@@H]2C[C@H]2c2ccc(Cl)cc2Cl)CCO1 ZINC000247946322 566067923 /nfs/dbraw/zinc/06/79/23/566067923.db2.gz HOMXLQGQEMTFLJ-JGGQBBKZSA-N 0 3 386.323 3.069 10 0 GGAEHN Brc1cccc(-c2noc(CN3CCN4CCCC[C@H]4C3)n2)c1 ZINC000248343707 566076218 /nfs/dbraw/zinc/07/62/18/566076218.db2.gz KQBAGNTUSDNXOY-HNNXBMFYSA-N 0 3 377.286 3.169 10 0 GGAEHN C[C@H](CS(C)(=O)=O)N[C@@H]1CCN(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000248385851 566076290 /nfs/dbraw/zinc/07/62/90/566076290.db2.gz KEXKPFKOZJSZAL-JLZZUVOBSA-N 0 3 390.952 3.416 10 0 GGAEHN C[N@H+](CCCC[N-]S(=O)(=O)c1c(Cl)cccc1Br)C1CC1 ZINC000416509794 566079139 /nfs/dbraw/zinc/07/91/39/566079139.db2.gz VQVOJBAIPGHGRN-UHFFFAOYSA-N 0 3 395.750 3.255 10 0 GGAEHN C[N@@H+](CCCC[N-]S(=O)(=O)c1c(Cl)cccc1Br)C1CC1 ZINC000416509794 566079146 /nfs/dbraw/zinc/07/91/46/566079146.db2.gz VQVOJBAIPGHGRN-UHFFFAOYSA-N 0 3 395.750 3.255 10 0 GGAEHN O[C@@H]1CCCC[C@@H]1CN[C@H](c1ccc(Br)cc1)c1cncnc1 ZINC000248552583 566081402 /nfs/dbraw/zinc/08/14/02/566081402.db2.gz JCIKTBVVQMRYLY-ZTFGCOKTSA-N 0 3 376.298 3.469 10 0 GGAEHN O=C(NCCCn1cc(Br)cn1)c1cccc(CN2CCCC2)c1 ZINC000288603653 566082529 /nfs/dbraw/zinc/08/25/29/566082529.db2.gz MQVFMDLQUMXYDU-UHFFFAOYSA-N 0 3 391.313 3.062 10 0 GGAEHN COCCN(C)CCNC(=O)[C@H]1CCCO[C@H]1c1ccc(Cl)cc1Cl ZINC000248612869 566084115 /nfs/dbraw/zinc/08/41/15/566084115.db2.gz YCHNSJLWRADJRE-RDJZCZTQSA-N 0 3 389.323 3.156 10 0 GGAEHN C[N@@H+]1CCC[C@@H](CC[N-]S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000416558145 566087147 /nfs/dbraw/zinc/08/71/47/566087147.db2.gz OJUZBYDXDKTTEH-NSHDSACASA-N 0 3 395.750 3.113 10 0 GGAEHN C[N@H+]1CCC[C@@H](CC[N-]S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000416558145 566087149 /nfs/dbraw/zinc/08/71/49/566087149.db2.gz OJUZBYDXDKTTEH-NSHDSACASA-N 0 3 395.750 3.113 10 0 GGAEHN C[N@@H+]1CCC[C@H](CC[N-]S(=O)(=O)c2cccc(Br)c2Cl)C1 ZINC000416561979 566087187 /nfs/dbraw/zinc/08/71/87/566087187.db2.gz VQJXPOLENYCMPI-LLVKDONJSA-N 0 3 395.750 3.113 10 0 GGAEHN C[N@H+]1CCC[C@H](CC[N-]S(=O)(=O)c2cccc(Br)c2Cl)C1 ZINC000416561979 566087189 /nfs/dbraw/zinc/08/71/89/566087189.db2.gz VQJXPOLENYCMPI-LLVKDONJSA-N 0 3 395.750 3.113 10 0 GGAEHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1ncsc1Br ZINC000288714087 566088039 /nfs/dbraw/zinc/08/80/39/566088039.db2.gz SMEGIQQGPZHPLS-CYBMUJFWSA-N 0 3 380.311 3.473 10 0 GGAEHN CC(C)CSCCNC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000365301475 566094239 /nfs/dbraw/zinc/09/42/39/566094239.db2.gz YRQWJYIMEDHDMG-UHFFFAOYSA-N 0 3 381.508 3.480 10 0 GGAEHN CCO[C@@H]1C[C@@H](N[C@H](CO)c2cccc(Br)c2)C12CCOCC2 ZINC000249056257 566095113 /nfs/dbraw/zinc/09/51/13/566095113.db2.gz XQCYTWRIYNCULO-BRWVUGGUSA-N 0 3 384.314 3.046 10 0 GGAEHN C[C@H](CN(C)C[C@@H](O)COC[C@@H]1CCCO1)Oc1ccc(Cl)c(Cl)c1 ZINC000249281856 566100576 /nfs/dbraw/zinc/10/05/76/566100576.db2.gz LAIVCQIWEKIUHA-FMKPAKJESA-N 0 3 392.323 3.249 10 0 GGAEHN CN1CCC(Cc2nc(CC(=O)Nc3c(Cl)cccc3Cl)no2)CC1 ZINC000289019433 566101848 /nfs/dbraw/zinc/10/18/48/566101848.db2.gz FKTYWKPRQUSOJU-UHFFFAOYSA-N 0 3 383.279 3.442 10 0 GGAEHN CN1CCC(Cc2nc(CC(=O)Nc3ccc(Cl)cc3Cl)no2)CC1 ZINC000289041252 566103063 /nfs/dbraw/zinc/10/30/63/566103063.db2.gz GRBRWMONTMCBOH-UHFFFAOYSA-N 0 3 383.279 3.442 10 0 GGAEHN OC[C@@H]1CN(C[C@H](O)c2ccccc2Br)C[C@H]1c1ccsc1 ZINC000249552503 566103693 /nfs/dbraw/zinc/10/36/93/566103693.db2.gz INBKHQGONKSXNE-QRTARXTBSA-N 0 3 382.323 3.252 10 0 GGAEHN OC[C@@H]1CN(C[C@@H](O)c2cccc(Br)c2)C[C@H]1c1ccsc1 ZINC000249569997 566104294 /nfs/dbraw/zinc/10/42/94/566104294.db2.gz OALBQNAYRZKJMS-BHYGNILZSA-N 0 3 382.323 3.252 10 0 GGAEHN C[C@@H](NC(=O)CN(C)[C@]1(CO)CC[C@@H](C)C1)c1ccc(Br)cc1 ZINC000249568668 566104315 /nfs/dbraw/zinc/10/43/15/566104315.db2.gz NRAHRCUIOARXMC-HBUWYVDXSA-N 0 3 383.330 3.109 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)N[C@H](C)c2ccc(OC)c(Br)c2)C1 ZINC000249758020 566108246 /nfs/dbraw/zinc/10/82/46/566108246.db2.gz IYHFZDDHIBMDSM-TZMCWYRMSA-N 0 3 384.318 3.302 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N1CCC[C@H]2CN(C)CC[C@H]21 ZINC000251994917 566113112 /nfs/dbraw/zinc/11/31/12/566113112.db2.gz VPOQUHGLIMLZAT-GOEBONIOSA-N 0 3 396.329 3.083 10 0 GGAEHN O[C@H](CNc1nccc(-c2sccc2Br)n1)CN1CCCCC1 ZINC000252499274 566114159 /nfs/dbraw/zinc/11/41/59/566114159.db2.gz RYCHSEUNOVPNPB-GFCCVEGCSA-N 0 3 397.342 3.226 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=S)N[C@H]1CCOc2ccc(Br)cc21 ZINC000252458626 566114669 /nfs/dbraw/zinc/11/46/69/566114669.db2.gz YAULMRJFSSUCQG-HIFRSBDPSA-N 0 3 398.370 3.221 10 0 GGAEHN C[C@@H]1CC(O)C[C@@H](C)N1C[C@@H](O)COc1ccc(Cl)cc1Br ZINC000253335856 566117135 /nfs/dbraw/zinc/11/71/35/566117135.db2.gz ATKXPQJIKRDZIF-JTNHKYCSSA-N 0 3 392.721 3.076 10 0 GGAEHN C[C@@H]1C[C@@H](O)C[C@H](C)N1C[C@H](O)COc1ccc(Cl)cc1Br ZINC000253335857 566117256 /nfs/dbraw/zinc/11/72/56/566117256.db2.gz ATKXPQJIKRDZIF-XCCSTKFXSA-N 0 3 392.721 3.076 10 0 GGAEHN CCN1CCC[C@H](NC(=O)N2CCO[C@@H](c3ccc(Br)cc3)C2)C1 ZINC000253358395 566117987 /nfs/dbraw/zinc/11/79/87/566117987.db2.gz ORCSKBHTXUBZPH-DLBZAZTESA-N 0 3 396.329 3.016 10 0 GGAEHN CN(Cc1ccccc1)C[C@H](O)CN(C)Cc1ccc(Br)cc1 ZINC000261414523 566123988 /nfs/dbraw/zinc/12/39/88/566123988.db2.gz UIDQMYBAYCQPBX-IBGZPJMESA-N 0 3 377.326 3.374 10 0 GGAEHN CS(=O)(=O)CC1(CN[C@@H]2CCCOc3ccc(Br)cc32)CC1 ZINC000181224255 566126470 /nfs/dbraw/zinc/12/64/70/566126470.db2.gz FTGDMAHTBOWZHF-CQSZACIVSA-N 0 3 388.327 3.077 10 0 GGAEHN CC(C)C[C@@](C)(C[NH3+])[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000261715064 566130871 /nfs/dbraw/zinc/13/08/71/566130871.db2.gz JUNCESMOELTRCF-ZDUSSCGKSA-N 0 3 383.739 3.144 10 0 GGAEHN COc1ccc(CN2CCNC[C@@H]2c2cccnc2)c(Br)c1OC ZINC000261745905 566131985 /nfs/dbraw/zinc/13/19/85/566131985.db2.gz MYYWDUUJTPIEOB-OAHLLOKOSA-N 0 3 392.297 3.008 10 0 GGAEHN O=C(CCN1CCNC[C@@H]1c1cccnc1)Nc1c(Cl)cccc1Cl ZINC000261732015 566132145 /nfs/dbraw/zinc/13/21/45/566132145.db2.gz LXZFFWYZSGGEKE-MRXNPFEDSA-N 0 3 379.291 3.364 10 0 GGAEHN COc1ccc(CN2CCNC[C@H]2c2cccnc2)c(Br)c1OC ZINC000261745903 566132339 /nfs/dbraw/zinc/13/23/39/566132339.db2.gz MYYWDUUJTPIEOB-HNNXBMFYSA-N 0 3 392.297 3.008 10 0 GGAEHN CCNC(=O)N1CC[C@H](N[C@@H]2CCSc3ccc(Br)cc32)C1 ZINC000181335232 566133763 /nfs/dbraw/zinc/13/37/63/566133763.db2.gz YBVXGEOSGREYFO-GXTWGEPZSA-N 0 3 384.343 3.379 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C ZINC000261786742 566134731 /nfs/dbraw/zinc/13/47/31/566134731.db2.gz YLMJXUOGQWKQMO-BGIGGGFGSA-N 0 3 395.341 3.029 10 0 GGAEHN CN(Cc1ccc(F)c(Br)c1)C1CCN(c2cnccn2)CC1 ZINC000366105515 566134975 /nfs/dbraw/zinc/13/49/75/566134975.db2.gz VNNDLIPKEAVWKN-UHFFFAOYSA-N 0 3 379.277 3.479 10 0 GGAEHN C[C@H](CCc1ccc(Br)cc1)NC(=O)N[C@@H]1CNCCC1(F)F ZINC000417221622 566138030 /nfs/dbraw/zinc/13/80/30/566138030.db2.gz DAYIWKKLMSDNPJ-BXUZGUMPSA-N 0 3 390.272 3.067 10 0 GGAEHN CSC[C@@H]1CCCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000366228838 566142942 /nfs/dbraw/zinc/14/29/42/566142942.db2.gz HQHJYHSAHZNUBR-SLTAFYQDSA-N 0 3 379.492 3.329 10 0 GGAEHN CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(Cc1cnc(N)s1)CC2 ZINC000262023719 566144602 /nfs/dbraw/zinc/14/46/02/566144602.db2.gz NKCNALAYWYOCFM-MRXNPFEDSA-N 0 3 376.551 3.190 10 0 GGAEHN COc1cc(Br)ccc1CCCN1CCC(C(=O)N(C)C)CC1 ZINC000181508065 566145566 /nfs/dbraw/zinc/14/55/66/566145566.db2.gz CZOOHHYKHOSIJT-UHFFFAOYSA-N 0 3 383.330 3.191 10 0 GGAEHN COc1ccc(CN(CC[NH3+])CCc2ccccc2)c(Br)c1[O-] ZINC000262097151 566147314 /nfs/dbraw/zinc/14/73/14/566147314.db2.gz VHZQDNSUAQBMNJ-UHFFFAOYSA-N 0 3 379.298 3.167 10 0 GGAEHN N[C@@H]1CN(C(=O)NCCc2ccccc2Br)C[C@H]1c1ccccc1 ZINC000417359360 566147939 /nfs/dbraw/zinc/14/79/39/566147939.db2.gz VPJZZXQWDCPFJL-FUHWJXTLSA-N 0 3 388.309 3.128 10 0 GGAEHN CN(Cc1cc(Br)cs1)C(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C ZINC000262401698 566151583 /nfs/dbraw/zinc/15/15/83/566151583.db2.gz CHGFFOQJBAQSSY-XJKCOSOUSA-N 0 3 387.343 3.002 10 0 GGAEHN COC[C@@H](NC[C@H](O)COc1cccc(Br)c1)c1ccccc1 ZINC000181645487 566154584 /nfs/dbraw/zinc/15/45/84/566154584.db2.gz RGDLPWWNOZQPJQ-FUHWJXTLSA-N 0 3 380.282 3.166 10 0 GGAEHN C[C@H](NC[C@H]1CCCN(S(C)(=O)=O)C1)c1cc(F)c(Cl)cc1Cl ZINC000181645154 566154650 /nfs/dbraw/zinc/15/46/50/566154650.db2.gz IZHGWOONTTYLPM-WDEREUQCSA-N 0 3 383.316 3.455 10 0 GGAEHN CCSc1nccnc1C(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1 ZINC000366579623 566159339 /nfs/dbraw/zinc/15/93/39/566159339.db2.gz KNMVSAOQLGMFAQ-XJKSGUPXSA-N 0 3 376.551 3.463 10 0 GGAEHN C[C@H](NC[C@H](C)N1CCN(C)CC1)c1cc2cc(Br)ccc2o1 ZINC000181702918 566159812 /nfs/dbraw/zinc/15/98/12/566159812.db2.gz SUAPOYCTEKDWAA-KBPBESRZSA-N 0 3 380.330 3.482 10 0 GGAEHN C[C@@H](CC(=O)NC1CCN([C@@H]2CCOC2)CC1)c1ccc(Br)cc1 ZINC000366592725 566159851 /nfs/dbraw/zinc/15/98/51/566159851.db2.gz VXHYMQFBBKYVFS-KBXCAEBGSA-N 0 3 395.341 3.312 10 0 GGAEHN CNS(=O)(=O)c1cccc([C@@H](C)NCCOCc2ccc(Cl)cc2)c1 ZINC000181711342 566160828 /nfs/dbraw/zinc/16/08/28/566160828.db2.gz TUUZTMURJSOEOQ-CQSZACIVSA-N 0 3 382.913 3.116 10 0 GGAEHN CNS(=O)(=O)c1ccc([C@@H](C)NCCOCc2ccc(Cl)cc2)cc1 ZINC000181711477 566161039 /nfs/dbraw/zinc/16/10/39/566161039.db2.gz HOJOCJJUJICGLF-CQSZACIVSA-N 0 3 382.913 3.116 10 0 GGAEHN CN1CC[C@H]2[C@H](CCCN2S(=O)(=O)Cc2ccc(Cl)cc2Cl)C1 ZINC000181708304 566161063 /nfs/dbraw/zinc/16/10/63/566161063.db2.gz REFNORMFFJJEJS-WBMJQRKESA-N 0 3 377.337 3.239 10 0 GGAEHN C[C@@H](N[C@@H](C)CN1CCN(C)CC1)c1cc2cc(Br)ccc2o1 ZINC000181720937 566161952 /nfs/dbraw/zinc/16/19/52/566161952.db2.gz WYBAZQOCXCZFGR-UONOGXRCSA-N 0 3 380.330 3.482 10 0 GGAEHN CC[C@@H]1CN(CCCc2ccc(Br)cc2OC)CCN1C[C@@H](C)O ZINC000181816518 566167175 /nfs/dbraw/zinc/16/71/75/566167175.db2.gz KTXKNKXBSMUDFP-CRAIPNDOSA-N 0 3 399.373 3.167 10 0 GGAEHN COCCN1CCN(CCCc2ccc(Br)cc2OC)C[C@H]1C ZINC000181817735 566167325 /nfs/dbraw/zinc/16/73/25/566167325.db2.gz JTHWHXMICGTCKC-OAHLLOKOSA-N 0 3 385.346 3.043 10 0 GGAEHN C[C@H](CNC(=O)NC[C@@H](N)c1ccccc1)Oc1ccccc1Br ZINC000417828936 566176851 /nfs/dbraw/zinc/17/68/51/566176851.db2.gz QRZUHXGJCQDBQI-CZUORRHYSA-N 0 3 392.297 3.216 10 0 GGAEHN C[C@@H](CNC(=O)NC[C@H](N)c1ccccc1)Oc1ccccc1Br ZINC000417828934 566177304 /nfs/dbraw/zinc/17/73/04/566177304.db2.gz QRZUHXGJCQDBQI-BBRMVZONSA-N 0 3 392.297 3.216 10 0 GGAEHN Cc1nn(C)c(C)c1CCNCc1ccc(F)cc1I ZINC000417858292 566178301 /nfs/dbraw/zinc/17/83/01/566178301.db2.gz PEZCJSMQHCKRLY-UHFFFAOYSA-N 0 3 387.240 3.113 10 0 GGAEHN CC(C)[C@@H](NC[C@@H](O)CS(=O)(=O)c1cccs1)c1ccc(F)c(F)c1 ZINC000182164448 566186348 /nfs/dbraw/zinc/18/63/48/566186348.db2.gz BEJNOHVEFAWACO-CXAGYDPISA-N 0 3 389.489 3.148 10 0 GGAEHN CC(C)[C@@H](NC[C@H](O)CS(=O)(=O)c1cccs1)c1ccc(F)c(F)c1 ZINC000182164418 566186358 /nfs/dbraw/zinc/18/63/58/566186358.db2.gz BEJNOHVEFAWACO-SUMWQHHRSA-N 0 3 389.489 3.148 10 0 GGAEHN CN1CCN([C@@H]2CCCCN(CCCc3ccccc3Br)C2)CC1 ZINC000182211037 566189797 /nfs/dbraw/zinc/18/97/97/566189797.db2.gz XMTHAOQUFIGCMD-LJQANCHMSA-N 0 3 394.401 3.484 10 0 GGAEHN CCCOC[C@H](Cc1cccc(Br)c1)NCc1cnnn1CC ZINC000418018376 566190255 /nfs/dbraw/zinc/19/02/55/566190255.db2.gz ZXAXOECKMUQWDZ-INIZCTEOSA-N 0 3 381.318 3.188 10 0 GGAEHN CO[C@@H](CCNCc1ccc(F)cc1I)C(F)(F)F ZINC000418015595 566190364 /nfs/dbraw/zinc/19/03/64/566190364.db2.gz QETPVVWSEVTTHP-NSHDSACASA-N 0 3 391.146 3.487 10 0 GGAEHN CO[C@H](CCNCc1ccc(F)cc1I)C(F)(F)F ZINC000418015594 566190384 /nfs/dbraw/zinc/19/03/84/566190384.db2.gz QETPVVWSEVTTHP-LLVKDONJSA-N 0 3 391.146 3.487 10 0 GGAEHN CCn1nncc1CN[C@@H](C)CCc1ccc(I)cc1 ZINC000418032280 566191262 /nfs/dbraw/zinc/19/12/62/566191262.db2.gz PMILZQOXCRLKIB-LBPRGKRZSA-N 0 3 384.265 3.014 10 0 GGAEHN CN1CCN(CCCNC(=O)c2sc3ccccc3c2Br)CC1 ZINC000290852504 566192390 /nfs/dbraw/zinc/19/23/90/566192390.db2.gz PWUUDZDYFKFFRH-UHFFFAOYSA-N 0 3 396.354 3.031 10 0 GGAEHN CCOC(=O)c1csc(CCN[C@@H](C)c2ccc(Br)nc2)n1 ZINC000290851747 566192626 /nfs/dbraw/zinc/19/26/26/566192626.db2.gz ZNYVPWUYOFGXQN-JTQLQIEISA-N 0 3 384.299 3.371 10 0 GGAEHN O=C(NCCCc1nccs1)NC[C@H]1CCCN(Cc2cccs2)C1 ZINC000290862591 566193479 /nfs/dbraw/zinc/19/34/79/566193479.db2.gz QVENFRSGBVPZAG-OAHLLOKOSA-N 0 3 378.567 3.349 10 0 GGAEHN CCn1nncc1CN(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000418054787 566193660 /nfs/dbraw/zinc/19/36/60/566193660.db2.gz AOZZJCUMFRHRRH-UHFFFAOYSA-N 0 3 392.345 3.157 10 0 GGAEHN FCC1(CNCc2ccc(F)cc2I)CCOCC1 ZINC000418070031 566195196 /nfs/dbraw/zinc/19/51/96/566195196.db2.gz GCCSTSCHARZZQP-UHFFFAOYSA-N 0 3 381.204 3.286 10 0 GGAEHN COC(=O)CCCCCNCc1ccc(F)cc1I ZINC000418070189 566195506 /nfs/dbraw/zinc/19/55/06/566195506.db2.gz QQLPAUJPRNMDFV-UHFFFAOYSA-N 0 3 379.213 3.253 10 0 GGAEHN COc1ncccc1CCNCc1ccc(F)cc1I ZINC000418086270 566195980 /nfs/dbraw/zinc/19/59/80/566195980.db2.gz ZPZJHMBIDPANIR-UHFFFAOYSA-N 0 3 386.208 3.166 10 0 GGAEHN COCC[C@@H](NC(=O)N[C@H]1CNCCC1(F)F)c1ccc(Cl)c(Cl)c1 ZINC000418172409 566202194 /nfs/dbraw/zinc/20/21/94/566202194.db2.gz RPHJVADHQTWUOQ-KGLIPLIRSA-N 0 3 396.265 3.367 10 0 GGAEHN OC[C@@H](NC1CCN(CCC(F)(F)F)CC1)c1cccc(Br)c1 ZINC000291068752 566203996 /nfs/dbraw/zinc/20/39/96/566203996.db2.gz DXFQKTQIMDNGGW-OAHLLOKOSA-N 0 3 395.263 3.489 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000264134821 566206968 /nfs/dbraw/zinc/20/69/68/566206968.db2.gz WXXOWPTZTTZYGD-MRXNPFEDSA-N 0 3 396.329 3.256 10 0 GGAEHN CN(Cc1ccccc1Br)C(=O)NCCCNCc1cccnc1 ZINC000418326673 566209193 /nfs/dbraw/zinc/20/91/93/566209193.db2.gz KSEREXPICJJOOP-UHFFFAOYSA-N 0 3 391.313 3.165 10 0 GGAEHN COc1ccc(Br)c(CN(C)C(=O)NC[C@@H](N)c2ccccc2)c1 ZINC000418439381 566213300 /nfs/dbraw/zinc/21/33/00/566213300.db2.gz ZZKGDTKGBHTBIR-QGZVFWFLSA-N 0 3 392.297 3.299 10 0 GGAEHN N[C@H](CNC(=O)N[C@@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000418425327 566213320 /nfs/dbraw/zinc/21/33/20/566213320.db2.gz HYWWEPZHGWUOEZ-SJORKVTESA-N 0 3 382.291 3.416 10 0 GGAEHN CN(CCc1cccc(Br)c1)C(=O)NC[C@@H](N)c1ccccc1 ZINC000418453015 566213503 /nfs/dbraw/zinc/21/35/03/566213503.db2.gz ONCMGZFMERJFMS-QGZVFWFLSA-N 0 3 376.298 3.333 10 0 GGAEHN COC(=O)c1cc(NC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)ccc1Br ZINC000182626738 566215531 /nfs/dbraw/zinc/21/55/31/566215531.db2.gz WWHIVYRJQZQCGW-WCQYABFASA-N 0 3 398.301 3.182 10 0 GGAEHN COC(=O)c1cc(NC(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)ccc1Br ZINC000182642628 566218298 /nfs/dbraw/zinc/21/82/98/566218298.db2.gz PXUXTBHAKDSGET-NHYWBVRUSA-N 0 3 398.301 3.086 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)N1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000418745076 566222414 /nfs/dbraw/zinc/22/24/14/566222414.db2.gz GCTRSSOKOMDKFC-UONOGXRCSA-N 0 3 375.872 3.137 10 0 GGAEHN OC[C@@H](CN[C@H]1CCCOc2c(Br)cccc21)c1cccnc1 ZINC000367905523 566222533 /nfs/dbraw/zinc/22/25/33/566222533.db2.gz XJPHSWSSFHARKO-PBHICJAKSA-N 0 3 377.282 3.424 10 0 GGAEHN C[C@@H](c1ccccc1Br)N(C)C(=O)N[C@H]1CNCCC1(F)F ZINC000418775929 566223202 /nfs/dbraw/zinc/22/32/02/566223202.db2.gz WQVBSRZDBUIUNQ-GWCFXTLKSA-N 0 3 376.245 3.149 10 0 GGAEHN CN(Cc1ccc(Br)cc1Cl)C(=O)N[C@@H]1CNCCC1(F)F ZINC000418777338 566223301 /nfs/dbraw/zinc/22/33/01/566223301.db2.gz XXBPJARMQDQYFT-GFCCVEGCSA-N 0 3 396.663 3.241 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)N1CCC(F)(c2ccc(Cl)cc2)CC1 ZINC000418764159 566223357 /nfs/dbraw/zinc/22/33/57/566223357.db2.gz NXMFHGAEUFVJQZ-CQSZACIVSA-N 0 3 375.822 3.307 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)N1CCC[C@H]1c1ccc(Br)s1 ZINC000418764061 566223379 /nfs/dbraw/zinc/22/33/79/566223379.db2.gz NRKIUCABDGKEJU-GXSJLCMTSA-N 0 3 394.285 3.354 10 0 GGAEHN CN1CCC(CC(=O)NC[C@H]2CCN(c3ccc(Br)cc3)C2)CC1 ZINC000291541778 566224801 /nfs/dbraw/zinc/22/48/01/566224801.db2.gz VHCBXUCYBYOVMJ-MRXNPFEDSA-N 0 3 394.357 3.124 10 0 GGAEHN C[C@@H]1CN(CCSc2ccnc3cc(Cl)ccc32)[C@H](C)CN1CCO ZINC000419327976 566232392 /nfs/dbraw/zinc/23/23/92/566232392.db2.gz DFSCVZIQVYWFSW-HUUCEWRRSA-N 0 3 379.957 3.367 10 0 GGAEHN C[C@@H]1CN(CCO)[C@@H](C)CN1CCSc1ccnc2cc(Cl)ccc21 ZINC000419327978 566232489 /nfs/dbraw/zinc/23/24/89/566232489.db2.gz DFSCVZIQVYWFSW-LSDHHAIUSA-N 0 3 379.957 3.367 10 0 GGAEHN COc1cc(Br)ccc1CCCNC(=O)CC1CCN(C)CC1 ZINC000291723160 566232604 /nfs/dbraw/zinc/23/26/04/566232604.db2.gz RDBFFUPKIPJOFW-UHFFFAOYSA-N 0 3 383.330 3.238 10 0 GGAEHN C[C@H]1CN(CCSc2ccnc3cc(Cl)ccc32)[C@@H](C)CN1CCO ZINC000419327975 566232717 /nfs/dbraw/zinc/23/27/17/566232717.db2.gz DFSCVZIQVYWFSW-GJZGRUSLSA-N 0 3 379.957 3.367 10 0 GGAEHN CCN1CC[C@@H](CNC(=O)[C@@H](C)CC(=O)c2cccc(Br)c2)C1 ZINC000265942778 566244029 /nfs/dbraw/zinc/24/40/29/566244029.db2.gz JRQZBGUJBYHXFS-KBPBESRZSA-N 0 3 381.314 3.116 10 0 GGAEHN CN1CCC[C@H](CNC(=O)N2CCc3ncsc3C2)[C@@H]1c1cccs1 ZINC000368680284 566244430 /nfs/dbraw/zinc/24/44/30/566244430.db2.gz KYGPBDNJRFHOIB-CXAGYDPISA-N 0 3 376.551 3.355 10 0 GGAEHN CN1CCC[C@@H](CNC(=O)N2CCc3ncsc3C2)[C@H]1c1cccs1 ZINC000368680286 566244448 /nfs/dbraw/zinc/24/44/48/566244448.db2.gz KYGPBDNJRFHOIB-GUYCJALGSA-N 0 3 376.551 3.355 10 0 GGAEHN O[C@H]([C@@H]1CCCN(CCCc2nc(-c3cccs3)no2)C1)C(F)(F)F ZINC000444732968 566250376 /nfs/dbraw/zinc/25/03/76/566250376.db2.gz QBRCZGIOBUNBTO-BXUZGUMPSA-N 0 3 375.416 3.366 10 0 GGAEHN CCOC(=O)C[C@H](O)CN(C)[C@@H]1CCSc2ccc(Br)cc21 ZINC000599287129 566252288 /nfs/dbraw/zinc/25/22/88/566252288.db2.gz QWMURSHKPIQKHL-GXTWGEPZSA-N 0 3 388.327 3.232 10 0 GGAEHN CN1CC[C@@H](NC(=O)COc2ccc(Br)cc2)[C@H]1c1ccccc1 ZINC000534756647 566253237 /nfs/dbraw/zinc/25/32/37/566253237.db2.gz XPHICRXUYLLOLZ-IEBWSBKVSA-N 0 3 389.293 3.390 10 0 GGAEHN OC[C@H](CNCc1cnc(-c2ccc(Br)cc2)s1)[C@H]1CCOC1 ZINC000481811483 566254010 /nfs/dbraw/zinc/25/40/10/566254010.db2.gz BMHZLKLZYJCUIW-KBPBESRZSA-N 0 3 397.338 3.307 10 0 GGAEHN CN(C)CC[C@](C)(O)CNC(=O)c1sc2ccccc2c1Br ZINC000419971553 566255179 /nfs/dbraw/zinc/25/51/79/566255179.db2.gz DYRLXBDQPUAGNC-INIZCTEOSA-N 0 3 385.327 3.096 10 0 GGAEHN CCOc1cc(C[NH2+]C[C@H]2CC(=O)N(C(C)(C)C)C2)cc(Br)c1[O-] ZINC000668692109 566255998 /nfs/dbraw/zinc/25/59/98/566255998.db2.gz YPVGGCDUFZGZGE-CYBMUJFWSA-N 0 3 399.329 3.290 10 0 GGAEHN CCS(=O)(=O)C1(CNC2CC(c3ccc(Br)cc3F)C2)CC1 ZINC000668694548 566256486 /nfs/dbraw/zinc/25/64/86/566256486.db2.gz CRPFFTMQPNWFSJ-UHFFFAOYSA-N 0 3 390.318 3.391 10 0 GGAEHN CN(C)CC[C@](C)(O)CNC(=O)c1ccc2scc(Br)c2c1 ZINC000419969842 566256467 /nfs/dbraw/zinc/25/64/67/566256467.db2.gz ANZFJZIVLBQURE-INIZCTEOSA-N 0 3 385.327 3.096 10 0 GGAEHN CCOC(=O)C[C@@H](O)CN[C@@H](CC1CC1)c1cc(F)cc(Br)c1 ZINC000599377052 566258794 /nfs/dbraw/zinc/25/87/94/566258794.db2.gz GSNCBXDLHWSIHT-CVEARBPZSA-N 0 3 388.277 3.333 10 0 GGAEHN CCOC(=O)C[C@H](O)CN[C@@H](CC1CC1)c1cc(F)cc(Br)c1 ZINC000599377053 566258964 /nfs/dbraw/zinc/25/89/64/566258964.db2.gz GSNCBXDLHWSIHT-HOTGVXAUSA-N 0 3 388.277 3.333 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000624939274 566260415 /nfs/dbraw/zinc/26/04/15/566260415.db2.gz IOPMUEZFLYYWBY-DZGCQCFKSA-N 0 3 384.343 3.130 10 0 GGAEHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1cccc(O)c1 ZINC000509085483 566261145 /nfs/dbraw/zinc/26/11/45/566261145.db2.gz LAIBOTBQVPSLEU-UHFFFAOYSA-N 0 3 377.282 3.359 10 0 GGAEHN COC(=O)c1cnc(CNC(C)(C)Cc2ccc(Br)c(C)c2)cn1 ZINC000599426059 566264304 /nfs/dbraw/zinc/26/43/04/566264304.db2.gz WFOQDCIAIARVDI-UHFFFAOYSA-N 0 3 392.297 3.445 10 0 GGAEHN CN1CCN(C)[C@@H](CN[C@H]2CCC(C)(C)c3ccc(Br)cc32)C1 ZINC000481923018 566264833 /nfs/dbraw/zinc/26/48/33/566264833.db2.gz JRHRRFBPVXEKNB-YJBOKZPZSA-N 0 3 380.374 3.397 10 0 GGAEHN CN1CCN(C)[C@H](CN[C@H]2CCC(C)(C)c3ccc(Br)cc32)C1 ZINC000481923015 566265140 /nfs/dbraw/zinc/26/51/40/566265140.db2.gz JRHRRFBPVXEKNB-QAPCUYQASA-N 0 3 380.374 3.397 10 0 GGAEHN CN(Cc1ccc(OC(F)F)c(Br)c1)C1(CO)CCOCC1 ZINC000668804390 566268660 /nfs/dbraw/zinc/26/86/60/566268660.db2.gz AEAWGKDTCGTEET-UHFFFAOYSA-N 0 3 380.229 3.024 10 0 GGAEHN C[NH+](C)[C@H]1CCC[C@H]([N-]S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000509168827 566269131 /nfs/dbraw/zinc/26/91/31/566269131.db2.gz WLMKBDXWMWGVIF-QWRGUYRKSA-N 0 3 395.750 3.254 10 0 GGAEHN NC(C(=O)NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)C(F)(F)F ZINC000575398280 566269198 /nfs/dbraw/zinc/26/91/98/566269198.db2.gz FPLDCZQASOECNB-JTQLQIEISA-N 0 3 383.317 3.335 10 0 GGAEHN C[C@H]([N-]S(=O)(=O)c1c(Cl)cccc1Br)C(C)(C)C[NH+](C)C ZINC000509189345 566272908 /nfs/dbraw/zinc/27/29/08/566272908.db2.gz YWMHJZPLLVCYMW-JTQLQIEISA-N 0 3 397.766 3.357 10 0 GGAEHN CCN(CC)[C@H](CN[C@H](C)Cn1cc(Br)ccc1=O)c1ccco1 ZINC000556233881 566276304 /nfs/dbraw/zinc/27/63/04/566276304.db2.gz LTNRTGSZOGBJLU-GDBMZVCRSA-N 0 3 396.329 3.265 10 0 GGAEHN O=C(CN1C[C@H]2CCC[C@@H](C1)N2)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000420402120 566276746 /nfs/dbraw/zinc/27/67/46/566276746.db2.gz QGDVSKSNRMXHKB-DAYGRLMNSA-N 0 3 382.335 3.483 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc3c(c(Cl)c2)O[C@@H](C)C3)[C@@H](C)C1 ZINC000462302207 566278389 /nfs/dbraw/zinc/27/83/89/566278389.db2.gz MDWINGRGUDPXNX-DCGLDWPTSA-N 0 3 386.945 3.014 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc3c(c(Cl)c2)O[C@H](C)C3)[C@H](C)C1 ZINC000462302209 566278418 /nfs/dbraw/zinc/27/84/18/566278418.db2.gz MDWINGRGUDPXNX-XNJGSVPQSA-N 0 3 386.945 3.014 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(OC)c(Cl)c2Cl)[C@H](C)C1 ZINC000462310471 566279802 /nfs/dbraw/zinc/27/98/02/566279802.db2.gz CSMBGMZHOJSUCK-NEPJUHHUSA-N 0 3 395.352 3.353 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2sc(C)cc2Br)[C@@H](C)C1 ZINC000462317637 566281899 /nfs/dbraw/zinc/28/18/99/566281899.db2.gz VRLWXPWMVRRNQH-GWCFXTLKSA-N 0 3 395.388 3.170 10 0 GGAEHN CCN1CC[C@@H](N(C)C(=O)c2nn(C(C)(C)C)cc2Br)[C@@H](C)C1 ZINC000669126234 566285994 /nfs/dbraw/zinc/28/59/94/566285994.db2.gz VGAWDLVDJANINC-GXTWGEPZSA-N 0 3 385.350 3.203 10 0 GGAEHN COC(=O)C1C[C@H](C)N(CCC(=O)Nc2ccc(Br)cc2)[C@@H](C)C1 ZINC000599703487 566287966 /nfs/dbraw/zinc/28/79/66/566287966.db2.gz BNKILHCKJWVVAH-STQMWFEESA-N 0 3 397.313 3.440 10 0 GGAEHN COc1ccc(CCC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c(Br)c1 ZINC000669128360 566288845 /nfs/dbraw/zinc/28/88/45/566288845.db2.gz HFRSOOJOVQVNJZ-DZGCQCFKSA-N 0 3 383.330 3.331 10 0 GGAEHN C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000482173248 566289061 /nfs/dbraw/zinc/28/90/61/566289061.db2.gz DTFUOOZIKGFQHM-SWLSCSKDSA-N 0 3 383.305 3.462 10 0 GGAEHN COC(=O)C1C[C@H](C)N(C[C@@H](O)COc2cc(Cl)ccc2Cl)[C@@H](C)C1 ZINC000599711583 566289683 /nfs/dbraw/zinc/28/96/83/566289683.db2.gz UOJAAEGIKUJXCR-SLEUVZQESA-N 0 3 390.307 3.395 10 0 GGAEHN COC(=O)C1C[C@H](C)N(C[C@@H](O)COc2c(Cl)cccc2Cl)[C@@H](C)C1 ZINC000599705790 566289760 /nfs/dbraw/zinc/28/97/60/566289760.db2.gz HQVLWPGJWAHYKY-SGMGOOAPSA-N 0 3 390.307 3.395 10 0 GGAEHN CS[C@H](C)CNC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1nccs1 ZINC000599716452 566289801 /nfs/dbraw/zinc/28/98/01/566289801.db2.gz DAJNMKNFXXSYII-DJIMGWMZSA-N 0 3 375.563 3.226 10 0 GGAEHN COC(=O)[C@@H]1C[C@@H](C)N(C[C@@H](O)COc2c(Cl)cccc2Cl)[C@@H](C)C1 ZINC000599705791 566290012 /nfs/dbraw/zinc/29/00/12/566290012.db2.gz HQVLWPGJWAHYKY-XJFOESAGSA-N 0 3 390.307 3.395 10 0 GGAEHN C[C@@H]1C[C@@H](NC(=O)c2c(F)c(F)c(Br)c(F)c2F)CCN1C ZINC000669182257 566290750 /nfs/dbraw/zinc/29/07/50/566290750.db2.gz KDPLTWDINATAHK-RQJHMYQMSA-N 0 3 383.183 3.218 10 0 GGAEHN C[C@H]1C[C@@H](NC(=O)c2c(F)c(F)c(Br)c(F)c2F)CCN1C ZINC000669182252 566291023 /nfs/dbraw/zinc/29/10/23/566291023.db2.gz KDPLTWDINATAHK-BQBZGAKWSA-N 0 3 383.183 3.218 10 0 GGAEHN COc1cc(C(=O)N2C[C@@H](SC)[C@H](N3CCCC3)C2)ccc1Br ZINC000599759823 566292682 /nfs/dbraw/zinc/29/26/82/566292682.db2.gz DNHOQYKQMNWORN-GDBMZVCRSA-N 0 3 399.354 3.110 10 0 GGAEHN CCCN(C)CC(=O)N1CCC[C@H]1c1ccc(I)cc1 ZINC000535285945 566293190 /nfs/dbraw/zinc/29/31/90/566293190.db2.gz NKEXMHOPWKSZQX-HNNXBMFYSA-N 0 3 386.277 3.297 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N1CC[C@@H](N(C)Cc2ccccc2)C1 ZINC000669286212 566293573 /nfs/dbraw/zinc/29/35/73/566293573.db2.gz LWTYYICHDFMUCV-MRXNPFEDSA-N 0 3 388.309 3.499 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N1CC[C@H](N(C)Cc2ccccc2)C1 ZINC000669286211 566293590 /nfs/dbraw/zinc/29/35/90/566293590.db2.gz LWTYYICHDFMUCV-INIZCTEOSA-N 0 3 388.309 3.499 10 0 GGAEHN COCCN1CCC[C@H]1CN[C@@H]1CCCOc2cc(Br)ccc21 ZINC000482236234 566296309 /nfs/dbraw/zinc/29/63/09/566296309.db2.gz GOKXTAXMAPAGLC-DOTOQJQBSA-N 0 3 383.330 3.363 10 0 GGAEHN COCCN1CCC[C@@H]1CN[C@H]1CCCOc2ccc(Br)cc21 ZINC000482247090 566296854 /nfs/dbraw/zinc/29/68/54/566296854.db2.gz RIEHRKBHRZXAIF-WBVHZDCISA-N 0 3 383.330 3.363 10 0 GGAEHN COCCN1CCC[C@@H]1CN[C@H](C)c1ccccc1I ZINC000482241776 566297024 /nfs/dbraw/zinc/29/70/24/566297024.db2.gz JFVGFAURTGPOAA-ZIAGYGMSSA-N 0 3 388.293 3.053 10 0 GGAEHN COCCN1CCC[C@@H]1CN[C@H]1CCCOc2c(Br)cccc21 ZINC000482256616 566297870 /nfs/dbraw/zinc/29/78/70/566297870.db2.gz MWEWWGRMZRSODU-PBHICJAKSA-N 0 3 383.330 3.363 10 0 GGAEHN Cc1cc(Br)c(F)c(C(=O)N(CCN(C)C)C[C@H]2CCCO2)c1 ZINC000625280653 566300835 /nfs/dbraw/zinc/30/08/35/566300835.db2.gz NRHDFNRMGXVDNX-CYBMUJFWSA-N 0 3 387.293 3.079 10 0 GGAEHN Cc1ccc(O[C@H](C)C(=O)N(C)[C@H]2CCN(C3CC3)C2)c(Br)c1 ZINC000599868018 566301441 /nfs/dbraw/zinc/30/14/41/566301441.db2.gz YLFOULHYXMTZKR-HIFRSBDPSA-N 0 3 381.314 3.220 10 0 GGAEHN Cn1cc(Br)c(CN[C@H]2CN(Cc3ccccc3)C(C)(C)C2)n1 ZINC000648731501 566305375 /nfs/dbraw/zinc/30/53/75/566305375.db2.gz HRIZVMVMQZMAJU-OAHLLOKOSA-N 0 3 377.330 3.325 10 0 GGAEHN C[C@H]1CN(CCCOc2cccc(I)c2)[C@@H](C)CN1C ZINC000509462880 566307675 /nfs/dbraw/zinc/30/76/75/566307675.db2.gz KNJWDSPQEMGTAY-KBPBESRZSA-N 0 3 388.293 3.085 10 0 GGAEHN C[C@@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)N1CCCC[C@@H]1C ZINC000600005996 566308832 /nfs/dbraw/zinc/30/88/32/566308832.db2.gz NCQGWRGJQOLJQC-RYUDHWBXSA-N 0 3 379.302 3.318 10 0 GGAEHN Brc1cncc([C@H](NCCc2nnnn2-c2ccccc2)C2CC2)c1 ZINC000556522925 566309956 /nfs/dbraw/zinc/30/99/56/566309956.db2.gz QIRDGSQUGXKHJP-GOSISDBHSA-N 0 3 399.296 3.103 10 0 GGAEHN C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)NCc1ccc([O-])c(Br)c1 ZINC000482478333 566310429 /nfs/dbraw/zinc/31/04/29/566310429.db2.gz OCMZIYNYMLGQGK-BETUJISGSA-N 0 3 384.318 3.217 10 0 GGAEHN C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)NCc1ccc([O-])c(Br)c1 ZINC000482478333 566310435 /nfs/dbraw/zinc/31/04/35/566310435.db2.gz OCMZIYNYMLGQGK-BETUJISGSA-N 0 3 384.318 3.217 10 0 GGAEHN O=C1Nc2ccc(Br)cc2CC[C@@H]1N1CC[C@@]2(C1)CCCOC2 ZINC000625402086 566317381 /nfs/dbraw/zinc/31/73/81/566317381.db2.gz DCYBAAIJLQVMLO-FUHWJXTLSA-N 0 3 379.298 3.205 10 0 GGAEHN Cc1nccn1CCCN1CCN(Cc2ccc(Br)cc2)CC1 ZINC000535668729 566319097 /nfs/dbraw/zinc/31/90/97/566319097.db2.gz YDZZQTGDAZOGBW-UHFFFAOYSA-N 0 3 377.330 3.162 10 0 GGAEHN C[C@H](CC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)n1cc(Br)cn1 ZINC000648842548 566320482 /nfs/dbraw/zinc/32/04/82/566320482.db2.gz BYSIOZVSLFRDBQ-SKDZVZGDSA-N 0 3 391.313 3.158 10 0 GGAEHN CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NCc1c(Cl)ccc(Cl)c1Cl ZINC000669686513 566320452 /nfs/dbraw/zinc/32/04/52/566320452.db2.gz HXGNWJCKXJHANU-ZANVPECISA-N 0 3 385.744 3.454 10 0 GGAEHN C[N@@H+]1CCCC[C@@H](C[N-]S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000625426392 566321218 /nfs/dbraw/zinc/32/12/18/566321218.db2.gz VTPJUJSUKFMECE-NSHDSACASA-N 0 3 395.750 3.113 10 0 GGAEHN C[N@H+]1CCCC[C@@H](C[N-]S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000625426392 566321224 /nfs/dbraw/zinc/32/12/24/566321224.db2.gz VTPJUJSUKFMECE-NSHDSACASA-N 0 3 395.750 3.113 10 0 GGAEHN COC(=O)Cc1ccc(CNCc2cc3c(c(Br)c2)OCO3)cc1 ZINC000600187339 566322607 /nfs/dbraw/zinc/32/26/07/566322607.db2.gz OIYVOHMMXWMKGR-UHFFFAOYSA-N 0 3 392.249 3.183 10 0 GGAEHN CC[C@@H](CN1CCCC1)NC(=O)Cc1c(F)ccc(Br)c1F ZINC000669705299 566322852 /nfs/dbraw/zinc/32/28/52/566322852.db2.gz CXDZNGZKVRPCNB-NSHDSACASA-N 0 3 375.257 3.260 10 0 GGAEHN O=C(NC[C@@H]1CC12CCSCC2)NCC1(N2CCSCC2)CCCC1 ZINC000420859651 566325194 /nfs/dbraw/zinc/32/51/94/566325194.db2.gz MFZQJWLORHSMTQ-INIZCTEOSA-N 0 3 383.627 3.181 10 0 GGAEHN CN(C[C@@H]1CCCN1C)C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000420875532 566327125 /nfs/dbraw/zinc/32/71/25/566327125.db2.gz ZTFWBCXLDOYXAK-SWLSCSKDSA-N 0 3 382.302 3.008 10 0 GGAEHN COC[C@@H]1CCCN([C@H]2CCc3cc(Br)ccc3NC2=O)CC1 ZINC000625466082 566327841 /nfs/dbraw/zinc/32/78/41/566327841.db2.gz WIYAEEFXCUKAME-DYVFJYSZSA-N 0 3 381.314 3.451 10 0 GGAEHN CN1CCC[C@@]2(CCN(C(=O)[C@H]3CCc4cc(Br)ccc43)C2)C1 ZINC000648914752 566328567 /nfs/dbraw/zinc/32/85/67/566328567.db2.gz UJJDDIRMIYVVQK-PKOBYXMFSA-N 0 3 377.326 3.423 10 0 GGAEHN CN(C)CCOc1ccc(NC(=O)c2ncsc2Br)cc1F ZINC000576239951 566328836 /nfs/dbraw/zinc/32/88/36/566328836.db2.gz NDSAUPWTQMNQJW-UHFFFAOYSA-N 0 3 388.262 3.237 10 0 GGAEHN CCN1CCN(CCCCNC(=O)c2sc3ncccc3c2Cl)CC1 ZINC000625553264 566336141 /nfs/dbraw/zinc/33/61/41/566336141.db2.gz FQIPEGGCLGHTDH-UHFFFAOYSA-N 0 3 380.945 3.097 10 0 GGAEHN CN(CCCCO)CCOc1c(Br)cccc1Br ZINC000482855769 566339658 /nfs/dbraw/zinc/33/96/58/566339658.db2.gz JBCCNMMRZCUFQI-UHFFFAOYSA-N 0 3 381.108 3.295 10 0 GGAEHN CNS(=O)(=O)CCCN1CCC(Cc2cc(Cl)ccc2Cl)CC1 ZINC000482897694 566340800 /nfs/dbraw/zinc/34/08/00/566340800.db2.gz VTBRJVRZPHUEJD-UHFFFAOYSA-N 0 3 379.353 3.187 10 0 GGAEHN Cc1[nH]c2ccc(Br)cc2c1CC(=O)N(C)[C@H]1CN2CCC1CC2 ZINC000600516930 566342593 /nfs/dbraw/zinc/34/25/93/566342593.db2.gz SZKVJNZWVPZMIE-SFHVURJKSA-N 0 3 390.325 3.334 10 0 GGAEHN C[C@]12C[C@H]1CCC[C@@H]2[NH2+]CC[N-]S(=O)(=O)c1cccc(Cl)c1Cl ZINC000556911017 566342666 /nfs/dbraw/zinc/34/26/66/566342666.db2.gz IURYNMYFXIITQG-WPGHFRTFSA-N 0 3 377.337 3.440 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)NCC1(S(C)(=O)=O)CCCC1 ZINC000556921870 566344540 /nfs/dbraw/zinc/34/45/40/566344540.db2.gz YKJFFHVXFXYNTQ-GFCCVEGCSA-N 0 3 392.334 3.466 10 0 GGAEHN Cc1cc(Cl)c2c(c1)[C@H](NC[C@@H]1CCCCN1S(C)(=O)=O)CCCO2 ZINC000556920589 566344777 /nfs/dbraw/zinc/34/47/77/566344777.db2.gz NHIJFHXCTPOAEB-WMLDXEAASA-N 0 3 386.945 3.266 10 0 GGAEHN C[C@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1cccc(OC(F)(F)F)c1 ZINC000556921577 566344797 /nfs/dbraw/zinc/34/47/97/566344797.db2.gz PSRJIFWIEHSRMU-JSGCOSHPSA-N 0 3 380.432 3.050 10 0 GGAEHN COc1ccc([C@@H](C)N[C@H](C)C2(S(C)(=O)=O)CC2)cc1Br ZINC000556920555 566345141 /nfs/dbraw/zinc/34/51/41/566345141.db2.gz JWDGMBZOPBDABA-GHMZBOCLSA-N 0 3 376.316 3.074 10 0 GGAEHN COc1ccc([C@H](C)N[C@@H](C)C2(S(C)(=O)=O)CC2)cc1Br ZINC000556920561 566345166 /nfs/dbraw/zinc/34/51/66/566345166.db2.gz JWDGMBZOPBDABA-QWRGUYRKSA-N 0 3 376.316 3.074 10 0 GGAEHN C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)N1CCOC2(CCN(C)CC2)C1 ZINC000649134277 566347834 /nfs/dbraw/zinc/34/78/34/566347834.db2.gz ULXUEYRZNHVPIB-CYBMUJFWSA-N 0 3 387.307 3.084 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)C(C)(C)c1ccc(Br)cc1)CCO2 ZINC000649133846 566348249 /nfs/dbraw/zinc/34/82/49/566348249.db2.gz BXQJVOHYIPXYSJ-UHFFFAOYSA-N 0 3 395.341 3.050 10 0 GGAEHN CCN1CCC[C@H](Nc2ncnc3ccc(I)cc32)C1 ZINC000462789341 566353195 /nfs/dbraw/zinc/35/31/95/566353195.db2.gz KSRFAPXEPSANHI-LBPRGKRZSA-N 0 3 382.249 3.131 10 0 GGAEHN O=C(COc1ccccc1)N1CC[C@@H](NCc2cc(Br)cs2)C1 ZINC000510003844 566355704 /nfs/dbraw/zinc/35/57/04/566355704.db2.gz FNOOWKVYVNMVIJ-CQSZACIVSA-N 0 3 395.322 3.280 10 0 GGAEHN CCS(=O)(=O)CCCCCN[C@@H]1Cc2ccccc2O[C@H]1C(F)(F)F ZINC000625746182 566356487 /nfs/dbraw/zinc/35/64/87/566356487.db2.gz ZGDKPNVHJXPSPY-GDBMZVCRSA-N 0 3 379.444 3.116 10 0 GGAEHN O[C@@H](COc1cc(F)cc(Br)c1)CN1CC[C@H]2CC[C@@H](C1)S2 ZINC000625777183 566357445 /nfs/dbraw/zinc/35/74/45/566357445.db2.gz BVZNZHVYUHJESH-BMFZPTHFSA-N 0 3 390.318 3.298 10 0 GGAEHN COc1cc(Br)ccc1[C@@H]1CCCN1C[C@H](O)CN(C)C1CC1 ZINC000625794392 566358664 /nfs/dbraw/zinc/35/86/64/566358664.db2.gz JJCMKUZSPSNYMJ-WBVHZDCISA-N 0 3 383.330 3.050 10 0 GGAEHN COc1ccc(Br)cc1[C@H]1CCCN1C(=O)CN1CC[C@H](C)C1 ZINC000576595850 566360752 /nfs/dbraw/zinc/36/07/52/566360752.db2.gz PZSBDDYPPIBNET-XJKSGUPXSA-N 0 3 381.314 3.463 10 0 GGAEHN OCc1ccc(F)c(CN[C@]2(CO)CCc3cc(Br)ccc3C2)c1 ZINC000625796235 566360697 /nfs/dbraw/zinc/36/06/97/566360697.db2.gz IPDIFIVKPQILBU-LJQANCHMSA-N 0 3 394.284 3.090 10 0 GGAEHN NC(=O)CC1(CNCc2cnc(-c3ccc(Br)cc3)s2)CC1 ZINC000421349851 566366603 /nfs/dbraw/zinc/36/66/03/566366603.db2.gz JXCCPDRXLCKWKX-UHFFFAOYSA-N 0 3 380.311 3.318 10 0 GGAEHN CN(CCCNC(=O)C(=O)c1ccc(Br)cc1)Cc1ccccc1 ZINC000510135609 566366750 /nfs/dbraw/zinc/36/67/50/566366750.db2.gz PCNSJYYYMYHIPY-UHFFFAOYSA-N 0 3 389.293 3.270 10 0 GGAEHN CNC(=O)[C@H]1CCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000421373225 566367605 /nfs/dbraw/zinc/36/76/05/566367605.db2.gz DSEMMGVOTPNXGI-LBPRGKRZSA-N 0 3 380.311 3.141 10 0 GGAEHN NC[C@@H](NC(=O)NCC/C=C\c1ccc(Br)cc1)C(F)(F)F ZINC000625899544 566368587 /nfs/dbraw/zinc/36/85/87/566368587.db2.gz WKWWZJIXOCOIDL-BIVBXWGWSA-N 0 3 380.208 3.041 10 0 GGAEHN C[C@@H]1C[C@@H](c2ccc(Br)cc2)CN1C(=O)N[C@@H](CN)C(F)(F)F ZINC000625898887 566368679 /nfs/dbraw/zinc/36/86/79/566368679.db2.gz FMYIXGALESOWFZ-XWIASGKRSA-N 0 3 394.235 3.226 10 0 GGAEHN C[C@@H]1C[C@@H](c2ccc(Br)cc2)CN1C(=O)N[C@H](CN)C(F)(F)F ZINC000625898885 566368711 /nfs/dbraw/zinc/36/87/11/566368711.db2.gz FMYIXGALESOWFZ-IRUJWGPZSA-N 0 3 394.235 3.226 10 0 GGAEHN CS(=O)(=O)NCC1CCN(CCCSc2ccccc2Cl)CC1 ZINC000510212755 566368621 /nfs/dbraw/zinc/36/86/21/566368621.db2.gz PKPNHKIVRIKELW-UHFFFAOYSA-N 0 3 376.975 3.083 10 0 GGAEHN CC1(N2CCOCC2)CCN(Cc2ncc(Br)cc2Cl)CC1 ZINC000625960504 566370009 /nfs/dbraw/zinc/37/00/09/566370009.db2.gz HQKRCKBPLCDTPN-UHFFFAOYSA-N 0 3 388.737 3.184 10 0 GGAEHN CN(C)[C@]1(CNC(=O)c2cc(OCc3ccccc3)cs2)CCSC1 ZINC000625985499 566371893 /nfs/dbraw/zinc/37/18/93/566371893.db2.gz QVSOIAMPYFBGPQ-IBGZPJMESA-N 0 3 376.547 3.494 10 0 GGAEHN Cc1cc(Br)c(F)c(C(=O)NC[C@@]2(N(C)C)CCSC2)c1 ZINC000625985068 566372827 /nfs/dbraw/zinc/37/28/27/566372827.db2.gz ATXPMYZLXAPFSJ-HNNXBMFYSA-N 0 3 375.307 3.064 10 0 GGAEHN CN(C)C[C@@H](NC[C@@H](O)COCc1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000625983125 566373066 /nfs/dbraw/zinc/37/30/66/566373066.db2.gz GLUPYNYFLRBEQU-RDTXWAMCSA-N 0 3 387.307 3.356 10 0 GGAEHN Cc1cc(Br)ccc1[C@@H]1CCCN1C[C@@H](O)COC[C@H]1CCCO1 ZINC000626009181 566375188 /nfs/dbraw/zinc/37/51/88/566375188.db2.gz ANDLJYOCQYIGTQ-LMMKCTJWSA-N 0 3 398.341 3.451 10 0 GGAEHN CN(C)S(=O)(=O)c1ccc(CN[C@H]2CCC[C@@H]2Cc2ccccc2)s1 ZINC000557257867 566375552 /nfs/dbraw/zinc/37/55/52/566375552.db2.gz GLUARRCLJKPYFT-AEFFLSMTSA-N 0 3 378.563 3.499 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)cc2C)[C@@H](C)C1 ZINC000510338851 566376245 /nfs/dbraw/zinc/37/62/45/566376245.db2.gz GBHUXGWZILALPU-ZFWWWQNUSA-N 0 3 378.460 3.365 10 0 GGAEHN C[C@@H]1C[C@H](c2ccc(Br)cc2)CN1CC[C@@H]1CCS(=O)(=O)C1 ZINC000626040999 566378384 /nfs/dbraw/zinc/37/83/84/566378384.db2.gz PHNFSOCKEDICML-FMKPAKJESA-N 0 3 386.355 3.452 10 0 GGAEHN CCOC(=O)COCCN(C)[C@H]1CCSc2ccc(Br)cc21 ZINC000576791505 566378531 /nfs/dbraw/zinc/37/85/31/566378531.db2.gz CFVMVZXWCSKCPW-AWEZNQCLSA-N 0 3 388.327 3.498 10 0 GGAEHN C[C@H]1C[C@H](c2ccc(Br)cc2)CN1Cc1cc(=O)n2nccc2[nH]1 ZINC000626040727 566378581 /nfs/dbraw/zinc/37/85/81/566378581.db2.gz KVLCFIYLSAWGGT-JSGCOSHPSA-N 0 3 387.281 3.163 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2ccc(F)cc2C(F)(F)F)C[C@H]1N1CCCC1 ZINC000483387595 566379414 /nfs/dbraw/zinc/37/94/14/566379414.db2.gz CBRCNOXIIJGBLF-HUUCEWRRSA-N 0 3 376.419 3.496 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cc(C)cc(Br)c2)C[C@@H]1N1CCCC1 ZINC000483400707 566381159 /nfs/dbraw/zinc/38/11/59/566381159.db2.gz DISBMKIGIZZQJQ-JKSUJKDBSA-N 0 3 383.355 3.409 10 0 GGAEHN CNC(=O)C[C@@H](NCCOc1ccc(Br)cc1)c1ccccc1 ZINC000483421938 566382434 /nfs/dbraw/zinc/38/24/34/566382434.db2.gz PEWWKCQEBVPMAR-QGZVFWFLSA-N 0 3 377.282 3.295 10 0 GGAEHN CNC(=O)C[C@H](NCCOc1cccc(Br)c1)c1ccccc1 ZINC000483420187 566382528 /nfs/dbraw/zinc/38/25/28/566382528.db2.gz KLJDXXINNADZPF-KRWDZBQOSA-N 0 3 377.282 3.295 10 0 GGAEHN O=C(c1csc(C(F)(F)F)c1)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000626090959 566384496 /nfs/dbraw/zinc/38/44/96/566384496.db2.gz ADNWZBCMTAPAME-AWEZNQCLSA-N 0 3 376.444 3.484 10 0 GGAEHN COC1(C[C@@H](C)N[C@@H]2CCN(c3cccc(Br)c3)C2=O)CCC1 ZINC000447095850 566385999 /nfs/dbraw/zinc/38/59/99/566385999.db2.gz ZYNVBDVPTKTMMN-CZUORRHYSA-N 0 3 381.314 3.492 10 0 GGAEHN C[C@@]1(Cc2cccc(Cl)c2)CCCN1C[C@H]1CCCN(S(C)(=O)=O)C1 ZINC000649684191 566385969 /nfs/dbraw/zinc/38/59/69/566385969.db2.gz IKKAZYQGAAUEOJ-MJGOQNOKSA-N 0 3 384.973 3.409 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000510478191 566386230 /nfs/dbraw/zinc/38/62/30/566386230.db2.gz GCTHFUSRHHUGQM-KGLIPLIRSA-N 0 3 380.330 3.330 10 0 GGAEHN COC1(C[C@H](C)N[C@@H]2CCN(c3cccc(Br)c3)C2=O)CCC1 ZINC000447095851 566386683 /nfs/dbraw/zinc/38/66/83/566386683.db2.gz ZYNVBDVPTKTMMN-XJKSGUPXSA-N 0 3 381.314 3.492 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000510478190 566386624 /nfs/dbraw/zinc/38/66/24/566386624.db2.gz GCTHFUSRHHUGQM-KBPBESRZSA-N 0 3 380.330 3.330 10 0 GGAEHN CO[C@@H]1CCCN(CCCOc2cccc(I)c2)C1 ZINC000536598523 566387085 /nfs/dbraw/zinc/38/70/85/566387085.db2.gz CZWBLTZIMCLMLC-OAHLLOKOSA-N 0 3 375.250 3.171 10 0 GGAEHN CC(C)N1CCN(CCCN2CCc3cc(F)cc(Br)c3C2)CC1 ZINC000626132616 566387491 /nfs/dbraw/zinc/38/74/91/566387491.db2.gz QYTXMXKSVTZWAN-UHFFFAOYSA-N 0 3 398.364 3.362 10 0 GGAEHN O=C(NCCc1ccccc1Br)N1CC[C@@H](N2CCCCC2)C1 ZINC000557449786 566388085 /nfs/dbraw/zinc/38/80/85/566388085.db2.gz DLDJINHFAWKCRV-MRXNPFEDSA-N 0 3 380.330 3.261 10 0 GGAEHN O=C(NCCc1ccccc1Br)N1CC[C@H](N2CCCCC2)C1 ZINC000557449784 566388144 /nfs/dbraw/zinc/38/81/44/566388144.db2.gz DLDJINHFAWKCRV-INIZCTEOSA-N 0 3 380.330 3.261 10 0 GGAEHN CNS(=O)(=O)C[C@H]1CCCN(C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000626166591 566389299 /nfs/dbraw/zinc/38/92/99/566389299.db2.gz ARCFCFGMXFPXHV-KGLIPLIRSA-N 0 3 378.460 3.070 10 0 GGAEHN CNS(=O)(=O)C[C@H]1CCCN(C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000626166590 566389919 /nfs/dbraw/zinc/38/99/19/566389919.db2.gz ARCFCFGMXFPXHV-KBPBESRZSA-N 0 3 378.460 3.070 10 0 GGAEHN CNS(=O)(=O)C[C@H]1CCCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1 ZINC000626165946 566390069 /nfs/dbraw/zinc/39/00/69/566390069.db2.gz JXHGHYZTKNTKPI-ZFWWWQNUSA-N 0 3 378.460 3.114 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000649764441 566390528 /nfs/dbraw/zinc/39/05/28/566390528.db2.gz CHMXPOQJLUODDI-XPKDYRNWSA-N 0 3 381.314 3.114 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)[C@H]2CCOc3ccc(Br)cc32)CCN1C ZINC000649765566 566391857 /nfs/dbraw/zinc/39/18/57/566391857.db2.gz ZTGZDRLMPPVUIZ-SNPRPXQTSA-N 0 3 381.314 3.256 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)N1CCOc2ccc(Br)cc2C1 ZINC000576960772 566393065 /nfs/dbraw/zinc/39/30/65/566393065.db2.gz QSODPSGPMWKZAD-INIZCTEOSA-N 0 3 398.345 3.329 10 0 GGAEHN CC[C@@H]1C[C@@H](C)CC[C@H]1NCc1ccc(S(=O)(=O)N2CCOCC2)s1 ZINC000536700398 566394614 /nfs/dbraw/zinc/39/46/14/566394614.db2.gz SVHIWTZTIOZEMJ-ZMSDIMECSA-N 0 3 386.583 3.073 10 0 GGAEHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000649816519 566396377 /nfs/dbraw/zinc/39/63/77/566396377.db2.gz OCPLVSLSHIAOLG-PMPSAXMXSA-N 0 3 393.325 3.400 10 0 GGAEHN CN(CCCN(C)C(=O)Cc1cscc1Br)Cc1ccncc1 ZINC000576997941 566396878 /nfs/dbraw/zinc/39/68/78/566396878.db2.gz BDVPKHINVNGLDG-UHFFFAOYSA-N 0 3 396.354 3.429 10 0 GGAEHN COCCN1CCN(CCOc2cc(F)cc(Br)c2)C(C)(C)C1 ZINC000649851016 566399624 /nfs/dbraw/zinc/39/96/24/566399624.db2.gz IUACDZZNVZMNMH-UHFFFAOYSA-N 0 3 389.309 3.010 10 0 GGAEHN COCCN(C)CCNC(=O)N1CCC(c2cccc(Cl)c2Cl)CC1 ZINC000463323808 566400612 /nfs/dbraw/zinc/40/06/12/566400612.db2.gz KSFCWPFXHVYOIZ-UHFFFAOYSA-N 0 3 388.339 3.461 10 0 GGAEHN CN(C[C@@H]1CCCN1C)C(=O)c1c(Br)cccc1Br ZINC000421713139 566403048 /nfs/dbraw/zinc/40/30/48/566403048.db2.gz RWDLEZPXHWOQPX-JTQLQIEISA-N 0 3 390.119 3.378 10 0 GGAEHN O[C@H](COc1cc(F)cc(Br)c1)CN1CC[C@@]2(CC2(F)F)C1 ZINC000649908213 566405337 /nfs/dbraw/zinc/40/53/37/566405337.db2.gz JOCNMZRXIXCRLO-GXTWGEPZSA-N 0 3 380.204 3.059 10 0 GGAEHN CCO[C@@H]1C[C@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)[C@]12CCCO2 ZINC000577172760 566410412 /nfs/dbraw/zinc/41/04/12/566410412.db2.gz CQFBEXQZSMUBGQ-BUIXCFAXSA-N 0 3 390.307 3.049 10 0 GGAEHN CN(Cc1ccccc1)C[C@@H](O)CN1CCc2ccc(Br)cc2C1 ZINC000671245006 566411494 /nfs/dbraw/zinc/41/14/94/566411494.db2.gz CYVNGBQEPOHNQG-HXUWFJFHSA-N 0 3 389.337 3.300 10 0 GGAEHN CCN(CC)CCN(C(=O)c1nccs1)c1ccc(Br)cn1 ZINC000649988937 566411976 /nfs/dbraw/zinc/41/19/76/566411976.db2.gz UCYZESNIIYLYDV-UHFFFAOYSA-N 0 3 383.315 3.289 10 0 GGAEHN C[C@@H](CNC(=O)N(C)[C@H]1CCN(C2CC2)C1)Oc1ccccc1Br ZINC000484009250 566412134 /nfs/dbraw/zinc/41/21/34/566412134.db2.gz PCBJGSTVJHXEHU-ZFWWWQNUSA-N 0 3 396.329 3.095 10 0 GGAEHN CN(Cc1ccccc1Br)C(=O)CN1CCCCC[C@@H]1CCO ZINC000671247822 566412530 /nfs/dbraw/zinc/41/25/30/566412530.db2.gz GBXAWPHELJEQFL-MRXNPFEDSA-N 0 3 383.330 3.035 10 0 GGAEHN CCC[C@H](OC)C(=O)N(CCN(CC)CC)c1ccc(Br)cn1 ZINC000649989063 566412595 /nfs/dbraw/zinc/41/25/95/566412595.db2.gz ZHHVKPYTIHGAON-HNNXBMFYSA-N 0 3 386.334 3.334 10 0 GGAEHN C[C@@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CC[C@@]2(C1)CCCOC2 ZINC000671254312 566412769 /nfs/dbraw/zinc/41/27/69/566412769.db2.gz BMSGNNADCWDKIQ-HNAYVOBHSA-N 0 3 395.341 3.299 10 0 GGAEHN CCNC(=O)C[C@H]1CCCCN1C[C@@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000671248956 566412939 /nfs/dbraw/zinc/41/29/39/566412939.db2.gz SGMZDNVMEHUFOH-ZIAGYGMSSA-N 0 3 389.323 3.114 10 0 GGAEHN C[C@@H](NC(=O)CN1CC[C@@]2(C1)CCCOC2)c1ccc(Br)cc1 ZINC000671254517 566413475 /nfs/dbraw/zinc/41/34/75/566413475.db2.gz APMLRMNRNIBVFM-RDTXWAMCSA-N 0 3 381.314 3.129 10 0 GGAEHN CSC1(CNC(=O)NCc2ccsc2C(F)(F)F)CCN(C)CC1 ZINC000601608611 566414295 /nfs/dbraw/zinc/41/42/95/566414295.db2.gz JZCZZCIQJIHKNY-UHFFFAOYSA-N 0 3 381.489 3.394 10 0 GGAEHN COc1ccc([C@H](CN(C)C)NC(=O)Cc2ccc(Br)s2)cc1 ZINC000671293402 566414971 /nfs/dbraw/zinc/41/49/71/566414971.db2.gz BKEJKZULIQMKLJ-HNNXBMFYSA-N 0 3 397.338 3.481 10 0 GGAEHN Cc1ccc(I)c(C(=O)NCCN2CCCC[C@@H]2C)c1 ZINC000510834159 566415885 /nfs/dbraw/zinc/41/58/85/566415885.db2.gz BCKQPAGOMOCTTJ-ZDUSSCGKSA-N 0 3 386.277 3.204 10 0 GGAEHN CCc1n[nH]c(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)c1Br ZINC000447565046 566415964 /nfs/dbraw/zinc/41/59/64/566415964.db2.gz IHTNRTYIAQTFMQ-AWEZNQCLSA-N 0 3 391.313 3.081 10 0 GGAEHN Brc1ccc2c(c1)[C@H](NCC1(N3CCOCC3)CC1)CCCO2 ZINC000447592627 566417826 /nfs/dbraw/zinc/41/78/26/566417826.db2.gz MTSJKCZCAVRPPI-MRXNPFEDSA-N 0 3 381.314 3.117 10 0 GGAEHN O=C(CC(F)(F)F)NC[C@H]1CCCN(CCOc2cccc(Cl)c2)C1 ZINC000510903744 566418437 /nfs/dbraw/zinc/41/84/37/566418437.db2.gz TWOSJTKQKIAQLR-CYBMUJFWSA-N 0 3 378.822 3.499 10 0 GGAEHN CCn1nccc1CCN(CCn1ccnc1)Cc1ccc(Br)o1 ZINC000510906960 566418504 /nfs/dbraw/zinc/41/85/04/566418504.db2.gz QOUPUZPTSWVKOG-UHFFFAOYSA-N 0 3 392.301 3.200 10 0 GGAEHN CC(C)N1CC[C@H](N(C)C(=O)[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000650085760 566421959 /nfs/dbraw/zinc/42/19/59/566421959.db2.gz XRIJEQZLJFLNGL-LSDHHAIUSA-N 0 3 381.314 3.256 10 0 GGAEHN Clc1ccc2c(c1)OCCC[C@@H]2NC[C@]1(N2CCOCC2)CCSC1 ZINC000537105143 566422154 /nfs/dbraw/zinc/42/21/54/566422154.db2.gz PMNLLNIJCYUHEV-PKOBYXMFSA-N 0 3 382.957 3.351 10 0 GGAEHN CC[C@H](N[C@@H](CO)CC1CCCC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000510945241 566422329 /nfs/dbraw/zinc/42/23/29/566422329.db2.gz LZZGSEVWLUTPAN-WBVHZDCISA-N 0 3 388.961 3.230 10 0 GGAEHN C[C@@H](NCCc1nnnn1-c1ccccc1)c1ccc(F)c(Br)c1 ZINC000510957440 566422405 /nfs/dbraw/zinc/42/24/05/566422405.db2.gz GPPMRWABVNXKKQ-GFCCVEGCSA-N 0 3 390.260 3.457 10 0 GGAEHN CC(C)[C@@H](NCCNS(=O)(=O)c1ccc(F)cc1Cl)c1cccnc1 ZINC000510944741 566422508 /nfs/dbraw/zinc/42/25/08/566422508.db2.gz KSZAJDJRHQAYKY-QGZVFWFLSA-N 0 3 385.892 3.139 10 0 GGAEHN C[C@@H](CCC(F)(F)F)[NH2+]CC[N-]S(=O)(=O)c1ccc(F)cc1Cl ZINC000510959457 566422650 /nfs/dbraw/zinc/42/26/50/566422650.db2.gz PCZGOKNBYBCPEB-VIFPVBQESA-N 0 3 376.803 3.078 10 0 GGAEHN CCCN1CCC[C@H]1CNS(=O)(=O)c1c(Cl)cccc1Br ZINC000510979354 566425087 /nfs/dbraw/zinc/42/50/87/566425087.db2.gz CQMDYQJMFDSMJQ-NSHDSACASA-N 0 3 395.750 3.255 10 0 GGAEHN CCc1nc(CNC(=O)NCC2(N3CCSCC3)CCCCC2)cs1 ZINC000601898217 566431505 /nfs/dbraw/zinc/43/15/05/566431505.db2.gz CELZKFSJIDHDPR-UHFFFAOYSA-N 0 3 382.599 3.256 10 0 GGAEHN CN(C[C@H]1CCCN1C)C(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000422163868 566436468 /nfs/dbraw/zinc/43/64/68/566436468.db2.gz UQICKODUQYYCPA-UKRRQHHQSA-N 0 3 382.302 3.008 10 0 GGAEHN C[C@@H](CN1CCC[C@H](S(=O)(=O)N(C)C)C1)c1ccc(C(F)(F)F)cc1 ZINC000511127267 566439696 /nfs/dbraw/zinc/43/96/96/566439696.db2.gz SNSHGIORLMWUHI-BBRMVZONSA-N 0 3 378.460 3.165 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)c(F)c2)[C@@H](C)C1 ZINC000447874378 566442383 /nfs/dbraw/zinc/44/23/83/566442383.db2.gz LFQYQQVLNWQANN-XHDPSFHLSA-N 0 3 382.423 3.195 10 0 GGAEHN COc1ccc(COCCN[C@](C)(CO)c2ccc(Br)cc2)cc1 ZINC000671708215 566443145 /nfs/dbraw/zinc/44/31/45/566443145.db2.gz BSSAVODMKKDEIS-LJQANCHMSA-N 0 3 394.309 3.472 10 0 GGAEHN O=C(c1cc(Cl)c[nH]1)N1CCC(NCc2nc3c(s2)CCCC3)CC1 ZINC000671727317 566446044 /nfs/dbraw/zinc/44/60/44/566446044.db2.gz ZTCOKFWBCRYVEX-UHFFFAOYSA-N 0 3 378.929 3.398 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)N[C@H](C)C1=CCN(C)CC1)CC2 ZINC000511273239 566449460 /nfs/dbraw/zinc/44/94/60/566449460.db2.gz LXDNERFEDGFWPE-CQSZACIVSA-N 0 3 392.341 3.476 10 0 GGAEHN C[C@@H](NCCC1(F)CCC1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000558259499 566460651 /nfs/dbraw/zinc/46/06/51/566460651.db2.gz SEZMMIHTUSBAPK-SNVBAGLBSA-N 0 3 379.295 3.029 10 0 GGAEHN FC(F)Oc1c(Cl)cc(Cl)cc1CN[C@H](C1CC1)[C@@H]1CNCCO1 ZINC000422876882 566464826 /nfs/dbraw/zinc/46/48/26/566464826.db2.gz QVXSFRBIJGVUNW-UONOGXRCSA-N 0 3 381.250 3.451 10 0 GGAEHN FC(F)Oc1c(Cl)cc(Cl)cc1CN[C@@H](C1CC1)[C@H]1CNCCO1 ZINC000422876881 566465429 /nfs/dbraw/zinc/46/54/29/566465429.db2.gz QVXSFRBIJGVUNW-KGLIPLIRSA-N 0 3 381.250 3.451 10 0 GGAEHN C[C@H](NC[C@@H]1CCN(c2cccc(Br)c2)C1)c1cnccc1N ZINC000422902197 566465538 /nfs/dbraw/zinc/46/55/38/566465538.db2.gz UADYYMBPFWEIBF-KBPBESRZSA-N 0 3 375.314 3.434 10 0 GGAEHN C[C@@H](NC[C@@H]1CCN(c2ccc(Br)cc2)C1)c1cnccc1N ZINC000422941501 566466609 /nfs/dbraw/zinc/46/66/09/566466609.db2.gz JIVYPNYJTBXJBG-KGLIPLIRSA-N 0 3 375.314 3.434 10 0 GGAEHN CN(C(=O)N[C@@H]1C[C@H]1c1cccc(Br)c1)[C@H]1CCN(C2CC2)C1 ZINC000558389387 566468493 /nfs/dbraw/zinc/46/84/93/566468493.db2.gz QHKIOIFYPWWMMY-YESZJQIVSA-N 0 3 378.314 3.183 10 0 GGAEHN Cc1c(Br)ccc(C(=O)Nc2ccnc(OCCN(C)C)c2)c1F ZINC000448329044 566469573 /nfs/dbraw/zinc/46/95/73/566469573.db2.gz UGIQCUFUHQZGHP-UHFFFAOYSA-N 0 3 396.260 3.484 10 0 GGAEHN C[C@@H]1CC[C@@H](C)N1[C@@H]1CCCN(C(=O)C(=O)c2ccc(Br)cc2)C1 ZINC000511543622 566469566 /nfs/dbraw/zinc/46/95/66/566469566.db2.gz YBWZDLAFCKRRTI-CKEIUWERSA-N 0 3 393.325 3.496 10 0 GGAEHN FC(F)(F)c1cc(Br)ccc1CN[C@H](C1CC1)[C@H]1CNCCO1 ZINC000423020661 566469615 /nfs/dbraw/zinc/46/96/15/566469615.db2.gz CMWHWLLVDVIQRX-HUUCEWRRSA-N 0 3 393.247 3.325 10 0 GGAEHN C[C@](CO)(NCCC(=O)Nc1ccc(F)cc1)c1ccc(Br)cc1 ZINC000511544372 566470302 /nfs/dbraw/zinc/47/03/02/566470302.db2.gz YUGZFZFZZNOVGB-GOSISDBHSA-N 0 3 395.272 3.414 10 0 GGAEHN Cc1nccc(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c1Br ZINC000558425356 566471699 /nfs/dbraw/zinc/47/16/99/566471699.db2.gz BECRYCJCHKPGDP-CXAGYDPISA-N 0 3 391.313 3.387 10 0 GGAEHN COc1ccccc1OCCN[C@@](C)(CO)c1ccc(Br)cc1 ZINC000511565493 566471645 /nfs/dbraw/zinc/47/16/45/566471645.db2.gz SSWMEXKOQUQDNA-SFHVURJKSA-N 0 3 380.282 3.334 10 0 GGAEHN CCN1CCN(CCC(=O)N2CC(C)(C)c3cc(Br)ccc32)CC1 ZINC000672191166 566471799 /nfs/dbraw/zinc/47/17/99/566471799.db2.gz GRSURSAZICPJID-UHFFFAOYSA-N 0 3 394.357 3.101 10 0 GGAEHN C[C@@](CO)(NCCOCC(F)(F)C(F)F)c1ccc(Br)cc1 ZINC000511596663 566474690 /nfs/dbraw/zinc/47/46/90/566474690.db2.gz SQUZWCLHAOTQAV-ZDUSSCGKSA-N 0 3 388.199 3.163 10 0 GGAEHN C[C@@](CO)(NC[C@@H](O)CCc1ccccc1)c1ccc(Br)cc1 ZINC000511589134 566475102 /nfs/dbraw/zinc/47/51/02/566475102.db2.gz VSFQDOXCVSBPSH-OALUTQOASA-N 0 3 378.310 3.240 10 0 GGAEHN N[C@@H](C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1)C1CCC1 ZINC000423099806 566475405 /nfs/dbraw/zinc/47/54/05/566475405.db2.gz UHLWCXZQVXHIOP-QGZVFWFLSA-N 0 3 380.275 3.269 10 0 GGAEHN CCN1CCN(CCCOc2cccc(I)c2)[C@H](C)C1 ZINC000511608040 566475854 /nfs/dbraw/zinc/47/58/54/566475854.db2.gz AWQBLGQJTSUDFA-CQSZACIVSA-N 0 3 388.293 3.086 10 0 GGAEHN Cn1c2ccccc2nc1CCN[C@](C)(CO)c1ccc(Br)cc1 ZINC000511628016 566476399 /nfs/dbraw/zinc/47/63/99/566476399.db2.gz XFKWSNCXKKTABG-LJQANCHMSA-N 0 3 388.309 3.376 10 0 GGAEHN COC1CCN(CCNc2ccc(Br)c(C(F)(F)F)n2)CC1 ZINC000672232406 566476436 /nfs/dbraw/zinc/47/64/36/566476436.db2.gz KSKHVMOXOCRZGW-UHFFFAOYSA-N 0 3 382.224 3.386 10 0 GGAEHN CN(C)CCOC1CCN(C(=O)CCOc2cccc(Cl)c2Cl)CC1 ZINC000485115366 566476714 /nfs/dbraw/zinc/47/67/14/566476714.db2.gz GIWGDSNHBGMVLI-UHFFFAOYSA-N 0 3 389.323 3.332 10 0 GGAEHN CN(C)CCOC1CCN(C(=O)C(C)(C)c2cccc(Br)c2)CC1 ZINC000485118072 566476781 /nfs/dbraw/zinc/47/67/81/566476781.db2.gz KTRHSPKGZIQSAM-UHFFFAOYSA-N 0 3 397.357 3.296 10 0 GGAEHN COC(=O)C[C@](C)(NCCc1ccncc1)c1ccc(Br)cc1 ZINC000558466707 566477101 /nfs/dbraw/zinc/47/71/01/566477101.db2.gz PMXNJDDELQUOSV-SFHVURJKSA-N 0 3 377.282 3.455 10 0 GGAEHN Cn1c2ccccc2nc1CCN[C@@](C)(CO)c1ccc(Br)cc1 ZINC000511628013 566477189 /nfs/dbraw/zinc/47/71/89/566477189.db2.gz XFKWSNCXKKTABG-IBGZPJMESA-N 0 3 388.309 3.376 10 0 GGAEHN O=C(N[C@H]1C[C@H](c2ccc(Br)cc2)C1)N1CC[C@@H](N2CC=CC2)C1 ZINC000464471607 566478083 /nfs/dbraw/zinc/47/80/83/566478083.db2.gz YNVJECCHVOGDJL-KBAYOESNSA-N 0 3 390.325 3.351 10 0 GGAEHN Cc1c(Br)cccc1C[C@H](CO)CN[C@H](C)c1cnccc1N ZINC000423149042 566479256 /nfs/dbraw/zinc/47/92/56/566479256.db2.gz AESRZJSPQTZSNG-KGLIPLIRSA-N 0 3 378.314 3.067 10 0 GGAEHN Cc1ccc(C[C@@H](CO)CN[C@@H](C)c2cnccc2N)cc1Br ZINC000423161645 566480893 /nfs/dbraw/zinc/48/08/93/566480893.db2.gz NYBKYQCQIMTFQJ-DZGCQCFKSA-N 0 3 378.314 3.067 10 0 GGAEHN COc1ccc([C@H](C)Nc2ccc(N3CCNCC3)cn2)cc1Br ZINC000423231074 566482604 /nfs/dbraw/zinc/48/26/04/566482604.db2.gz KQKSQJYLBYELPY-ZDUSSCGKSA-N 0 3 391.313 3.435 10 0 GGAEHN CN(C)[C@@H](CNC(=O)Cc1sccc1Br)Cc1ccccc1 ZINC000448602286 566482825 /nfs/dbraw/zinc/48/28/25/566482825.db2.gz AHUMFUHTNHUEKH-CQSZACIVSA-N 0 3 381.339 3.342 10 0 GGAEHN C[C@H](CC(=O)Nc1cccc(Br)c1)NCCOc1ncccc1F ZINC000537950092 566482928 /nfs/dbraw/zinc/48/29/28/566482928.db2.gz IEYCQMXZXGASBY-GFCCVEGCSA-N 0 3 396.260 3.369 10 0 GGAEHN CCSc1ccc(CC(=O)N2CC[C@@H]3CN(C)C[C@H]32)c(Br)c1 ZINC000627488477 566483154 /nfs/dbraw/zinc/48/31/54/566483154.db2.gz ZSCFSZNCIAFIHS-CZUORRHYSA-N 0 3 383.355 3.266 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3c(F)ccc(C(F)(F)F)c3Br)[C@H]2C1 ZINC000627487825 566483221 /nfs/dbraw/zinc/48/32/21/566483221.db2.gz LKSIHIUDGMVIAE-KCJUWKMLSA-N 0 3 395.194 3.383 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3c(F)ccc(C(F)(F)F)c3Br)[C@@H]2C1 ZINC000627487827 566483624 /nfs/dbraw/zinc/48/36/24/566483624.db2.gz LKSIHIUDGMVIAE-LDYMZIIASA-N 0 3 395.194 3.383 10 0 GGAEHN CC1(C)CCCN[C@@H]1C(=O)Nc1nccn1Cc1ccc(Br)cc1 ZINC000423286922 566483625 /nfs/dbraw/zinc/48/36/25/566483625.db2.gz JMFFXTKFPBSZMA-OAHLLOKOSA-N 0 3 391.313 3.411 10 0 GGAEHN C[C@H]1C[C@@H](NCCN2CCN(C(=O)C3CCC3)CC2)c2ccsc2S1 ZINC000537978203 566483997 /nfs/dbraw/zinc/48/39/97/566483997.db2.gz KPMOMHBMKONOOD-WMLDXEAASA-N 0 3 379.595 3.207 10 0 GGAEHN CS[C@H]1CN(C(=O)N[C@H](c2ccc(F)cc2)C(F)(F)F)C[C@H]1N(C)C ZINC000485226138 566484967 /nfs/dbraw/zinc/48/49/67/566484967.db2.gz WIDNGKWFEVHDMQ-HZSPNIEDSA-N 0 3 379.423 3.116 10 0 GGAEHN Brc1cc2c(s1)CC[C@H]2Nc1ccc(N2CCNCC2)cn1 ZINC000423242610 566484999 /nfs/dbraw/zinc/48/49/99/566484999.db2.gz YZPAVPXKJQXLCV-CYBMUJFWSA-N 0 3 379.327 3.415 10 0 GGAEHN CS[C@H]1CN(C(=O)N[C@H](c2ccc(F)cc2)C(F)(F)F)C[C@@H]1N(C)C ZINC000485226139 566485081 /nfs/dbraw/zinc/48/50/81/566485081.db2.gz WIDNGKWFEVHDMQ-MELADBBJSA-N 0 3 379.423 3.116 10 0 GGAEHN COCCNCCN[C@H](C)c1ccc(Br)cc1Br ZINC000423333285 566485983 /nfs/dbraw/zinc/48/59/83/566485983.db2.gz VSMKMEXXLAVBDS-SNVBAGLBSA-N 0 3 380.124 3.098 10 0 GGAEHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000558570390 566487401 /nfs/dbraw/zinc/48/74/01/566487401.db2.gz XYSFZHPSKBQCHJ-RLCCDNCMSA-N 0 3 394.313 3.055 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)Cc1cccc(Br)c1 ZINC000511769229 566488036 /nfs/dbraw/zinc/48/80/36/566488036.db2.gz ITZXBKBJCWHQBU-GOSISDBHSA-N 0 3 375.310 3.281 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NCc1cccc2c1CCCN2 ZINC000423413847 566488454 /nfs/dbraw/zinc/48/84/54/566488454.db2.gz LHICKSVNVGHIFD-CYBMUJFWSA-N 0 3 376.298 3.147 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NCc1ccc2c(c1)CCCN2 ZINC000423444322 566488989 /nfs/dbraw/zinc/48/89/89/566488989.db2.gz LPUGNTXLJBHQQC-ZDUSSCGKSA-N 0 3 376.298 3.147 10 0 GGAEHN C[C@]1(F)CNCCN(CC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000578070728 566489624 /nfs/dbraw/zinc/48/96/24/566489624.db2.gz DLGOYVUIYOVODM-AEFFLSMTSA-N 0 3 388.314 3.290 10 0 GGAEHN C[C@H](N[C@H]1CNCCC1(F)F)c1ccc(F)c(I)c1 ZINC000423472779 566490451 /nfs/dbraw/zinc/49/04/51/566490451.db2.gz GDIWZVCVJLUROU-UFBFGSQYSA-N 0 3 384.183 3.078 10 0 GGAEHN C[C@H](N[C@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1nccs1 ZINC000578101723 566491284 /nfs/dbraw/zinc/49/12/84/566491284.db2.gz WEMVIRVTJZSYQX-LKTVYLICSA-N 0 3 382.892 3.298 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N(C)CCN1CCCCC1 ZINC000651043740 566491705 /nfs/dbraw/zinc/49/17/05/566491705.db2.gz OGMOJKFONWUEEF-UHFFFAOYSA-N 0 3 384.318 3.085 10 0 GGAEHN CCN(C(=O)[C@@H]1CCOc2ccc(Br)cc21)C1CCN(C)CC1 ZINC000627615287 566492219 /nfs/dbraw/zinc/49/22/19/566492219.db2.gz SFFLKDUPSXSDQW-OAHLLOKOSA-N 0 3 381.314 3.258 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)Cc1sccc1Br ZINC000448755744 566493223 /nfs/dbraw/zinc/49/32/23/566493223.db2.gz HRAGVJOCDIPRDM-CQSZACIVSA-N 0 3 381.339 3.342 10 0 GGAEHN COC(=O)c1cc(NC(=O)[C@H]2NCCCC2(C)C)cc(Br)c1F ZINC000423908773 566496121 /nfs/dbraw/zinc/49/61/21/566496121.db2.gz COZANZURWVPDTM-CYBMUJFWSA-N 0 3 387.249 3.092 10 0 GGAEHN CCc1ccccc1[C@@H](N)CNC(=O)COc1ccccc1Br ZINC000423936941 566496163 /nfs/dbraw/zinc/49/61/63/566496163.db2.gz FHZLNMHMFZZYAB-INIZCTEOSA-N 0 3 377.282 3.207 10 0 GGAEHN C[C@H](CN1CCCCC1)NC(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000651096314 566496677 /nfs/dbraw/zinc/49/66/77/566496677.db2.gz BLOWWUYROIQHLH-HIFRSBDPSA-N 0 3 381.314 3.306 10 0 GGAEHN C[C@@H](CN1CCCCC1)NC(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000651096316 566497289 /nfs/dbraw/zinc/49/72/89/566497289.db2.gz BLOWWUYROIQHLH-ZFWWWQNUSA-N 0 3 381.314 3.306 10 0 GGAEHN CC1(C)NC(=O)CC[C@@H]1NCc1cc(Cl)cc(I)c1 ZINC000424300293 566526807 /nfs/dbraw/zinc/52/68/07/566526807.db2.gz UALWTRYJAMXSLR-LBPRGKRZSA-N 0 3 392.668 3.091 10 0 GGAEHN CC1(C)CCCN1CCNC(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000627697505 566499319 /nfs/dbraw/zinc/49/93/19/566499319.db2.gz CNFWKCCYKGYSMD-USXIJHARSA-N 0 3 377.326 3.325 10 0 GGAEHN OC[C@H](CN[C@H](c1ccc(Br)cc1)[C@@H]1CCCO1)c1cccnc1 ZINC000672618414 566499694 /nfs/dbraw/zinc/49/96/94/566499694.db2.gz CIOXBKBCHZNYFQ-YTQUADARSA-N 0 3 391.309 3.430 10 0 GGAEHN Cc1cc(Br)c(C(=O)N2CCC(N3CCCOCC3)CC2)s1 ZINC000627742099 566502642 /nfs/dbraw/zinc/50/26/42/566502642.db2.gz ITZSBOPARSIVEE-UHFFFAOYSA-N 0 3 387.343 3.146 10 0 GGAEHN CC(C)n1cc(Br)cc1C(=O)N1CCC(N2CCCOCC2)CC1 ZINC000627740552 566502671 /nfs/dbraw/zinc/50/26/71/566502671.db2.gz VHNDUZMEYOAMEY-UHFFFAOYSA-N 0 3 398.345 3.158 10 0 GGAEHN O=C(c1csc(-c2cccs2)n1)N1CCC(N2CCCOCC2)CC1 ZINC000627738201 566502973 /nfs/dbraw/zinc/50/29/73/566502973.db2.gz BXUJWKAOOLRZNB-UHFFFAOYSA-N 0 3 377.535 3.199 10 0 GGAEHN O=C(COc1ccc(Cl)cc1Cl)N1CCC(N2CCCOCC2)CC1 ZINC000627737517 566503188 /nfs/dbraw/zinc/50/31/88/566503188.db2.gz ZHFAYPWGXGFGOE-UHFFFAOYSA-N 0 3 387.307 3.086 10 0 GGAEHN CN(Cc1cccc(Br)c1)C[C@H](O)COc1ccc2c(c1)OCO2 ZINC000511987181 566503124 /nfs/dbraw/zinc/50/31/24/566503124.db2.gz FRBRYCPRXUDKIE-HNNXBMFYSA-N 0 3 394.265 3.050 10 0 GGAEHN Cc1ccc(CC(=O)N2CCC(N3CCCOCC3)CC2)c(Br)c1 ZINC000627742374 566503235 /nfs/dbraw/zinc/50/32/35/566503235.db2.gz SZVDMIMPIQJQLV-UHFFFAOYSA-N 0 3 395.341 3.013 10 0 GGAEHN Cc1c(Br)cccc1C(=O)N1CCC(N2CCCOCC2)CC1 ZINC000627740642 566503541 /nfs/dbraw/zinc/50/35/41/566503541.db2.gz ZJANFYGLCGKGOS-UHFFFAOYSA-N 0 3 381.314 3.084 10 0 GGAEHN Cc1cc(Br)c(F)c(C(=O)N2CCC(N3CCCOCC3)CC2)c1 ZINC000627742619 566503835 /nfs/dbraw/zinc/50/38/35/566503835.db2.gz FDAFPBSWVAHWQY-UHFFFAOYSA-N 0 3 399.304 3.224 10 0 GGAEHN O=C([C@@H]1CCOc2ccc(Br)cc21)N1CC[C@@H](N2CCCC2)C1 ZINC000651235964 566504260 /nfs/dbraw/zinc/50/42/60/566504260.db2.gz QDFYSKLJFRDYSD-HUUCEWRRSA-N 0 3 379.298 3.012 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000651260405 566505560 /nfs/dbraw/zinc/50/55/60/566505560.db2.gz XTLUVOGTXHPCSV-HNNXBMFYSA-N 0 3 381.314 3.115 10 0 GGAEHN O=C([C@@H]1CCOc2ccc(Br)cc21)N1CC[C@H](N2CCCCC2)C1 ZINC000651290015 566507391 /nfs/dbraw/zinc/50/73/91/566507391.db2.gz GVCREGAPPJSOEG-JKSUJKDBSA-N 0 3 393.325 3.402 10 0 GGAEHN O=C([C@H]1CCOc2ccc(Br)cc21)N1CC[C@H](N2CCCCC2)C1 ZINC000651290013 566507409 /nfs/dbraw/zinc/50/74/09/566507409.db2.gz GVCREGAPPJSOEG-HOTGVXAUSA-N 0 3 393.325 3.402 10 0 GGAEHN COC1CCN(C(C)(C)CNC(=O)Nc2ncc(C(F)(F)F)s2)CC1 ZINC000558800135 566508309 /nfs/dbraw/zinc/50/83/09/566508309.db2.gz CLUSUPSXLYHKAE-UHFFFAOYSA-N 0 3 380.436 3.173 10 0 GGAEHN CN(C)CCOc1cccc(CNC(=O)Cc2sccc2Br)c1 ZINC000448888568 566509227 /nfs/dbraw/zinc/50/92/27/566509227.db2.gz XCQQQMGTSDNKBC-UHFFFAOYSA-N 0 3 397.338 3.310 10 0 GGAEHN CCN1CCCC[C@H]1CNC(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000651305607 566509514 /nfs/dbraw/zinc/50/95/14/566509514.db2.gz PVGNATCGWCHVBE-GJZGRUSLSA-N 0 3 381.314 3.306 10 0 GGAEHN Cc1c(C(=O)N2CCC[C@@H]2CN(C)C)cnn1-c1cccc(Br)c1 ZINC000464921369 566510063 /nfs/dbraw/zinc/51/00/63/566510063.db2.gz NTLCDIJQVFKJNU-MRXNPFEDSA-N 0 3 391.313 3.109 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1cc(Cl)c(F)cc1Br ZINC000448905943 566510261 /nfs/dbraw/zinc/51/02/61/566510261.db2.gz BTCZVOYLUMFZQV-JTQLQIEISA-N 0 3 393.684 3.082 10 0 GGAEHN CC(C)N1CC[C@@H](NC[C@@H](C)CS(C)(=O)=O)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558829550 566510317 /nfs/dbraw/zinc/51/03/17/566510317.db2.gz SCMHRHJXHILJAT-XWIAVFTESA-N 0 3 390.952 3.273 10 0 GGAEHN Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)NC(=O)[C@@H]1C[C@@H]1N ZINC000424120117 566513299 /nfs/dbraw/zinc/51/32/99/566513299.db2.gz GRXUMCASEFNNKJ-CKLFPEKLSA-N 0 3 380.311 3.405 10 0 GGAEHN CC1(C)CN(c2ncc(Br)c3ccc(F)cc32)CCN1CCO ZINC000651344528 566514855 /nfs/dbraw/zinc/51/48/55/566514855.db2.gz JFJGHAHLABWQFV-UHFFFAOYSA-N 0 3 382.277 3.029 10 0 GGAEHN CN(C(=O)c1cc2c(ccc(F)c2Br)[nH]1)[C@@H]1CN2CCC1CC2 ZINC000448956588 566515746 /nfs/dbraw/zinc/51/57/46/566515746.db2.gz QROBHPSWPDIAMB-OAHLLOKOSA-N 0 3 380.261 3.236 10 0 GGAEHN CC(C)n1cncc1CNC[C@H](CO)Cc1cc(Br)ccc1F ZINC000424170467 566516002 /nfs/dbraw/zinc/51/60/02/566516002.db2.gz ICOZHGJRSKEISA-CYBMUJFWSA-N 0 3 384.293 3.306 10 0 GGAEHN C[C@H]1CN(c2ncc(Br)c3ccc(F)cc32)[C@@H](C)CN1CCO ZINC000651357808 566517890 /nfs/dbraw/zinc/51/78/90/566517890.db2.gz HVNWAOWBTNUMAY-RYUDHWBXSA-N 0 3 382.277 3.028 10 0 GGAEHN NC(=O)C1CCC(NCc2cccc(Br)c2OC(F)F)CC1 ZINC000538532724 566519198 /nfs/dbraw/zinc/51/91/98/566519198.db2.gz VEVWAXBLKNZIEY-UHFFFAOYSA-N 0 3 377.229 3.184 10 0 GGAEHN CC(C)C[C@H](N[C@H](C)c1ccc(Br)s1)C(=O)NCCN(C)C ZINC000538548521 566519838 /nfs/dbraw/zinc/51/98/38/566519838.db2.gz OTEINSJENXVFHX-OLZOCXBDSA-N 0 3 390.391 3.254 10 0 GGAEHN OCCN1CCCC[C@@H]1CN[C@H](c1ccc(Br)cc1)[C@H]1CCCO1 ZINC000651379973 566520557 /nfs/dbraw/zinc/52/05/57/566520557.db2.gz IUJRJOGDMIKJPY-GUDVDZBRSA-N 0 3 397.357 3.106 10 0 GGAEHN O[C@@H](CNCc1ccc(I)cc1Cl)CC(F)(F)F ZINC000578436323 566522035 /nfs/dbraw/zinc/52/20/35/566522035.db2.gz MEOURKGHSUGGIK-SECBINFHSA-N 0 3 393.574 3.348 10 0 GGAEHN CN(Cc1cc2c(cc1Br)OCCCO2)[C@H]1CCN(C2CC2)C1 ZINC000538619223 566523036 /nfs/dbraw/zinc/52/30/36/566523036.db2.gz LJELRMWTVZXOOB-HNNXBMFYSA-N 0 3 381.314 3.279 10 0 GGAEHN CN(C)CCN(Cc1ccccc1F)C(=O)c1ncsc1Br ZINC000512268695 566523617 /nfs/dbraw/zinc/52/36/17/566523617.db2.gz JAIZUTZDGYMYSQ-UHFFFAOYSA-N 0 3 386.290 3.249 10 0 GGAEHN CCN(CC)S(=O)(=O)c1ccc(CN[C@H]2C[C@@H]3C[C@H](OC)C[C@@H]3C2)s1 ZINC000424273995 566525507 /nfs/dbraw/zinc/52/55/07/566525507.db2.gz VAINFQCONOZNKV-PLAPLOCASA-N 0 3 386.583 3.072 10 0 GGAEHN CC1(C)NC(=O)CC[C@H]1NCc1cc(Cl)cc(I)c1 ZINC000424300292 566526936 /nfs/dbraw/zinc/52/69/36/566526936.db2.gz UALWTRYJAMXSLR-GFCCVEGCSA-N 0 3 392.668 3.091 10 0 GGAEHN C[C@H](NCCOc1cccc(S(C)(=O)=O)c1)c1ccc2ncsc2c1 ZINC000485816570 566529185 /nfs/dbraw/zinc/52/91/85/566529185.db2.gz NRNJFRHGOYUAID-ZDUSSCGKSA-N 0 3 376.503 3.429 10 0 GGAEHN C[C@@H](NCCOc1cccc(S(C)(=O)=O)c1)c1ccc2ncsc2c1 ZINC000485816569 566529656 /nfs/dbraw/zinc/52/96/56/566529656.db2.gz NRNJFRHGOYUAID-CYBMUJFWSA-N 0 3 376.503 3.429 10 0 GGAEHN O=S(=O)(Cc1cc(Cl)sc1Cl)N1CCC[C@@H]1CN1CCCC1 ZINC000651534644 566530532 /nfs/dbraw/zinc/53/05/32/566530532.db2.gz SAMNFRXMRUGLLJ-GFCCVEGCSA-N 0 3 383.366 3.445 10 0 GGAEHN O=S(=O)(Cc1cc(Cl)sc1Cl)N1CCC[C@H]1CN1CCCC1 ZINC000651534645 566531134 /nfs/dbraw/zinc/53/11/34/566531134.db2.gz SAMNFRXMRUGLLJ-LBPRGKRZSA-N 0 3 383.366 3.445 10 0 GGAEHN O=S(=O)(C[C@H](O)CN[C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1)c1cccs1 ZINC000449195743 566534891 /nfs/dbraw/zinc/53/48/91/566534891.db2.gz VQGXOUUJCGNZJL-DJIMGWMZSA-N 0 3 399.965 3.462 10 0 GGAEHN O=S(=O)(Cc1cc(Cl)sc1Cl)N1CC[C@H](CN2CCCC2)C1 ZINC000651573757 566535522 /nfs/dbraw/zinc/53/55/22/566535522.db2.gz HGKXYWMMIOUGBS-LLVKDONJSA-N 0 3 383.366 3.302 10 0 GGAEHN Cc1cc(CN)cc(NC(=O)C(=O)N[C@@H]2CCCc3sc(Cl)cc32)c1 ZINC000424473974 566536333 /nfs/dbraw/zinc/53/63/33/566536333.db2.gz XFTXPJJJUCDJQJ-CQSZACIVSA-N 0 3 377.897 3.301 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2sc(Br)cc2C)[C@H](C)C1 ZINC000651576690 566536516 /nfs/dbraw/zinc/53/65/16/566536516.db2.gz NWMUNBXIJJYQCK-NEPJUHHUSA-N 0 3 395.388 3.170 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2sc(Br)cc2C)[C@@H](C)C1 ZINC000651576691 566536774 /nfs/dbraw/zinc/53/67/74/566536774.db2.gz NWMUNBXIJJYQCK-NWDGAFQWSA-N 0 3 395.388 3.170 10 0 GGAEHN NC(=O)N[C@H]1CCN(Cc2ccc(-c3cccc(Br)c3)s2)C1 ZINC000538795246 566537153 /nfs/dbraw/zinc/53/71/53/566537153.db2.gz PAKJIHOZZXSHSC-ZDUSSCGKSA-N 0 3 380.311 3.420 10 0 GGAEHN CC[C@](C)(COc1ncccc1Cl)NCc1cccc(S(C)(=O)=O)c1 ZINC000449198155 566537422 /nfs/dbraw/zinc/53/74/22/566537422.db2.gz ACRZUWPMIXYHMV-GOSISDBHSA-N 0 3 382.913 3.476 10 0 GGAEHN CN1CC[C@@H](NCc2cccc(S(C)(=O)=O)c2)[C@@H]1c1ccc(Cl)cc1 ZINC000449212991 566537510 /nfs/dbraw/zinc/53/75/10/566537510.db2.gz JSGZONPRYDVRGI-MOPGFXCFSA-N 0 3 378.925 3.279 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2sc(Br)cc2C)[C@H](C)C1 ZINC000651576693 566537785 /nfs/dbraw/zinc/53/77/85/566537785.db2.gz NWMUNBXIJJYQCK-VXGBXAGGSA-N 0 3 395.388 3.170 10 0 GGAEHN O=S1(=O)CCC(CCNCc2cnc(CCc3ccccc3)s2)CC1 ZINC000449217363 566537960 /nfs/dbraw/zinc/53/79/60/566537960.db2.gz YSQAERCJGSBTAA-UHFFFAOYSA-N 0 3 378.563 3.233 10 0 GGAEHN COc1ccc(Br)c(CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1 ZINC000465657388 566539901 /nfs/dbraw/zinc/53/99/01/566539901.db2.gz IUDMUQZOYATRIW-TZMCWYRMSA-N 0 3 384.318 3.082 10 0 GGAEHN CN1CCC[C@H]2CN(S(=O)(=O)Cc3cc(Cl)sc3Cl)CC[C@H]21 ZINC000651604232 566540324 /nfs/dbraw/zinc/54/03/24/566540324.db2.gz UVACKHIAFXLSCK-CMPLNLGQSA-N 0 3 383.366 3.301 10 0 GGAEHN CCO[C@H](CC)C(=O)N(CCN(CC)CC)c1ccc(Br)cn1 ZINC000578632301 566540998 /nfs/dbraw/zinc/54/09/98/566540998.db2.gz RIQLWVXBCBTISP-OAHLLOKOSA-N 0 3 386.334 3.334 10 0 GGAEHN CCN1CC[C@H]2OCCN(Cc3ccc(Br)c4cccnc34)[C@H]2C1 ZINC000559301547 566541391 /nfs/dbraw/zinc/54/13/91/566541391.db2.gz CQBYFJPNWSGHPV-ZWKOTPCHSA-N 0 3 390.325 3.292 10 0 GGAEHN Cc1cc(Br)sc1S(=O)(=O)[N-]C1CCC(C[NH+](C)C)CC1 ZINC000651611300 566542122 /nfs/dbraw/zinc/54/21/22/566542122.db2.gz RRBHBLVHXMBPND-UHFFFAOYSA-N 0 3 395.388 3.218 10 0 GGAEHN C[C@H]([NH2+]CC[N-]S(=O)(=O)c1cccc(Cl)c1Cl)C1CC(F)(F)C1 ZINC000628271744 566543296 /nfs/dbraw/zinc/54/32/96/566543296.db2.gz ONCWRUSVSVDBIZ-VIFPVBQESA-N 0 3 387.279 3.295 10 0 GGAEHN Cc1cc(CN[C@@H](C2CCOCC2)C2(CO)CCC2)ncc1Br ZINC000628319381 566546460 /nfs/dbraw/zinc/54/64/60/566546460.db2.gz HKJDKWJPZLGIPE-KRWDZBQOSA-N 0 3 383.330 3.200 10 0 GGAEHN C[C@H](Cc1ccoc1)NCC(=O)Nc1ccc(I)cc1 ZINC000449310081 566548524 /nfs/dbraw/zinc/54/85/24/566548524.db2.gz GHLPWPCFWNZIJD-LLVKDONJSA-N 0 3 384.217 3.044 10 0 GGAEHN CN(C(=O)C1(c2cc(F)cc(Br)c2)CC1)[C@H]1CCN(C2CC2)C1 ZINC000512676426 566548656 /nfs/dbraw/zinc/54/86/56/566548656.db2.gz BKGFCAGHZQMOGN-INIZCTEOSA-N 0 3 381.289 3.315 10 0 GGAEHN O=S(=O)(Cc1cc(Cl)sc1Cl)NCC1CCN(C2CC2)CC1 ZINC000651674743 566550184 /nfs/dbraw/zinc/55/01/84/566550184.db2.gz ADVOZFUAMSYBLB-UHFFFAOYSA-N 0 3 383.366 3.349 10 0 GGAEHN O[C@@H](CCNCc1cnn(-c2ccc(Br)cc2)c1)C(F)(F)F ZINC000578735335 566550556 /nfs/dbraw/zinc/55/05/56/566550556.db2.gz GVFJWKSCWCIKSS-ZDUSSCGKSA-N 0 3 378.192 3.038 10 0 GGAEHN Cc1ccnc([C@H]2CCN(Cc3cc(=O)n4cc(Br)ccc4n3)C2)c1 ZINC000578761281 566551660 /nfs/dbraw/zinc/55/16/60/566551660.db2.gz AMOKAFWFIMWOMM-AWEZNQCLSA-N 0 3 399.292 3.150 10 0 GGAEHN Cc1cc(CNC[C@H]2CS(=O)(=O)c3ccccc32)ccc1Br ZINC000449361154 566552641 /nfs/dbraw/zinc/55/26/41/566552641.db2.gz WVLPMGHWFNCUBA-AWEZNQCLSA-N 0 3 380.307 3.418 10 0 GGAEHN C[C@@H]1C[C@H](N2CCCC2)CN1S(=O)(=O)Cc1cc(Cl)sc1Cl ZINC000651701976 566553143 /nfs/dbraw/zinc/55/31/43/566553143.db2.gz GZPIIBFUMIAYJM-PWSUYJOCSA-N 0 3 383.366 3.443 10 0 GGAEHN O=S1(=O)C[C@H](CNCc2ccc(F)c(Br)c2)c2ccccc21 ZINC000449363033 566553127 /nfs/dbraw/zinc/55/31/27/566553127.db2.gz OOYPNZDNYJUTGP-LBPRGKRZSA-N 0 3 384.270 3.249 10 0 GGAEHN C[C@H](NC(=O)[C@@H]1CCOc2ccc(Br)cc21)C1=CCN(C)CC1 ZINC000651696288 566553353 /nfs/dbraw/zinc/55/33/53/566553353.db2.gz MJNWFPHZEVKNIX-SWLSCSKDSA-N 0 3 379.298 3.082 10 0 GGAEHN C[C@@H](NS(=O)(=O)c1ccc(CN(C)C)cc1)c1ccc2ncsc2c1 ZINC000559502280 566553670 /nfs/dbraw/zinc/55/36/70/566553670.db2.gz MDBRWTNZVPQZFT-CYBMUJFWSA-N 0 3 375.519 3.397 10 0 GGAEHN CCN1CCCC[C@@H]1CNC(=O)Cc1noc2ccc(Br)cc21 ZINC000424666716 566555489 /nfs/dbraw/zinc/55/54/89/566555489.db2.gz PQEXGJIPAMRJRM-CYBMUJFWSA-N 0 3 380.286 3.123 10 0 GGAEHN Cc1ncc(CN2CC[C@H](Cc3cccc(I)c3)C2)cn1 ZINC000449388711 566556304 /nfs/dbraw/zinc/55/63/04/566556304.db2.gz AWNLOKXRTAQCIW-OAHLLOKOSA-N 0 3 393.272 3.454 10 0 GGAEHN Ic1cccc(C[C@H]2CCN(Cc3cncnc3)C2)c1 ZINC000449394334 566556657 /nfs/dbraw/zinc/55/66/57/566556657.db2.gz NRQLWLISNUQZNH-CQSZACIVSA-N 0 3 379.245 3.146 10 0 GGAEHN Nc1c(Br)cc(Br)cc1CN[C@H]1CO[C@H](C2CC2)C1 ZINC000628463066 566556933 /nfs/dbraw/zinc/55/69/33/566556933.db2.gz RHTXZSDSAJMXKV-YPMHNXCESA-N 0 3 390.119 3.451 10 0 GGAEHN COC[C@](C)(O)CCNCc1cc(Br)c(C)c(Br)c1 ZINC000449386617 566557068 /nfs/dbraw/zinc/55/70/68/566557068.db2.gz UPEOBVNHFWWNIB-CQSZACIVSA-N 0 3 395.135 3.397 10 0 GGAEHN Cc1n[nH]cc1CN1CC[C@@H](Cc2cccc(I)c2)C1 ZINC000449397216 566558453 /nfs/dbraw/zinc/55/84/53/566558453.db2.gz UPSQCFNQNSMUFT-AWEZNQCLSA-N 0 3 381.261 3.387 10 0 GGAEHN O[C@H](CNC[C@@H]1COc2ccccc2O1)COc1ccc(Cl)cc1Cl ZINC000559581214 566558881 /nfs/dbraw/zinc/55/88/81/566558881.db2.gz FVMKQVZYDVCMMQ-ZIAGYGMSSA-N 0 3 384.259 3.163 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)Cc2noc3ccc(Br)cc32)CCN1C ZINC000424688444 566558896 /nfs/dbraw/zinc/55/88/96/566558896.db2.gz NUVTYYFRXTYQTO-WCQYABFASA-N 0 3 380.286 3.074 10 0 GGAEHN COc1cc(C(=O)NCCN2[C@@H](C)CCC[C@@H]2C)cc(Br)c1OC ZINC000559569891 566559123 /nfs/dbraw/zinc/55/91/23/566559123.db2.gz LHOKZOFHPZPBFY-STQMWFEESA-N 0 3 399.329 3.459 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@H]1CN(C2CC2)C[C@H]1C ZINC000466221626 566559867 /nfs/dbraw/zinc/55/98/67/566559867.db2.gz VMVWDLCNSSNJAI-XNJGSVPQSA-N 0 3 380.330 3.162 10 0 GGAEHN CCOc1cc(CN[C@H](CC)[C@H](O)C(F)F)cc(Br)c1OC ZINC000449426532 566559977 /nfs/dbraw/zinc/55/99/77/566559977.db2.gz VEDKVQJWQCGOPX-YPMHNXCESA-N 0 3 382.245 3.351 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@H]1CN(C2CC2)C[C@@H]1C ZINC000466221623 566560438 /nfs/dbraw/zinc/56/04/38/566560438.db2.gz VMVWDLCNSSNJAI-AHIWAGSCSA-N 0 3 380.330 3.162 10 0 GGAEHN CC[C@H](NCc1cn(-c2ccc(Br)cc2)nc1C)[C@H](O)C(F)F ZINC000449421865 566560593 /nfs/dbraw/zinc/56/05/93/566560593.db2.gz JPEFBTUWPDWJAV-GJZGRUSLSA-N 0 3 388.256 3.437 10 0 GGAEHN CC[C@H](NCc1cn(-c2ccc(Br)cc2)nc1C)[C@@H](O)C(F)F ZINC000449421867 566560760 /nfs/dbraw/zinc/56/07/60/566560760.db2.gz JPEFBTUWPDWJAV-LSDHHAIUSA-N 0 3 388.256 3.437 10 0 GGAEHN CCOc1c(Br)cc(CN[C@H](CC)[C@H](O)C(F)F)cc1OC ZINC000449428408 566562000 /nfs/dbraw/zinc/56/20/00/566562000.db2.gz YIDGATVTOCMFGJ-YPMHNXCESA-N 0 3 382.245 3.351 10 0 GGAEHN O[C@@H]1C[C@H]([C@H]2CCCOC2)N(CC2=Cc3cc(Br)ccc3OC2)C1 ZINC000449434736 566562038 /nfs/dbraw/zinc/56/20/38/566562038.db2.gz SHVFQELOUORYGK-BMGDILEWSA-N 0 3 394.309 3.087 10 0 GGAEHN O[C@@H]1C[C@@H]([C@@H]2CCCOC2)N(Cc2ccc(Br)c3cccnc23)C1 ZINC000449431190 566562748 /nfs/dbraw/zinc/56/27/48/566562748.db2.gz CYQPZTSXDSIKCJ-RKVPGOIHSA-N 0 3 391.309 3.359 10 0 GGAEHN CN(C)CCn1cc(NC(=O)N[C@@H]2COc3c2ccc(Cl)c3Cl)cn1 ZINC000673871042 566564005 /nfs/dbraw/zinc/56/40/05/566564005.db2.gz JKDPOAJLGHPBFX-CYBMUJFWSA-N 0 3 384.267 3.007 10 0 GGAEHN O=C(N1CCCC1)N1CCC[C@H](NCc2ccc(Br)c(F)c2)C1 ZINC000512855484 566564125 /nfs/dbraw/zinc/56/41/25/566564125.db2.gz IICNUQGGCRPICO-AWEZNQCLSA-N 0 3 384.293 3.358 10 0 GGAEHN CN(C)CCn1cc(NC(=O)N[C@@H]2CCc3c2cccc3Br)cn1 ZINC000673871192 566564309 /nfs/dbraw/zinc/56/43/09/566564309.db2.gz YITIKCDXRGQDQT-MRXNPFEDSA-N 0 3 392.301 3.016 10 0 GGAEHN C[C@H](CNC(=O)N(C)[C@H]1CCN(C2CC2)C1)Oc1cccc(Br)c1 ZINC000466303069 566564521 /nfs/dbraw/zinc/56/45/21/566564521.db2.gz OAIIFEOITNWNAA-CJNGLKHVSA-N 0 3 396.329 3.095 10 0 GGAEHN C[C@@H](CNC(=O)N(C)[C@H]1CCN(C2CC2)C1)Oc1cccc(Br)c1 ZINC000466303068 566564540 /nfs/dbraw/zinc/56/45/40/566564540.db2.gz OAIIFEOITNWNAA-BBRMVZONSA-N 0 3 396.329 3.095 10 0 GGAEHN C[C@H](NCc1ccc(Br)c2cccnc12)C1(S(C)(=O)=O)CC1 ZINC000512879344 566566494 /nfs/dbraw/zinc/56/64/94/566566494.db2.gz CJQMGLVKRNUOQO-NSHDSACASA-N 0 3 383.311 3.053 10 0 GGAEHN Brc1ccc2ncnc(N3CCCN(C[C@@H]4CCCO4)CC3)c2c1 ZINC000673933194 566567095 /nfs/dbraw/zinc/56/70/95/566567095.db2.gz QAHJBZAOQBYJCT-HNNXBMFYSA-N 0 3 391.313 3.083 10 0 GGAEHN Brc1ccc2ncnc(N3CCCN(C[C@H]4CCCO4)CC3)c2c1 ZINC000673933195 566567730 /nfs/dbraw/zinc/56/77/30/566567730.db2.gz QAHJBZAOQBYJCT-OAHLLOKOSA-N 0 3 391.313 3.083 10 0 GGAEHN CS(=O)(=O)N[C@@H]1CCCC[C@@H]1CNCc1csc(-c2ccccc2)n1 ZINC000512904668 566567918 /nfs/dbraw/zinc/56/79/18/566567918.db2.gz ZXPPHKCPKKDGOY-NVXWUHKLSA-N 0 3 379.551 3.008 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cc(Br)c(C)s2)C[C@H]1N1CCCC1 ZINC000424773900 566569605 /nfs/dbraw/zinc/56/96/05/566569605.db2.gz GSMOZNKLKDLCNA-OCCSQVGLSA-N 0 3 389.384 3.471 10 0 GGAEHN C[C@@H]1C[C@@H](NCc2nn(C)cc2Br)CN(Cc2ccccc2)C1 ZINC000449483037 566569951 /nfs/dbraw/zinc/56/99/51/566569951.db2.gz FWEDJJRSWXJKJN-GDBMZVCRSA-N 0 3 377.330 3.183 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)N[C@@H]1CN(C3CC3)C[C@H]1C)CC2 ZINC000539285382 566572280 /nfs/dbraw/zinc/57/22/80/566572280.db2.gz PJHWKYIDYIYIRG-FZKQIMNGSA-N 0 3 392.341 3.308 10 0 GGAEHN CN(C[C@@H]1CCCN(C)C1)C(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000604644245 566572539 /nfs/dbraw/zinc/57/25/39/566572539.db2.gz ADDWLOQKSSQHBX-CZUORRHYSA-N 0 3 396.329 3.256 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@H]1CNCc1ccc(Cl)c(Br)c1 ZINC000512997438 566573087 /nfs/dbraw/zinc/57/30/87/566573087.db2.gz PCJFTUASSOOMLW-LBPRGKRZSA-N 0 3 395.750 3.006 10 0 GGAEHN O=C(NC[C@H]1CCCCN1C1CC1)[C@H]1CCOc2ccc(Br)cc21 ZINC000651897174 566573306 /nfs/dbraw/zinc/57/33/06/566573306.db2.gz QPFXXFUMUACWSY-CVEARBPZSA-N 0 3 393.325 3.448 10 0 GGAEHN Cc1cc([C@H](C)NC[C@@H]2CCCCN2S(C)(=O)=O)sc1Br ZINC000513012643 566574208 /nfs/dbraw/zinc/57/42/08/566574208.db2.gz RJXIDKXQHOBJLQ-RYUDHWBXSA-N 0 3 395.388 3.284 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@@H]1CNCc1ccc(Cl)c(C(F)(F)F)c1 ZINC000513026626 566574551 /nfs/dbraw/zinc/57/45/51/566574551.db2.gz DQNGMWFKDBBAIC-GFCCVEGCSA-N 0 3 384.851 3.263 10 0 GGAEHN COc1cc(Cl)ccc1CN[C@H](C)Cn1cc(Br)ccc1=O ZINC000559894436 566574837 /nfs/dbraw/zinc/57/48/37/566574837.db2.gz QCIHWPCZKLTHSB-LLVKDONJSA-N 0 3 385.689 3.451 10 0 GGAEHN C[C@@H](COc1cccc(F)c1)N[C@@H](C)Cn1cc(Br)ccc1=O ZINC000559892857 566575125 /nfs/dbraw/zinc/57/51/25/566575125.db2.gz ARLQFMXNHDQKDX-STQMWFEESA-N 0 3 383.261 3.196 10 0 GGAEHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)Cc1noc2ccc(Br)cc21 ZINC000424828186 566576882 /nfs/dbraw/zinc/57/68/82/566576882.db2.gz FYVIALRCKNQICS-JSGCOSHPSA-N 0 3 392.297 3.218 10 0 GGAEHN CCOC(=O)c1sc2ccsc2c1CNC(=O)CC1CCN(C)CC1 ZINC000486305897 566577140 /nfs/dbraw/zinc/57/71/40/566577140.db2.gz YBKDPMMMZWJLAG-UHFFFAOYSA-N 0 3 380.535 3.488 10 0 GGAEHN COc1cc(Br)ccc1CN[C@H]1CCO[C@@H](c2ccnn2C)C1 ZINC000449589304 566577239 /nfs/dbraw/zinc/57/72/39/566577239.db2.gz JTCCLFRBSYHCBG-WMLDXEAASA-N 0 3 380.286 3.201 10 0 GGAEHN COc1cc(Br)ccc1[C@H]1CCCN1C(=O)CN1CC[C@H](C)C1 ZINC000628679241 566577460 /nfs/dbraw/zinc/57/74/60/566577460.db2.gz FEQOQWCKOUTVAN-XJKSGUPXSA-N 0 3 381.314 3.463 10 0 GGAEHN CN1CCCC(C)(C)[C@@H]1CNC(=O)Cc1noc2ccc(Br)cc21 ZINC000424849699 566577770 /nfs/dbraw/zinc/57/77/70/566577770.db2.gz ILWZDYCYMDMWQQ-INIZCTEOSA-N 0 3 394.313 3.369 10 0 GGAEHN CCCN(CCN1CCCCC1)C(=O)c1cnc(OC)c(Br)c1 ZINC000424841784 566578492 /nfs/dbraw/zinc/57/84/92/566578492.db2.gz RKJHWCXAYBAGKE-UHFFFAOYSA-N 0 3 384.318 3.191 10 0 GGAEHN CN(C(=O)NCCCc1ccc(Br)cc1F)[C@H]1CCN(C2CC2)C1 ZINC000604824074 566579366 /nfs/dbraw/zinc/57/93/66/566579366.db2.gz NMQHMEOFAYTMIO-INIZCTEOSA-N 0 3 398.320 3.399 10 0 GGAEHN COC(=O)C[C@@](C)(NCCCn1ccnc1C)c1ccc(Br)cc1 ZINC000513133282 566582637 /nfs/dbraw/zinc/58/26/37/566582637.db2.gz GCSVLJGVQZNJCV-GOSISDBHSA-N 0 3 394.313 3.412 10 0 GGAEHN COC(=O)C[C@@](C)(NCCOCC(F)(F)F)c1ccc(Br)cc1 ZINC000513143189 566582741 /nfs/dbraw/zinc/58/27/41/566582741.db2.gz ANDMLYBISIGXFM-CQSZACIVSA-N 0 3 398.219 3.396 10 0 GGAEHN COC(=O)C[C@](C)(NCCn1cc(C)cn1)c1ccc(Br)cc1 ZINC000513139275 566583826 /nfs/dbraw/zinc/58/38/26/566583826.db2.gz OUTTZTKMRQOWNF-KRWDZBQOSA-N 0 3 380.286 3.022 10 0 GGAEHN COC(=O)C[C@@](C)(NC[C@H](O)CC(F)(F)F)c1ccc(Br)cc1 ZINC000513168737 566584638 /nfs/dbraw/zinc/58/46/38/566584638.db2.gz VYKBXCNPUBCEPT-TZMCWYRMSA-N 0 3 398.219 3.130 10 0 GGAEHN COC(=O)C[C@](C)(NC[C@@H](O)CC(F)(F)F)c1ccc(Br)cc1 ZINC000513168735 566584860 /nfs/dbraw/zinc/58/48/60/566584860.db2.gz VYKBXCNPUBCEPT-JSGCOSHPSA-N 0 3 398.219 3.130 10 0 GGAEHN COC1CCN(CCNC(=O)c2cc(Br)cc3ccccc32)CC1 ZINC000674310382 566584937 /nfs/dbraw/zinc/58/49/37/566584937.db2.gz DLZMTUIPKOKMOF-UHFFFAOYSA-N 0 3 391.309 3.443 10 0 GGAEHN COc1ncc(Br)cc1CNC(=O)[C@@H]1CCCCN1C1CCCC1 ZINC000628793466 566585077 /nfs/dbraw/zinc/58/50/77/566585077.db2.gz GZGWIYXZZXVTOY-INIZCTEOSA-N 0 3 396.329 3.266 10 0 GGAEHN COC1CCN(CCNC(=O)N[C@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000674327278 566585317 /nfs/dbraw/zinc/58/53/17/566585317.db2.gz IPSFTTKCSHYDNY-INIZCTEOSA-N 0 3 386.323 3.391 10 0 GGAEHN Cc1cc(C(=O)NC2(CN(C)C)CCC2)nn1-c1ccc(Br)cc1 ZINC000466584991 566587882 /nfs/dbraw/zinc/58/78/82/566587882.db2.gz MRFXTXITSBHJDJ-UHFFFAOYSA-N 0 3 391.313 3.157 10 0 GGAEHN CNC(=O)CC[C@@H]1CCCCN1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000513216243 566590548 /nfs/dbraw/zinc/59/05/48/566590548.db2.gz ZBLOTWHGSGJUPD-KBPBESRZSA-N 0 3 389.323 3.114 10 0 GGAEHN C[C@@H]1OCC[C@@H]1N(CCO)Cc1ccc(OC(F)(F)F)c(Br)c1 ZINC000449683215 566590557 /nfs/dbraw/zinc/59/05/57/566590557.db2.gz YHPXOXCHHZTRMI-GWCFXTLKSA-N 0 3 398.219 3.319 10 0 GGAEHN C[C@@H]1OCC[C@H]1N(CCO)Cc1ccc(OC(F)(F)F)c(Br)c1 ZINC000449683217 566591158 /nfs/dbraw/zinc/59/11/58/566591158.db2.gz YHPXOXCHHZTRMI-GXFFZTMASA-N 0 3 398.219 3.319 10 0 GGAEHN CCCn1cc(CNC[C@@H](CO)Cc2ccc(F)c(Br)c2)cn1 ZINC000449685398 566592821 /nfs/dbraw/zinc/59/28/21/566592821.db2.gz UJGCLOPOLBPFJU-AWEZNQCLSA-N 0 3 384.293 3.136 10 0 GGAEHN CCCN1CCC[C@H]1CNC(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000652140530 566593498 /nfs/dbraw/zinc/59/34/98/566593498.db2.gz SQTDEWFIFPCGIM-LSDHHAIUSA-N 0 3 381.314 3.306 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)c2cc(Br)cnc2OCC2CC2)CCN1C ZINC000513299049 566594346 /nfs/dbraw/zinc/59/43/46/566594346.db2.gz ROVKPLVRKTVCAU-WFASDCNBSA-N 0 3 396.329 3.188 10 0 GGAEHN CNC(=O)[C@H](C)Oc1ccc(Br)cc1CNC[C@@H]1C[C@H]1C1CC1 ZINC000449740471 566597100 /nfs/dbraw/zinc/59/71/00/566597100.db2.gz GLRMEDXVUYILIZ-RBOXIYTFSA-N 0 3 381.314 3.098 10 0 GGAEHN CC1(C)CCC[C@H](CNCc2ccc(S(=O)(=O)N3CCOCC3)s2)C1 ZINC000539713671 566598392 /nfs/dbraw/zinc/59/83/92/566598392.db2.gz FXAAUEQQUSZSJL-HNNXBMFYSA-N 0 3 386.583 3.075 10 0 GGAEHN CO[C@H](C(=O)NC[C@@H]1CCN1C1CCCC1)c1ccccc1Br ZINC000628966456 566598607 /nfs/dbraw/zinc/59/86/07/566598607.db2.gz UVWIVSMOUGGVMB-YOEHRIQHSA-N 0 3 381.314 3.270 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCC1)[C@H]1CCOc2ccc(Br)cc21 ZINC000628966374 566598913 /nfs/dbraw/zinc/59/89/13/566598913.db2.gz QZXCFJMYBHSSJO-HOTGVXAUSA-N 0 3 393.325 3.448 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCC1)c1cnc2ncc(Br)cc2c1 ZINC000628965037 566599330 /nfs/dbraw/zinc/59/93/30/566599330.db2.gz TYAPDWNINGMZIW-INIZCTEOSA-N 0 3 389.297 3.139 10 0 GGAEHN C[C@@H](C(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1)N1CCSCC1 ZINC000628969149 566600046 /nfs/dbraw/zinc/60/00/46/566600046.db2.gz OJTNCJSGYRLUOV-LRDDRELGSA-N 0 3 390.380 3.150 10 0 GGAEHN CN(C[C@H](O)COc1ccc(Cl)cc1Br)C[C@H]1CCCCO1 ZINC000513414430 566600396 /nfs/dbraw/zinc/60/03/96/566600396.db2.gz DKKDGDGQMATNEB-UONOGXRCSA-N 0 3 392.721 3.343 10 0 GGAEHN CN(C[C@@H](O)COc1ccc(Cl)cc1Br)C[C@H]1CCCCO1 ZINC000513414431 566600470 /nfs/dbraw/zinc/60/04/70/566600470.db2.gz DKKDGDGQMATNEB-ZIAGYGMSSA-N 0 3 392.721 3.343 10 0 GGAEHN CN(C)C[C@@H](NC(=O)CN(C)[C@@H]1CCSC1)c1ccc(Cl)c(Cl)c1 ZINC000628969843 566602053 /nfs/dbraw/zinc/60/20/53/566602053.db2.gz ZNEPRKYFVZPFQN-CZUORRHYSA-N 0 3 390.380 3.150 10 0 GGAEHN CCc1ccc(S(=O)(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)s1 ZINC000486602517 566602601 /nfs/dbraw/zinc/60/26/01/566602601.db2.gz YLKVHKVFFPWKDK-WBVHZDCISA-N 0 3 378.563 3.499 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)C1(c2cccc(Br)c2)CCCC1 ZINC000579355589 566602944 /nfs/dbraw/zinc/60/29/44/566602944.db2.gz MFLWPGPCPQCONR-AWEZNQCLSA-N 0 3 387.268 3.374 10 0 GGAEHN CCNC(=O)C[C@H]1CCCCN1CCOc1cc(F)cc(Br)c1 ZINC000560176573 566605808 /nfs/dbraw/zinc/60/58/08/566605808.db2.gz CVYQTDSDLARZDN-OAHLLOKOSA-N 0 3 387.293 3.348 10 0 GGAEHN C[C@@H]1CN(C(=O)[C@H]2CCOc3ccc(Br)cc32)CCN(C2CC2)C1 ZINC000652372755 566607059 /nfs/dbraw/zinc/60/70/59/566607059.db2.gz LAEKXYJNEHVAKA-BBRMVZONSA-N 0 3 393.325 3.258 10 0 GGAEHN CN(C[C@H]1CCCN(C)C1)C(=O)c1cc2c(Br)cccc2cn1 ZINC000449867336 566610412 /nfs/dbraw/zinc/61/04/12/566610412.db2.gz HBZLASHFZVJQLC-ZDUSSCGKSA-N 0 3 376.298 3.411 10 0 GGAEHN COC(=O)c1ccc(CN2CCC[C@H]([C@H]3CCOC3)C2)c(Br)c1 ZINC000560261167 566611352 /nfs/dbraw/zinc/61/13/52/566611352.db2.gz PXLHRQDRYZBOJE-HOCLYGCPSA-N 0 3 382.298 3.484 10 0 GGAEHN CC[C@@H]1C[C@H]1C(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000449894546 566613443 /nfs/dbraw/zinc/61/34/43/566613443.db2.gz IAOCGXZECUTMBK-RDTXWAMCSA-N 0 3 395.341 3.455 10 0 GGAEHN CCCN(C(=O)[C@H]1CCOc2ccc(Br)cc21)[C@@H]1CCN(C)C1 ZINC000652489962 566614829 /nfs/dbraw/zinc/61/48/29/566614829.db2.gz QADYXKNYXFOBER-CABCVRRESA-N 0 3 381.314 3.258 10 0 GGAEHN CN(CCN1CCCCC1)c1nnc(-c2ccccc2Br)n1C ZINC000652553981 566617648 /nfs/dbraw/zinc/61/76/48/566617648.db2.gz ZLOHBPIRCYXZSV-UHFFFAOYSA-N 0 3 378.318 3.167 10 0 GGAEHN C[C@@H](c1ccccc1Br)N1CCC[C@@H](C(=O)N2CCOCC2)C1 ZINC000513683848 566617680 /nfs/dbraw/zinc/61/76/80/566617680.db2.gz NDADAJDBVKQMPW-LSDHHAIUSA-N 0 3 381.314 3.081 10 0 GGAEHN CC(=O)N1C[C@@H]2CCC[C@H](NCc3nc4cc(Br)ccc4[nH]3)[C@H]2C1 ZINC000579577387 566621201 /nfs/dbraw/zinc/62/12/01/566621201.db2.gz VMRIVKKKINXJIR-QEJZJMRPSA-N 0 3 391.313 3.062 10 0 GGAEHN CN(C(=O)Cc1c[nH]c2cccc(Br)c12)[C@H]1CCN(C2CC2)C1 ZINC000513774794 566622269 /nfs/dbraw/zinc/62/22/69/566622269.db2.gz FOSQCPJNFRZOCH-AWEZNQCLSA-N 0 3 376.298 3.168 10 0 GGAEHN CCOc1cc(CNCC[C@@H](O)C(F)(F)F)cc(Br)c1OC ZINC000579647388 566627848 /nfs/dbraw/zinc/62/78/48/566627848.db2.gz LFUXKMRTNTTXOR-GFCCVEGCSA-N 0 3 386.208 3.259 10 0 GGAEHN CC[C@@H](CN1CCCC1)NC(=O)N1CCc2cccc(Br)c2C1 ZINC000675194933 566628094 /nfs/dbraw/zinc/62/80/94/566628094.db2.gz SEOVIAFZFXFEFY-HNNXBMFYSA-N 0 3 380.330 3.391 10 0 GGAEHN CC[C@H](CN1CCCC1)NC(=O)N1CCN(Cc2ccc(Cl)s2)CC1 ZINC000675193587 566628129 /nfs/dbraw/zinc/62/81/29/566628129.db2.gz IVJNGWKIPLLQHU-OAHLLOKOSA-N 0 3 384.977 3.103 10 0 GGAEHN CN(C)CCN1CCN(C(=O)C2(c3ccc(Cl)c(Cl)c3)CCC2)CC1 ZINC000486854553 566630096 /nfs/dbraw/zinc/63/00/96/566630096.db2.gz BJWCFXIMYDQYOH-UHFFFAOYSA-N 0 3 384.351 3.121 10 0 GGAEHN C[C@H](N[C@@H](CO)c1ccc(Br)cc1)c1ccc(-n2cncn2)cc1 ZINC000540140928 566630523 /nfs/dbraw/zinc/63/05/23/566630523.db2.gz AXSIUDGISSZXRM-UGSOOPFHSA-N 0 3 387.281 3.414 10 0 GGAEHN Cc1ccc(CC(=O)N(CCN(C)C)Cc2ccco2)c(Br)c1 ZINC000450083474 566631637 /nfs/dbraw/zinc/63/16/37/566631637.db2.gz ASOSIMCMYLUGOM-UHFFFAOYSA-N 0 3 379.298 3.483 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)c2c(Cl)cc(F)cc2Br)CCSC1 ZINC000450083358 566632163 /nfs/dbraw/zinc/63/21/63/566632163.db2.gz AELBXRGGZWYYSN-CQSZACIVSA-N 0 3 395.725 3.409 10 0 GGAEHN Brc1ccc(CN2CC[C@@H](c3nc[nH]n3)C2)cc1Br ZINC000425351967 566632805 /nfs/dbraw/zinc/63/28/05/566632805.db2.gz HDLCBSXRPSFAGU-SNVBAGLBSA-N 0 3 386.091 3.319 10 0 GGAEHN CS[C@H]1CC[C@@H]1NCc1cccnc1Oc1cccc(S(C)(=O)=O)c1 ZINC000425345696 566633697 /nfs/dbraw/zinc/63/36/97/566633697.db2.gz JVBRRRRCYIPGGE-IRXDYDNUSA-N 0 3 378.519 3.261 10 0 GGAEHN Cn1ncc(Br)c1CNCCc1ccc(F)c(Br)c1 ZINC000486934463 566635937 /nfs/dbraw/zinc/63/59/37/566635937.db2.gz CDCQMHVJZOUEDC-UHFFFAOYSA-N 0 3 391.082 3.417 10 0 GGAEHN CO[C@@H]1CN(C[C@H](O)COc2ccc(Cl)cc2Br)CC[C@@H]1C ZINC000467294105 566638658 /nfs/dbraw/zinc/63/86/58/566638658.db2.gz TXLFGJBUYWGNAJ-DETPVDSQSA-N 0 3 392.721 3.199 10 0 GGAEHN CN1CCC[C@@H](CNC(=O)Nc2nnc(C3CC3)s2)[C@@H]1c1cccs1 ZINC000579784704 566638714 /nfs/dbraw/zinc/63/87/14/566638714.db2.gz PPRKHYZPRALVRY-GXTWGEPZSA-N 0 3 377.539 3.104 10 0 GGAEHN CO[C@@H]1CN(C[C@H](O)COc2ccc(Cl)cc2Br)CC[C@H]1C ZINC000467294107 566638786 /nfs/dbraw/zinc/63/87/86/566638786.db2.gz TXLFGJBUYWGNAJ-PVXIVEMSSA-N 0 3 392.721 3.199 10 0 GGAEHN Cn1cncc1CCN1CCC(C(=O)Nc2ccc(Br)cc2)CC1 ZINC000560578105 566639310 /nfs/dbraw/zinc/63/93/10/566639310.db2.gz YHJRAGSTHLYJAB-UHFFFAOYSA-N 0 3 391.313 3.076 10 0 GGAEHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)c1c(Cl)cc(F)cc1Br ZINC000450151281 566639777 /nfs/dbraw/zinc/63/97/77/566639777.db2.gz GGRNDDWEAUAFDP-SDBXPKJASA-N 0 3 375.669 3.454 10 0 GGAEHN Cc1ccc([C@H](CNCc2c(Br)cnn2C)N2CCCC2)cc1 ZINC000486965248 566639960 /nfs/dbraw/zinc/63/99/60/566639960.db2.gz JUXPVMWONBTAQO-KRWDZBQOSA-N 0 3 377.330 3.418 10 0 GGAEHN Cc1ccc([C@@H](CNCc2c(Br)cnn2C)N2CCCC2)cc1 ZINC000486965250 566640299 /nfs/dbraw/zinc/64/02/99/566640299.db2.gz JUXPVMWONBTAQO-QGZVFWFLSA-N 0 3 377.330 3.418 10 0 GGAEHN CS(=O)(=O)C1(CN[C@H]2CCCc3ncc(C(F)(F)F)cc32)CCCC1 ZINC000560580914 566640885 /nfs/dbraw/zinc/64/08/85/566640885.db2.gz LFZUQZRBYQWHJZ-HNNXBMFYSA-N 0 3 376.444 3.425 10 0 GGAEHN CCN(CC)[C@@H](CNCc1c(Br)cnn1C)Cc1ccccc1 ZINC000486990091 566641682 /nfs/dbraw/zinc/64/16/82/566641682.db2.gz OJSORVAFQHQFAP-MRXNPFEDSA-N 0 3 379.346 3.225 10 0 GGAEHN CCN(CC)[C@@H](CNCc1c(Br)cnn1C)c1cccc(OC)c1 ZINC000486986695 566641881 /nfs/dbraw/zinc/64/18/81/566641881.db2.gz YMXIFSYCOGXNTJ-KRWDZBQOSA-N 0 3 395.345 3.364 10 0 GGAEHN CC[C@H]1C[C@H](CN2CCCN(c3nnc(C(F)(F)F)s3)CC2)CCO1 ZINC000467365365 566642314 /nfs/dbraw/zinc/64/23/14/566642314.db2.gz PLEUVTBIYIKBMD-OLZOCXBDSA-N 0 3 378.464 3.274 10 0 GGAEHN CN(CCN1CCCCC1)C(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000652992876 566643966 /nfs/dbraw/zinc/64/39/66/566643966.db2.gz JOIZXRISZMKPSI-OAHLLOKOSA-N 0 3 381.314 3.260 10 0 GGAEHN CN(CCN1CCCCC1)C(=O)Cc1c(F)ccc(Br)c1F ZINC000652992382 566644249 /nfs/dbraw/zinc/64/42/49/566644249.db2.gz MTFHSWNOZPAYML-UHFFFAOYSA-N 0 3 375.257 3.214 10 0 GGAEHN C[C@H]1CCN(CC(=O)N2CCC[C@H]2c2ccc(I)cc2)C1 ZINC000579851482 566644529 /nfs/dbraw/zinc/64/45/29/566644529.db2.gz PBURIBVEKWVBPS-BBRMVZONSA-N 0 3 398.288 3.297 10 0 GGAEHN CC(C)N(CCN1CCCCCC1)Cc1ccc(S(=O)(=O)N(C)C)s1 ZINC000425459806 566645577 /nfs/dbraw/zinc/64/55/77/566645577.db2.gz PXNNDYCFUZSAIF-UHFFFAOYSA-N 0 3 387.615 3.085 10 0 GGAEHN CN(C)CCN(Cc1cccc(O)c1)C(=O)Cc1sccc1Br ZINC000450216960 566646141 /nfs/dbraw/zinc/64/61/41/566646141.db2.gz RPUKVLQSZRXGBO-UHFFFAOYSA-N 0 3 397.338 3.349 10 0 GGAEHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)CCc2cccc(F)c2Br)C1 ZINC000450234965 566647129 /nfs/dbraw/zinc/64/71/29/566647129.db2.gz TTWJVTKBQBMJDD-GOEBONIOSA-N 0 3 383.305 3.464 10 0 GGAEHN CS[C@H]1CN(C(=O)c2c(C)cccc2Br)C[C@@H]1N1CCCC1 ZINC000487092533 566647379 /nfs/dbraw/zinc/64/73/79/566647379.db2.gz AYFAGOVNDIUNPJ-GJZGRUSLSA-N 0 3 383.355 3.409 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)N[C@@H]1CCN(C3CC3)C1)CC2 ZINC000540378219 566648424 /nfs/dbraw/zinc/64/84/24/566648424.db2.gz JUNDURJEMZSCAU-OAHLLOKOSA-N 0 3 378.314 3.062 10 0 GGAEHN CS[C@@H]1CN(C(=O)Cc2ccc(Br)s2)C[C@H]1N1CCCC1 ZINC000487113618 566648798 /nfs/dbraw/zinc/64/87/98/566648798.db2.gz PFIOOOOFWRFEQD-CHWSQXEVSA-N 0 3 389.384 3.091 10 0 GGAEHN C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ccc(Br)cn2)CC1 ZINC000450246641 566650009 /nfs/dbraw/zinc/65/00/09/566650009.db2.gz VJQRZBOCOCEYCZ-MAUKXSAKSA-N 0 3 390.325 3.131 10 0 GGAEHN CCN1CCN([C@H](C)CNc2ncc(Br)cc2C(F)(F)F)CC1 ZINC000450257215 566650713 /nfs/dbraw/zinc/65/07/13/566650713.db2.gz KIEZCJGTUZJXDW-LLVKDONJSA-N 0 3 395.267 3.301 10 0 GGAEHN CCc1ccc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)s1 ZINC000487126773 566651225 /nfs/dbraw/zinc/65/12/25/566651225.db2.gz BFZVJEPPSXQTFY-QAPCUYQASA-N 0 3 378.563 3.499 10 0 GGAEHN CCN1CC[C@H](NCC2(CS(C)(=O)=O)CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000579932112 566651279 /nfs/dbraw/zinc/65/12/79/566651279.db2.gz PCPNRDMRISZABS-DLBZAZTESA-N 0 3 388.936 3.029 10 0 GGAEHN CCN1CCN([C@@H](C)CNc2ncc(Br)cc2C(F)(F)F)CC1 ZINC000450257217 566651476 /nfs/dbraw/zinc/65/14/76/566651476.db2.gz KIEZCJGTUZJXDW-NSHDSACASA-N 0 3 395.267 3.301 10 0 GGAEHN COC(=O)c1ccc(CN[C@@H](C)Cc2c(C)nn(C)c2C)c(Br)c1 ZINC000579934377 566651919 /nfs/dbraw/zinc/65/19/19/566651919.db2.gz GTEJEZAOKCZWAC-NSHDSACASA-N 0 3 394.313 3.307 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)c1cc(COc2c(Cl)cccc2Cl)on1 ZINC000467525434 566652112 /nfs/dbraw/zinc/65/21/12/566652112.db2.gz LHCIKJLYINJDJD-NSHDSACASA-N 0 3 384.263 3.384 10 0 GGAEHN Cn1ncc(Br)c1CNC[C@]1(Cc2ccc(F)cc2)CCC[C@@H]1O ZINC000487162275 566652691 /nfs/dbraw/zinc/65/26/91/566652691.db2.gz SEURCHBYNNYJPT-ZWKOTPCHSA-N 0 3 396.304 3.185 10 0 GGAEHN Cc1ccc(C2(C(=O)NC[C@@H]3CNCCO3)CCCCC2)c(Br)c1 ZINC000653163080 566653651 /nfs/dbraw/zinc/65/36/51/566653651.db2.gz GCOIJJDSJYIZFS-HNNXBMFYSA-N 0 3 395.341 3.064 10 0 GGAEHN N[C@H]1Cc2ccccc2N(C(=O)[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000653165016 566654250 /nfs/dbraw/zinc/65/42/50/566654250.db2.gz CMMLLSYYFOVKBQ-LSDHHAIUSA-N 0 3 387.277 3.232 10 0 GGAEHN Clc1cc(CN2CC[C@@H](c3nc[nH]n3)C2)ccc1I ZINC000425551668 566654744 /nfs/dbraw/zinc/65/47/44/566654744.db2.gz QPYYEVMOEZXVIT-SNVBAGLBSA-N 0 3 388.640 3.052 10 0 GGAEHN CNS(=O)(=O)CCCN[C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 ZINC000540519026 566656183 /nfs/dbraw/zinc/65/61/83/566656183.db2.gz AMKCYNVOEXZDSV-CQSZACIVSA-N 0 3 384.851 3.339 10 0 GGAEHN CCCN1CCC[C@H]1C(=O)NCc1ccc(I)c(C)c1 ZINC000467637161 566658007 /nfs/dbraw/zinc/65/80/07/566658007.db2.gz BDTINDNRVIQIRV-HNNXBMFYSA-N 0 3 386.277 3.090 10 0 GGAEHN CN(C)C[C@H]1CCc2ccccc2N1C(=O)c1ncsc1Br ZINC000425615638 566659463 /nfs/dbraw/zinc/65/94/63/566659463.db2.gz ZQBSYSJUGGTCQC-GFCCVEGCSA-N 0 3 380.311 3.429 10 0 GGAEHN O=C(c1ncsc1Br)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1 ZINC000425624114 566660236 /nfs/dbraw/zinc/66/02/36/566660236.db2.gz UVMYTLGSCIXYFK-UONOGXRCSA-N 0 3 392.322 3.252 10 0 GGAEHN Brc1cc2c(cc1CNCCc1cnc(C3CC3)nc1)OCO2 ZINC000540619419 566660837 /nfs/dbraw/zinc/66/08/37/566660837.db2.gz CJORIRNBRIWSEK-UHFFFAOYSA-N 0 3 376.254 3.178 10 0 GGAEHN Cn1ncc(Br)c1CNC[C@H]1CCCN(C)[C@H]1c1cccs1 ZINC000487264050 566660972 /nfs/dbraw/zinc/66/09/72/566660972.db2.gz FZWFONJQNMMPFF-MLGOLLRUSA-N 0 3 383.359 3.417 10 0 GGAEHN O=C1N[C@H](c2ccccc2Br)C(=O)N1C[C@H]1CCN1C1CCCC1 ZINC000629488286 566662067 /nfs/dbraw/zinc/66/20/67/566662067.db2.gz YWYZEVYFXCVHNN-CZUORRHYSA-N 0 3 392.297 3.059 10 0 GGAEHN COc1cc(CN2CCNC[C@@](C)(F)C2)cc(Br)c1OC(F)F ZINC000514673243 566662072 /nfs/dbraw/zinc/66/20/72/566662072.db2.gz GYRVEAAFNIJGPS-OAHLLOKOSA-N 0 3 397.235 3.193 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)N1CCC[C@H]2CN(C)C[C@H]21 ZINC000425650167 566662356 /nfs/dbraw/zinc/66/23/56/566662356.db2.gz IZTASYOGZNCRAS-JLJPHGGASA-N 0 3 380.330 3.116 10 0 GGAEHN CC[C@@H](CO)N1CCN(c2ccnc3cc(F)c(Br)cc32)CC1 ZINC000450359115 566662600 /nfs/dbraw/zinc/66/26/00/566662600.db2.gz DYYOWKSFPAQXMN-LBPRGKRZSA-N 0 3 382.277 3.029 10 0 GGAEHN CN(C)C[C@@H](c1ccc(Cl)c(Cl)c1)N1C(=O)N[C@@](C)(CCF)C1=O ZINC000629487221 566662881 /nfs/dbraw/zinc/66/28/81/566662881.db2.gz KEVMJMMOZMQZEJ-BBRMVZONSA-N 0 3 376.259 3.266 10 0 GGAEHN CN(CCCCOc1ccccc1C(F)(F)F)C[C@H]1CCS(=O)(=O)C1 ZINC000607193463 566663554 /nfs/dbraw/zinc/66/35/54/566663554.db2.gz NTWYIOZMSLZPJI-CQSZACIVSA-N 0 3 379.444 3.231 10 0 GGAEHN CCCN(CC(F)(F)F)C(=O)CN1CCNC[C@@H]1c1cccc(Cl)c1 ZINC000629531016 566664858 /nfs/dbraw/zinc/66/48/58/566664858.db2.gz XLQIEGCSWAPEBH-OAHLLOKOSA-N 0 3 377.838 3.087 10 0 GGAEHN CS[C@@H]1CN(c2ncc(Br)cc2C(F)(F)F)C[C@@H]1N(C)C ZINC000450399507 566667445 /nfs/dbraw/zinc/66/74/45/566667445.db2.gz DHTXEYLJGBLVLO-WDEREUQCSA-N 0 3 384.265 3.345 10 0 GGAEHN COc1ccc(Cl)cc1C(C)(C)NC(=O)NC[C@]1(N(C)C)CCSC1 ZINC000425688220 566668623 /nfs/dbraw/zinc/66/86/23/566668623.db2.gz AUCFQACVQITWEO-GOSISDBHSA-N 0 3 385.961 3.320 10 0 GGAEHN O[C@@H](CNC[C@@H]1Cc2ccccc2CO1)COc1ccc(Cl)cc1Cl ZINC000629587588 566669424 /nfs/dbraw/zinc/66/94/24/566669424.db2.gz NWFITYPEYMSTSJ-IRXDYDNUSA-N 0 3 382.287 3.464 10 0 GGAEHN COC1CCN(CCN[C@H]2CCCOc3ccc(Br)cc32)CC1 ZINC000675929490 566670166 /nfs/dbraw/zinc/67/01/66/566670166.db2.gz IGLXYWWVYUBXRS-KRWDZBQOSA-N 0 3 383.330 3.363 10 0 GGAEHN CC(C)C[C@H](N[C@@H](C)c1sccc1Br)C(=O)NCCN(C)C ZINC000540746644 566670611 /nfs/dbraw/zinc/67/06/11/566670611.db2.gz WTLCXROHCACHNM-JSGCOSHPSA-N 0 3 390.391 3.254 10 0 GGAEHN CN(Cc1ccccc1)C[C@H](O)CNCc1ccc(Br)c(F)c1F ZINC000629598178 566671112 /nfs/dbraw/zinc/67/11/12/566671112.db2.gz VGUMMSHGPYRRBY-OAHLLOKOSA-N 0 3 399.279 3.310 10 0 GGAEHN COc1ncc(Br)cc1CNC[C@H](O)Cc1cccc(Cl)c1 ZINC000629592932 566671283 /nfs/dbraw/zinc/67/12/83/566671283.db2.gz HDPVPUMXXWQVPE-OAHLLOKOSA-N 0 3 385.689 3.199 10 0 GGAEHN O[C@@H](CNC[C@H](n1cccn1)C(F)(F)F)COc1ccc(Cl)c(Cl)c1 ZINC000629599092 566671464 /nfs/dbraw/zinc/67/14/64/566671464.db2.gz NBDCTYVDXXEJLB-HZMBPMFUSA-N 0 3 398.212 3.323 10 0 GGAEHN Cc1nc(CSc2ccc(C(=O)N[C@@H]3CNCCC3(F)F)cc2)cs1 ZINC000580193562 566672288 /nfs/dbraw/zinc/67/22/88/566672288.db2.gz IOAZOGJFMYXXDQ-OAHLLOKOSA-N 0 3 383.489 3.471 10 0 GGAEHN CN(CCC(=O)N1CC(Cc2ccccc2Br)C1)c1ccncc1 ZINC000629605287 566672490 /nfs/dbraw/zinc/67/24/90/566672490.db2.gz JJMKWRBCDLSVJO-UHFFFAOYSA-N 0 3 388.309 3.372 10 0 GGAEHN O[C@@H](CNC[C@H](n1cccn1)C(F)(F)F)COc1cc(Cl)ccc1Cl ZINC000629601761 566672994 /nfs/dbraw/zinc/67/29/94/566672994.db2.gz VAEMTLCERWCTMT-FZMZJTMJSA-N 0 3 398.212 3.323 10 0 GGAEHN O=C1CC[C@@H](CN2CCC[C@@H]2c2ccc(I)cc2)CCN1 ZINC000450457337 566673178 /nfs/dbraw/zinc/67/31/78/566673178.db2.gz RPXFAMILTBZUCF-CZUORRHYSA-N 0 3 398.288 3.344 10 0 GGAEHN O=C1CC[C@@H](CN2CCC[C@H]2c2ccc(I)cc2)CCN1 ZINC000450457336 566673425 /nfs/dbraw/zinc/67/34/25/566673425.db2.gz RPXFAMILTBZUCF-CJNGLKHVSA-N 0 3 398.288 3.344 10 0 GGAEHN COc1ccccc1COC[C@@H](O)CNCc1csc(C(F)(F)F)c1 ZINC000629615631 566676003 /nfs/dbraw/zinc/67/60/03/566676003.db2.gz WTSWQOFJPMPXQB-AWEZNQCLSA-N 0 3 375.412 3.443 10 0 GGAEHN O=C(c1ccccc1)N1C[C@@H](CNCc2cc(Cl)cs2)N2CC[C@H]1C2 ZINC000487552990 566679677 /nfs/dbraw/zinc/67/96/77/566679677.db2.gz QRZRVASFSNOBFB-DLBZAZTESA-N 0 3 375.925 3.090 10 0 GGAEHN CCC1(CC)CN(C(=O)[C@H](N)CCC(=O)OC)c2ccc(Br)cc21 ZINC000514936560 566680250 /nfs/dbraw/zinc/68/02/50/566680250.db2.gz UPVCUMOZSDYNHX-CQSZACIVSA-N 0 3 397.313 3.134 10 0 GGAEHN O=C(c1ccccc1)N1C[C@@H](CNCc2sccc2Cl)N2CC[C@H]1C2 ZINC000487557265 566680438 /nfs/dbraw/zinc/68/04/38/566680438.db2.gz YEWANVXROPDFMD-JKSUJKDBSA-N 0 3 375.925 3.090 10 0 GGAEHN CN(CCC(=O)NCCc1cc(Br)ccc1F)c1ccncc1 ZINC000540928849 566681393 /nfs/dbraw/zinc/68/13/93/566681393.db2.gz BMVAFRLGRJZRDE-UHFFFAOYSA-N 0 3 380.261 3.168 10 0 GGAEHN CC(C)N1CCN(c2cccc(NCc3c(Br)cnn3C)c2)CC1 ZINC000487567197 566681531 /nfs/dbraw/zinc/68/15/31/566681531.db2.gz CTJGMYUHQKIHBG-UHFFFAOYSA-N 0 3 392.345 3.325 10 0 GGAEHN CCN(CC)CCN(C(=O)C[C@@H](C)COC)c1ccc(Br)cn1 ZINC000514942145 566681749 /nfs/dbraw/zinc/68/17/49/566681749.db2.gz RZGUWRJTKVUZAO-CQSZACIVSA-N 0 3 386.334 3.192 10 0 GGAEHN CN(Cc1ccccc1)[C@H](CNCc1c(Br)cnn1C)C1CC1 ZINC000487577938 566681835 /nfs/dbraw/zinc/68/18/35/566681835.db2.gz WWVFOFKQNOPMJY-QGZVFWFLSA-N 0 3 377.330 3.183 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1CC[C@@H](CO)[C@H]1C ZINC000425975924 566683853 /nfs/dbraw/zinc/68/38/53/566683853.db2.gz DHXAVRHTSMTKDT-HIFRSBDPSA-N 0 3 378.314 3.454 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1CC[C@H](CO)[C@@H]1C ZINC000425975918 566684909 /nfs/dbraw/zinc/68/49/09/566684909.db2.gz DHXAVRHTSMTKDT-DZGCQCFKSA-N 0 3 378.314 3.454 10 0 GGAEHN CS[C@H]1CN(C(=O)c2ccsc2Br)C[C@@H]1N1CCCC1 ZINC000450576487 566686043 /nfs/dbraw/zinc/68/60/43/566686043.db2.gz CHEYDRPRSHCGKU-RYUDHWBXSA-N 0 3 375.357 3.162 10 0 GGAEHN COc1cc(Br)ccc1CN(C)CC(C)(C)CN1CCOCC1 ZINC000540997489 566686088 /nfs/dbraw/zinc/68/60/88/566686088.db2.gz HAJMXKBOOCMROE-UHFFFAOYSA-N 0 3 385.346 3.248 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N(CCN(C)C)C1CCCC1 ZINC000607907177 566686320 /nfs/dbraw/zinc/68/63/20/566686320.db2.gz SVDKZRSOBSOQGQ-UHFFFAOYSA-N 0 3 383.330 3.333 10 0 GGAEHN CCn1c(CNC(=O)CC2CCN(C)CC2)nc2cc(Br)ccc21 ZINC000487712406 566687288 /nfs/dbraw/zinc/68/72/88/566687288.db2.gz XMNNAPOOWDEUBM-UHFFFAOYSA-N 0 3 393.329 3.167 10 0 GGAEHN OC[C@@H](NCCOCCOc1ccccc1)c1cccc(Br)c1 ZINC000541053185 566691424 /nfs/dbraw/zinc/69/14/24/566691424.db2.gz GSZNDSQSGZXBQV-GOSISDBHSA-N 0 3 380.282 3.168 10 0 GGAEHN CCN(CC)CCN(C(=O)c1ccc(OC)o1)c1ccc(Br)cn1 ZINC000653775133 566692235 /nfs/dbraw/zinc/69/22/35/566692235.db2.gz NJUZWTVUONCZIA-UHFFFAOYSA-N 0 3 396.285 3.434 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@@H]1O[C@H](C)C[C@H]1C)c1ccc(Br)cn1 ZINC000580436475 566692751 /nfs/dbraw/zinc/69/27/51/566692751.db2.gz YKNDXCDWAJHNOR-CKEIUWERSA-N 0 3 398.345 3.332 10 0 GGAEHN CN1CCC[C@@H]1C(=O)N1CCN(c2ccc(C(F)(F)F)cc2Cl)CC1 ZINC000561307900 566694075 /nfs/dbraw/zinc/69/40/75/566694075.db2.gz DHZZLQFBEGYSPK-OAHLLOKOSA-N 0 3 375.822 3.102 10 0 GGAEHN CN1CCC[C@H]1C(=O)N1CCN(c2ccc(C(F)(F)F)cc2Cl)CC1 ZINC000561307899 566694207 /nfs/dbraw/zinc/69/42/07/566694207.db2.gz DHZZLQFBEGYSPK-HNNXBMFYSA-N 0 3 375.822 3.102 10 0 GGAEHN CCN(Cc1c(Br)cnn1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000426147988 566695730 /nfs/dbraw/zinc/69/57/30/566695730.db2.gz GDBKUICCARAUCD-INIZCTEOSA-N 0 3 377.330 3.279 10 0 GGAEHN C[C@@H](Nc1ncc(I)cn1)[C@@H](c1ccccc1)N(C)C ZINC000561324866 566695854 /nfs/dbraw/zinc/69/58/54/566695854.db2.gz LMIVWTCIWUFYKO-RISCZKNCSA-N 0 3 382.249 3.185 10 0 GGAEHN COc1ccc2c(c1)[C@H](NC[C@@H]1CS(=O)(=O)c3ccccc31)CCS2 ZINC000515208064 566697504 /nfs/dbraw/zinc/69/75/04/566697504.db2.gz NGFYPPLXAQZFOS-CXAGYDPISA-N 0 3 375.515 3.393 10 0 GGAEHN COc1ccc2c(c1)[C@@H](NC[C@@H]1CS(=O)(=O)c3ccccc31)CCS2 ZINC000515208065 566697855 /nfs/dbraw/zinc/69/78/55/566697855.db2.gz NGFYPPLXAQZFOS-DYVFJYSZSA-N 0 3 375.515 3.393 10 0 GGAEHN CC[C@@H](NCC(=O)N(C)Cc1ccccc1Br)[C@H]1CCCCO1 ZINC000653881770 566700771 /nfs/dbraw/zinc/70/07/71/566700771.db2.gz QJKZQNIFIRZCIV-IAGOWNOFSA-N 0 3 383.330 3.345 10 0 GGAEHN CC[C@@H](NCC(=O)N(C)Cc1ccccc1Br)[C@@H]1CCCCO1 ZINC000653881772 566701650 /nfs/dbraw/zinc/70/16/50/566701650.db2.gz QJKZQNIFIRZCIV-SJORKVTESA-N 0 3 383.330 3.345 10 0 GGAEHN COC[C@H](C)CNCc1cc(Cl)c(I)cc1OC ZINC000515267905 566702339 /nfs/dbraw/zinc/70/23/39/566702339.db2.gz RDLUJABXHIZAFK-SECBINFHSA-N 0 3 383.657 3.325 10 0 GGAEHN CCn1nc2c(cc1=O)CN(CC/C=C/c1ccc(Br)cc1)CC2 ZINC000608096271 566702359 /nfs/dbraw/zinc/70/23/59/566702359.db2.gz OCGATKQCVCITFX-HWKANZROSA-N 0 3 388.309 3.487 10 0 GGAEHN C[C@@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1cccc(Br)c1 ZINC000541229075 566704515 /nfs/dbraw/zinc/70/45/15/566704515.db2.gz KIVNUBZSFDZXQQ-CZUORRHYSA-N 0 3 391.313 3.024 10 0 GGAEHN CN1CCC[C@H](NC(=O)CCc2nc3cc(Br)ccc3s2)C1 ZINC000608127048 566704879 /nfs/dbraw/zinc/70/48/79/566704879.db2.gz BRMQATGQBSCDCP-LBPRGKRZSA-N 0 3 382.327 3.202 10 0 GGAEHN Cc1cc(S(=O)(=O)NCCN[C@@H]2C[C@H](c3ccccc3)[C@H]2C)c(C)s1 ZINC000541239706 566706135 /nfs/dbraw/zinc/70/61/35/566706135.db2.gz NWFNDTMLFLVFAI-FHLIZLRMSA-N 0 3 378.563 3.425 10 0 GGAEHN C[C@@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Br)cc1 ZINC000541230525 566706437 /nfs/dbraw/zinc/70/64/37/566706437.db2.gz XBJYZRYSBYADAG-CJNGLKHVSA-N 0 3 391.313 3.024 10 0 GGAEHN CCN(CCNC(=O)N[C@@H](C)c1ccc(Br)cc1OC)C1CC1 ZINC000468516501 566706894 /nfs/dbraw/zinc/70/68/94/566706894.db2.gz PGNDPEBMFRBWRH-LBPRGKRZSA-N 0 3 384.318 3.302 10 0 GGAEHN CS(=O)(=O)c1ccc(CNC[C@@H](O)CC2CCCC2)cc1C(F)(F)F ZINC000515415041 566711857 /nfs/dbraw/zinc/71/18/57/566711857.db2.gz NWFCCVZGLTWCEK-AWEZNQCLSA-N 0 3 379.444 3.140 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)NCC1(N(C)C)CCC1 ZINC000468599086 566713132 /nfs/dbraw/zinc/71/31/32/566713132.db2.gz OCTSEJPSBXIGTP-GFCCVEGCSA-N 0 3 384.318 3.302 10 0 GGAEHN CN(C)CCN1CCC(NC(=O)N[C@H]2CCCc3sc(Cl)cc32)CC1 ZINC000488213320 566714733 /nfs/dbraw/zinc/71/47/33/566714733.db2.gz CZPDZNQTAMLAAN-HNNXBMFYSA-N 0 3 384.977 3.104 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000468745911 566725550 /nfs/dbraw/zinc/72/55/50/566725550.db2.gz WNUOSGDGTZRIQT-CHWSQXEVSA-N 0 3 396.329 3.468 10 0 GGAEHN Cc1csc(CCNC(=O)NC[C@H]2CCCN(C)[C@H]2c2cccs2)n1 ZINC000608638882 566726987 /nfs/dbraw/zinc/72/69/87/566726987.db2.gz HLEFUJRQLYRWBC-RHSMWYFYSA-N 0 3 378.567 3.438 10 0 GGAEHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)N[C@@H]1[C@@H]2CCC[C@@H]21 ZINC000426756935 566727434 /nfs/dbraw/zinc/72/74/34/566727434.db2.gz AZNUPMUDKJBDAH-BJWYYQGGSA-N 0 3 380.330 3.321 10 0 GGAEHN O=C(N[C@@H]1CCCN2CCCC[C@@H]12)[C@H]1CCOc2ccc(Br)cc21 ZINC000654314674 566727642 /nfs/dbraw/zinc/72/76/42/566727642.db2.gz OLZMMRZGMXRTBP-UAGQMJEPSA-N 0 3 393.325 3.448 10 0 GGAEHN O=C(Cc1noc2ccc(Br)cc12)N[C@H]1CCCN2CCCC[C@H]12 ZINC000654313609 566727766 /nfs/dbraw/zinc/72/77/66/566727766.db2.gz ATDYAONYIUJHEA-GOEBONIOSA-N 0 3 392.297 3.266 10 0 GGAEHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)[C@@H]1CCOc2ccc(Br)cc21 ZINC000654314672 566728052 /nfs/dbraw/zinc/72/80/52/566728052.db2.gz OLZMMRZGMXRTBP-DJIMGWMZSA-N 0 3 393.325 3.448 10 0 GGAEHN O=C(NCCCc1cccc(Br)c1)N1CC[C@@H](N2CC=CC2)C1 ZINC000608675922 566728275 /nfs/dbraw/zinc/72/82/75/566728275.db2.gz XZCWGYYPFOXWLH-QGZVFWFLSA-N 0 3 378.314 3.037 10 0 GGAEHN C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NCc1ccc(S(C)(=O)=O)s1 ZINC000468786286 566729630 /nfs/dbraw/zinc/72/96/30/566729630.db2.gz BGDAXTMLVKLNQP-YJBOKZPZSA-N 0 3 378.563 3.152 10 0 GGAEHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc[nH]c(=O)c2Br)C1 ZINC000468801023 566731368 /nfs/dbraw/zinc/73/13/68/566731368.db2.gz CMESOLJTJVAQEP-JSGCOSHPSA-N 0 3 390.281 3.115 10 0 GGAEHN CCC1(O)CCN(CCCOc2cccc(I)c2)CC1 ZINC000468803414 566731762 /nfs/dbraw/zinc/73/17/62/566731762.db2.gz BXHCIGXMWRMBIM-UHFFFAOYSA-N 0 3 389.277 3.297 10 0 GGAEHN CCN1CCCC[C@@H]1CNC(=O)NCc1ccc(Br)cc1OC ZINC000488520987 566731900 /nfs/dbraw/zinc/73/19/00/566731900.db2.gz WZZOMBZLVSBXGC-OAHLLOKOSA-N 0 3 384.318 3.131 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N[C@H](C)CN1CCCCC1 ZINC000488546064 566733646 /nfs/dbraw/zinc/73/36/46/566733646.db2.gz QDAKFUZFNDBGFB-CYBMUJFWSA-N 0 3 384.318 3.131 10 0 GGAEHN O=S(=O)(c1ccc(CNCCCC2CCCCC2)s1)N1CCOCC1 ZINC000580919966 566735155 /nfs/dbraw/zinc/73/51/55/566735155.db2.gz OBIDLTWFXCSDAN-UHFFFAOYSA-N 0 3 386.583 3.219 10 0 GGAEHN O=S(=O)(c1ccccc1)N1CC[C@H](NCc2ccc(Br)cc2)C1 ZINC000561750734 566735557 /nfs/dbraw/zinc/73/55/57/566735557.db2.gz RUZKWOIZTAXMLC-INIZCTEOSA-N 0 3 395.322 3.002 10 0 GGAEHN CO[C@H](CCN[C@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1)C(F)(F)F ZINC000468840044 566735722 /nfs/dbraw/zinc/73/57/22/566735722.db2.gz DBZQCVHEWCVIHC-ARFHVFGLSA-N 0 3 380.838 3.269 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@H]1CCOC[C@@H]1C)c1ccc(Br)cn1 ZINC000515852327 566735800 /nfs/dbraw/zinc/73/58/00/566735800.db2.gz XTUHZJITQVYZAT-HOCLYGCPSA-N 0 3 398.345 3.192 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@@H]1CCOC[C@H]1C)c1ccc(Br)cn1 ZINC000515852325 566735859 /nfs/dbraw/zinc/73/58/59/566735859.db2.gz XTUHZJITQVYZAT-GDBMZVCRSA-N 0 3 398.345 3.192 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@H]1CCOC[C@H]1C)c1ccc(Br)cn1 ZINC000515852328 566736308 /nfs/dbraw/zinc/73/63/08/566736308.db2.gz XTUHZJITQVYZAT-ZBFHGGJFSA-N 0 3 398.345 3.192 10 0 GGAEHN CN(C(=O)N[C@@H]1CSc2ccc(Br)cc21)[C@@H]1CCN(C2CC2)C1 ZINC000426857234 566736449 /nfs/dbraw/zinc/73/64/49/566736449.db2.gz GQJHFVVCKIQJKZ-UKRRQHHQSA-N 0 3 396.354 3.474 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CCCC[C@@H]2CN(C)C)c1 ZINC000608783892 566736559 /nfs/dbraw/zinc/73/65/59/566736559.db2.gz WIELNVGAOIVGBO-CYBMUJFWSA-N 0 3 386.277 3.156 10 0 GGAEHN O[C@H](CNCc1cnn(CC(F)(F)F)c1)COc1c(Cl)cccc1Cl ZINC000580947784 566737474 /nfs/dbraw/zinc/73/74/74/566737474.db2.gz NJBCTYIOKRRKEA-LLVKDONJSA-N 0 3 398.212 3.282 10 0 GGAEHN C[S@](=O)C[C@@H](NCCCc1nc(-c2cccs2)no1)c1ccccc1 ZINC000541608342 566737814 /nfs/dbraw/zinc/73/78/14/566737814.db2.gz PEFDRWDKRVVSIU-BZQUYTCOSA-N 0 3 375.519 3.440 10 0 GGAEHN CC(C)(C)[C@@H]1CCN(C[C@H](O)COc2c(Cl)cccc2Cl)C[C@@H]1O ZINC000541618369 566738207 /nfs/dbraw/zinc/73/82/07/566738207.db2.gz MQOAQACFCBAGBI-ZENOOKHLSA-N 0 3 376.324 3.462 10 0 GGAEHN C[S@](=O)C[C@H](NCCCc1nc(-c2cccs2)no1)c1ccccc1 ZINC000541608343 566738355 /nfs/dbraw/zinc/73/83/55/566738355.db2.gz PEFDRWDKRVVSIU-MQNRADLISA-N 0 3 375.519 3.440 10 0 GGAEHN C[C@H](NCCCOc1cccc(I)c1)c1cnn(C)c1 ZINC000541644521 566740257 /nfs/dbraw/zinc/74/02/57/566740257.db2.gz RADBEJZNSFLSHK-LBPRGKRZSA-N 0 3 385.249 3.144 10 0 GGAEHN C[C@H](C(=O)Nc1ccc(=O)n(CCN(C)C)c1)c1c(Cl)cccc1Cl ZINC000677327124 566740948 /nfs/dbraw/zinc/74/09/48/566740948.db2.gz ACXSDQBVAGJMBI-LBPRGKRZSA-N 0 3 382.291 3.459 10 0 GGAEHN O=C(CSCc1cc(-c2cccs2)on1)N1CC[C@H](N2CCCC2)C1 ZINC000608906082 566742226 /nfs/dbraw/zinc/74/22/26/566742226.db2.gz PBLAKTCZIUDRHG-HNNXBMFYSA-N 0 3 377.535 3.333 10 0 GGAEHN C[C@H](NC[C@@H](O)COc1c(Cl)cccc1Cl)C(=O)N1CCCC[C@H]1C ZINC000516050059 566743871 /nfs/dbraw/zinc/74/38/71/566743871.db2.gz KOUNNFYNTGGZRS-HZSPNIEDSA-N 0 3 389.323 3.112 10 0 GGAEHN C[C@H]1CCN(CC(=O)N2CCc3[nH]c4c(cccc4Br)c3C2)C1 ZINC000654592242 566744450 /nfs/dbraw/zinc/74/44/50/566744450.db2.gz KATKHLRLHBDABE-LBPRGKRZSA-N 0 3 376.298 3.157 10 0 GGAEHN Cc1cc(Cl)ccc1S(=O)(=O)NCCN[C@H](c1cccnc1)C(C)C ZINC000581062487 566747711 /nfs/dbraw/zinc/74/77/11/566747711.db2.gz GUSPAPSOEDPWKK-SFHVURJKSA-N 0 3 381.929 3.309 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)CSCc1ccc(Cl)cc1Cl ZINC000609045730 566747834 /nfs/dbraw/zinc/74/78/34/566747834.db2.gz QEQRKQZDJLUTFK-HNNXBMFYSA-N 0 3 391.364 3.454 10 0 GGAEHN Cc1ccc(C(=O)N2CCC[C@@H]2CN2CCCC2)cc1I ZINC000609072010 566748835 /nfs/dbraw/zinc/74/88/35/566748835.db2.gz BODHDPXCRGTQTN-OAHLLOKOSA-N 0 3 398.288 3.300 10 0 GGAEHN O=C(Cc1cccc(Br)c1)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000427142963 566749655 /nfs/dbraw/zinc/74/96/55/566749655.db2.gz LDABRQUPXURCIA-SFHVURJKSA-N 0 3 395.341 3.095 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1ccc(Br)cc1SC ZINC000654724740 566751744 /nfs/dbraw/zinc/75/17/44/566751744.db2.gz KDWBFTUXKIBPOL-ZDUSSCGKSA-N 0 3 387.343 3.012 10 0 GGAEHN CS[C@H]1CN(C(=O)COc2cc(Cl)ccc2Cl)C[C@H]1N1CCCC1 ZINC000541843635 566754088 /nfs/dbraw/zinc/75/40/88/566754088.db2.gz GUBWZYGHOWQMQU-ZBFHGGJFSA-N 0 3 389.348 3.410 10 0 GGAEHN Cc1cc(CNCCNS(=O)(=O)c2ccc(Cl)cc2C)cc(C)c1O ZINC000561974506 566754281 /nfs/dbraw/zinc/75/42/81/566754281.db2.gz CXSDHHWZEFJDHN-UHFFFAOYSA-N 0 3 382.913 3.039 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000469047263 566756203 /nfs/dbraw/zinc/75/62/03/566756203.db2.gz RENISFGLGJQLQB-DOMZBBRYSA-N 0 3 396.329 3.397 10 0 GGAEHN CC(C)N(CCn1nc2ccccn2c1=O)Cc1cccc(Br)c1 ZINC000516307493 566756857 /nfs/dbraw/zinc/75/68/57/566756857.db2.gz OUAOFEDRSKXJFL-UHFFFAOYSA-N 0 3 389.297 3.169 10 0 GGAEHN CN(C)CCOc1cccc(NC(=O)c2c(F)cncc2Br)c1 ZINC000630866045 566757533 /nfs/dbraw/zinc/75/75/33/566757533.db2.gz JEAMXGISOTXZKJ-UHFFFAOYSA-N 0 3 382.233 3.176 10 0 GGAEHN C[C@H](N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1)C(=O)NCc1cccs1 ZINC000562049518 566760880 /nfs/dbraw/zinc/76/08/80/566760880.db2.gz URWABGXYPGMRGM-MORSLUCNSA-N 0 3 377.941 3.441 10 0 GGAEHN CCN1CCC(N(C)C(=O)[C@H]2[C@@H]3c4ccc(Br)cc4C[C@H]23)CC1 ZINC000630896069 566761635 /nfs/dbraw/zinc/76/16/35/566761635.db2.gz ADFXTGXMDWIINO-RCCFBDPRSA-N 0 3 377.326 3.278 10 0 GGAEHN O[C@@H](COc1ccc(Cl)cc1Br)CN1CC[C@@H](C(F)F)C1 ZINC000677732237 566761701 /nfs/dbraw/zinc/76/17/01/566761701.db2.gz MRQGXGSSIBQQLW-MWLCHTKSSA-N 0 3 384.648 3.429 10 0 GGAEHN Cc1[nH]c(=O)c(Br)cc1C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000581266686 566762310 /nfs/dbraw/zinc/76/23/10/566762310.db2.gz GKMWNJGVEUKHRA-HZPDHXFCSA-N 0 3 390.281 3.033 10 0 GGAEHN CCNC(=O)C[C@@H]1CCCCN1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000581265798 566762781 /nfs/dbraw/zinc/76/27/81/566762781.db2.gz LAOUFKKXPWNUOD-KBPBESRZSA-N 0 3 389.323 3.114 10 0 GGAEHN COCCCN1CCC(NC(=O)c2oc3ccccc3c2Br)CC1 ZINC000630898692 566763031 /nfs/dbraw/zinc/76/30/31/566763031.db2.gz ZBARYXGQLIAXQK-UHFFFAOYSA-N 0 3 395.297 3.426 10 0 GGAEHN CC(C)N1CCCN(C(=O)[C@@H]2[C@@H]3Cc4cc(Br)ccc4[C@@H]32)CC1 ZINC000630913844 566763201 /nfs/dbraw/zinc/76/32/01/566763201.db2.gz YQQULLQDEGOJOQ-FGTMMUONSA-N 0 3 377.326 3.278 10 0 GGAEHN CN(CCSc1ccnc2cc(Cl)ccc21)[C@H]1CCN2CCO[C@H]1C2 ZINC000451142196 566766058 /nfs/dbraw/zinc/76/60/58/566766058.db2.gz WAGWYZUUGFINFZ-ROUUACIJSA-N 0 3 377.941 3.385 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@H]1CCN(C)[C@@H](C)C1 ZINC000469189260 566769003 /nfs/dbraw/zinc/76/90/03/566769003.db2.gz ZQNVNRARPZVDGN-OBJOEFQTSA-N 0 3 384.318 3.301 10 0 GGAEHN CC(C)(CNCc1cn(C[C@H]2CCOC2)nn1)c1ccc(Br)cc1 ZINC000631043464 566773579 /nfs/dbraw/zinc/77/35/79/566773579.db2.gz XIQJOTCAXAXXQO-CQSZACIVSA-N 0 3 393.329 3.145 10 0 GGAEHN C[C@H](CCc1ccc(Br)cc1)NCc1cn(C[C@@H]2CCOC2)nn1 ZINC000631049557 566773636 /nfs/dbraw/zinc/77/36/36/566773636.db2.gz JKGMOSTUJWWZCZ-ZBFHGGJFSA-N 0 3 393.329 3.188 10 0 GGAEHN CC(C)n1ncnc1CNCC1(c2ccc(Br)cc2)CCOCC1 ZINC000631058301 566773702 /nfs/dbraw/zinc/77/37/02/566773702.db2.gz ABCBPZDVRPDEDU-UHFFFAOYSA-N 0 3 393.329 3.460 10 0 GGAEHN CCN(Cc1ccc(CN(C)C)cc1)C(=O)c1cc[nH]c(=O)c1Br ZINC000469239483 566774625 /nfs/dbraw/zinc/77/46/25/566774625.db2.gz UCGPNWHERGBGOT-UHFFFAOYSA-N 0 3 392.297 3.274 10 0 GGAEHN Cc1cc(C(=O)N[C@H]2CNCCC2(F)F)nn1-c1ccc(Cl)c(Cl)c1 ZINC000516650357 566775368 /nfs/dbraw/zinc/77/53/68/566775368.db2.gz TXGIBSOYRDZMIR-AWEZNQCLSA-N 0 3 389.233 3.215 10 0 GGAEHN CC(C)(CNCc1cn(C[C@H]2CCOC2)nn1)c1cccc(Br)c1 ZINC000631060362 566775627 /nfs/dbraw/zinc/77/56/27/566775627.db2.gz XGWJPMAQLZGAHP-CQSZACIVSA-N 0 3 393.329 3.145 10 0 GGAEHN COc1cccc(N2CC[C@H](CNCc3ccncc3Br)C2)c1 ZINC000631061065 566776084 /nfs/dbraw/zinc/77/60/84/566776084.db2.gz GLOVFTCNMGCWCS-CQSZACIVSA-N 0 3 376.298 3.469 10 0 GGAEHN C[C@@H](NCCOc1c(Cl)cccc1Cl)c1cccc(S(N)(=O)=O)c1 ZINC000542134645 566776526 /nfs/dbraw/zinc/77/65/26/566776526.db2.gz OKJLYMOAOSAJEQ-LLVKDONJSA-N 0 3 389.304 3.370 10 0 GGAEHN CN(C)Cc1ccc(C(N)=O)cc1NCc1ncc(Br)cc1Cl ZINC000631097140 566777660 /nfs/dbraw/zinc/77/76/60/566777660.db2.gz QKXXRIKTHUZSNK-UHFFFAOYSA-N 0 3 397.704 3.270 10 0 GGAEHN Clc1cc(Br)cnc1CN[C@H]1CCOC2(CCOCC2)C1 ZINC000631093148 566777785 /nfs/dbraw/zinc/77/77/85/566777785.db2.gz IMHFNXMYVCVZAP-LBPRGKRZSA-N 0 3 375.694 3.315 10 0 GGAEHN O=C(c1ccccc1)N1C[C@@H](CNCc2cscc2Cl)N2CC[C@H]1C2 ZINC000678057946 566779448 /nfs/dbraw/zinc/77/94/48/566779448.db2.gz FASSCLYWORBTDT-DLBZAZTESA-N 0 3 375.925 3.090 10 0 GGAEHN CN1CCN(CCC(C)(C)NCc2ncc(Br)cc2Cl)CC1 ZINC000631114745 566779405 /nfs/dbraw/zinc/77/94/05/566779405.db2.gz XXANXWFVWUXFQZ-UHFFFAOYSA-N 0 3 389.769 3.003 10 0 GGAEHN O=C(c1ccccc1)N1C[C@H](CNCc2cscc2Cl)N2CC[C@H]1C2 ZINC000678057947 566779956 /nfs/dbraw/zinc/77/99/56/566779956.db2.gz FASSCLYWORBTDT-IRXDYDNUSA-N 0 3 375.925 3.090 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1cccc(Br)c1Cl ZINC000516744983 566780598 /nfs/dbraw/zinc/78/05/98/566780598.db2.gz MOSQLZILTHXREN-NSHDSACASA-N 0 3 390.709 3.335 10 0 GGAEHN COCCc1ncc(CNC2CC(N3CCC(C(F)(F)F)CC3)C2)s1 ZINC000631123797 566782520 /nfs/dbraw/zinc/78/25/20/566782520.db2.gz ABQCDDLSIPPEID-UHFFFAOYSA-N 0 3 377.476 3.227 10 0 GGAEHN CC[C@@H]1[C@@H](CO)CCN1Cc1ccnc(-c2ccc(Br)cc2)n1 ZINC000451247837 566782761 /nfs/dbraw/zinc/78/27/61/566782761.db2.gz AJPKGJRRTYHODB-RHSMWYFYSA-N 0 3 376.298 3.499 10 0 GGAEHN CN1CCC[C@H](CNc2c(F)cccc2S(N)(=O)=O)[C@H]1c1cccs1 ZINC000631128466 566784040 /nfs/dbraw/zinc/78/40/40/566784040.db2.gz MSTSBIISFGDVEY-PXAZEXFGSA-N 0 3 383.514 3.030 10 0 GGAEHN Cc1c(Br)csc1C(=O)N(CCN(C)C)Cc1ccccn1 ZINC000631130712 566784161 /nfs/dbraw/zinc/78/41/61/566784161.db2.gz NOUIGHGDGCDXKE-UHFFFAOYSA-N 0 3 382.327 3.418 10 0 GGAEHN Cn1ccnc1[C@@H]1C[C@H](NCc2ncc(Br)cc2Cl)CCO1 ZINC000631154139 566785407 /nfs/dbraw/zinc/78/54/07/566785407.db2.gz FHZVCQDEUAYZHL-RISCZKNCSA-N 0 3 385.693 3.241 10 0 GGAEHN CC[C@H](CN1CCCC1)NC(=O)c1cc(C)ccc1I ZINC000609833651 566787949 /nfs/dbraw/zinc/78/79/49/566787949.db2.gz RDSUADJSGIUUAM-CYBMUJFWSA-N 0 3 386.277 3.204 10 0 GGAEHN COCCCn1nccc1CN[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000631195185 566788797 /nfs/dbraw/zinc/78/87/97/566788797.db2.gz ZPHPZQQGJDZPOH-BPQIPLTHSA-N 0 3 376.298 3.110 10 0 GGAEHN Cc1nn(C)c2ncc(CN[C@@H]3[C@@H]4Cc5c(cccc5Br)[C@@H]43)cc12 ZINC000631190925 566789754 /nfs/dbraw/zinc/78/97/54/566789754.db2.gz FBUJMEOQHGFYIJ-BPQIPLTHSA-N 0 3 383.293 3.467 10 0 GGAEHN C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(Br)c2c1OCCC2 ZINC000469437812 566790718 /nfs/dbraw/zinc/79/07/18/566790718.db2.gz CQUVLUVRIRUTIZ-OLZOCXBDSA-N 0 3 379.298 3.083 10 0 GGAEHN O[C@@H]1C[C@H]([C@@H]2CCCOC2)N(Cc2cc(Br)cc3cccnc32)C1 ZINC000451295091 566790904 /nfs/dbraw/zinc/79/09/04/566790904.db2.gz CWBURJFIOGMQKN-ZTFGCOKTSA-N 0 3 391.309 3.359 10 0 GGAEHN COc1c(CNCCc2c[nH]c3ccc(Br)cc23)c(C)nn1C ZINC000542313966 566793629 /nfs/dbraw/zinc/79/36/29/566793629.db2.gz CBQKEDIVHJULEX-UHFFFAOYSA-N 0 3 377.286 3.313 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)N1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000581657171 566796209 /nfs/dbraw/zinc/79/62/09/566796209.db2.gz JEPPARNQRDCUMU-KBPBESRZSA-N 0 3 394.249 3.074 10 0 GGAEHN CCN1CCC(N(C)S(=O)(=O)Cc2cccc(Br)c2C)CC1 ZINC000655469940 566801676 /nfs/dbraw/zinc/80/16/76/566801676.db2.gz DVEOENOSJBDGAI-UHFFFAOYSA-N 0 3 389.359 3.003 10 0 GGAEHN CC(C)N1C[C@H](C)[C@H](NC(=O)c2ccc(Br)c3c2OCCC3)C1 ZINC000469599944 566802383 /nfs/dbraw/zinc/80/23/83/566802383.db2.gz BPNSDEFMYLNMPF-BLLLJJGKSA-N 0 3 381.314 3.233 10 0 GGAEHN CO[C@H](C(=O)N1CCc2ccccc2[C@H]1CN)c1ccccc1Br ZINC000655483760 566802950 /nfs/dbraw/zinc/80/29/50/566802950.db2.gz LLKOFJDKIWYVJD-MSOLQXFVSA-N 0 3 389.293 3.221 10 0 GGAEHN O=S1(=O)CCCN1CCCN[C@@H]1CCCc2c(Cl)sc(Cl)c21 ZINC000678580078 566805650 /nfs/dbraw/zinc/80/56/50/566805650.db2.gz BFBMCVUZXUVIJJ-LLVKDONJSA-N 0 3 383.366 3.448 10 0 GGAEHN Cc1cc(C(=O)N[C@H](CN)C(F)(F)F)nn1-c1ccc(Cl)cc1Cl ZINC000655515039 566805944 /nfs/dbraw/zinc/80/59/44/566805944.db2.gz KCQDROZBGLBCOH-GFCCVEGCSA-N 0 3 381.185 3.107 10 0 GGAEHN NC[C@H](C(=O)N1CCOc2cccc(Br)c2C1)c1ccc(F)cc1 ZINC000655504046 566805968 /nfs/dbraw/zinc/80/59/68/566805968.db2.gz KWFGJXLBQDGJDV-AWEZNQCLSA-N 0 3 393.256 3.052 10 0 GGAEHN O=C(c1nc2cc(Cl)ccc2s1)N1CCC(N2CCCOCC2)CC1 ZINC000631491866 566806097 /nfs/dbraw/zinc/80/60/97/566806097.db2.gz GOGTWYFYBCBFBJ-UHFFFAOYSA-N 0 3 379.913 3.277 10 0 GGAEHN O=C(Nc1ccc(Br)cc1)N1CCC(N2CCCOCC2)CC1 ZINC000631494558 566806302 /nfs/dbraw/zinc/80/63/02/566806302.db2.gz PJJIFCUKDUEDFX-UHFFFAOYSA-N 0 3 382.302 3.168 10 0 GGAEHN Cc1cc(C(=O)N[C@@H](CN)C(F)(F)F)nn1-c1ccc(Cl)c(Cl)c1 ZINC000655515999 566806493 /nfs/dbraw/zinc/80/64/93/566806493.db2.gz TXXKCLDHXCQNIY-LBPRGKRZSA-N 0 3 381.185 3.107 10 0 GGAEHN NC[C@H](NC(=O)CCc1nc2cc(C(F)(F)F)ccc2s1)C(F)(F)F ZINC000655511836 566806740 /nfs/dbraw/zinc/80/67/40/566806740.db2.gz MHKHLHYIZMIHSL-JTQLQIEISA-N 0 3 385.333 3.254 10 0 GGAEHN CN1CCC(n2cc(Nc3ncnc4cc(Br)sc43)cn2)CC1 ZINC000631475633 566806932 /nfs/dbraw/zinc/80/69/32/566806932.db2.gz MLPMBAFPMJTOHL-UHFFFAOYSA-N 0 3 393.314 3.083 10 0 GGAEHN NC[C@H](NC(=O)CCCSc1ccc(Br)cc1)C(F)(F)F ZINC000655511768 566807179 /nfs/dbraw/zinc/80/71/79/566807179.db2.gz KXOQWNBNHSVYDJ-NSHDSACASA-N 0 3 385.249 3.327 10 0 GGAEHN Cc1cccc(C[C@@H](CO)NC[C@H](O)COc2c(Cl)cccc2Cl)c1 ZINC000581824241 566807447 /nfs/dbraw/zinc/80/74/47/566807447.db2.gz CRCYEWLYFIKLTD-HOTGVXAUSA-N 0 3 384.303 3.235 10 0 GGAEHN N[C@@H](CC(F)F)C(=O)N1CCN(c2cc(Cl)c(Cl)c(Cl)c2)CC1 ZINC000655525303 566808431 /nfs/dbraw/zinc/80/84/31/566808431.db2.gz MVIFWAGLPLCURJ-NSHDSACASA-N 0 3 386.657 3.278 10 0 GGAEHN CC[C@@H](CN(C)CCCS(=O)(=O)NC)Oc1ccc(Cl)c(Cl)c1 ZINC000469748152 566810648 /nfs/dbraw/zinc/81/06/48/566810648.db2.gz HXPZPAUULIJOCD-LBPRGKRZSA-N 0 3 383.341 3.022 10 0 GGAEHN CS(=O)(=O)[C@@H]1CCCC[C@@H]1N[C@@H]1[C@H]2Cc3c(cccc3Br)[C@@H]12 ZINC000631659939 566812950 /nfs/dbraw/zinc/81/29/50/566812950.db2.gz GHZDUJUBXLATQX-WSOGKROESA-N 0 3 384.339 3.033 10 0 GGAEHN CN(C)[C@]1(CNC(=O)c2oc3ccccc3c2Br)CCSC1 ZINC000631617716 566813127 /nfs/dbraw/zinc/81/31/27/566813127.db2.gz VXIUKZLZCOJIMZ-INIZCTEOSA-N 0 3 383.311 3.362 10 0 GGAEHN Brc1cccc(C2CC([NH2+]Cc3nnc(C4CCOCC4)[n-]3)C2)c1 ZINC000631693629 566816595 /nfs/dbraw/zinc/81/65/95/566816595.db2.gz LZVMXEUHDMVNQV-UHFFFAOYSA-N 0 3 391.313 3.497 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)NCc1cc(Br)ccc1F ZINC000581942183 566816717 /nfs/dbraw/zinc/81/67/17/566816717.db2.gz BEMSBFVTDOWCPM-QGZVFWFLSA-N 0 3 392.272 3.356 10 0 GGAEHN C[C@H](Cc1ccc(Br)c(F)c1)NCc1nnc(C2CCOCC2)[nH]1 ZINC000631695717 566818067 /nfs/dbraw/zinc/81/80/67/566818067.db2.gz IMKQLNXYZMKDMP-LLVKDONJSA-N 0 3 397.292 3.321 10 0 GGAEHN C[C@H](Cc1ccc(Br)c(F)c1)[NH2+]Cc1nnc(C2CCOCC2)[n-]1 ZINC000631695717 566818074 /nfs/dbraw/zinc/81/80/74/566818074.db2.gz IMKQLNXYZMKDMP-LLVKDONJSA-N 0 3 397.292 3.321 10 0 GGAEHN Brc1ccc2c(c1)CC[C@@H]([NH2+]Cc1nnc(C3CCOCC3)[n-]1)C2 ZINC000631696039 566818624 /nfs/dbraw/zinc/81/86/24/566818624.db2.gz MCYYWKJYIUCSJV-MRXNPFEDSA-N 0 3 391.313 3.108 10 0 GGAEHN Brc1ccc2c(c1)CC[C@@H](NCc1nnc(C3CCOCC3)[nH]1)C2 ZINC000631696039 566818628 /nfs/dbraw/zinc/81/86/28/566818628.db2.gz MCYYWKJYIUCSJV-MRXNPFEDSA-N 0 3 391.313 3.108 10 0 GGAEHN O=S1(=O)CC[C@@H](N[C@@H]2CCOC3(CCSCC3)C2)c2cc(F)ccc21 ZINC000678807258 566818772 /nfs/dbraw/zinc/81/87/72/566818772.db2.gz FPMLUCUIJXNMDG-GDBMZVCRSA-N 0 3 385.526 3.079 10 0 GGAEHN Cc1c(Br)cccc1CS(=O)(=O)N(C)[C@@H]1CCN(C(C)C)C1 ZINC000655606744 566821402 /nfs/dbraw/zinc/82/14/02/566821402.db2.gz VBDBFUHTECEUIR-OAHLLOKOSA-N 0 3 389.359 3.002 10 0 GGAEHN COCCC[C@@H](NC1CN(c2ccncn2)C1)c1ccc(Br)cc1 ZINC000631746475 566822558 /nfs/dbraw/zinc/82/25/58/566822558.db2.gz KHPOKGPOMGGKGA-QGZVFWFLSA-N 0 3 391.313 3.185 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@@H](CCCO)c1ccccc1 ZINC000428215997 566825161 /nfs/dbraw/zinc/82/51/61/566825161.db2.gz BBNJXIUULNMLGD-YOEHRIQHSA-N 0 3 379.298 3.103 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cccc(Br)c2C)C[C@H]1N1CCCC1 ZINC000542772669 566825628 /nfs/dbraw/zinc/82/56/28/566825628.db2.gz AGVLZSCACAHPPJ-HZPDHXFCSA-N 0 3 383.355 3.409 10 0 GGAEHN COCc1cc(CN[C@@H](C)Cn2cc(Br)ccc2=O)ccc1F ZINC000428214786 566825800 /nfs/dbraw/zinc/82/58/00/566825800.db2.gz FYEYTDBDAOZZIO-LBPRGKRZSA-N 0 3 383.261 3.075 10 0 GGAEHN C[C@H](CNC(=O)N[C@H](CO)c1cccc(Br)c1)N1CCCC[C@H]1C ZINC000490031759 566825984 /nfs/dbraw/zinc/82/59/84/566825984.db2.gz PHBZWYIFGZZLFI-CKEIUWERSA-N 0 3 398.345 3.045 10 0 GGAEHN COc1ccc(Cl)cc1CN[C@H](C)Cn1cc(Br)ccc1=O ZINC000428223868 566825980 /nfs/dbraw/zinc/82/59/80/566825980.db2.gz KUSNPUPACXNITK-LLVKDONJSA-N 0 3 385.689 3.451 10 0 GGAEHN C[C@H](CNC(=O)N[C@@H](CO)c1cccc(Br)c1)N1CCCC[C@H]1C ZINC000490031761 566826234 /nfs/dbraw/zinc/82/62/34/566826234.db2.gz PHBZWYIFGZZLFI-CPUCHLNUSA-N 0 3 398.345 3.045 10 0 GGAEHN C[C@@H](CNC(=O)N[C@H](CO)c1cccc(Br)c1)N1CCCC[C@H]1C ZINC000490031762 566826314 /nfs/dbraw/zinc/82/63/14/566826314.db2.gz PHBZWYIFGZZLFI-JKIFEVAISA-N 0 3 398.345 3.045 10 0 GGAEHN O=C(c1c(F)cccc1Br)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000469914842 566826419 /nfs/dbraw/zinc/82/64/19/566826419.db2.gz FBFUDFOAALEDOY-CQSZACIVSA-N 0 3 399.304 3.305 10 0 GGAEHN O=C(Cc1ccccc1Br)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000469932225 566827942 /nfs/dbraw/zinc/82/79/42/566827942.db2.gz FWOINOWGRLRIOR-KRWDZBQOSA-N 0 3 395.341 3.095 10 0 GGAEHN C[C@@H](CC(=O)Nc1ccc(Br)cc1)N[C@@H]1CCCn2nccc21 ZINC000631809312 566828272 /nfs/dbraw/zinc/82/82/72/566828272.db2.gz NLPSLWARSBEUJP-SWLSCSKDSA-N 0 3 377.286 3.487 10 0 GGAEHN C[C@@H](CC(=O)Nc1cccc(Br)c1)N[C@H]1CCCn2nccc21 ZINC000631809535 566828414 /nfs/dbraw/zinc/82/84/14/566828414.db2.gz QHAFHCCMRFYLBB-WFASDCNBSA-N 0 3 377.286 3.487 10 0 GGAEHN C[C@@H](CC(=O)Nc1ccc(Br)cc1)N[C@H]1CCCn2nccc21 ZINC000631809313 566828684 /nfs/dbraw/zinc/82/86/84/566828684.db2.gz NLPSLWARSBEUJP-WFASDCNBSA-N 0 3 377.286 3.487 10 0 GGAEHN Cc1c(Br)cccc1C(=O)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000469933166 566828970 /nfs/dbraw/zinc/82/89/70/566828970.db2.gz BEHQISNNGZCYPW-INIZCTEOSA-N 0 3 395.341 3.475 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)[C@@H]1CCCN1C1CCCC1 ZINC000428268583 566829225 /nfs/dbraw/zinc/82/92/25/566829225.db2.gz FFRFHJFDQNLQQK-INIZCTEOSA-N 0 3 381.314 3.481 10 0 GGAEHN Cc1cc(Br)oc1C(=O)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000469933656 566829512 /nfs/dbraw/zinc/82/95/12/566829512.db2.gz CYRNSQSZFLHTCJ-CQSZACIVSA-N 0 3 385.302 3.068 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)NC1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000542841988 566830418 /nfs/dbraw/zinc/83/04/18/566830418.db2.gz PIYWYEYNJSFABE-AWEZNQCLSA-N 0 3 386.323 3.393 10 0 GGAEHN O=C(c1ccc(Br)s1)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000469950207 566830786 /nfs/dbraw/zinc/83/07/86/566830786.db2.gz JPDOLFZTOKRDGU-CYBMUJFWSA-N 0 3 387.343 3.228 10 0 GGAEHN CN1CCCN(C(=O)NCc2ccc(Br)cc2C(F)(F)F)CC1 ZINC000490226328 566836621 /nfs/dbraw/zinc/83/66/21/566836621.db2.gz ZGYZWJSDLRYISO-UHFFFAOYSA-N 0 3 394.235 3.315 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CC[C@@]2(CCN(C)C2)C1 ZINC000490223493 566837263 /nfs/dbraw/zinc/83/72/63/566837263.db2.gz OJNQNQBSAJNUQY-FZKQIMNGSA-N 0 3 396.329 3.256 10 0 GGAEHN CN(CCC(=O)N1CCC[C@@H]1c1ccc(Br)cn1)c1ccncc1 ZINC000562968904 566838672 /nfs/dbraw/zinc/83/86/72/566838672.db2.gz SPBKWOCUHYWVAH-QGZVFWFLSA-N 0 3 389.297 3.429 10 0 GGAEHN COC(=O)CC1(NCc2ccc(Br)c(Br)c2)CC1 ZINC000582186007 566839429 /nfs/dbraw/zinc/83/94/29/566839429.db2.gz JLNKHYWSEJBPBA-UHFFFAOYSA-N 0 3 377.076 3.397 10 0 GGAEHN CC(C)(C)OC(=O)[C@H]1CCN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000610538599 566840096 /nfs/dbraw/zinc/84/00/96/566840096.db2.gz GGGXSQKMVITKJZ-STQMWFEESA-N 0 3 390.307 3.397 10 0 GGAEHN C[C@@H]1CN(CCCNC(=O)CCOc2cccc(Cl)c2Cl)CCCO1 ZINC000470065218 566842887 /nfs/dbraw/zinc/84/28/87/566842887.db2.gz IIRIYJXLBGZUBT-CQSZACIVSA-N 0 3 389.323 3.379 10 0 GGAEHN C[C@H]1CN(CCCNC(=O)C2(c3ccccc3Br)CC2)CCCO1 ZINC000470078005 566843849 /nfs/dbraw/zinc/84/38/49/566843849.db2.gz CVAAXKVEDPKWSB-HNNXBMFYSA-N 0 3 395.341 3.098 10 0 GGAEHN COc1cccc2c1CC[C@H]2N[C@H](C)Cn1cc(Br)ccc1=O ZINC000428450809 566844675 /nfs/dbraw/zinc/84/46/75/566844675.db2.gz YPATWTXYGQGERH-MLGOLLRUSA-N 0 3 377.282 3.285 10 0 GGAEHN Brc1cccc2c1OCC[C@@H]2NC1CCN([C@@H]2CCOC2)CC1 ZINC000655763542 566846067 /nfs/dbraw/zinc/84/60/67/566846067.db2.gz PRSILKIXACWSJJ-PBHICJAKSA-N 0 3 381.314 3.116 10 0 GGAEHN COC(=O)[C@@H]1CCCC[C@@H]1NCc1nc2ccc(Br)cc2n1C ZINC000451593210 566846453 /nfs/dbraw/zinc/84/64/53/566846453.db2.gz SFEHVILRHPRKBS-OLZOCXBDSA-N 0 3 380.286 3.157 10 0 GGAEHN COCC[C@@H](COC)NCc1cn(-c2cccc(Br)c2)nc1C ZINC000655777415 566847811 /nfs/dbraw/zinc/84/78/11/566847811.db2.gz UNAFMPAADCCCIY-INIZCTEOSA-N 0 3 382.302 3.084 10 0 GGAEHN CC[C@H](NCc1cn(-c2cccc(Br)c2)nc1C)[C@H](O)C(F)F ZINC000655778200 566847971 /nfs/dbraw/zinc/84/79/71/566847971.db2.gz FAYBAWOTLUJDMP-GJZGRUSLSA-N 0 3 388.256 3.437 10 0 GGAEHN CC[C@@H](NCc1cn(-c2cccc(Br)c2)nc1C)[C@H](O)C(F)F ZINC000655778199 566848151 /nfs/dbraw/zinc/84/81/51/566848151.db2.gz FAYBAWOTLUJDMP-CABCVRRESA-N 0 3 388.256 3.437 10 0 GGAEHN COc1ccc(Br)cc1C1(NC2CCN([C@H]3CCOC3)CC2)CC1 ZINC000655779676 566849404 /nfs/dbraw/zinc/84/94/04/566849404.db2.gz QIEONGDETIFFAI-INIZCTEOSA-N 0 3 395.341 3.290 10 0 GGAEHN C[C@@H](NC(=O)N1CCN(CCC(C)(C)C)CC1)c1ncc(Br)cn1 ZINC000563056887 566849527 /nfs/dbraw/zinc/84/95/27/566849527.db2.gz GHNDCJWDYJDZQA-CYBMUJFWSA-N 0 3 398.349 3.064 10 0 GGAEHN COc1ccc(Br)cc1C1(NC2CCN([C@@H]3CCOC3)CC2)CC1 ZINC000655779677 566849880 /nfs/dbraw/zinc/84/98/80/566849880.db2.gz QIEONGDETIFFAI-MRXNPFEDSA-N 0 3 395.341 3.290 10 0 GGAEHN Cc1ccc(C[C@@H](CO)CNCc2cc3n(n2)CCCC3)cc1Br ZINC000655779490 566850014 /nfs/dbraw/zinc/85/00/14/566850014.db2.gz MIRVQPHAWCAFGB-MRXNPFEDSA-N 0 3 392.341 3.231 10 0 GGAEHN OCC[C@]1(CN[C@H](c2ccc(Br)cc2)[C@H]2CCCO2)CCOC1 ZINC000679349024 566851448 /nfs/dbraw/zinc/85/14/48/566851448.db2.gz JAWWAAMGKYJWIF-KZNAEPCWSA-N 0 3 384.314 3.048 10 0 GGAEHN CCNC(=O)N1CC[C@H](N[C@H](c2ccc(Br)cc2)[C@H]2CCCO2)C1 ZINC000679353516 566851479 /nfs/dbraw/zinc/85/14/79/566851479.db2.gz DUCCEASSZIDLSS-GVDBMIGSSA-N 0 3 396.329 3.063 10 0 GGAEHN CCNC(=O)N1CC[C@H](N[C@H](c2ccc(Br)cc2)[C@@H]2CCCO2)C1 ZINC000679353522 566851830 /nfs/dbraw/zinc/85/18/30/566851830.db2.gz DUCCEASSZIDLSS-YESZJQIVSA-N 0 3 396.329 3.063 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)NCc1ccc(F)cc1Br ZINC000563093818 566853893 /nfs/dbraw/zinc/85/38/93/566853893.db2.gz VZBDKAOGALVFBU-KRWDZBQOSA-N 0 3 392.272 3.356 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)NCc1ccc(F)cc1Br ZINC000563093819 566853959 /nfs/dbraw/zinc/85/39/59/566853959.db2.gz VZBDKAOGALVFBU-QGZVFWFLSA-N 0 3 392.272 3.356 10 0 GGAEHN CS(=O)(=O)c1ccc(CNCc2cc(-n3ccnc3)cs2)cc1Cl ZINC000428536781 566854595 /nfs/dbraw/zinc/85/45/95/566854595.db2.gz MEEZAYQVUPSQSD-UHFFFAOYSA-N 0 3 381.910 3.281 10 0 GGAEHN CN(CCC(=O)NCCCc1cccc(Br)c1)c1ccncc1 ZINC000679409210 566855064 /nfs/dbraw/zinc/85/50/64/566855064.db2.gz MPAKRHPHJRBMBN-UHFFFAOYSA-N 0 3 376.298 3.419 10 0 GGAEHN COc1cc(Br)c(CN2CCc3ccccc3[C@H]2CN)cc1O ZINC000563135540 566858560 /nfs/dbraw/zinc/85/85/60/566858560.db2.gz PPEMQQKQBXCHPQ-MRXNPFEDSA-N 0 3 377.282 3.221 10 0 GGAEHN NC[C@H](NC(=O)NCCc1csc(-c2ccc(Cl)cc2)n1)C(F)(F)F ZINC000655923351 566858651 /nfs/dbraw/zinc/85/86/51/566858651.db2.gz WKTGSOUEVMQVOI-LBPRGKRZSA-N 0 3 392.834 3.195 10 0 GGAEHN NC[C@@H](NC(=O)N(Cc1cc(Br)ccc1F)C1CC1)C(F)(F)F ZINC000655915524 566858796 /nfs/dbraw/zinc/85/87/96/566858796.db2.gz OEMWJAABSKJNJH-GFCCVEGCSA-N 0 3 398.198 3.152 10 0 GGAEHN NC[C@@H](NC(=O)NCc1cc(Cl)cc(Cl)c1OC(F)F)C(F)(F)F ZINC000655918838 566858841 /nfs/dbraw/zinc/85/88/41/566858841.db2.gz DWLXQIURXOTONC-MRVPVSSYSA-N 0 3 396.143 3.284 10 0 GGAEHN NC[C@H](NC(=O)NCCOc1c(Cl)cc(Cl)cc1Cl)C(F)(F)F ZINC000655922176 566858863 /nfs/dbraw/zinc/85/88/63/566858863.db2.gz QQGFGSRGKNDSON-VIFPVBQESA-N 0 3 394.608 3.214 10 0 GGAEHN NC[C@@H](NC(=O)N1CCC[C@H](COc2ccccc2Cl)C1)C(F)(F)F ZINC000655919447 566858924 /nfs/dbraw/zinc/85/89/24/566858924.db2.gz CORXNFLSAUHPJO-SMDDNHRTSA-N 0 3 379.810 3.030 10 0 GGAEHN NC[C@H](NC(=O)N1CCC[C@@H]1c1ccc(Br)cc1)C(F)(F)F ZINC000655910949 566858953 /nfs/dbraw/zinc/85/89/53/566858953.db2.gz FPWUSTPMTCLONA-NEPJUHHUSA-N 0 3 380.208 3.185 10 0 GGAEHN Cc1nc(-c2cc3c(s2)CCN(C(=O)N[C@@H](CN)C(F)(F)F)C3)cs1 ZINC000655919489 566859109 /nfs/dbraw/zinc/85/91/09/566859109.db2.gz BPANSYODEPTSBT-ZDUSSCGKSA-N 0 3 390.456 3.137 10 0 GGAEHN NC[C@@H](NC(=O)N1CCC[C@H]1c1ccc(Br)cc1)C(F)(F)F ZINC000655910956 566859190 /nfs/dbraw/zinc/85/91/90/566859190.db2.gz FPWUSTPMTCLONA-NWDGAFQWSA-N 0 3 380.208 3.185 10 0 GGAEHN Cc1cc([C@H]2CCCN2C(=O)N[C@@H](CN)C(F)(F)F)ccc1Br ZINC000655928482 566860585 /nfs/dbraw/zinc/86/05/85/566860585.db2.gz MVRAKNBNDDZFBH-OLZOCXBDSA-N 0 3 394.235 3.494 10 0 GGAEHN NC[C@H](NC(=O)NC1(c2ccccc2Br)CCC1)C(F)(F)F ZINC000655932105 566860675 /nfs/dbraw/zinc/86/06/75/566860675.db2.gz SGKMDLAZWZMFMB-NSHDSACASA-N 0 3 380.208 3.017 10 0 GGAEHN NC[C@@H](NC(=O)NCc1cnc(-c2ccc(Cl)cc2)s1)C(F)(F)F ZINC000655925755 566860687 /nfs/dbraw/zinc/86/06/87/566860687.db2.gz ASNCAYYYDVPHMK-LLVKDONJSA-N 0 3 378.807 3.152 10 0 GGAEHN NC[C@@H](NC(=O)N1CCC[C@H]1c1ccc(Br)c(F)c1)C(F)(F)F ZINC000655928542 566860698 /nfs/dbraw/zinc/86/06/98/566860698.db2.gz OILZLYDQPVIUAR-NWDGAFQWSA-N 0 3 398.198 3.324 10 0 GGAEHN Cc1cc([C@H]2CCCN2C(=O)N[C@H](CN)C(F)(F)F)ccc1Br ZINC000655928280 566860967 /nfs/dbraw/zinc/86/09/67/566860967.db2.gz MVRAKNBNDDZFBH-CHWSQXEVSA-N 0 3 394.235 3.494 10 0 GGAEHN NC[C@H](NC(=O)N1CCC[C@@H]1c1ccc(Br)s1)C(F)(F)F ZINC000655925280 566861170 /nfs/dbraw/zinc/86/11/70/566861170.db2.gz ZPDXCRGPGVIJKT-APPZFPTMSA-N 0 3 386.237 3.247 10 0 GGAEHN NC[C@H](NC(=O)N(Cc1cccc(Br)c1)CC1CC1)C(F)(F)F ZINC000655929930 566861406 /nfs/dbraw/zinc/86/14/06/566861406.db2.gz XUXJPYHBTYOZSQ-ZDUSSCGKSA-N 0 3 394.235 3.260 10 0 GGAEHN NC[C@@H](NC(=O)N1CCC(c2cccc(Br)c2)CC1)C(F)(F)F ZINC000655925900 566861489 /nfs/dbraw/zinc/86/14/89/566861489.db2.gz ACZVQEARXMYUSN-CYBMUJFWSA-N 0 3 394.235 3.228 10 0 GGAEHN N[C@@H](CNC(=O)N1CCOc2cccc(Br)c2C1)c1ccccc1 ZINC000655962903 566863115 /nfs/dbraw/zinc/86/31/15/566863115.db2.gz HWKFMISUIDGPRZ-INIZCTEOSA-N 0 3 390.281 3.053 10 0 GGAEHN COC(=O)[C@H](c1cc(Cl)cc(Cl)c1)N1CCN(c2ccncc2)CC1 ZINC000610787568 566864154 /nfs/dbraw/zinc/86/41/54/566864154.db2.gz XNIYADPQGTZIIC-KRWDZBQOSA-N 0 3 380.275 3.425 10 0 GGAEHN Cc1ccc(C(=O)N2CC[C@@H](N3CCCCC3)C2)cc1I ZINC000518080627 566864911 /nfs/dbraw/zinc/86/49/11/566864911.db2.gz HKLMJQCJURJAMH-OAHLLOKOSA-N 0 3 398.288 3.300 10 0 GGAEHN CN1CCC[C@H](N[C@H]2CCCOc3ccc(I)cc32)C1 ZINC000610804149 566865578 /nfs/dbraw/zinc/86/55/78/566865578.db2.gz BGADAFGGPXHOEV-ZFWWWQNUSA-N 0 3 386.277 3.189 10 0 GGAEHN COC[C@@H](CN[C@H](Cc1ccccn1)c1ccc(Br)cc1)OC ZINC000679722618 566869714 /nfs/dbraw/zinc/86/97/14/566869714.db2.gz GZSGATBYHPNLJL-QZTJIDSGSA-N 0 3 379.298 3.379 10 0 GGAEHN C[C@]12CCN(C[C@H](O)COc3cc(F)cc(Br)c3)C[C@H]1C2(F)F ZINC000428728155 566873658 /nfs/dbraw/zinc/87/36/58/566873658.db2.gz RATBFHKEDMQMAI-CFVMTHIKSA-N 0 3 394.231 3.305 10 0 GGAEHN C[C@H]1CN(CCOc2c(Cl)cccc2Cl)CC[C@@H]1N1CCN(C)CC1 ZINC000490652080 566873677 /nfs/dbraw/zinc/87/36/77/566873677.db2.gz QICQTFNTNUJCPO-YJBOKZPZSA-N 0 3 386.367 3.330 10 0 GGAEHN CCNC(=O)CN(CC)CCCC(=O)Nc1c(C)cc(Br)cc1C ZINC000679816115 566874886 /nfs/dbraw/zinc/87/48/86/566874886.db2.gz CIZXRXFPHNSFGU-UHFFFAOYSA-N 0 3 398.345 3.243 10 0 GGAEHN CCCN(CCCC(=O)Nc1c(C)cc(Br)cc1C)CC(=O)NC ZINC000679816371 566875366 /nfs/dbraw/zinc/87/53/66/566875366.db2.gz ULTDYATWXBOWGC-UHFFFAOYSA-N 0 3 398.345 3.243 10 0 GGAEHN Cc1c(Br)cccc1CNC[C@@H](O)COc1ccc2c(c1)OCO2 ZINC000656153883 566875854 /nfs/dbraw/zinc/87/58/54/566875854.db2.gz DVWUFCGXSLKVDP-CQSZACIVSA-N 0 3 394.265 3.016 10 0 GGAEHN C[C@@H]1COCCN1C1CCN(Cc2nc3cc(Br)ccc3[nH]2)CC1 ZINC000563362546 566877860 /nfs/dbraw/zinc/87/78/60/566877860.db2.gz BOPCXSOOZVZHGH-CYBMUJFWSA-N 0 3 393.329 3.011 10 0 GGAEHN C[C@@H]1COCCN1C1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000563362546 566877869 /nfs/dbraw/zinc/87/78/69/566877869.db2.gz BOPCXSOOZVZHGH-CYBMUJFWSA-N 0 3 393.329 3.011 10 0 GGAEHN C[C@H](NC(=O)[C@@H]1[C@@H]2Cc3cc(Br)ccc3[C@@H]21)C1=CCN(C)CC1 ZINC000632367444 566879360 /nfs/dbraw/zinc/87/93/60/566879360.db2.gz NMTWNQZQDXHQKQ-HQKIHSOMSA-N 0 3 375.310 3.101 10 0 GGAEHN C[C@H]1COCCCN1CCCOc1cccc(I)c1 ZINC000610991002 566879578 /nfs/dbraw/zinc/87/95/78/566879578.db2.gz XPOHVZUCRNHYNO-ZDUSSCGKSA-N 0 3 375.250 3.171 10 0 GGAEHN C[C@H](NC(=O)[C@H]1[C@@H]2c3ccc(Br)cc3C[C@H]12)C1=CCN(C)CC1 ZINC000632367446 566879589 /nfs/dbraw/zinc/87/95/89/566879589.db2.gz NMTWNQZQDXHQKQ-ZUHTVMMCSA-N 0 3 375.310 3.101 10 0 GGAEHN Cc1ccnc([C@@H]2CCN(C[C@H](O)COc3ccc(Br)cc3)C2)c1 ZINC000563365921 566880532 /nfs/dbraw/zinc/88/05/32/566880532.db2.gz FMPFARQUZHDUPX-WBVHZDCISA-N 0 3 391.309 3.382 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)NC[C@H]1CCCCS1(=O)=O ZINC000543427320 566880948 /nfs/dbraw/zinc/88/09/48/566880948.db2.gz YGCBSRDRNWXMGE-BXUZGUMPSA-N 0 3 378.307 3.076 10 0 GGAEHN Cc1cc(Br)cc(C)c1S(=O)(=O)N(C)CC1CCN(C)CC1 ZINC000518425058 566882303 /nfs/dbraw/zinc/88/23/03/566882303.db2.gz YIBIWQFWTZDPPE-UHFFFAOYSA-N 0 3 389.359 3.028 10 0 GGAEHN Cc1ccc(OCCC(=O)N(C)[C@@H]2CN3CCC2CC3)c(Br)c1 ZINC000518432642 566882953 /nfs/dbraw/zinc/88/29/53/566882953.db2.gz WZGKKBHERRGTFN-MRXNPFEDSA-N 0 3 381.314 3.079 10 0 GGAEHN COc1cc(C[NH2+][C@H]2COc3cc(F)ccc3C2)cc(Br)c1[O-] ZINC000563442180 566883556 /nfs/dbraw/zinc/88/35/56/566883556.db2.gz GSIBKNAQYGOEJS-CYBMUJFWSA-N 0 3 382.229 3.396 10 0 GGAEHN O=C1[C@H](N[C@@H]2CCCc3c(Br)cccc32)CCN1C1CCOCC1 ZINC000679991595 566884881 /nfs/dbraw/zinc/88/48/81/566884881.db2.gz AXSKJUUZMGPNAE-QZTJIDSGSA-N 0 3 393.325 3.196 10 0 GGAEHN O[C@@H]1C[C@H]2CN(c3cc(C4CC4)nc4c(Br)cccc34)CCN2C1 ZINC000656219526 566886853 /nfs/dbraw/zinc/88/68/53/566886853.db2.gz ZHMKMKGEYUDBFS-UONOGXRCSA-N 0 3 388.309 3.130 10 0 GGAEHN CN1CCN(CC2(C)CCN(Cc3cccc(Br)c3)CC2)CC1 ZINC000543524520 566888108 /nfs/dbraw/zinc/88/81/08/566888108.db2.gz VMFGLZBBMSYYLR-UHFFFAOYSA-N 0 3 380.374 3.299 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1CCCC[C@H]1CC(N)=O ZINC000656251076 566889592 /nfs/dbraw/zinc/88/95/92/566889592.db2.gz GEGQRSDBNYSQHF-INIZCTEOSA-N 0 3 391.313 3.173 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1C[C@@H](C(N)=O)CC[C@@H]1C ZINC000656250618 566890058 /nfs/dbraw/zinc/89/00/58/566890058.db2.gz WLJMKJQBFBIXFN-JSGCOSHPSA-N 0 3 391.313 3.029 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)NCc1cc(Br)cs1 ZINC000518529769 566890442 /nfs/dbraw/zinc/89/04/42/566890442.db2.gz VPDNWVJVZAGYLC-HNNXBMFYSA-N 0 3 380.311 3.278 10 0 GGAEHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1c(F)cncc1Br ZINC000632482645 566890510 /nfs/dbraw/zinc/89/05/10/566890510.db2.gz HLMSKHRNBIIIAY-BLLLJJGKSA-N 0 3 392.272 3.234 10 0 GGAEHN C[C@@H](NC(=O)c1c(F)cncc1Br)[C@H](c1ccccc1)N(C)C ZINC000632517328 566891691 /nfs/dbraw/zinc/89/16/91/566891691.db2.gz IDWRIAFNMKPTPP-BDJLRTHQSA-N 0 3 380.261 3.404 10 0 GGAEHN CN1CCN(CC2(C)CCN(C(=O)c3cc4sccc4s3)CC2)CC1 ZINC000543609963 566893267 /nfs/dbraw/zinc/89/32/67/566893267.db2.gz RPGSQBNTAFDVNA-UHFFFAOYSA-N 0 3 377.579 3.453 10 0 GGAEHN COc1cc(S(=O)(=O)N[C@H](C)[C@@H]2CCCN(C3CCC3)C2)ccc1Cl ZINC000563539932 566893513 /nfs/dbraw/zinc/89/35/13/566893513.db2.gz DWNLYWMQUKIKBI-ZIAGYGMSSA-N 0 3 386.945 3.280 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CNCC[C@@H](O)C(F)(F)F ZINC000656261192 566894636 /nfs/dbraw/zinc/89/46/36/566894636.db2.gz FBTJENGAKACKPI-CQSZACIVSA-N 0 3 392.219 3.346 10 0 GGAEHN C[C@@H]1CN(CCC(=O)Nc2cccc(Cl)c2)CCN(CC(F)(F)F)C1 ZINC000451870046 566898523 /nfs/dbraw/zinc/89/85/23/566898523.db2.gz HMEZCAWTODGNKO-CYBMUJFWSA-N 0 3 377.838 3.485 10 0 GGAEHN CS[C@H]1CN(C(=O)CCc2ccc(Br)cc2)C[C@@H]1N1CCCC1 ZINC000543700306 566903379 /nfs/dbraw/zinc/90/33/79/566903379.db2.gz APALASPXKYORIP-IRXDYDNUSA-N 0 3 397.382 3.420 10 0 GGAEHN COc1cc(NC(=O)N(CCN(C)C)Cc2ccco2)ncc1Br ZINC000680368066 566903769 /nfs/dbraw/zinc/90/37/69/566903769.db2.gz GKIOGGSNWOQJBC-UHFFFAOYSA-N 0 3 397.273 3.041 10 0 GGAEHN COc1cc(NC(=O)NC[C@@H](C)N2CCC(C)CC2)ncc1Br ZINC000680369026 566903924 /nfs/dbraw/zinc/90/39/24/566903924.db2.gz YFIHTYZTLJLFPI-GFCCVEGCSA-N 0 3 385.306 3.095 10 0 GGAEHN COc1ccc(S[C@H](C)C(=O)N2C[C@@H](SC)[C@@H](N3CCCC3)C2)cc1 ZINC000543701161 566904073 /nfs/dbraw/zinc/90/40/73/566904073.db2.gz AKXJCGRMFTXUOF-FHLIZLRMSA-N 0 3 380.579 3.214 10 0 GGAEHN COc1ccc2c(c1)[C@@H](N[C@H](C)Cn1cc(Br)ccc1=O)CCO2 ZINC000563670409 566905968 /nfs/dbraw/zinc/90/59/68/566905968.db2.gz IOPNUSDWELBNHO-WBMJQRKESA-N 0 3 393.281 3.121 10 0 GGAEHN CN(CCC(=O)Nc1ccc(F)cc1I)c1ccncc1 ZINC000543712950 566906066 /nfs/dbraw/zinc/90/60/66/566906066.db2.gz WXXQJFDSAYPJQZ-UHFFFAOYSA-N 0 3 399.207 3.290 10 0 GGAEHN O[C@H]([C@H]1CCN(CCc2nc(-c3cccc(Cl)c3)no2)C1)C(F)(F)F ZINC000451915571 566906686 /nfs/dbraw/zinc/90/66/86/566906686.db2.gz VRCPXQRXMJKKTG-SMDDNHRTSA-N 0 3 375.778 3.178 10 0 GGAEHN O[C@@H]([C@@H]1CCN(CCc2nc(-c3ccc(Cl)cc3)no2)C1)C(F)(F)F ZINC000451919239 566908399 /nfs/dbraw/zinc/90/83/99/566908399.db2.gz ZGDVSCQGFSINIC-RISCZKNCSA-N 0 3 375.778 3.178 10 0 GGAEHN Cc1ccccc1CCNC(=O)C(C)S(=O)(=O)Cc1ccsc1Cl ZINC000656533182 566912128 /nfs/dbraw/zinc/91/21/28/566912128.db2.gz QDNKEEZWFCYJND-CYBMUJFWSA-N 0 3 385.938 3.372 10 0 GGAEHN CC(C(=O)NCc1ccccc1F)S(=O)(=O)Cc1ccsc1Cl ZINC000656534016 566913944 /nfs/dbraw/zinc/91/39/44/566913944.db2.gz IUNZDIAFUFNQFI-JTQLQIEISA-N 0 3 375.874 3.160 10 0 GGAEHN CC[C@@H](CN1CCCC1)NC(=O)Nc1ccc(Br)c(C(=O)OC)c1 ZINC000611391357 566915005 /nfs/dbraw/zinc/91/50/05/566915005.db2.gz HCZPACNDZBPEAB-LBPRGKRZSA-N 0 3 398.301 3.232 10 0 GGAEHN Cc1ccc(OC[C@H](O)CN[C@@H](CO)c2cccc(Br)c2)c(C)c1 ZINC000543835952 566915336 /nfs/dbraw/zinc/91/53/36/566915336.db2.gz DGVJCSQXUFIQCS-MSOLQXFVSA-N 0 3 394.309 3.129 10 0 GGAEHN N[C@H]1CCCc2cn(Cc3cc4c(cc3Br)OCCCO4)nc21 ZINC000583019389 566915359 /nfs/dbraw/zinc/91/53/59/566915359.db2.gz ACSXUOQHUDLKRC-AWEZNQCLSA-N 0 3 378.270 3.191 10 0 GGAEHN C[C@@H]1[C@H](C(F)(F)F)CCN1C[C@@H](O)COc1ccc(Br)cc1 ZINC000470948894 566916084 /nfs/dbraw/zinc/91/60/84/566916084.db2.gz MIIPZBXMJMJYFN-MPKXVKKWSA-N 0 3 382.220 3.462 10 0 GGAEHN COc1cc(Br)ccc1CCC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000543858695 566917755 /nfs/dbraw/zinc/91/77/55/566917755.db2.gz ROMPBGVMNSRVJZ-XJKSGUPXSA-N 0 3 383.330 3.331 10 0 GGAEHN COCc1cc(Cl)cc(S(=O)(=O)N2CCCC[C@@H](N3CCCC3)C2)c1 ZINC000583113181 566921257 /nfs/dbraw/zinc/92/12/57/566921257.db2.gz ZVTAKOVECNMHKO-QGZVFWFLSA-N 0 3 386.945 3.125 10 0 GGAEHN CN1CCC[C@H](N2CCN(c3nnc(-c4ccccc4Cl)s3)CC2)C1 ZINC000680622678 566923876 /nfs/dbraw/zinc/92/38/76/566923876.db2.gz QTLFDXWESHMGJV-AWEZNQCLSA-N 0 3 377.945 3.075 10 0 GGAEHN O=C(NCCNc1ccncc1)Nc1cc(F)c(Br)c(Cl)c1 ZINC000492140794 566924181 /nfs/dbraw/zinc/92/41/81/566924181.db2.gz HIBALIWIBKQGKC-UHFFFAOYSA-N 0 3 387.640 3.292 10 0 GGAEHN COCc1c(Br)cccc1NC(=O)CCN(C)c1ccncc1 ZINC000563873041 566924501 /nfs/dbraw/zinc/92/45/01/566924501.db2.gz OSTMEYSBIAEHMS-UHFFFAOYSA-N 0 3 378.270 3.456 10 0 GGAEHN C[C@H](C[N-]S(=O)(=O)c1cccc(Br)c1Cl)C[NH+]1CCCC1 ZINC000563902215 566925747 /nfs/dbraw/zinc/92/57/47/566925747.db2.gz JFHRGZYEAPJGKF-LLVKDONJSA-N 0 3 395.750 3.113 10 0 GGAEHN CCN(CC)CCN(C(=O)CC[C@@H]1CCOC1)c1ccc(Br)cn1 ZINC000563932501 566930169 /nfs/dbraw/zinc/93/01/69/566930169.db2.gz QWJMTPRJDKWSGL-OAHLLOKOSA-N 0 3 398.345 3.336 10 0 GGAEHN COCCCN1CCC(NC(=O)NCc2ccsc2C(F)(F)F)CC1 ZINC000633032286 566931192 /nfs/dbraw/zinc/93/11/92/566931192.db2.gz GHZJEHZZUUFHBM-UHFFFAOYSA-N 0 3 379.448 3.067 10 0 GGAEHN CC(C)(CN1CCCC1)NCCS(=O)(=O)c1cc(Cl)ccc1Cl ZINC000452084385 566931284 /nfs/dbraw/zinc/93/12/84/566931284.db2.gz IFMHTBBWGQOFRL-UHFFFAOYSA-N 0 3 379.353 3.231 10 0 GGAEHN COC[C@H](N[C@H](C)C(=O)Nc1ccc(C)cc1Br)C1CCOCC1 ZINC000656676709 566931737 /nfs/dbraw/zinc/93/17/37/566931737.db2.gz CPOMVJIUZKNXME-DYVFJYSZSA-N 0 3 399.329 3.116 10 0 GGAEHN COC[C@H](N[C@H](C)C(=O)Nc1cc(Cl)ccc1Cl)C1CCOCC1 ZINC000656679443 566931821 /nfs/dbraw/zinc/93/18/21/566931821.db2.gz IKYKVHAJPBSYFV-BZNIZROVSA-N 0 3 375.296 3.352 10 0 GGAEHN COC[C@@H](N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)C1CCOCC1 ZINC000656680624 566933040 /nfs/dbraw/zinc/93/30/40/566933040.db2.gz YXZZFTMHEFTZCK-HZPDHXFCSA-N 0 3 387.307 3.130 10 0 GGAEHN COC[C@@H](N[C@@H](C)C(=O)Nc1ccc(Cl)c(Cl)c1)C1CCOCC1 ZINC000656679849 566933093 /nfs/dbraw/zinc/93/30/93/566933093.db2.gz RMKDZSVRQMHPIO-MEDUHNTESA-N 0 3 375.296 3.352 10 0 GGAEHN CC[C@H](c1ccc(Br)cc1)N1CCN(C[C@@]2(O)CCCOC2)CC1 ZINC000656696687 566933518 /nfs/dbraw/zinc/93/35/18/566933518.db2.gz JRKDSKOJQKWCGP-MOPGFXCFSA-N 0 3 397.357 3.059 10 0 GGAEHN Cc1cc(N2CC[C@H](N[C@H]3COC4(CCC4)C3)C2=O)ccc1Br ZINC000656683036 566933825 /nfs/dbraw/zinc/93/38/25/566933825.db2.gz DLEHNKGLHZBHTA-CJNGLKHVSA-N 0 3 379.298 3.164 10 0 GGAEHN CC(C)(CN1CCCC1)NCc1noc(Cc2ccc(Br)cc2)n1 ZINC000452096225 566934880 /nfs/dbraw/zinc/93/48/80/566934880.db2.gz NMAHFLPDIPUIHV-UHFFFAOYSA-N 0 3 393.329 3.387 10 0 GGAEHN CN1CCN([C@H]2CC[C@@H](NC(=O)Cc3c(Cl)cccc3Cl)CC2)CC1 ZINC000680839146 566935118 /nfs/dbraw/zinc/93/51/18/566935118.db2.gz CIPNWHICUWYTNN-GASCZTMLSA-N 0 3 384.351 3.211 10 0 GGAEHN C[C@H](NC(=O)N[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]12)C1=CCN(C)CC1 ZINC000633158160 566938626 /nfs/dbraw/zinc/93/86/26/566938626.db2.gz IMRDERQZDPBDDJ-ZUHTVMMCSA-N 0 3 390.325 3.037 10 0 GGAEHN Cc1nc(-c2ccc(C(=O)N3CCOC[C@@H]3[C@H]3CCCN3C)s2)cs1 ZINC000633195444 566942028 /nfs/dbraw/zinc/94/20/28/566942028.db2.gz GJFSHPRAXXDZQZ-HUUCEWRRSA-N 0 3 377.535 3.115 10 0 GGAEHN Cc1cc(N2CCC[C@@H](N[C@H](C)c3ccc(Br)cn3)C2)n(C)n1 ZINC000519505867 566942471 /nfs/dbraw/zinc/94/24/71/566942471.db2.gz SGOPLOMZEUOGSZ-UKRRQHHQSA-N 0 3 378.318 3.206 10 0 GGAEHN CN1CCC(N(Cc2ccccc2Br)C(=O)[C@H](O)C2CCC2)CC1 ZINC000452143974 566942638 /nfs/dbraw/zinc/94/26/38/566942638.db2.gz BAAXVVDNAMLIFF-GOSISDBHSA-N 0 3 395.341 3.033 10 0 GGAEHN CC1(C)CCC[C@H](NCc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1 ZINC000564100115 566944817 /nfs/dbraw/zinc/94/48/17/566944817.db2.gz AQSGHMDDIDVTBD-HNNXBMFYSA-N 0 3 386.583 3.218 10 0 GGAEHN COCCCN(C(=O)Cc1ccc(C)cc1Br)C1CCN(C)CC1 ZINC000452159640 566944929 /nfs/dbraw/zinc/94/49/29/566944929.db2.gz SEVYSSGNVAOTFC-UHFFFAOYSA-N 0 3 397.357 3.259 10 0 GGAEHN COCC[C@@H](Cc1ccco1)[NH2+]Cc1cc(Br)c([O-])c(OC)c1 ZINC000544175190 566945231 /nfs/dbraw/zinc/94/52/31/566945231.db2.gz RKLXRCMSEKBPDV-ZDUSSCGKSA-N 0 3 384.270 3.494 10 0 GGAEHN COCC[C@H](Cc1ccco1)[NH2+]Cc1cc(Br)c([O-])c(OC)c1 ZINC000544175188 566945699 /nfs/dbraw/zinc/94/56/99/566945699.db2.gz RKLXRCMSEKBPDV-CYBMUJFWSA-N 0 3 384.270 3.494 10 0 GGAEHN Cc1ccc(C(=O)N2CCN(C3CC3)C[C@@H](C)C2)cc1I ZINC000452168709 566945898 /nfs/dbraw/zinc/94/58/98/566945898.db2.gz DPTDQCSYXFEXIM-GFCCVEGCSA-N 0 3 398.288 3.156 10 0 GGAEHN C[C@@H]1CN(C(=O)c2cc3c(cccc3Br)[nH]2)CCN(C2CC2)C1 ZINC000452166884 566946469 /nfs/dbraw/zinc/94/64/69/566946469.db2.gz AUWOZEUJYXHZFO-LBPRGKRZSA-N 0 3 376.298 3.487 10 0 GGAEHN Cc1nn(-c2ccncc2)cc1CN[C@@H](CO)c1ccc(Br)cc1 ZINC000544175751 566947158 /nfs/dbraw/zinc/94/71/58/566947158.db2.gz DUDOXUDAFZGKOB-SFHVURJKSA-N 0 3 387.281 3.161 10 0 GGAEHN C[C@H]1CN(C(=O)c2cc3c(cccc3Br)[nH]2)CCN(C2CC2)C1 ZINC000452166882 566947355 /nfs/dbraw/zinc/94/73/55/566947355.db2.gz AUWOZEUJYXHZFO-GFCCVEGCSA-N 0 3 376.298 3.487 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CCN(C3CC3)C[C@H](C)C2)c1 ZINC000452177958 566949191 /nfs/dbraw/zinc/94/91/91/566949191.db2.gz YAEXUQZMAMIYDV-ZDUSSCGKSA-N 0 3 398.288 3.156 10 0 GGAEHN Brc1cc2c(cc1CNc1ccc([C@@H]3CNCCO3)cc1)OCO2 ZINC000656793206 566950714 /nfs/dbraw/zinc/95/07/14/566950714.db2.gz QQPASNCQRFREMI-SFHVURJKSA-N 0 3 391.265 3.451 10 0 GGAEHN COc1ccc(CNc2ccc([C@@H]3CNCCO3)cc2)c(Br)c1O ZINC000656792913 566950870 /nfs/dbraw/zinc/95/08/70/566950870.db2.gz OXWNRAVTGBOLOQ-INIZCTEOSA-N 0 3 393.281 3.436 10 0 GGAEHN Brc1cc2c(cc1CNc1ccc([C@H]3CNCCO3)cc1)OCO2 ZINC000656793205 566950884 /nfs/dbraw/zinc/95/08/84/566950884.db2.gz QQPASNCQRFREMI-GOSISDBHSA-N 0 3 391.265 3.451 10 0 GGAEHN CCCN1CCC[C@@H]1C(=O)NCCc1c[nH]c2ccc(Br)cc12 ZINC000544305392 566952488 /nfs/dbraw/zinc/95/24/88/566952488.db2.gz ICQSKYLMGOIKAV-QGZVFWFLSA-N 0 3 378.314 3.464 10 0 GGAEHN COc1ccc(CCC(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)c(Br)c1 ZINC000612102604 566953357 /nfs/dbraw/zinc/95/33/57/566953357.db2.gz CCZLKBQEGHRNIR-JSGCOSHPSA-N 0 3 381.314 3.132 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CN1C(=O)CN(Cc2cccc(Br)c2)C1=O ZINC000656823718 566954194 /nfs/dbraw/zinc/95/41/94/566954194.db2.gz WYJYXSLBYMMNPJ-HNNXBMFYSA-N 0 3 394.313 3.086 10 0 GGAEHN Cn1nc2c(c1CNC[C@@H](O)COc1c(Cl)cccc1Cl)CCCC2 ZINC000519636259 566955449 /nfs/dbraw/zinc/95/54/49/566955449.db2.gz HLSWFPKRXFOPGF-GFCCVEGCSA-N 0 3 384.307 3.135 10 0 GGAEHN O=C(Nc1nc2c(cccc2Cl)[nH]1)C(C[C@H]1COCCO1)C(F)(F)F ZINC000612190984 566957407 /nfs/dbraw/zinc/95/74/07/566957407.db2.gz ORAADFILDAUXPY-IUCAKERBSA-N 0 3 377.750 3.139 10 0 GGAEHN O=C(Nc1nc2c(cccc2Cl)[nH]1)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000612190982 566957427 /nfs/dbraw/zinc/95/74/27/566957427.db2.gz ORAADFILDAUXPY-BDAKNGLRSA-N 0 3 377.750 3.139 10 0 GGAEHN O=C(Nc1nc2c(cccc2Cl)[nH]1)C(C[C@H]1COCCO1)C(F)(F)F ZINC000612190983 566957834 /nfs/dbraw/zinc/95/78/34/566957834.db2.gz ORAADFILDAUXPY-DTWKUNHWSA-N 0 3 377.750 3.139 10 0 GGAEHN Cc1cc(C)c(CNCCC(=O)Nc2cccc(Br)c2)c(=O)[nH]1 ZINC000564257316 566958102 /nfs/dbraw/zinc/95/81/02/566958102.db2.gz FYFJEFDHBPEMNJ-UHFFFAOYSA-N 0 3 378.270 3.285 10 0 GGAEHN Cc1ccc(CCC(=O)Nc2cnn(CCN(C)C)c2)c(Br)c1 ZINC000681227807 566959898 /nfs/dbraw/zinc/95/98/98/566959898.db2.gz RJFJOAXZEJNUSM-UHFFFAOYSA-N 0 3 379.302 3.087 10 0 GGAEHN O=C(CN[C@@H]1CC[C@@H]1C1CCC1)Nc1ccc(I)cc1 ZINC000583571277 566963622 /nfs/dbraw/zinc/96/36/22/566963622.db2.gz NBQIASCCYFJHCO-HUUCEWRRSA-N 0 3 384.261 3.398 10 0 GGAEHN O=C(CN[C@H]1CC[C@H]1C1CCC1)Nc1ccc(I)cc1 ZINC000583571276 566963734 /nfs/dbraw/zinc/96/37/34/566963734.db2.gz NBQIASCCYFJHCO-GJZGRUSLSA-N 0 3 384.261 3.398 10 0 GGAEHN Cc1ccccc1C[C@H](CO)NC[C@H](O)COc1c(Cl)cccc1Cl ZINC000583565091 566963899 /nfs/dbraw/zinc/96/38/99/566963899.db2.gz QBXRXOAYKBLULV-CVEARBPZSA-N 0 3 384.303 3.235 10 0 GGAEHN C[C@@H](CC(F)(F)F)CS(=O)(=O)N1CCCN(CC2CCCCC2)CC1 ZINC000656882627 566964554 /nfs/dbraw/zinc/96/45/54/566964554.db2.gz TVJWFVJUNBPBEH-HNNXBMFYSA-N 0 3 384.508 3.493 10 0 GGAEHN C[C@H](CC(F)(F)F)CS(=O)(=O)N1CCCN(CC2CCCCC2)CC1 ZINC000656882628 566964746 /nfs/dbraw/zinc/96/47/46/566964746.db2.gz TVJWFVJUNBPBEH-OAHLLOKOSA-N 0 3 384.508 3.493 10 0 GGAEHN CN1CC[C@@]2(CCN(C(=O)c3c(Cl)cc(F)cc3Br)C2)C1 ZINC000452340479 566964830 /nfs/dbraw/zinc/96/48/30/566964830.db2.gz AKHPQMYETWORGN-OAHLLOKOSA-N 0 3 375.669 3.409 10 0 GGAEHN CN(C)CCN(C)c1ccc(Br)cc1NC(=O)CC1CSC1 ZINC000633491956 566966642 /nfs/dbraw/zinc/96/66/42/566966642.db2.gz DCRVJCDVAQIKHG-UHFFFAOYSA-N 0 3 386.359 3.139 10 0 GGAEHN C[C@H](CC(F)(F)F)CS(=O)(=O)NCC1CCN(Cc2cccs2)CC1 ZINC000656890823 566966902 /nfs/dbraw/zinc/96/69/02/566966902.db2.gz YMXVCDJGUNFIHH-CYBMUJFWSA-N 0 3 398.516 3.468 10 0 GGAEHN COC(=O)C[C@@H](NC(=O)CN1[C@H](C)CC[C@H]1C)c1cccc(Br)c1 ZINC000612342845 566967201 /nfs/dbraw/zinc/96/72/01/566967201.db2.gz CAHGGILYQNDQTD-XJKCOSOUSA-N 0 3 397.313 3.042 10 0 GGAEHN CCO[C@@H](CN[C@@H](C)Cn1cc(Br)ccc1=O)c1ccccc1 ZINC000519775178 566967818 /nfs/dbraw/zinc/96/78/18/566967818.db2.gz PQKGFXCTPHITMU-YOEHRIQHSA-N 0 3 379.298 3.367 10 0 GGAEHN COCCN(Cc1cc(Br)cs1)C[C@H](O)CC(F)(F)F ZINC000494027107 566967950 /nfs/dbraw/zinc/96/79/50/566967950.db2.gz LIHMWBMTNSKWOJ-SNVBAGLBSA-N 0 3 376.238 3.272 10 0 GGAEHN COC1(c2nc(CC(F)(F)F)no2)CCN(CCc2cccs2)CC1 ZINC000583615900 566968680 /nfs/dbraw/zinc/96/86/80/566968680.db2.gz LQTQUCYBOYGWKJ-UHFFFAOYSA-N 0 3 375.416 3.416 10 0 GGAEHN CCN(Cc1ccc(CN(C)C)cc1)S(=O)(=O)C[C@H](C)CC(F)(F)F ZINC000656894526 566969468 /nfs/dbraw/zinc/96/94/68/566969468.db2.gz UXJADOGWADBJHX-CQSZACIVSA-N 0 3 380.476 3.488 10 0 GGAEHN Cc1cc(Br)cc2c(C(=O)NC[C@H]3CCCN3CCCO)coc21 ZINC000452368263 566970014 /nfs/dbraw/zinc/97/00/14/566970014.db2.gz QTIHGLFRUHBSRO-CQSZACIVSA-N 0 3 395.297 3.080 10 0 GGAEHN C[C@H]1[C@@H](C(F)(F)F)CCN1C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000471676843 566970831 /nfs/dbraw/zinc/97/08/31/566970831.db2.gz NCLRAUUJBPCUIE-KBPBESRZSA-N 0 3 379.492 3.330 10 0 GGAEHN O=C(N[C@H]1CCCN(CCCO)C1)c1cc(Br)cc2ccccc21 ZINC000452379311 566971579 /nfs/dbraw/zinc/97/15/79/566971579.db2.gz ZVSNXCLCCXEFML-INIZCTEOSA-N 0 3 391.309 3.179 10 0 GGAEHN C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000471676844 566971674 /nfs/dbraw/zinc/97/16/74/566971674.db2.gz NCLRAUUJBPCUIE-KGLIPLIRSA-N 0 3 379.492 3.330 10 0 GGAEHN CSc1ccc(CNCc2ccccc2N2CCN(C(C)=O)CC2)s1 ZINC000564407752 566972364 /nfs/dbraw/zinc/97/23/64/566972364.db2.gz LPMBBCZOFLOBKL-UHFFFAOYSA-N 0 3 375.563 3.428 10 0 GGAEHN C[C@H](CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccncc1 ZINC000681391410 566972519 /nfs/dbraw/zinc/97/25/19/566972519.db2.gz FWVQFGLONNIOIO-MLGOLLRUSA-N 0 3 395.322 3.456 10 0 GGAEHN O=C(N[C@H]1CCCN(CCCO)C1)c1ccc2scc(Br)c2c1 ZINC000452386754 566973392 /nfs/dbraw/zinc/97/33/92/566973392.db2.gz OEKZCHKHTCLMBN-ZDUSSCGKSA-N 0 3 397.338 3.240 10 0 GGAEHN Cc1cc(Br)c(NC(=O)NCCNc2ccncc2)cc1Cl ZINC000429973628 566973396 /nfs/dbraw/zinc/97/33/96/566973396.db2.gz OMWOCHVCCRYMDC-UHFFFAOYSA-N 0 3 383.677 3.461 10 0 GGAEHN Brc1ccc2[nH]c(CN3CCCN(C[C@@H]4CCCO4)CC3)nc2c1 ZINC000681398466 566973833 /nfs/dbraw/zinc/97/38/33/566973833.db2.gz FWZKADJOFDTRTO-HNNXBMFYSA-N 0 3 393.329 3.012 10 0 GGAEHN CC(C)N1C(=O)C[C@@H](NCCOCC(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000494217008 566976845 /nfs/dbraw/zinc/97/68/45/566976845.db2.gz SHLFSNMPYMQBER-RHSMWYFYSA-N 0 3 378.822 3.401 10 0 GGAEHN CC(C)Nc1cc(Br)ccc1NC(=O)c1cnn(CCN(C)C)c1 ZINC000633645935 566977215 /nfs/dbraw/zinc/97/72/15/566977215.db2.gz HNNOCXHFSPBQJM-UHFFFAOYSA-N 0 3 394.317 3.280 10 0 GGAEHN OCCN(CCc1ccc2c(c1)CCO2)Cc1cc(Br)cs1 ZINC000494253179 566978226 /nfs/dbraw/zinc/97/82/26/566978226.db2.gz FQORAUBHNDSBNA-UHFFFAOYSA-N 0 3 382.323 3.483 10 0 GGAEHN CCC[C@@H](C)[C@H](CO)NCC(=O)Nc1c(F)cc(F)cc1Br ZINC000583755973 566980040 /nfs/dbraw/zinc/98/00/40/566980040.db2.gz LIDSMQHFSBXCHU-RNCFNFMXSA-N 0 3 379.245 3.053 10 0 GGAEHN O=C(NCCNc1ccncc1)Nc1nc2c(cccc2Br)s1 ZINC000494320179 566987137 /nfs/dbraw/zinc/98/71/37/566987137.db2.gz SDNRWJABYDJMMT-UHFFFAOYSA-N 0 3 392.282 3.109 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)c1nc(C2CC2)ncc1Br ZINC000494323154 566988108 /nfs/dbraw/zinc/98/81/08/566988108.db2.gz PJWAYZAUIDVYKJ-TXEJJXNPSA-N 0 3 381.318 3.109 10 0 GGAEHN OC[C@H](N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)c(F)c1 ZINC000430148900 566992871 /nfs/dbraw/zinc/99/28/71/566992871.db2.gz UJROSXYMHAFFPM-APWZRJJASA-N 0 3 393.300 3.486 10 0 GGAEHN OC[C@H](N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)c(F)c1 ZINC000430148901 566992948 /nfs/dbraw/zinc/99/29/48/566992948.db2.gz UJROSXYMHAFFPM-LPHOPBHVSA-N 0 3 393.300 3.486 10 0 GGAEHN CCN(C[C@@H]1CCCN1CC)C(=O)c1cc(OC)c(OC)cc1Br ZINC000564631704 566993735 /nfs/dbraw/zinc/99/37/35/566993735.db2.gz GPTFFGOLNGXRIN-ZDUSSCGKSA-N 0 3 399.329 3.413 10 0 GGAEHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1[nH]nc2ccc(Br)cc21 ZINC000520310042 566995417 /nfs/dbraw/zinc/99/54/17/566995417.db2.gz BGFVWDGPILRULO-OAHLLOKOSA-N 0 3 399.292 3.330 10 0 GGAEHN CN(C(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1)[C@@H]1CCN(C2CC2)C1 ZINC000520317810 566997176 /nfs/dbraw/zinc/99/71/76/566997176.db2.gz OOARGJBINPJYNH-CQSZACIVSA-N 0 3 379.291 3.488 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)c1c[nH]c2ncc(Br)cc12 ZINC000472089565 567000328 /nfs/dbraw/zinc/00/03/28/567000328.db2.gz GXBLGJUTDAJFAU-RYUDHWBXSA-N 0 3 379.302 3.318 10 0 GGAEHN Cc1ccsc1[C@@H](CO)NC[C@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000681695698 567002129 /nfs/dbraw/zinc/00/21/29/567002129.db2.gz KMKAOUKXIARVGP-XHDPSFHLSA-N 0 3 376.305 3.426 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N1CCN(C2CCCC2)CC1 ZINC000430267524 567003888 /nfs/dbraw/zinc/00/38/88/567003888.db2.gz JZUZABXIQITVSP-UHFFFAOYSA-N 0 3 396.329 3.228 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N1CCCN(C(C)C)CC1 ZINC000430278141 567004262 /nfs/dbraw/zinc/00/42/62/567004262.db2.gz OZKIQMYIHQETJP-UHFFFAOYSA-N 0 3 384.318 3.083 10 0 GGAEHN CN1CCC[C@@H](NC(=O)Nc2ccnn2Cc2cccc(Cl)c2Cl)C1 ZINC000681777605 567004455 /nfs/dbraw/zinc/00/44/55/567004455.db2.gz RYIOGNZVYIKOND-CYBMUJFWSA-N 0 3 382.295 3.454 10 0 GGAEHN O=C(NC[C@@H]1CCCCS1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472152377 567004871 /nfs/dbraw/zinc/00/48/71/567004871.db2.gz GPARIYMKABRTRM-NRXISQOPSA-N 0 3 379.492 3.377 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N1CCCN(C(C)(C)C)CC1 ZINC000681797972 567006273 /nfs/dbraw/zinc/00/62/73/567006273.db2.gz NBRJJAPNQPZWSK-UHFFFAOYSA-N 0 3 398.345 3.474 10 0 GGAEHN Cc1cc(Br)cc2c1[C@H](N[C@H]1CCN(C3CCOCC3)C1=O)CC2 ZINC000494613951 567011792 /nfs/dbraw/zinc/01/17/92/567011792.db2.gz LELCYEFUPJRKRX-SJORKVTESA-N 0 3 393.325 3.114 10 0 GGAEHN O=C(Nc1ccc2c(c1F)CCNC2)[C@@H]1COc2ccc(Br)cc21 ZINC000584107745 567012087 /nfs/dbraw/zinc/01/20/87/567012087.db2.gz ILASVJGPVSZEST-CQSZACIVSA-N 0 3 391.240 3.349 10 0 GGAEHN CCN1CCN(CCC(=O)Nc2ccc(Br)c(OC(C)C)c2)CC1 ZINC000634057850 567015283 /nfs/dbraw/zinc/01/52/83/567015283.db2.gz ZOCFJKSSYHXZIW-UHFFFAOYSA-N 0 3 398.345 3.202 10 0 GGAEHN C[C@]12C[C@H]1CCC[C@H]2NCC(=O)Nc1ccc(I)cc1 ZINC000520623129 567015322 /nfs/dbraw/zinc/01/53/22/567015322.db2.gz CDMWFJFBUHZYJJ-XFJVYGCCSA-N 0 3 384.261 3.398 10 0 GGAEHN C[C@]12C[C@H]1CCC[C@@H]2NCC(=O)Nc1ccc(I)cc1 ZINC000520623128 567015756 /nfs/dbraw/zinc/01/57/56/567015756.db2.gz CDMWFJFBUHZYJJ-WPGHFRTFSA-N 0 3 384.261 3.398 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N[C@H]1C[C@H](c2ccc(F)c(Br)c2)C1 ZINC000430447058 567015750 /nfs/dbraw/zinc/01/57/50/567015750.db2.gz HMXVULGBQVGNEQ-IHRRRGAJSA-N 0 3 384.293 3.228 10 0 GGAEHN CN1CCC(n2cc(NC(=O)Cc3cscc3Br)cn2)CC1 ZINC000634094795 567016217 /nfs/dbraw/zinc/01/62/17/567016217.db2.gz CFSKVOKVGQPSFO-UHFFFAOYSA-N 0 3 383.315 3.155 10 0 GGAEHN Cc1ccc(C(=O)Nc2cnn(C3CCN(C)CC3)c2)c(Br)c1 ZINC000634094064 567016314 /nfs/dbraw/zinc/01/63/14/567016314.db2.gz XPFLHHYEYMGXJT-UHFFFAOYSA-N 0 3 377.286 3.473 10 0 GGAEHN CC(C)c1[nH]nc(C(=O)Nc2cnn(C3CCN(C)CC3)c2)c1Br ZINC000634089799 567016567 /nfs/dbraw/zinc/01/65/67/567016567.db2.gz MWTIJYJUNSRJTG-UHFFFAOYSA-N 0 3 395.305 3.011 10 0 GGAEHN Cc1cc(Br)cc(C(=O)Nc2cnn(C3CCN(C)CC3)c2)c1 ZINC000634095698 567016636 /nfs/dbraw/zinc/01/66/36/567016636.db2.gz PTZWZINUKZJJKA-UHFFFAOYSA-N 0 3 377.286 3.473 10 0 GGAEHN CN1CCC(n2cc(NC(=O)Cc3ccc(Br)cc3F)cn2)CC1 ZINC000634095778 567016645 /nfs/dbraw/zinc/01/66/45/567016645.db2.gz HLERLNKOEFRBNZ-UHFFFAOYSA-N 0 3 395.276 3.233 10 0 GGAEHN Cc1ccc(Br)c(C(=O)Nc2cnn(C3CCN(C)CC3)c2)c1 ZINC000634092689 567016812 /nfs/dbraw/zinc/01/68/12/567016812.db2.gz ZCRSITCVZZWXNA-UHFFFAOYSA-N 0 3 377.286 3.473 10 0 GGAEHN CN1CCC(n2cc(NC(=O)Cc3ccccc3Br)cn2)CC1 ZINC000634090316 567016851 /nfs/dbraw/zinc/01/68/51/567016851.db2.gz XCGHVRSSFXSXCU-UHFFFAOYSA-N 0 3 377.286 3.094 10 0 GGAEHN Cc1cccc(Br)c1C(=O)Nc1cnn(C2CCN(C)CC2)c1 ZINC000634094927 567016912 /nfs/dbraw/zinc/01/69/12/567016912.db2.gz DZJHUUZRDFEXRZ-UHFFFAOYSA-N 0 3 377.286 3.473 10 0 GGAEHN Cc1cccc(C(=O)Nc2cnn(C3CCN(C)CC3)c2)c1Br ZINC000634093847 567017049 /nfs/dbraw/zinc/01/70/49/567017049.db2.gz SMDRHSJGQKBDRL-UHFFFAOYSA-N 0 3 377.286 3.473 10 0 GGAEHN Cc1ccsc1[C@@H](CO)NC[C@H](O)COc1c(Cl)cccc1Cl ZINC000494675100 567017146 /nfs/dbraw/zinc/01/71/46/567017146.db2.gz YSQIVOZRPIDNBT-SMDDNHRTSA-N 0 3 376.305 3.426 10 0 GGAEHN CN1CCC(n2cc(NC(=O)c3cc(F)ccc3Br)cn2)CC1 ZINC000634087252 567017242 /nfs/dbraw/zinc/01/72/42/567017242.db2.gz KYKYHXWVFJJEAZ-UHFFFAOYSA-N 0 3 381.249 3.304 10 0 GGAEHN O=C(Nc1cnc2c(Br)cccn12)N1CC[C@@H](N2CCCCC2)C1 ZINC000564883412 567017393 /nfs/dbraw/zinc/01/73/93/567017393.db2.gz ZLKWJMHDJRQLDS-CYBMUJFWSA-N 0 3 392.301 3.189 10 0 GGAEHN O=C(CCCCOc1ccc(Br)cc1)N[C@H]1CNCCC1(F)F ZINC000584172058 567019351 /nfs/dbraw/zinc/01/93/51/567019351.db2.gz VMIJLDUDAGKOKI-AWEZNQCLSA-N 0 3 391.256 3.112 10 0 GGAEHN CC(C)[C@H]1CN(C)CCN1c1ncnc2cccc(I)c21 ZINC000545164032 567023776 /nfs/dbraw/zinc/02/37/76/567023776.db2.gz HFXJGNDSVJZZPK-CQSZACIVSA-N 0 3 396.276 3.011 10 0 GGAEHN C[C@H]1C[C@H](N(C)c2ncnc3cccc(I)c32)CCN1C ZINC000545166431 567025194 /nfs/dbraw/zinc/02/51/94/567025194.db2.gz XRDOJBDZYAPUFA-NWDGAFQWSA-N 0 3 396.276 3.153 10 0 GGAEHN C[C@H](CC(=O)Nc1ccnn1CCN(C)C)c1ccc(Br)cc1 ZINC000584251431 567025574 /nfs/dbraw/zinc/02/55/74/567025574.db2.gz QAGCTRMNBYAMRH-CYBMUJFWSA-N 0 3 379.302 3.340 10 0 GGAEHN C[C@@H](Nc1ncnc2cccc(I)c21)C1=CCN(C)CC1 ZINC000545165566 567025736 /nfs/dbraw/zinc/02/57/36/567025736.db2.gz MAHIXFLZXLOGHM-LLVKDONJSA-N 0 3 394.260 3.297 10 0 GGAEHN CCc1cccc(OC[C@@H](O)CN[C@H](CO)c2cccc(Br)c2)c1 ZINC000520783227 567025859 /nfs/dbraw/zinc/02/58/59/567025859.db2.gz WFPRAXYJJANZGG-PKOBYXMFSA-N 0 3 394.309 3.074 10 0 GGAEHN C[C@H]1C[C@@H](N(C)c2ncnc3cccc(I)c32)CCN1C ZINC000545166433 567026233 /nfs/dbraw/zinc/02/62/33/567026233.db2.gz XRDOJBDZYAPUFA-RYUDHWBXSA-N 0 3 396.276 3.153 10 0 GGAEHN C[C@H](CC(F)(F)F)NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472447013 567026591 /nfs/dbraw/zinc/02/65/91/567026591.db2.gz LKTAMTKYKYSWRS-OIKLOGQESA-N 0 3 375.357 3.432 10 0 GGAEHN CN1CC=C(CNC(=O)c2cc(Br)cc(N3CCCC3)c2)CC1 ZINC000613267671 567026863 /nfs/dbraw/zinc/02/68/63/567026863.db2.gz XONPKQRWRMRTJS-UHFFFAOYSA-N 0 3 378.314 3.041 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1ccc(Br)cc1OC(C)C ZINC000520836936 567027311 /nfs/dbraw/zinc/02/73/11/567027311.db2.gz DSMGPOBWVPSXEK-HNNXBMFYSA-N 0 3 399.329 3.077 10 0 GGAEHN Cc1ccccc1CCN[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430697930 567028829 /nfs/dbraw/zinc/02/88/29/567028829.db2.gz UCMQTQAPCKVNDM-CYBMUJFWSA-N 0 3 397.338 3.298 10 0 GGAEHN Cc1ccccc1CCN[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430697936 567028889 /nfs/dbraw/zinc/02/88/89/567028889.db2.gz UCMQTQAPCKVNDM-ZDUSSCGKSA-N 0 3 397.338 3.298 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N1CCc2ccccc2[C@H]1CN ZINC000565001071 567029148 /nfs/dbraw/zinc/02/91/48/567029148.db2.gz KUPZOGASRLTUIT-QGZVFWFLSA-N 0 3 389.293 3.085 10 0 GGAEHN C[C@@H](c1ccccc1)N1CC[C@@H](Nc2ncc(I)cn2)C1 ZINC000545208469 567029146 /nfs/dbraw/zinc/02/91/46/567029146.db2.gz VNHHGBRZEAUIHT-SWLSCSKDSA-N 0 3 394.260 3.329 10 0 GGAEHN CCO[C@H]1C[C@](N)(C(=O)NCc2c(Cl)cccc2OC(F)F)C1(C)C ZINC000634298990 567029302 /nfs/dbraw/zinc/02/93/02/567029302.db2.gz DPAKKFNNJSXKCG-GUYCJALGSA-N 0 3 376.831 3.090 10 0 GGAEHN CCN(CC)[C@@H](CNc1cc(Br)cnc1C(N)=O)c1ccsc1 ZINC000472494243 567029388 /nfs/dbraw/zinc/02/93/88/567029388.db2.gz FHJNANMLUJZLHX-AWEZNQCLSA-N 0 3 397.342 3.500 10 0 GGAEHN Cc1ccc([C@@H](CNc2cc(Br)cnc2C(N)=O)N2CCCC2)o1 ZINC000472490966 567029445 /nfs/dbraw/zinc/02/94/45/567029445.db2.gz ACTULDFCUOJPKK-CQSZACIVSA-N 0 3 393.285 3.093 10 0 GGAEHN C[C@H](c1ccccc1)N1CC[C@@H](Nc2cc(Br)cnc2C(N)=O)C1 ZINC000472493885 567030042 /nfs/dbraw/zinc/03/00/42/567030042.db2.gz FIELFJJVLLEZMR-IUODEOHRSA-N 0 3 389.297 3.190 10 0 GGAEHN C[C@H](c1ccccc1)N1CC[C@H](Nc2cc(Br)cnc2C(N)=O)C1 ZINC000472493872 567030256 /nfs/dbraw/zinc/03/02/56/567030256.db2.gz FIELFJJVLLEZMR-DOMZBBRYSA-N 0 3 389.297 3.190 10 0 GGAEHN C[C@@H]1C[C@H](Nc2cc(Br)cnc2C(N)=O)CN1Cc1ccccc1 ZINC000472500567 567031078 /nfs/dbraw/zinc/03/10/78/567031078.db2.gz NIZMJKHFHWNDCG-DOMZBBRYSA-N 0 3 389.297 3.018 10 0 GGAEHN CCCC1(CN[C@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)CC1 ZINC000430709011 567031335 /nfs/dbraw/zinc/03/13/35/567031335.db2.gz VZVZKIKBJWJITQ-LLVKDONJSA-N 0 3 375.332 3.327 10 0 GGAEHN C[C@H]1C[C@@H](Nc2cc(Br)cnc2C(N)=O)CN1Cc1ccccc1 ZINC000472500577 567031693 /nfs/dbraw/zinc/03/16/93/567031693.db2.gz NIZMJKHFHWNDCG-SWLSCSKDSA-N 0 3 389.297 3.018 10 0 GGAEHN C[C@@H](NC(=O)c1c(F)c(F)c(Br)c(F)c1F)C1=CCN(C)CC1 ZINC000613374813 567032398 /nfs/dbraw/zinc/03/23/98/567032398.db2.gz IYANLENUENFKBZ-SSDOTTSWSA-N 0 3 395.194 3.386 10 0 GGAEHN C[C@H](NC(=O)c1c(F)c(F)c(Br)c(F)c1F)C1=CCN(C)CC1 ZINC000613374821 567033396 /nfs/dbraw/zinc/03/33/96/567033396.db2.gz IYANLENUENFKBZ-ZETCQYMHSA-N 0 3 395.194 3.386 10 0 GGAEHN CCNC(=O)c1cc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)c(C)s1 ZINC000634419741 567034668 /nfs/dbraw/zinc/03/46/68/567034668.db2.gz MEMGFHRMMYXWPX-QWRGUYRKSA-N 0 3 378.416 3.492 10 0 GGAEHN Cn1ncc(Br)c1CN1CCN(Cc2ccccc2)C(C)(C)C1 ZINC000494968722 567037089 /nfs/dbraw/zinc/03/70/89/567037089.db2.gz CRUAJEYBGPIWBE-UHFFFAOYSA-N 0 3 377.330 3.279 10 0 GGAEHN CN1CCN(C(=O)c2[nH]nc3ccc(Br)cc32)[C@@H](c2ccccc2)C1 ZINC000521066315 567038651 /nfs/dbraw/zinc/03/86/51/567038651.db2.gz OXTCWTGGLMODPU-QGZVFWFLSA-N 0 3 399.292 3.454 10 0 GGAEHN C[C@@H](Oc1ccc(F)cc1Br)C(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000521081970 567040576 /nfs/dbraw/zinc/04/05/76/567040576.db2.gz FTSLAZZPQGIEHS-BXUZGUMPSA-N 0 3 385.277 3.051 10 0 GGAEHN O=C1N[C@@]2(CCN(Cc3ccccc3)C2)C(=O)N1Cc1ccsc1Cl ZINC000657256524 567041223 /nfs/dbraw/zinc/04/12/23/567041223.db2.gz FTBHSQGATNAMBG-GOSISDBHSA-N 0 3 375.881 3.098 10 0 GGAEHN CC(C)(C)OC(=O)[C@H]1CCN(C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000495056772 567042768 /nfs/dbraw/zinc/04/27/68/567042768.db2.gz DRCYRKRMRQIQMD-GXTWGEPZSA-N 0 3 390.307 3.397 10 0 GGAEHN O=C(CN1CCCSc2ccc(Cl)cc21)NC1CCN(C2CC2)CC1 ZINC000430952236 567042703 /nfs/dbraw/zinc/04/27/03/567042703.db2.gz YECHRFHXZJTNMK-UHFFFAOYSA-N 0 3 379.957 3.385 10 0 GGAEHN CCCN(CCN(C)C)C(=O)c1ncc(Br)cc1Br ZINC000545364541 567043035 /nfs/dbraw/zinc/04/30/35/567043035.db2.gz PVYVUGXCNVNAAS-UHFFFAOYSA-N 0 3 393.123 3.020 10 0 GGAEHN CC(C)(C)OC(=O)[C@@H]1CCN(C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000495067790 567044625 /nfs/dbraw/zinc/04/46/25/567044625.db2.gz OTIUHVFNWPLNBH-TZMCWYRMSA-N 0 3 390.307 3.397 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000682458437 567046729 /nfs/dbraw/zinc/04/67/29/567046729.db2.gz XGBLWTUOMUCOAL-IUODEOHRSA-N 0 3 396.329 3.302 10 0 GGAEHN Brc1cccc(N2CC[C@@H](CNCc3cc4n(n3)CCC4)C2)c1 ZINC000657328986 567047263 /nfs/dbraw/zinc/04/72/63/567047263.db2.gz GSTOLHHZXQUHIL-AWEZNQCLSA-N 0 3 375.314 3.208 10 0 GGAEHN Cc1cc(C(=O)NC[C@@H](C)N(C)C2CC2)nn1-c1ccc(Br)cc1 ZINC000431026740 567047314 /nfs/dbraw/zinc/04/73/14/567047314.db2.gz XUZILVUWUPUNHN-CYBMUJFWSA-N 0 3 391.313 3.156 10 0 GGAEHN CN(C)CCOc1cccc(CNCc2c(F)cncc2Br)c1 ZINC000657315708 567047370 /nfs/dbraw/zinc/04/73/70/567047370.db2.gz RGWRMWJWSMARMQ-UHFFFAOYSA-N 0 3 382.277 3.213 10 0 GGAEHN CN(CCN(C)C1CC1)C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000613597285 567047698 /nfs/dbraw/zinc/04/76/98/567047698.db2.gz QZNXSSRTQUQCAP-UHFFFAOYSA-N 0 3 380.330 3.216 10 0 GGAEHN Cc1cc(C(=O)N(C)CCN2CCCC2)nn1-c1ccc(Br)cc1 ZINC000431020113 567047689 /nfs/dbraw/zinc/04/76/89/567047689.db2.gz WQPWTYNHPZMNJG-UHFFFAOYSA-N 0 3 391.313 3.111 10 0 GGAEHN O=S1(=O)CC(CCNCc2ccc(-c3cccc(Br)c3)o2)C1 ZINC000682474646 567047729 /nfs/dbraw/zinc/04/77/29/567047729.db2.gz NEBXDOIYPAPJAP-UHFFFAOYSA-N 0 3 384.295 3.233 10 0 GGAEHN Fc1cncc(Br)c1CNCC1(N2CCCCC2)CCOCC1 ZINC000657355738 567048946 /nfs/dbraw/zinc/04/89/46/567048946.db2.gz ASOCPMHYMKVOCO-UHFFFAOYSA-N 0 3 386.309 3.108 10 0 GGAEHN Cc1cc(Br)ccc1NC(=O)CCNCc1cnn2c1CCC2 ZINC000657343347 567049339 /nfs/dbraw/zinc/04/93/39/567049339.db2.gz ZARDUUUVGCXWQD-UHFFFAOYSA-N 0 3 377.286 3.019 10 0 GGAEHN Cc1cccc(S(=O)(=O)N2CC[C@H](c3ccc(F)cc3)[C@@H](N)C2)c1Cl ZINC000565243904 567049392 /nfs/dbraw/zinc/04/93/92/567049392.db2.gz CVTNFFNSLYYBJN-CVEARBPZSA-N 0 3 382.888 3.293 10 0 GGAEHN C[C@H](Cn1ncc2ccccc2c1=O)N[C@@H](C)c1cncc(Br)c1 ZINC000565241926 567049943 /nfs/dbraw/zinc/04/99/43/567049943.db2.gz AMDNTKWNXVSYTE-OLZOCXBDSA-N 0 3 387.281 3.293 10 0 GGAEHN c1csc(-c2noc(CCCN3CCCN(c4nccs4)CC3)n2)c1 ZINC000521226647 567050369 /nfs/dbraw/zinc/05/03/69/567050369.db2.gz DIXCSDHUPGBLKM-UHFFFAOYSA-N 0 3 375.523 3.400 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)[C@H](N)Cc1ccccc1 ZINC000584524586 567050443 /nfs/dbraw/zinc/05/04/43/567050443.db2.gz RQBAEWDMXZBVPO-MLGOLLRUSA-N 0 3 377.282 3.205 10 0 GGAEHN CO[C@H](c1ccccc1Cl)[C@H](C)N[C@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000545459455 567052752 /nfs/dbraw/zinc/05/27/52/567052752.db2.gz YAITYBBGGFYLAK-VBHSOAQHSA-N 0 3 382.913 3.414 10 0 GGAEHN Cc1c(Br)cncc1CN[C@@H](C)Cn1ncc2ccccc2c1=O ZINC000657421909 567054473 /nfs/dbraw/zinc/05/44/73/567054473.db2.gz RQNSTERADCIWJV-LBPRGKRZSA-N 0 3 387.281 3.041 10 0 GGAEHN CCCOC[C@@H](Cc1cccc(Br)c1)NC[C@H](O)C(F)(F)F ZINC000565300380 567056110 /nfs/dbraw/zinc/05/61/10/567056110.db2.gz WRALGTYAMSYOKS-KGLIPLIRSA-N 0 3 384.236 3.300 10 0 GGAEHN Cn1ncc(C2CCC2)c1CNC[C@H](CO)Cc1ccccc1Br ZINC000657448214 567056420 /nfs/dbraw/zinc/05/64/20/567056420.db2.gz JKNWFTVUGZATDS-CQSZACIVSA-N 0 3 392.341 3.391 10 0 GGAEHN O[C@@H](CN[C@H]1CCCCc2cc(Br)ccc21)CC1(O)CCOCC1 ZINC000634722365 567056572 /nfs/dbraw/zinc/05/65/72/567056572.db2.gz NXVUUOXHNXTAJK-AEFFLSMTSA-N 0 3 398.341 3.099 10 0 GGAEHN Cn1ncc(C(F)(F)F)c1CNCCNc1cccc(Br)c1 ZINC000657430564 567056958 /nfs/dbraw/zinc/05/69/58/567056958.db2.gz QPQVRLHRIUTDME-UHFFFAOYSA-N 0 3 377.208 3.403 10 0 GGAEHN O=C(CCN1CCO[C@H](C(F)F)CC1)Nc1ccccc1Br ZINC000634755934 567058817 /nfs/dbraw/zinc/05/88/17/567058817.db2.gz KMHAOXZZYZTHNB-ZDUSSCGKSA-N 0 3 377.229 3.134 10 0 GGAEHN Cc1ncsc1-c1ccc(CNC[C@@H]2CCCCN2S(C)(=O)=O)cc1 ZINC000657463098 567059152 /nfs/dbraw/zinc/05/91/52/567059152.db2.gz IIONTPKPNPDMOT-KRWDZBQOSA-N 0 3 379.551 3.022 10 0 GGAEHN CS[C@H]1CN(C(=O)CSc2cccc(C(F)(F)F)c2)C[C@@H]1N(C)C ZINC000495566650 567062199 /nfs/dbraw/zinc/06/21/99/567062199.db2.gz XUVDJYIGRHIVRS-KBPBESRZSA-N 0 3 378.485 3.302 10 0 GGAEHN Brc1cccc(CN2CCC(NCc3cnn4c3CCC4)CC2)c1 ZINC000657493615 567062227 /nfs/dbraw/zinc/06/22/27/567062227.db2.gz GJAPCOQICIGORT-UHFFFAOYSA-N 0 3 389.341 3.346 10 0 GGAEHN CCN(CC)CCN(CCC(F)(F)F)C(=O)c1cccc([S@@](C)=O)c1 ZINC000613802787 567062803 /nfs/dbraw/zinc/06/28/03/567062803.db2.gz GTDJFJODAAJMQU-RUZDIDTESA-N 0 3 378.460 3.160 10 0 GGAEHN CS[C@H]1CN(C(=O)c2c[nH]c3cccc(Br)c23)C[C@@H]1N(C)C ZINC000495695600 567064073 /nfs/dbraw/zinc/06/40/73/567064073.db2.gz FBINCPOYKDJDPD-KBPBESRZSA-N 0 3 382.327 3.048 10 0 GGAEHN CS[C@@H]1CN(C(=O)CSCc2cc(-c3cccs3)on2)C[C@H]1N(C)C ZINC000495635111 567064244 /nfs/dbraw/zinc/06/42/44/567064244.db2.gz JEBRCJSWNURNJA-CZUORRHYSA-N 0 3 397.591 3.140 10 0 GGAEHN CS[C@H]1CN(C(=O)c2c[nH]c3cccc(Br)c23)C[C@H]1N(C)C ZINC000495695601 567064342 /nfs/dbraw/zinc/06/43/42/567064342.db2.gz FBINCPOYKDJDPD-KGLIPLIRSA-N 0 3 382.327 3.048 10 0 GGAEHN COc1cc2c(cc1F)CC[C@H]2NCCn1cc(Br)ccc1=O ZINC000453238639 567064837 /nfs/dbraw/zinc/06/48/37/567064837.db2.gz AARBLBVODQLNMP-OAHLLOKOSA-N 0 3 381.245 3.036 10 0 GGAEHN CO[C@H](CNCc1ccc(OC(F)(F)F)c(Br)c1)[C@@H]1CCOC1 ZINC000657540584 567066673 /nfs/dbraw/zinc/06/66/73/567066673.db2.gz IOENGEINUANVRR-BXUZGUMPSA-N 0 3 398.219 3.489 10 0 GGAEHN C[C@@H]1CCN(CC(=O)N2CCO[C@@H](c3cc(F)c(Cl)cc3Cl)C2)C1 ZINC000565439102 567066963 /nfs/dbraw/zinc/06/69/63/567066963.db2.gz CYZNRDJHJVNSIN-BDJLRTHQSA-N 0 3 375.271 3.374 10 0 GGAEHN C[C@H](NCCCC1CCOCC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000453241182 567067118 /nfs/dbraw/zinc/06/71/18/567067118.db2.gz VQYJKWXILWCSRM-NSHDSACASA-N 0 3 395.352 3.498 10 0 GGAEHN OCCCN1CCC[C@@H](N[C@@H]2CCCOc3ccc(Br)cc32)C1 ZINC000453253251 567067345 /nfs/dbraw/zinc/06/73/45/567067345.db2.gz CTILENJEASAARE-NVXWUHKLSA-N 0 3 383.330 3.099 10 0 GGAEHN CO[C@H](CNCc1cn(-c2ccc(Br)cc2)nc1C)[C@@H]1CCOC1 ZINC000657545567 567067433 /nfs/dbraw/zinc/06/74/33/567067433.db2.gz SDKUSQSOHPZMPS-RDTXWAMCSA-N 0 3 394.313 3.084 10 0 GGAEHN CO[C@H](CNCc1ccc(OC(F)(F)F)c(Br)c1)[C@H]1CCOC1 ZINC000657540590 567067483 /nfs/dbraw/zinc/06/74/83/567067483.db2.gz IOENGEINUANVRR-SMDDNHRTSA-N 0 3 398.219 3.489 10 0 GGAEHN CO[C@@H](CNCc1cc(OC(F)F)ccc1Br)[C@@H]1CCOC1 ZINC000657543200 567067565 /nfs/dbraw/zinc/06/75/65/567067565.db2.gz RVTAUFIIKJOZKH-YGRLFVJLSA-N 0 3 380.229 3.192 10 0 GGAEHN CO[C@@H](CNCc1cn(-c2ccc(Br)cc2)nc1C)[C@H]1CCOC1 ZINC000657545564 567067693 /nfs/dbraw/zinc/06/76/93/567067693.db2.gz SDKUSQSOHPZMPS-KSSFIOAISA-N 0 3 394.313 3.084 10 0 GGAEHN [O-]c1cccc(CNCC2CC[NH+](C3CCOCC3)CC2)c1Br ZINC000657537279 567067771 /nfs/dbraw/zinc/06/77/71/567067771.db2.gz GMPOENXBXHZDHT-UHFFFAOYSA-N 0 3 383.330 3.135 10 0 GGAEHN CO[C@@H](CNCc1ccc(OC(F)(F)F)c(Br)c1)[C@@H]1CCOC1 ZINC000657540588 567067886 /nfs/dbraw/zinc/06/78/86/567067886.db2.gz IOENGEINUANVRR-RISCZKNCSA-N 0 3 398.219 3.489 10 0 GGAEHN CO[C@H](CNCc1cn(-c2cccc(Br)c2)nc1C)[C@@H]1CCOC1 ZINC000657541640 567067925 /nfs/dbraw/zinc/06/79/25/567067925.db2.gz QPLDJVKGWAZSOL-RDTXWAMCSA-N 0 3 394.313 3.084 10 0 GGAEHN OCCCN1CCC[C@@H]1CN[C@@H]1CCCOc2ccc(Br)cc21 ZINC000453266980 567068806 /nfs/dbraw/zinc/06/88/06/567068806.db2.gz OVHCDUNOUIZAEM-NVXWUHKLSA-N 0 3 383.330 3.099 10 0 GGAEHN CS(=O)(=O)CC1(CCNCc2c(F)ccc(Br)c2F)CC1 ZINC000657547451 567068865 /nfs/dbraw/zinc/06/88/65/567068865.db2.gz PTESLZXJJQATAM-UHFFFAOYSA-N 0 3 382.270 3.032 10 0 GGAEHN CS(=O)(=O)CC1(CCNCc2cnc(CCc3ccccc3)s2)CC1 ZINC000657547465 567069555 /nfs/dbraw/zinc/06/95/55/567069555.db2.gz QFIQJTYTRPWRDR-UHFFFAOYSA-N 0 3 378.563 3.233 10 0 GGAEHN CS(=O)(=O)CC1(CCNCc2cc(Cl)ccc2Br)CC1 ZINC000657548448 567069636 /nfs/dbraw/zinc/06/96/36/567069636.db2.gz WJKUVEALAOFGGJ-UHFFFAOYSA-N 0 3 380.735 3.407 10 0 GGAEHN CC[C@H](N[C@@H](C)c1ccc(S(=O)(=O)C2CCCC2)cc1)[C@@H](O)C(F)F ZINC000453273103 567070679 /nfs/dbraw/zinc/07/06/79/567070679.db2.gz UAXNPALDGBBKNM-AFAVFJNCSA-N 0 3 375.481 3.458 10 0 GGAEHN COC[C@@H](NCc1nc(-c2ccc(Br)cc2)c[nH]1)C1CCOCC1 ZINC000657565126 567071105 /nfs/dbraw/zinc/07/11/05/567071105.db2.gz HDQCFRYBJKVZOY-QGZVFWFLSA-N 0 3 394.313 3.370 10 0 GGAEHN Ic1ccc2c(c1)[C@@H](NCC1=CCOCC1)CCCO2 ZINC000453278460 567071142 /nfs/dbraw/zinc/07/11/42/567071142.db2.gz CXYDKLOOTBHESX-HNNXBMFYSA-N 0 3 385.245 3.441 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1cc(Br)cc2ccccc21 ZINC000521646895 567072799 /nfs/dbraw/zinc/07/27/99/567072799.db2.gz BUJAYOLVGQKINS-MRXNPFEDSA-N 0 3 391.309 3.443 10 0 GGAEHN O[C@@H]1CCN(Cc2ccc(CNCc3cccc(F)c3Br)cc2)C1 ZINC000657595726 567074526 /nfs/dbraw/zinc/07/45/26/567074526.db2.gz JOBWLMCOELPYAQ-QGZVFWFLSA-N 0 3 393.300 3.445 10 0 GGAEHN O[C@@H]1CCN(Cc2ccc(CNCc3cc(F)cc(Br)c3)cc2)C1 ZINC000657595121 567074841 /nfs/dbraw/zinc/07/48/41/567074841.db2.gz FKTXHMXZOWLXGE-LJQANCHMSA-N 0 3 393.300 3.445 10 0 GGAEHN O[C@H]1CCN(Cc2ccc(CNCc3cccc(Br)c3F)cc2)C1 ZINC000657596455 567074908 /nfs/dbraw/zinc/07/49/08/567074908.db2.gz NHQURHJYFDLQAD-KRWDZBQOSA-N 0 3 393.300 3.445 10 0 GGAEHN CCOc1c(Br)cc(CNCCO[C@@H]2CC2(F)F)cc1OC ZINC000657618453 567077305 /nfs/dbraw/zinc/07/73/05/567077305.db2.gz UJQKHNYJQWXENU-CYBMUJFWSA-N 0 3 380.229 3.370 10 0 GGAEHN C[C@@H]1CC[C@H](NCc2ccnc3c(Br)cccc23)CS1(=O)=O ZINC000657637460 567078508 /nfs/dbraw/zinc/07/85/08/567078508.db2.gz IVHAATIKNYVWEF-YPMHNXCESA-N 0 3 383.311 3.053 10 0 GGAEHN O[C@@H]1CCC[C@H]1CN[C@H]1CCCOc2ccc(I)cc21 ZINC000453359448 567079649 /nfs/dbraw/zinc/07/96/49/567079649.db2.gz AITOXCJFDISERM-TUKIKUTGSA-N 0 3 387.261 3.256 10 0 GGAEHN CN(C)C[C@@]1(O)CCCN(C(=O)c2ccc3cc(Br)ccc3c2)C1 ZINC000614066372 567080397 /nfs/dbraw/zinc/08/03/97/567080397.db2.gz DCAQLTMZHSHZBM-IBGZPJMESA-N 0 3 391.309 3.131 10 0 GGAEHN C[C@H](Cc1ccc(F)cc1Br)N[C@H]1CC[C@@H](C)S(=O)(=O)C1 ZINC000657640233 567080908 /nfs/dbraw/zinc/08/09/08/567080908.db2.gz WRKQGQIHLXSGRW-GYSYKLTISA-N 0 3 378.307 3.075 10 0 GGAEHN CN(C)C[C@@]1(O)CCCN(C(=O)c2sc3ccccc3c2Br)C1 ZINC000614064325 567081114 /nfs/dbraw/zinc/08/11/14/567081114.db2.gz NWLUSXPUDCIDMQ-KRWDZBQOSA-N 0 3 397.338 3.193 10 0 GGAEHN CN(C)C[C@]1(O)CCCN(C(=O)c2ccc3cc(Br)ccc3c2)C1 ZINC000614066373 567081211 /nfs/dbraw/zinc/08/12/11/567081211.db2.gz DCAQLTMZHSHZBM-LJQANCHMSA-N 0 3 391.309 3.131 10 0 GGAEHN Cc1cc(Br)cc2c(C(=O)N3CCC[C@](O)(CN(C)C)C3)coc21 ZINC000614064518 567081224 /nfs/dbraw/zinc/08/12/24/567081224.db2.gz GPROIZPCGNWXAQ-SFHVURJKSA-N 0 3 395.297 3.032 10 0 GGAEHN CN(C)C[C@]1(O)CCCN(C(=O)c2cc3ccc(Br)cc3s2)C1 ZINC000614070405 567081237 /nfs/dbraw/zinc/08/12/37/567081237.db2.gz KNBMWIJDQCYXHT-QGZVFWFLSA-N 0 3 397.338 3.193 10 0 GGAEHN CCN1CCN(CCCCNC(=O)c2ccc(C)c(Br)c2C)CC1 ZINC000682900192 567081509 /nfs/dbraw/zinc/08/15/09/567081509.db2.gz VDFREMZQOWSJQZ-UHFFFAOYSA-N 0 3 396.373 3.213 10 0 GGAEHN C[C@@H]1CCC[C@@H](CNCc2ccc(Br)cc2N2CCOCC2)O1 ZINC000657662521 567082209 /nfs/dbraw/zinc/08/22/09/567082209.db2.gz ADKHWLABOZQNNC-PBHICJAKSA-N 0 3 383.330 3.333 10 0 GGAEHN COc1cc(SC)ccc1NC(=O)C(C[C@H]1COCCO1)C(F)(F)F ZINC000614081854 567082411 /nfs/dbraw/zinc/08/24/11/567082411.db2.gz MYPQPCAPNFOOKT-JQWIXIFHSA-N 0 3 379.400 3.340 10 0 GGAEHN Cn1cc(C[C@@H]2CCC[C@H]2NCc2cn3ccc(Br)cc3n2)cn1 ZINC000657685960 567084282 /nfs/dbraw/zinc/08/42/82/567084282.db2.gz BIHURFHZSFYPSB-WMLDXEAASA-N 0 3 388.313 3.331 10 0 GGAEHN C[C@@H](CC(=O)NC[C@@]1(N(C)C)CCSC1)c1ccc(Br)cc1 ZINC000431493313 567084396 /nfs/dbraw/zinc/08/43/96/567084396.db2.gz IGTZFSUXUXEVSG-GUYCJALGSA-N 0 3 385.371 3.496 10 0 GGAEHN CSc1c(C(=O)N(C)C[C@@H]2CCN(Cc3ccc(C)s3)C2)cnn1C ZINC000521885641 567084836 /nfs/dbraw/zinc/08/48/36/567084836.db2.gz VWRWGLRDVLXADL-AWEZNQCLSA-N 0 3 378.567 3.106 10 0 GGAEHN C[C@H](CC(=O)NC[C@]1(N(C)C)CCSC1)c1ccc(Br)cc1 ZINC000431493311 567085007 /nfs/dbraw/zinc/08/50/07/567085007.db2.gz IGTZFSUXUXEVSG-CXAGYDPISA-N 0 3 385.371 3.496 10 0 GGAEHN Cn1cc(C[C@@H]2CCC[C@@H]2NCc2cc3c(cc2Br)OCO3)cn1 ZINC000657689899 567086392 /nfs/dbraw/zinc/08/63/92/567086392.db2.gz ZMURWBGBEZWDNX-BBRMVZONSA-N 0 3 392.297 3.412 10 0 GGAEHN CCN1CCCN(C(=O)Cn2c(C)c(Br)c3ccccc32)CC1 ZINC000521923904 567086607 /nfs/dbraw/zinc/08/66/07/567086607.db2.gz REUZTZINBVUJGJ-UHFFFAOYSA-N 0 3 378.314 3.266 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CNCCc1cncc(C)n1 ZINC000657713779 567088157 /nfs/dbraw/zinc/08/81/57/567088157.db2.gz YEICSQWYAZSSJQ-UHFFFAOYSA-N 0 3 386.297 3.374 10 0 GGAEHN CC(C)N1CCCN(c2nnc(-c3ccc(Br)cc3)n2C)CC1 ZINC000453436096 567089308 /nfs/dbraw/zinc/08/93/08/567089308.db2.gz YYCMXFXOPWKVBN-UHFFFAOYSA-N 0 3 378.318 3.165 10 0 GGAEHN Fc1cc(CN[C@@H]2C[C@@H](N3CCOCC3)C23CCC3)ccc1Br ZINC000657746910 567091670 /nfs/dbraw/zinc/09/16/70/567091670.db2.gz JNBKRCDQQMLBAO-IAGOWNOFSA-N 0 3 383.305 3.321 10 0 GGAEHN Fc1ccc(CN[C@@H]2C[C@@H](N3CCOCC3)C23CCC3)c(Br)c1 ZINC000657747613 567092490 /nfs/dbraw/zinc/09/24/90/567092490.db2.gz PJOYEAMOANRGAO-IAGOWNOFSA-N 0 3 383.305 3.321 10 0 GGAEHN Cc1cc(Br)c(CNC[C@H](Cc2ccc(F)cc2)C(N)=O)s1 ZINC000453574505 567092626 /nfs/dbraw/zinc/09/26/26/567092626.db2.gz RBKLECBPTXCTIH-LBPRGKRZSA-N 0 3 385.302 3.392 10 0 GGAEHN CCc1nnc(C2CCN(Cc3cn4cc(Br)ccc4n3)CC2)[nH]1 ZINC000683039420 567092733 /nfs/dbraw/zinc/09/27/33/567092733.db2.gz OEBGVSRUISHFTI-UHFFFAOYSA-N 0 3 389.301 3.157 10 0 GGAEHN COc1ccc(CN[C@@H]2C[C@@H](N3CCOCC3)C23CCC3)c(Br)c1 ZINC000657749532 567093154 /nfs/dbraw/zinc/09/31/54/567093154.db2.gz XZEIVCBUJUEJBW-QZTJIDSGSA-N 0 3 395.341 3.191 10 0 GGAEHN NC(=O)[C@H](N[C@@H]1CCC[C@H]([C@@H]2CCOC2)C1)c1cccc(Br)c1 ZINC000545983434 567093801 /nfs/dbraw/zinc/09/38/01/567093801.db2.gz IIDCENIDXUNYCO-LBRJOISOSA-N 0 3 381.314 3.160 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1ccc(Br)c2cc(C)oc21 ZINC000473633087 567093931 /nfs/dbraw/zinc/09/39/31/567093931.db2.gz GNHUYHNVJHGBQQ-ZDUSSCGKSA-N 0 3 395.297 3.344 10 0 GGAEHN OC1(CNCc2cc(Br)c3c(c2)OCCO3)CCC(F)(F)CC1 ZINC000657776155 567094306 /nfs/dbraw/zinc/09/43/06/567094306.db2.gz NJNUBBQQBZLADM-UHFFFAOYSA-N 0 3 392.240 3.250 10 0 GGAEHN NC(=O)[C@H](N[C@@H]1CCC[C@H]([C@H]2CCOC2)C1)c1cccc(Br)c1 ZINC000545983432 567094303 /nfs/dbraw/zinc/09/43/03/567094303.db2.gz IIDCENIDXUNYCO-GUDXXQAFSA-N 0 3 381.314 3.160 10 0 GGAEHN CNC(=O)CC1(C[NH2+]Cc2cc(Br)c([O-])c(OC)c2)CCCCC1 ZINC000657763416 567094996 /nfs/dbraw/zinc/09/49/96/567094996.db2.gz XLQCOTJUSCAQQC-UHFFFAOYSA-N 0 3 399.329 3.340 10 0 GGAEHN COc1cc(Br)c(CNCC2(O)CCC(F)(F)CC2)cc1OC ZINC000657775780 567095382 /nfs/dbraw/zinc/09/53/82/567095382.db2.gz KONMWCDONVJXSH-UHFFFAOYSA-N 0 3 394.256 3.496 10 0 GGAEHN CCS(=O)(=O)c1c(Cl)cccc1CNCC1(CC(N)=O)CCCCC1 ZINC000657799416 567096483 /nfs/dbraw/zinc/09/64/83/567096483.db2.gz ZIZBXQLZFNXFCB-UHFFFAOYSA-N 0 3 386.945 3.049 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1cc(C)c(Br)cc1F ZINC000497432365 567096795 /nfs/dbraw/zinc/09/67/95/567096795.db2.gz DBZLOEVFJVQVLN-GFCCVEGCSA-N 0 3 388.281 3.129 10 0 GGAEHN C[C@H](NC1CCN(Cc2ccccc2Br)CC1)c1nccn1C ZINC000657794745 567096825 /nfs/dbraw/zinc/09/68/25/567096825.db2.gz VSDUUGWWYZVONU-AWEZNQCLSA-N 0 3 377.330 3.498 10 0 GGAEHN COc1ccc(CNCC2(CC(N)=O)CCCCC2)c(Br)c1O ZINC000657796984 567096886 /nfs/dbraw/zinc/09/68/86/567096886.db2.gz BFRJCHSIWKNJSX-UHFFFAOYSA-N 0 3 385.302 3.079 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N(C)[C@@H]1CN2CCC1CC2 ZINC000522041906 567097025 /nfs/dbraw/zinc/09/70/25/567097025.db2.gz GBCVAVUZIBXONE-QGZVFWFLSA-N 0 3 390.325 3.265 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1cc(C)c(Br)cc1F ZINC000497432370 567097246 /nfs/dbraw/zinc/09/72/46/567097246.db2.gz DBZLOEVFJVQVLN-LBPRGKRZSA-N 0 3 388.281 3.129 10 0 GGAEHN COc1c(Br)cc(CNC2CC(CO)C2)cc1Br ZINC000657812723 567098676 /nfs/dbraw/zinc/09/86/76/567098676.db2.gz MGRHYVHZVUPPDV-UHFFFAOYSA-N 0 3 379.092 3.081 10 0 GGAEHN CS[C@H]1CN(C(=O)CCC(=O)c2cc(C)sc2C)C[C@@H]1N1CCCC1 ZINC000546039292 567099054 /nfs/dbraw/zinc/09/90/54/567099054.db2.gz DKBBJIVHMADJQI-WMZOPIPTSA-N 0 3 380.579 3.366 10 0 GGAEHN CS[C@@H]1CN(C(=O)CCC(=O)c2cc(C)sc2C)C[C@H]1N1CCCC1 ZINC000546039291 567099146 /nfs/dbraw/zinc/09/91/46/567099146.db2.gz DKBBJIVHMADJQI-SJLPKXTDSA-N 0 3 380.579 3.366 10 0 GGAEHN COC[C@@H](CC1CCOCC1)NCc1cc2c(c(Br)c1)OCO2 ZINC000657848854 567100869 /nfs/dbraw/zinc/10/08/69/567100869.db2.gz BTGMEVAKCUVIIF-CQSZACIVSA-N 0 3 386.286 3.099 10 0 GGAEHN C[C@@H](NC(=O)Nc1cccc(CN(C)C)c1)c1ncc(Br)cn1 ZINC000431693868 567101251 /nfs/dbraw/zinc/10/12/51/567101251.db2.gz UMCXAOPUMMBFAB-LLVKDONJSA-N 0 3 378.274 3.183 10 0 GGAEHN CC[C@H]1CN(C)CCCN1C(=O)Cc1noc2ccc(Br)cc21 ZINC000614331544 567102909 /nfs/dbraw/zinc/10/29/09/567102909.db2.gz QWVMIFCSYGDAJT-ZDUSSCGKSA-N 0 3 380.286 3.076 10 0 GGAEHN CN(C)CCN1CCN(C(=O)c2ccc(-c3ccc(Cl)cc3)s2)CC1 ZINC000497513856 567102977 /nfs/dbraw/zinc/10/29/77/567102977.db2.gz WXPLRMFVTBDLTN-UHFFFAOYSA-N 0 3 377.941 3.388 10 0 GGAEHN CC[C@@H]1CN(C)CCCN1C(=O)Cc1noc2ccc(Br)cc21 ZINC000614331542 567103850 /nfs/dbraw/zinc/10/38/50/567103850.db2.gz QWVMIFCSYGDAJT-CYBMUJFWSA-N 0 3 380.286 3.076 10 0 GGAEHN OC[C@@H](CNCc1cn2cccc(F)c2n1)Cc1ccc(Br)cc1 ZINC000683205774 567106162 /nfs/dbraw/zinc/10/61/62/567106162.db2.gz IPJDBWJIUFMEBW-CQSZACIVSA-N 0 3 392.272 3.177 10 0 GGAEHN CN(C)CC1(NC(=O)c2cc(Br)cc(N3CCCC3)c2)CCC1 ZINC000614401805 567109069 /nfs/dbraw/zinc/10/90/69/567109069.db2.gz WGXVWOKZNPCKBH-UHFFFAOYSA-N 0 3 380.330 3.263 10 0 GGAEHN CN(C)[C@]1(CNC(=O)C2(c3ccccc3Br)CC2)CCSC1 ZINC000473860582 567109882 /nfs/dbraw/zinc/10/98/82/567109882.db2.gz SVSCCLFGJXFEJY-INIZCTEOSA-N 0 3 383.355 3.034 10 0 GGAEHN CN(CCN1CCCC1)C(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000497583898 567111108 /nfs/dbraw/zinc/11/11/08/567111108.db2.gz DNFCTHYXQLFJJW-HNNXBMFYSA-N 0 3 382.302 3.010 10 0 GGAEHN Cc1cc(Br)cc(C)c1S(=O)(=O)N(C)C[C@@H]1CCCN(C)C1 ZINC000522373135 567113783 /nfs/dbraw/zinc/11/37/83/567113783.db2.gz JYPIYEDMDADBMU-CQSZACIVSA-N 0 3 389.359 3.028 10 0 GGAEHN C[C@@H](NC[C@H]1CCN1C(C)(C)C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000658060170 567118987 /nfs/dbraw/zinc/11/89/87/567118987.db2.gz KGVZBSUNOKEYBM-GHMZBOCLSA-N 0 3 394.368 3.164 10 0 GGAEHN C[C@@H](CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccccn1 ZINC000658061305 567119100 /nfs/dbraw/zinc/11/91/00/567119100.db2.gz APCAVXZAIOJOPW-LRDDRELGSA-N 0 3 395.322 3.456 10 0 GGAEHN C[C@@H](CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccccn1 ZINC000658061303 567119205 /nfs/dbraw/zinc/11/92/05/567119205.db2.gz APCAVXZAIOJOPW-BLLLJJGKSA-N 0 3 395.322 3.456 10 0 GGAEHN C[C@H](CN[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)c1ccccn1 ZINC000658065764 567119243 /nfs/dbraw/zinc/11/92/43/567119243.db2.gz FRJZQTXTXAVURY-GHMZBOCLSA-N 0 3 388.320 3.490 10 0 GGAEHN C[C@@H](NC[C@H](C)c1ccccn1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000658065767 567119307 /nfs/dbraw/zinc/11/93/07/567119307.db2.gz FRJZQTXTXAVURY-WDEREUQCSA-N 0 3 388.320 3.490 10 0 GGAEHN COC[C@H](CCN[C@@H](C)c1nnn(-c2cccc(Br)c2)c1C)OC ZINC000658084791 567120342 /nfs/dbraw/zinc/12/03/42/567120342.db2.gz NYNJDYOVZJKMBC-LRDDRELGSA-N 0 3 397.317 3.040 10 0 GGAEHN COC[C@@H](NCCC1(CS(C)(=O)=O)CC1)c1cccc(C(F)(F)F)c1 ZINC000658079177 567120363 /nfs/dbraw/zinc/12/03/63/567120363.db2.gz WJTAYHWCKDKGHV-OAHLLOKOSA-N 0 3 379.444 3.197 10 0 GGAEHN COc1ccc([C@H](C)NCCC2(CS(C)(=O)=O)CC2)c(Br)c1 ZINC000658080694 567120556 /nfs/dbraw/zinc/12/05/56/567120556.db2.gz LRZCHSUAMUBRDS-LBPRGKRZSA-N 0 3 390.343 3.323 10 0 GGAEHN C[C@H]1CCC[N@H+](CCCCNC(=O)Cc2ccc(Br)cc2[O-])C1 ZINC000431992417 567121485 /nfs/dbraw/zinc/12/14/85/567121485.db2.gz NQXGNSQQZFNROU-AWEZNQCLSA-N 0 3 383.330 3.326 10 0 GGAEHN C[C@H]1CCC[N@@H+](CCCCNC(=O)Cc2ccc(Br)cc2[O-])C1 ZINC000431992417 567121493 /nfs/dbraw/zinc/12/14/93/567121493.db2.gz NQXGNSQQZFNROU-AWEZNQCLSA-N 0 3 383.330 3.326 10 0 GGAEHN C[C@@H]1CCC[N@H+](CCCCNC(=O)Cc2ccc(Br)cc2[O-])C1 ZINC000431992418 567121856 /nfs/dbraw/zinc/12/18/56/567121856.db2.gz NQXGNSQQZFNROU-CQSZACIVSA-N 0 3 383.330 3.326 10 0 GGAEHN C[C@@H]1CCC[N@@H+](CCCCNC(=O)Cc2ccc(Br)cc2[O-])C1 ZINC000431992418 567121860 /nfs/dbraw/zinc/12/18/60/567121860.db2.gz NQXGNSQQZFNROU-CQSZACIVSA-N 0 3 383.330 3.326 10 0 GGAEHN CN(C)CCn1cc(NC(=O)C(C)(C)c2cccc(Br)c2)cn1 ZINC000588231836 567123727 /nfs/dbraw/zinc/12/37/27/567123727.db2.gz XNNGOFISWUXEHV-UHFFFAOYSA-N 0 3 379.302 3.124 10 0 GGAEHN CC[C@@H]1C[C@H](N[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)CCO1 ZINC000566082973 567124034 /nfs/dbraw/zinc/12/40/34/567124034.db2.gz MGSQNHGUCOHMKY-UMVBOHGHSA-N 0 3 388.327 3.215 10 0 GGAEHN Cc1ccncc1CCN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000658123054 567124138 /nfs/dbraw/zinc/12/41/38/567124138.db2.gz IVEFHDMHYSELAE-NSHDSACASA-N 0 3 388.320 3.238 10 0 GGAEHN C[C@@H](NCc1ccc(CN2CC[C@H](O)C2)cc1)c1cncc(Br)c1 ZINC000658140621 567124435 /nfs/dbraw/zinc/12/44/35/567124435.db2.gz VNODHFDKAYLBER-KUHUBIRLSA-N 0 3 390.325 3.262 10 0 GGAEHN O=S1(=O)C[C@@H](CNC2CC(c3cccc(Cl)c3)C2)Oc2ccccc21 ZINC000566067911 567124503 /nfs/dbraw/zinc/12/45/03/567124503.db2.gz IGXQCUVRHSJVHA-BDVYOWHSSA-N 0 3 377.893 3.411 10 0 GGAEHN CC[C@@H]1C[C@@H](N[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)CCO1 ZINC000566082971 567124648 /nfs/dbraw/zinc/12/46/48/567124648.db2.gz MGSQNHGUCOHMKY-GZBFAFLISA-N 0 3 388.327 3.215 10 0 GGAEHN CC[C@H](NC[C@]1(OCCO)CCOC1)c1ccc(Br)cc1Cl ZINC000658143246 567124812 /nfs/dbraw/zinc/12/48/12/567124812.db2.gz GMPJOIFFSJAEER-JKSUJKDBSA-N 0 3 392.721 3.311 10 0 GGAEHN OCCO[C@@]1(CN[C@H](Cc2ccccc2Cl)c2ccsc2)CCOC1 ZINC000658143757 567125939 /nfs/dbraw/zinc/12/59/39/567125939.db2.gz IOVWIYOXJVYFKL-RTBURBONSA-N 0 3 381.925 3.443 10 0 GGAEHN COc1ccc([C@@H](CN(C)C)NC(=O)c2cncc(Br)c2C)cc1 ZINC000614612148 567126141 /nfs/dbraw/zinc/12/61/41/567126141.db2.gz TWOQRVPUCCEKPT-QGZVFWFLSA-N 0 3 392.297 3.194 10 0 GGAEHN CN(C)Cc1ccc(NC(=O)[C@@H](N)Cc2ccccc2)cc1Br ZINC000566101376 567126288 /nfs/dbraw/zinc/12/62/88/567126288.db2.gz LLQHRARCKHTYPJ-KRWDZBQOSA-N 0 3 376.298 3.019 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NC[C@@H]1C[C@H](c2ccccc2)CO1 ZINC000658206634 567130060 /nfs/dbraw/zinc/13/00/60/567130060.db2.gz JWYMVGJOSQDBNE-HFTRVMKXSA-N 0 3 391.309 3.162 10 0 GGAEHN C[C@H](NC[C@H]1CC(=O)N(C)C1)c1ccc(Br)cc1Br ZINC000658244060 567130924 /nfs/dbraw/zinc/13/09/24/567130924.db2.gz JVEYOAKTUNQYJD-VHSXEESVSA-N 0 3 390.119 3.341 10 0 GGAEHN C[C@@H](NC[C@H]1CC(=O)N(C)C1)c1ccc(Br)cc1Br ZINC000658244058 567131472 /nfs/dbraw/zinc/13/14/72/567131472.db2.gz JVEYOAKTUNQYJD-NXEZZACHSA-N 0 3 390.119 3.341 10 0 GGAEHN C[C@H](NC[C@@H]1C(C)(C)C1(F)F)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000658282372 567133943 /nfs/dbraw/zinc/13/39/43/567133943.db2.gz UZMAMCPMOWIGAK-QPUJVOFHSA-N 0 3 397.285 3.038 10 0 GGAEHN CCS(=O)(=O)C1(CN[C@@H](C)Cc2ccc(Br)cc2F)CC1 ZINC000658298592 567134048 /nfs/dbraw/zinc/13/40/48/567134048.db2.gz IDIFBJZYFZLWDP-NSHDSACASA-N 0 3 378.307 3.076 10 0 GGAEHN CN(Cc1csc(Br)c1)C[C@H](O)CN(C)Cc1ccccc1 ZINC000588690509 567134080 /nfs/dbraw/zinc/13/40/80/567134080.db2.gz DSDYCBVPWSKMKU-MRXNPFEDSA-N 0 3 383.355 3.435 10 0 GGAEHN C[C@@H](NC[C@@H]1C(C)(C)C1(F)F)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000658282370 567134178 /nfs/dbraw/zinc/13/41/78/567134178.db2.gz UZMAMCPMOWIGAK-PRHODGIISA-N 0 3 397.285 3.038 10 0 GGAEHN CN(Cc1ccccc1)C[C@@H](O)CN(C)Cc1cccc(Br)c1 ZINC000588690899 567134457 /nfs/dbraw/zinc/13/44/57/567134457.db2.gz KQWTWPIBQOLARM-LJQANCHMSA-N 0 3 377.326 3.374 10 0 GGAEHN C[C@@H](N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2)c1cncc(Br)c1 ZINC000658290906 567134628 /nfs/dbraw/zinc/13/46/28/567134628.db2.gz HYJLTUBDLXFHLL-KBRIMQKVSA-N 0 3 380.330 3.138 10 0 GGAEHN O=C1N(CCN[C@@H]2CCc3c2cccc3Br)C[C@@H]2CCCCN12 ZINC000658306473 567136017 /nfs/dbraw/zinc/13/60/17/567136017.db2.gz PWFUGUHNVWYBBJ-SUMWQHHRSA-N 0 3 378.314 3.316 10 0 GGAEHN O=C1N(CCN[C@@H]2CCc3c2cc(Br)cc3F)C[C@H]2CCCCN12 ZINC000658305604 567136057 /nfs/dbraw/zinc/13/60/57/567136057.db2.gz AVTVZEXNNWKFSR-CXAGYDPISA-N 0 3 396.304 3.455 10 0 GGAEHN CN(Cc1ccc(F)cc1Br)C(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C ZINC000566195899 567137513 /nfs/dbraw/zinc/13/75/13/567137513.db2.gz SJFNMFASXAGDDO-QIIPPGSGSA-N 0 3 399.304 3.079 10 0 GGAEHN C[C@H](NC[C@H]1CSc2ccccc2O1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000566220667 567139423 /nfs/dbraw/zinc/13/94/23/567139423.db2.gz LAJSBBDECOITLU-JSGCOSHPSA-N 0 3 381.494 3.433 10 0 GGAEHN O[C@@H](COC[C@@H]1CCCO1)CN1CC=C(c2cccc(Br)c2)CC1 ZINC000546586393 567140665 /nfs/dbraw/zinc/14/06/65/567140665.db2.gz HWFDQCLXNNBSBM-MOPGFXCFSA-N 0 3 396.325 3.095 10 0 GGAEHN O[C@@H](COC[C@H]1CCCO1)CN1CC=C(c2cccc(Br)c2)CC1 ZINC000546586396 567141130 /nfs/dbraw/zinc/14/11/30/567141130.db2.gz HWFDQCLXNNBSBM-RTBURBONSA-N 0 3 396.325 3.095 10 0 GGAEHN O=C(CN1CCNC[C@@H]1C(F)F)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000566243540 567142809 /nfs/dbraw/zinc/14/28/09/567142809.db2.gz WUWCYJWTROOVJL-LSDHHAIUSA-N 0 3 392.277 3.196 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N(C)CCCN(C)Cc1ccncc1 ZINC000614930013 567148376 /nfs/dbraw/zinc/14/83/76/567148376.db2.gz WNZSHYVLFUCNCB-UHFFFAOYSA-N 0 3 391.313 3.142 10 0 GGAEHN CN1CCC[C@@H](CNc2ncnc3c2NC(=O)CS3)[C@H]1c1cccs1 ZINC000683752235 567152025 /nfs/dbraw/zinc/15/20/25/567152025.db2.gz KPHXVTRNBJCFIZ-NHYWBVRUSA-N 0 3 375.523 3.077 10 0 GGAEHN CN(Cc1c(F)ccc(I)c1F)[C@@H]1CCN(C2CC2)C1 ZINC000474264486 567152275 /nfs/dbraw/zinc/15/22/75/567152275.db2.gz HVZPKECDIPACJB-LLVKDONJSA-N 0 3 392.231 3.238 10 0 GGAEHN Cn1ncc(Br)c1CN[C@H](CN1CCCCC1)c1ccccc1 ZINC000683769025 567153682 /nfs/dbraw/zinc/15/36/82/567153682.db2.gz CAPRIHQRTIRWRN-QGZVFWFLSA-N 0 3 377.330 3.499 10 0 GGAEHN Cc1cc(Br)cc2cc(C(=O)N3CCC[C@@](O)(CN(C)C)C3)oc21 ZINC000683909145 567160426 /nfs/dbraw/zinc/16/04/26/567160426.db2.gz GVYQCUIOESYWLQ-GOSISDBHSA-N 0 3 395.297 3.032 10 0 GGAEHN Cc1c2cc(Br)ccc2oc1C(=O)N1CCC[C@@](O)(CN(C)C)C1 ZINC000683909337 567160540 /nfs/dbraw/zinc/16/05/40/567160540.db2.gz AIVROMZMCYBGNH-GOSISDBHSA-N 0 3 395.297 3.032 10 0 GGAEHN CN(C)C[C@]1(O)CCCN(C(=O)CCCc2cc(Cl)sc2Cl)C1 ZINC000683910810 567160552 /nfs/dbraw/zinc/16/05/52/567160552.db2.gz WDHZJMGTMHSWPT-MRXNPFEDSA-N 0 3 379.353 3.293 10 0 GGAEHN C[C@H](NC(=O)NCCN1[C@H](C)CCC[C@H]1C)c1ccc(Br)cn1 ZINC000474334075 567161114 /nfs/dbraw/zinc/16/11/14/567161114.db2.gz TZGULLJGNRJRCK-MCIONIFRSA-N 0 3 383.334 3.467 10 0 GGAEHN CN(Cc1noc(Cc2ccc(Br)cc2)n1)[C@@H]1CCN(C2CC2)C1 ZINC000523582695 567163793 /nfs/dbraw/zinc/16/37/93/567163793.db2.gz DFXSEODAHIKJEC-MRXNPFEDSA-N 0 3 391.313 3.091 10 0 GGAEHN Cc1cc(Br)cc(C)c1CNC(=O)N1CC[C@H](N2CCCC2)C1 ZINC000589218700 567166161 /nfs/dbraw/zinc/16/61/61/567166161.db2.gz VZWMKLJKBVBJAJ-INIZCTEOSA-N 0 3 380.330 3.446 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)C1=Cc2cc(Br)ccc2OC1 ZINC000498328488 567167909 /nfs/dbraw/zinc/16/79/09/567167909.db2.gz LVTDCWVIJYIMPW-INIZCTEOSA-N 0 3 381.314 3.317 10 0 GGAEHN N[C@@H]1CN(S(=O)(=O)c2ccc(F)cc2Cl)CC[C@H]1c1ccc(F)cc1 ZINC000566571787 567168420 /nfs/dbraw/zinc/16/84/20/567168420.db2.gz FQFPJXMLNUDWOW-GOEBONIOSA-N 0 3 386.851 3.124 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)COc1ccc(F)cc1Br ZINC000498335711 567168997 /nfs/dbraw/zinc/16/89/97/567168997.db2.gz WPEYGCFFXJELOM-ZDUSSCGKSA-N 0 3 375.282 3.060 10 0 GGAEHN CN1CC[C@@]2(CCN(C(=O)c3c(F)c(F)c(Br)c(F)c3F)C2)C1 ZINC000615205048 567169792 /nfs/dbraw/zinc/16/97/92/567169792.db2.gz XMHVIOXXCBBIHV-OAHLLOKOSA-N 0 3 395.194 3.173 10 0 GGAEHN O[C@@H](CNCC1(C(F)(F)F)CC1)COc1cc(F)cc(Br)c1 ZINC000566616240 567172649 /nfs/dbraw/zinc/17/26/49/567172649.db2.gz URTOTQWIUIWIET-NSHDSACASA-N 0 3 386.183 3.260 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)CCCc1cccc(Br)c1 ZINC000615265996 567173842 /nfs/dbraw/zinc/17/38/42/567173842.db2.gz QXJDRSIZMYFSRG-QZTJIDSGSA-N 0 3 395.341 3.093 10 0 GGAEHN FC(F)(F)c1cc(Br)ccc1CNCCc1nnc2n1CCC2 ZINC000474482540 567174412 /nfs/dbraw/zinc/17/44/12/567174412.db2.gz LVURXIXRCODNAA-UHFFFAOYSA-N 0 3 389.219 3.338 10 0 GGAEHN C[C@H](CC(=O)N1CCOC[C@@H]1[C@H]1CCCN1C)c1ccc(Br)cc1 ZINC000615270002 567174566 /nfs/dbraw/zinc/17/45/66/567174566.db2.gz NSUMHNAZXDGPQO-ZTFGCOKTSA-N 0 3 395.341 3.264 10 0 GGAEHN Cc1ccc(CCC(=O)N2CCOC[C@H]2[C@H]2CCCN2C)c(Br)c1 ZINC000615270166 567174753 /nfs/dbraw/zinc/17/47/53/567174753.db2.gz OVIKQFGLFXCBJP-MSOLQXFVSA-N 0 3 395.341 3.012 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)c1ccc(Cl)c(Br)c1 ZINC000615269180 567174807 /nfs/dbraw/zinc/17/48/07/567174807.db2.gz KHDRMNGQBWPSGK-GJZGRUSLSA-N 0 3 387.705 3.038 10 0 GGAEHN C[C@H](CC(=O)N1CCOC[C@H]1[C@H]1CCCN1C)c1ccc(Br)cc1 ZINC000615270001 567175667 /nfs/dbraw/zinc/17/56/67/567175667.db2.gz NSUMHNAZXDGPQO-OLMNPRSZSA-N 0 3 395.341 3.264 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)c1ccc(Cl)c(Br)c1 ZINC000615269181 567175824 /nfs/dbraw/zinc/17/58/24/567175824.db2.gz KHDRMNGQBWPSGK-HUUCEWRRSA-N 0 3 387.705 3.038 10 0 GGAEHN Cc1ccc(CCC(=O)N2CCOC[C@H]2[C@@H]2CCCN2C)c(Br)c1 ZINC000615270168 567175830 /nfs/dbraw/zinc/17/58/30/567175830.db2.gz OVIKQFGLFXCBJP-ROUUACIJSA-N 0 3 395.341 3.012 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000615277547 567175930 /nfs/dbraw/zinc/17/59/30/567175930.db2.gz WLSULDHXXSAZRS-MJSCVDMRSA-N 0 3 383.319 3.419 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000615271758 567175976 /nfs/dbraw/zinc/17/59/76/567175976.db2.gz YIHSJROWKYAHKR-CABCVRRESA-N 0 3 376.806 3.294 10 0 GGAEHN COc1c(O)cccc1CNCCc1cn2cc(Br)cc(C)c2n1 ZINC000546973353 567177284 /nfs/dbraw/zinc/17/72/84/567177284.db2.gz YKAZLIKZGVXPEX-UHFFFAOYSA-N 0 3 390.281 3.452 10 0 GGAEHN CCSc1cccc(Br)c1NC(=O)N1CC[C@@H](F)[C@H](N)C1 ZINC000659014044 567177555 /nfs/dbraw/zinc/17/75/55/567177555.db2.gz FUNGTUWQHVRQMX-GHMZBOCLSA-N 0 3 376.295 3.464 10 0 GGAEHN Cc1nc(CNC(=O)NC[C@H](C)N2CCC[C@@H](C)C2)sc1Br ZINC000454492811 567178458 /nfs/dbraw/zinc/17/84/58/567178458.db2.gz ABCIDTBTPRNIRW-MNOVXSKESA-N 0 3 389.363 3.134 10 0 GGAEHN N[C@@H]1CN(C(=O)Nc2nnc(-c3cc(Cl)cc(Cl)c3)s2)CC[C@H]1F ZINC000659031985 567179023 /nfs/dbraw/zinc/17/90/23/567179023.db2.gz YZHUMAYJBDSJDZ-GHMZBOCLSA-N 0 3 390.271 3.415 10 0 GGAEHN CCCOc1c(Br)cc(C(=O)N2CCC[C@@H]2CN(C)C)cc1OC ZINC000524103738 567181416 /nfs/dbraw/zinc/18/14/16/567181416.db2.gz XZACJLNJWBMHTG-CQSZACIVSA-N 0 3 399.329 3.413 10 0 GGAEHN COc1ccc(CCC(=O)N2CCN(C3CC3)C[C@H](C)C2)c(Br)c1 ZINC000615451704 567185034 /nfs/dbraw/zinc/18/50/34/567185034.db2.gz RSEACXJBRKDTCI-AWEZNQCLSA-N 0 3 395.341 3.333 10 0 GGAEHN CN(Cc1ccc(Cl)s1)C(=O)CN[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000566766278 567188199 /nfs/dbraw/zinc/18/81/99/567188199.db2.gz FLFCHWKVXQGQOJ-QFBILLFUSA-N 0 3 377.941 3.395 10 0 GGAEHN CN(Cc1ccc(Cl)s1)C(=O)CN[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000566766277 567188757 /nfs/dbraw/zinc/18/87/57/567188757.db2.gz FLFCHWKVXQGQOJ-LPHOPBHVSA-N 0 3 377.941 3.395 10 0 GGAEHN O=C(C[C@H]1NCc2ccccc21)NCCOc1ccc(Br)cc1 ZINC000659254136 567193556 /nfs/dbraw/zinc/19/35/56/567193556.db2.gz IQMUGINGTDHQPY-QGZVFWFLSA-N 0 3 375.266 3.179 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N1CC=C(c2cccc(Br)c2)CC1 ZINC000547280079 567196900 /nfs/dbraw/zinc/19/69/00/567196900.db2.gz LKNQQWYTLLZKFO-KRWDZBQOSA-N 0 3 378.314 3.342 10 0 GGAEHN CC(C)[C@H](O)CN1CCC(Oc2ccccc2I)CC1 ZINC000432833071 567197202 /nfs/dbraw/zinc/19/72/02/567197202.db2.gz BCSMNVFQZYQZQB-OAHLLOKOSA-N 0 3 389.277 3.151 10 0 GGAEHN O=C(C[C@@H]1NCc2ccccc21)N1CCC(n2cc(Br)cn2)CC1 ZINC000659280223 567198923 /nfs/dbraw/zinc/19/89/23/567198923.db2.gz JEPOZEASWGNFES-KRWDZBQOSA-N 0 3 389.297 3.044 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2ccc(Br)c(C)c2F)C[C@H]1N(C)C ZINC000566894995 567200045 /nfs/dbraw/zinc/20/00/45/567200045.db2.gz CUFONXJPRLGIOD-CHWSQXEVSA-N 0 3 375.307 3.014 10 0 GGAEHN Nc1cccc(CC(=O)NCC2(N3CCSCC3)CCCCC2)c1Cl ZINC000659284643 567200277 /nfs/dbraw/zinc/20/02/77/567200277.db2.gz GSERNLNNCMHLLL-UHFFFAOYSA-N 0 3 381.973 3.333 10 0 GGAEHN NC1(C(=O)Nc2nccn2Cc2ccc(Br)cc2)CC2(CCC2)C1 ZINC000659293252 567200492 /nfs/dbraw/zinc/20/04/92/567200492.db2.gz URKIHAHVRUPDJX-UHFFFAOYSA-N 0 3 389.297 3.294 10 0 GGAEHN CC(C)C[C@H](CNC[C@@H](O)CS(=O)(=O)c1cccs1)c1ccccc1 ZINC000474803483 567201281 /nfs/dbraw/zinc/20/12/81/567201281.db2.gz CHTUQDJJFHPQBH-QZTJIDSGSA-N 0 3 381.563 3.302 10 0 GGAEHN O=C(C[C@@H]1NCc2ccccc21)N[C@H]1COc2cc(F)c(Br)cc21 ZINC000659314959 567204461 /nfs/dbraw/zinc/20/44/61/567204461.db2.gz MNUWUICBQPWOEU-HOTGVXAUSA-N 0 3 391.240 3.373 10 0 GGAEHN CN1C[C@H]2CCN(Cc3ccc(I)c(Cl)c3)[C@H]2C1 ZINC000590010650 567204922 /nfs/dbraw/zinc/20/49/22/567204922.db2.gz OCABLSRBEQYBBL-RISCZKNCSA-N 0 3 376.669 3.081 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)Cc1ccc(Br)cc1F ZINC000659324100 567205622 /nfs/dbraw/zinc/20/56/22/567205622.db2.gz BMYXKHQDOONFGR-KRWDZBQOSA-N 0 3 377.257 3.215 10 0 GGAEHN COc1ccc(CCC(=O)N2C[C@@H](N)Cc3ccccc32)c(Br)c1 ZINC000659326060 567206086 /nfs/dbraw/zinc/20/60/86/567206086.db2.gz WMVHNKYWHQVLCE-HNNXBMFYSA-N 0 3 389.293 3.307 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)[C@H]2CCc3cc(Br)ccc32)CCSC1 ZINC000566974816 567207329 /nfs/dbraw/zinc/20/73/29/567207329.db2.gz KHZNIWPOYVBIBS-DOTOQJQBSA-N 0 3 383.355 3.032 10 0 GGAEHN Cn1cc(C(C)(C)NCCCOc2cccc(I)c2)cn1 ZINC000547413573 567207496 /nfs/dbraw/zinc/20/74/96/567207496.db2.gz NXCQEWJRXSRIGA-UHFFFAOYSA-N 0 3 399.276 3.319 10 0 GGAEHN CN(C)[C@]1(CNC(=O)[C@H]2CCc3cc(Br)ccc32)CCSC1 ZINC000566974818 567208084 /nfs/dbraw/zinc/20/80/84/567208084.db2.gz KHZNIWPOYVBIBS-RDJZCZTQSA-N 0 3 383.355 3.032 10 0 GGAEHN CNC(=O)[C@@H](NCc1ccc(OC(F)(F)F)c(Br)c1)C(C)C ZINC000474889872 567208694 /nfs/dbraw/zinc/20/86/94/567208694.db2.gz SZQBNMRNUAAGEJ-LBPRGKRZSA-N 0 3 383.208 3.208 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)COc1cc(Cl)c(Cl)cc1Cl ZINC000590119470 567209034 /nfs/dbraw/zinc/20/90/34/567209034.db2.gz YUVPUSZXFHKSNR-LLVKDONJSA-N 0 3 395.714 3.253 10 0 GGAEHN O=C(Cc1ccc(Br)cc1)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659371077 567209760 /nfs/dbraw/zinc/20/97/60/567209760.db2.gz UZRCUUCZJLQPEX-KRWDZBQOSA-N 0 3 375.266 3.291 10 0 GGAEHN COc1ccc(Br)cc1C(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659373436 567210189 /nfs/dbraw/zinc/21/01/89/567210189.db2.gz SQMWPJVUGMATKF-QGZVFWFLSA-N 0 3 391.265 3.371 10 0 GGAEHN COc1ccc(Br)cc1C(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659373434 567210543 /nfs/dbraw/zinc/21/05/43/567210543.db2.gz SQMWPJVUGMATKF-KRWDZBQOSA-N 0 3 391.265 3.371 10 0 GGAEHN N[C@@H](CC(=O)N1CCOC[C@H]1c1cccc(Br)c1)c1ccccc1 ZINC000659370438 567210568 /nfs/dbraw/zinc/21/05/68/567210568.db2.gz XXLPWHOUFKPFRW-ROUUACIJSA-N 0 3 389.293 3.439 10 0 GGAEHN O=C(CNC[C@H]1CCCO1)N[C@@H]1CCCCc2cc(Br)ccc21 ZINC000659386912 567210844 /nfs/dbraw/zinc/21/08/44/567210844.db2.gz UIRJRBSLOALSAG-NVXWUHKLSA-N 0 3 381.314 3.101 10 0 GGAEHN Cc1ncc(Br)cc1NC(=O)C(C[C@H]1COCCO1)C(F)(F)F ZINC000615855036 567210840 /nfs/dbraw/zinc/21/08/40/567210840.db2.gz OAYQBMCNZIUWJW-WDEREUQCSA-N 0 3 397.191 3.075 10 0 GGAEHN O=C(CNC[C@H]1CCCO1)N[C@H]1CCCCc2cc(Br)ccc21 ZINC000659386914 567211505 /nfs/dbraw/zinc/21/15/05/567211505.db2.gz UIRJRBSLOALSAG-WBVHZDCISA-N 0 3 381.314 3.101 10 0 GGAEHN O=C(CNC[C@@H]1CCCO1)N[C@H]1CCCCc2cc(Br)ccc21 ZINC000659386913 567211792 /nfs/dbraw/zinc/21/17/92/567211792.db2.gz UIRJRBSLOALSAG-RDJZCZTQSA-N 0 3 381.314 3.101 10 0 GGAEHN N[C@@H]1CN(C(=O)c2csc(-c3ccc(Br)s3)n2)CC[C@H]1F ZINC000659390014 567212065 /nfs/dbraw/zinc/21/20/65/567212065.db2.gz RIEVIVRMTBKBQR-HTQZYQBOSA-N 0 3 390.303 3.145 10 0 GGAEHN N[C@@H]1CN(C(=O)c2csc(-c3cc(Br)cs3)n2)CC[C@H]1F ZINC000659388932 567212275 /nfs/dbraw/zinc/21/22/75/567212275.db2.gz HHSNJWXJXCBAAA-RKDXNWHRSA-N 0 3 390.303 3.145 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)NCCOc1cccc(Br)c1 ZINC000615906470 567214748 /nfs/dbraw/zinc/21/47/48/567214748.db2.gz SDOWIODYZDXVOE-AWEZNQCLSA-N 0 3 384.318 3.002 10 0 GGAEHN COc1cc(C)c(S(=O)(=O)N2CCCC[C@@H](N3CCCC3)C2)cc1Cl ZINC000433012982 567216071 /nfs/dbraw/zinc/21/60/71/567216071.db2.gz MYQRFRDOEAMKSH-OAHLLOKOSA-N 0 3 386.945 3.296 10 0 GGAEHN N[C@@H]1CN(C(=O)N[C@@H](c2cc(F)cc(Br)c2)C2CC2)CC[C@H]1F ZINC000659484714 567217055 /nfs/dbraw/zinc/21/70/55/567217055.db2.gz ZMGRLUWYLOHVLL-RBSFLKMASA-N 0 3 388.256 3.120 10 0 GGAEHN CN(C[C@H](O)COc1c(Cl)cccc1Cl)C[C@@H](O)Cc1ccccc1 ZINC000433039167 567217345 /nfs/dbraw/zinc/21/73/45/567217345.db2.gz KOMWMTPXTGHZDO-HOTGVXAUSA-N 0 3 384.303 3.269 10 0 GGAEHN O=C(NC[C@@H]1CCCCN1CCO)Nc1ccc(Cl)cc1Br ZINC000454986757 567219815 /nfs/dbraw/zinc/21/98/15/567219815.db2.gz FAMDEKRVJHXTAN-LBPRGKRZSA-N 0 3 390.709 3.071 10 0 GGAEHN C[C@@H]1CCN(CC(=O)N2CCC[C@@H]2c2ccccc2I)C1 ZINC000567121731 567220140 /nfs/dbraw/zinc/22/01/40/567220140.db2.gz NRRRAQSJCAWTGT-CZUORRHYSA-N 0 3 398.288 3.297 10 0 GGAEHN C[C@H]1COCC[C@H]1NCC(=O)Nc1ccc(Br)c(C(F)(F)F)c1 ZINC000433136499 567225122 /nfs/dbraw/zinc/22/51/22/567225122.db2.gz MBYMXIHMYXQAAD-TVQRCGJNSA-N 0 3 395.219 3.421 10 0 GGAEHN CN(CCC(=O)N[C@](C)(CO)c1cc(Cl)cc(Cl)c1)c1ccncc1 ZINC000616080293 567226394 /nfs/dbraw/zinc/22/63/94/567226394.db2.gz LRTYZXRBRSZVJP-GOSISDBHSA-N 0 3 382.291 3.239 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N[C@@H]1CCN(C)[C@H](C)C1 ZINC000525102014 567228255 /nfs/dbraw/zinc/22/82/55/567228255.db2.gz GDHNQGDQMOKZOA-TZMCWYRMSA-N 0 3 378.314 3.311 10 0 GGAEHN Cc1cc(Br)cn2c(CNCC3(CO)CC4(CCC4)C3)cnc12 ZINC000433195939 567231053 /nfs/dbraw/zinc/23/10/53/567231053.db2.gz ZSXLPXGPLMTLEY-UHFFFAOYSA-N 0 3 378.314 3.438 10 0 GGAEHN CNC(=O)[C@H](CNCc1ccc(Br)o1)Cc1ccc(F)cc1C ZINC000567268557 567231255 /nfs/dbraw/zinc/23/12/55/567231255.db2.gz GOFZDTZWDIUJJV-ZDUSSCGKSA-N 0 3 383.261 3.184 10 0 GGAEHN CNC(=O)[C@@H](CNCc1ccc(Br)o1)Cc1ccc(F)cc1C ZINC000567268556 567231607 /nfs/dbraw/zinc/23/16/07/567231607.db2.gz GOFZDTZWDIUJJV-CYBMUJFWSA-N 0 3 383.261 3.184 10 0 GGAEHN Brc1cnn(CCCCNCc2nccn2Cc2ccccc2)c1 ZINC000475200785 567232038 /nfs/dbraw/zinc/23/20/38/567232038.db2.gz BWJRISNLYVTJPU-UHFFFAOYSA-N 0 3 388.313 3.460 10 0 GGAEHN CCC[C@H](C)[C@H](CO)NCC(=O)Nc1ccc(Br)cc1Cl ZINC000567276892 567233225 /nfs/dbraw/zinc/23/32/25/567233225.db2.gz ZMOQSMKJTNKSPS-HZMBPMFUSA-N 0 3 377.710 3.428 10 0 GGAEHN Cc1nc(CCNC(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)cs1 ZINC000525256621 567238799 /nfs/dbraw/zinc/23/87/99/567238799.db2.gz DCIKPBDKFNWJBI-YOEHRIQHSA-N 0 3 378.567 3.438 10 0 GGAEHN CO[C@H](CN1CCN([C@@H](C)c2ccc(Br)cc2)CC1)[C@@H]1CCOC1 ZINC000659957887 567241783 /nfs/dbraw/zinc/24/17/83/567241783.db2.gz YPAJBCMFIUYVGA-KVSKMBFKSA-N 0 3 397.357 3.179 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)NCCN1CC[C@H](C)C1 ZINC000525292364 567242470 /nfs/dbraw/zinc/24/24/70/567242470.db2.gz XHPWWELYNKCEAL-ZDUSSCGKSA-N 0 3 378.314 3.170 10 0 GGAEHN CO[C@H]1CC[C@@H](C(=O)Nc2cc(Br)ccc2N(C)CCN(C)C)C1 ZINC000616422950 567244127 /nfs/dbraw/zinc/24/41/27/567244127.db2.gz USGQSRYJDUBAIX-HIFRSBDPSA-N 0 3 398.345 3.201 10 0 GGAEHN CO[C@H](C(=O)Nc1cc(Br)ccc1N(C)CCN(C)C)C1CCC1 ZINC000616422881 567244599 /nfs/dbraw/zinc/24/45/99/567244599.db2.gz OKALYZKPHCDHLV-KRWDZBQOSA-N 0 3 398.345 3.201 10 0 GGAEHN COc1ccc(C[C@@H](C)N[C@H](C(N)=O)c2cccc(Br)c2)cc1 ZINC000475438203 567248120 /nfs/dbraw/zinc/24/81/20/567248120.db2.gz FPTLDYYSCRGQHH-PXAZEXFGSA-N 0 3 377.282 3.205 10 0 GGAEHN FC1(F)C[C@H]1OCCNC1(c2ccc(Br)cc2)CCOCC1 ZINC000660033652 567250418 /nfs/dbraw/zinc/25/04/18/567250418.db2.gz BTZIBVRMUPFCCL-CQSZACIVSA-N 0 3 376.241 3.469 10 0 GGAEHN CN(C(=O)NCC1(c2ccccc2Br)CC1)[C@H]1CCN(C2CC2)C1 ZINC000525514423 567251681 /nfs/dbraw/zinc/25/16/81/567251681.db2.gz UOSYQDAHIJTTHO-HNNXBMFYSA-N 0 3 392.341 3.359 10 0 GGAEHN CS[C@H]1CN(C(=O)c2csc(Br)c2)C[C@@H]1N1CCCC1 ZINC000547860621 567252008 /nfs/dbraw/zinc/25/20/08/567252008.db2.gz SYCWMDWVXREXNV-RYUDHWBXSA-N 0 3 375.357 3.162 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2csc(Br)c2)C[C@H]1N1CCCC1 ZINC000547860622 567252509 /nfs/dbraw/zinc/25/25/09/567252509.db2.gz SYCWMDWVXREXNV-VXGBXAGGSA-N 0 3 375.357 3.162 10 0 GGAEHN O=S(=O)(NC[C@H]1CN(Cc2ccccc2)CC12CCC2)c1ccsc1 ZINC000660055323 567252666 /nfs/dbraw/zinc/25/26/66/567252666.db2.gz BVYHTBVGHYKNHI-KRWDZBQOSA-N 0 3 376.547 3.329 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)C2=Cc3cc(Br)ccc3OC2)CCN1C ZINC000525540958 567253707 /nfs/dbraw/zinc/25/37/07/567253707.db2.gz STVGBPXLRSVSAX-LRDDRELGSA-N 0 3 379.298 3.166 10 0 GGAEHN CN1CC[C@@H](NCC(=O)NC2CCCC2)C[C@H]1c1ccc(Br)cc1 ZINC000638527061 567254326 /nfs/dbraw/zinc/25/43/26/567254326.db2.gz JKFZILDDGVWEOF-MSOLQXFVSA-N 0 3 394.357 3.233 10 0 GGAEHN C[C@H]1C[C@@H](NC(=O)CSCc2ccc(Br)cc2F)CCN1C ZINC000525617493 567254701 /nfs/dbraw/zinc/25/47/01/567254701.db2.gz ODFNUBVHOFIQMN-FZMZJTMJSA-N 0 3 389.334 3.420 10 0 GGAEHN CCN1CCC[C@H](NC(=O)c2cc(I)c(C)cc2C)C1 ZINC000475658503 567265590 /nfs/dbraw/zinc/26/55/90/567265590.db2.gz VSKIPUBRDQYGEV-ZDUSSCGKSA-N 0 3 386.277 3.122 10 0 GGAEHN C[C@H]1CN(CCCCNc2nc(C3CC3)ncc2Br)C[C@H](C)O1 ZINC000685272350 567265731 /nfs/dbraw/zinc/26/57/31/567265731.db2.gz HZRDJZCOPBTLKU-STQMWFEESA-N 0 3 383.334 3.418 10 0 GGAEHN C[C@H]1CCN(CCNC(=O)CSCc2ccc(Br)cc2F)C1 ZINC000525805933 567266612 /nfs/dbraw/zinc/26/66/12/567266612.db2.gz WGTCKDQSKYZPJK-LBPRGKRZSA-N 0 3 389.334 3.279 10 0 GGAEHN Brc1ccc(CN2CCC[C@@H]3COCC[C@@H]32)c(N2CCOCC2)c1 ZINC000475708786 567269133 /nfs/dbraw/zinc/26/91/33/567269133.db2.gz ZRFGYDUNGMVAHN-AEFFLSMTSA-N 0 3 395.341 3.287 10 0 GGAEHN Cc1nccc(NC(=O)N(CCN(C)C)Cc2cccs2)c1Br ZINC000525848500 567269884 /nfs/dbraw/zinc/26/98/84/567269884.db2.gz BNWSKJXBGUZZQV-UHFFFAOYSA-N 0 3 397.342 3.232 10 0 GGAEHN Brc1ccc(CN2CCC[C@H]3COCC[C@@H]32)c(N2CCOCC2)c1 ZINC000475708789 567270240 /nfs/dbraw/zinc/27/02/40/567270240.db2.gz ZRFGYDUNGMVAHN-WMZOPIPTSA-N 0 3 395.341 3.287 10 0 GGAEHN O=C(NC[C@H]1CCCCN1CCO)Nc1cc(Cl)ccc1C(F)(F)F ZINC000455403409 567270697 /nfs/dbraw/zinc/27/06/97/567270697.db2.gz CBURVWFQNGJDID-GFCCVEGCSA-N 0 3 379.810 3.327 10 0 GGAEHN Cc1cc(CN[C@H]2CCN(C)[C@H](c3ccc(Br)cc3)C2)ncn1 ZINC000638812065 567271580 /nfs/dbraw/zinc/27/15/80/567271580.db2.gz REWMEDRWTPZMTK-WMZOPIPTSA-N 0 3 375.314 3.473 10 0 GGAEHN COc1cc(Br)c(C(=O)NC[C@H]2CCN2C(C)(C)C)cc1OC ZINC000617007285 567274889 /nfs/dbraw/zinc/27/48/89/567274889.db2.gz PTVIUOZWRRXGFY-LLVKDONJSA-N 0 3 385.302 3.069 10 0 GGAEHN COc1cc(Br)ccc1CCC(=O)NC[C@H]1CCN1C(C)(C)C ZINC000617010314 567275546 /nfs/dbraw/zinc/27/55/46/567275546.db2.gz NFAUQYNZZIMKMK-OAHLLOKOSA-N 0 3 383.330 3.379 10 0 GGAEHN CC[NH+]1CCC(CC[N-]S(=O)(=O)c2cc(C)c(Br)s2)CC1 ZINC000433833315 567275941 /nfs/dbraw/zinc/27/59/41/567275941.db2.gz NINJJVUTNQKQLY-UHFFFAOYSA-N 0 3 395.388 3.219 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)Cc1c[nH]c2cccc(Br)c12 ZINC000617011217 567276391 /nfs/dbraw/zinc/27/63/91/567276391.db2.gz ALAIYILHJQGORL-CYBMUJFWSA-N 0 3 378.314 3.462 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)Cc1c(F)ccc(Br)c1F ZINC000617006700 567276422 /nfs/dbraw/zinc/27/64/22/567276422.db2.gz DKKSOAIWTNYWPP-JTQLQIEISA-N 0 3 375.257 3.259 10 0 GGAEHN CCN1C[C@@H](C)N(c2nnc(-c3ccccc3Br)n2C)C[C@H]1C ZINC000685509590 567279302 /nfs/dbraw/zinc/27/93/02/567279302.db2.gz YOSYAJVPWHEWLT-CHWSQXEVSA-N 0 3 378.318 3.164 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N(CCN(C)C)C[C@H]1CCCO1 ZINC000499892385 567281219 /nfs/dbraw/zinc/28/12/19/567281219.db2.gz FQJQJZCNQBBADC-DZGCQCFKSA-N 0 3 389.323 3.330 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)Cc2c(F)ccc(Br)c2F)CCN1C ZINC000499888465 567281727 /nfs/dbraw/zinc/28/17/27/567281727.db2.gz RSGCVJXMPFMQQW-QWRGUYRKSA-N 0 3 375.257 3.211 10 0 GGAEHN C[C@H](NS(=O)(=O)c1ccc2ncsc2c1)[C@@H]1CCCN(C2CCC2)C1 ZINC000548123787 567281824 /nfs/dbraw/zinc/28/18/24/567281824.db2.gz KFSXEBYFONWOJB-UONOGXRCSA-N 0 3 379.551 3.228 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NC[C@@H]1CSc2ccccc2O1 ZINC000567857912 567284681 /nfs/dbraw/zinc/28/46/81/567284681.db2.gz PQWVOPUHQOBXQY-GXTWGEPZSA-N 0 3 395.322 3.142 10 0 GGAEHN Cc1cc(Br)ccc1CN(C)C(=O)N[C@H]1CN(C2CC2)C[C@@H]1C ZINC000433926106 567284683 /nfs/dbraw/zinc/28/46/83/567284683.db2.gz JIIZJBISODTDSS-GUYCJALGSA-N 0 3 380.330 3.382 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NC[C@H]1CSc2ccccc2O1 ZINC000567857913 567285001 /nfs/dbraw/zinc/28/50/01/567285001.db2.gz PQWVOPUHQOBXQY-JSGCOSHPSA-N 0 3 395.322 3.142 10 0 GGAEHN CC[C@H](NC[C@@H](O)COc1c(Cl)cccc1Cl)[C@@H](O)C(F)(F)F ZINC000567872485 567286292 /nfs/dbraw/zinc/28/62/92/567286292.db2.gz ADSOYSVNYPGEPA-YDEJPDAXSA-N 0 3 376.202 3.025 10 0 GGAEHN COc1ccc(C(=O)N2C[C@@H](N3CCCC3)[C@@H](SC)C2)c(Br)c1 ZINC000548188279 567287688 /nfs/dbraw/zinc/28/76/88/567287688.db2.gz CGZMSRKXTWQKKU-CVEARBPZSA-N 0 3 399.354 3.110 10 0 GGAEHN Cc1cc(C)c(C(=O)N(C)[C@H]2CCN(C3CC3)C2)cc1I ZINC000475928461 567288716 /nfs/dbraw/zinc/28/87/16/567288716.db2.gz CZGUXWKJTJVLMV-AWEZNQCLSA-N 0 3 398.288 3.217 10 0 GGAEHN COc1ccc(Br)c(CNC(=O)NC[C@@H]2CCN2C(C)(C)C)c1 ZINC000660357985 567288807 /nfs/dbraw/zinc/28/88/07/567288807.db2.gz ASGCGMYRCSYNBI-ZDUSSCGKSA-N 0 3 384.318 3.130 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)N1CCO[C@@](C)(C(F)F)C1)c1ccsc1 ZINC000660340747 567288900 /nfs/dbraw/zinc/28/89/00/567288900.db2.gz YFBXANASXMHRPE-WMLDXEAASA-N 0 3 375.485 3.197 10 0 GGAEHN COc1c(Br)cc(CN(C)CCCCO)cc1Br ZINC000526074884 567289508 /nfs/dbraw/zinc/28/95/08/567289508.db2.gz FFNZVMOXFWOZFY-UHFFFAOYSA-N 0 3 381.108 3.425 10 0 GGAEHN CN(C)CCn1nccc1NC(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000455643154 567289719 /nfs/dbraw/zinc/28/97/19/567289719.db2.gz CYNKMBWZWAGLMI-DZGCQCFKSA-N 0 3 382.295 3.429 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)CCOc1ccccc1Br ZINC000567926614 567290139 /nfs/dbraw/zinc/29/01/39/567290139.db2.gz MBGWXGAPQPQDDK-KRWDZBQOSA-N 0 3 389.293 3.303 10 0 GGAEHN COc1ccc([C@@H](NCCC2CS(=O)(=O)C2)C(C)C)c(Br)c1 ZINC000685654996 567290804 /nfs/dbraw/zinc/29/08/04/567290804.db2.gz SOJCYVLOFAXXRI-INIZCTEOSA-N 0 3 390.343 3.179 10 0 GGAEHN Cc1ccc([C@@H](CNC(=O)Nc2ccnc(C)c2Br)N(C)C)cc1 ZINC000526094977 567290868 /nfs/dbraw/zinc/29/08/68/567290868.db2.gz POCOZAYSLGAGPJ-MRXNPFEDSA-N 0 3 391.313 3.307 10 0 GGAEHN CN(C)S(=O)(=O)CCN[C@H]1CCC(C)(C)c2ccc(Br)cc21 ZINC000685666116 567291975 /nfs/dbraw/zinc/29/19/75/567291975.db2.gz SPPFRLTZDREDLE-HNNXBMFYSA-N 0 3 389.359 3.043 10 0 GGAEHN CN(C)CCn1nccc1NC(=O)N[C@H]1COc2c1ccc(Cl)c2Cl ZINC000455656344 567292377 /nfs/dbraw/zinc/29/23/77/567292377.db2.gz KJAHSIRZRKSSBK-LBPRGKRZSA-N 0 3 384.267 3.007 10 0 GGAEHN COCCN(Cc1cc(Br)cs1)C[C@@H](OC)[C@H]1CCOC1 ZINC000660411643 567292929 /nfs/dbraw/zinc/29/29/29/567292929.db2.gz SKRCDTJRSHITPC-SWLSCSKDSA-N 0 3 378.332 3.011 10 0 GGAEHN CC(C)C[C@](C)(NCCN1C(=O)CN(C)C1=O)c1cccc(Br)c1 ZINC000660452191 567295869 /nfs/dbraw/zinc/29/58/69/567295869.db2.gz CNGJJBZXJKEBOI-SFHVURJKSA-N 0 3 396.329 3.194 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)COc1ccc(Br)cc1 ZINC000617288247 567296532 /nfs/dbraw/zinc/29/65/32/567296532.db2.gz FAGZJDHPGNBPBG-QGZVFWFLSA-N 0 3 391.309 3.117 10 0 GGAEHN CC(C)(C)N1CC[C@@H](NC(=O)[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000617341774 567299159 /nfs/dbraw/zinc/29/91/59/567299159.db2.gz YMDWKPXZUWHZAZ-KGLIPLIRSA-N 0 3 381.314 3.304 10 0 GGAEHN Brc1ccc2[nH]c(CN3CCC[C@H](N4CCOCC4)CC3)nc2c1 ZINC000660472883 567299185 /nfs/dbraw/zinc/29/91/85/567299185.db2.gz ATKYNCCAPUYSEL-HNNXBMFYSA-N 0 3 393.329 3.012 10 0 GGAEHN Brc1ccc2nc(CN3CCC[C@H](N4CCOCC4)CC3)[nH]c2c1 ZINC000660472883 567299190 /nfs/dbraw/zinc/29/91/90/567299190.db2.gz ATKYNCCAPUYSEL-HNNXBMFYSA-N 0 3 393.329 3.012 10 0 GGAEHN CN(CCC(=O)N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1)c1ccncc1 ZINC000526941252 567299474 /nfs/dbraw/zinc/29/94/74/567299474.db2.gz NSWOAOLAPOEVJV-WMLDXEAASA-N 0 3 392.272 3.482 10 0 GGAEHN CC(C)(C)N1CC[C@H](NC(=O)[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000617341775 567299595 /nfs/dbraw/zinc/29/95/95/567299595.db2.gz YMDWKPXZUWHZAZ-UONOGXRCSA-N 0 3 381.314 3.304 10 0 GGAEHN COc1ncc(Br)cc1CN[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000660490720 567301693 /nfs/dbraw/zinc/30/16/93/567301693.db2.gz YHAWKUJZRXNIOD-IAGOWNOFSA-N 0 3 376.298 3.388 10 0 GGAEHN CC(C)(C)N1CC[C@@H](NC(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000617343177 567301822 /nfs/dbraw/zinc/30/18/22/567301822.db2.gz NDFBFGMJQLVUAB-SNVBAGLBSA-N 0 3 375.257 3.259 10 0 GGAEHN CC[C@H](NC[C@H](O)COC[C@H]1CCCO1)c1cc(F)cc(Br)c1 ZINC000548275283 567304253 /nfs/dbraw/zinc/30/42/53/567304253.db2.gz AFOFNPHOPKKNKM-BBWFWOEESA-N 0 3 390.293 3.185 10 0 GGAEHN COc1ccc(NC(=O)CCN[C@@H](C(C)C)[C@H](O)C(F)(F)F)cc1Cl ZINC000660524784 567305629 /nfs/dbraw/zinc/30/56/29/567305629.db2.gz FSEISZDQJLFCFR-GJZGRUSLSA-N 0 3 382.810 3.215 10 0 GGAEHN COc1ccc(CNC(=O)NC[C@H]2CCN2C(C)(C)C)cc1Br ZINC000660533030 567306561 /nfs/dbraw/zinc/30/65/61/567306561.db2.gz APQJXKYMHZXMAN-CYBMUJFWSA-N 0 3 384.318 3.130 10 0 GGAEHN COc1c(Br)cc(CN(C)CC2(CO)CC2)cc1Br ZINC000527113563 567315684 /nfs/dbraw/zinc/31/56/84/567315684.db2.gz HZSNAIHSUQKALR-UHFFFAOYSA-N 0 3 393.119 3.425 10 0 GGAEHN C[C@@H](NCCO[C@@H]1CC1(F)F)c1ccc(Br)cc1OCCCO ZINC000660597483 567311428 /nfs/dbraw/zinc/31/14/28/567311428.db2.gz RLCKDLHICSQPQR-IAQYHMDHSA-N 0 3 394.256 3.285 10 0 GGAEHN CSc1nnc(CNC(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)s1 ZINC000527081520 567311452 /nfs/dbraw/zinc/31/14/52/567311452.db2.gz ZPPSFQATPZPONJ-SMDDNHRTSA-N 0 3 397.595 3.204 10 0 GGAEHN COC(=O)c1cc(NC(=O)CCN(C)c2ccncc2)ccc1Br ZINC000548380777 567312156 /nfs/dbraw/zinc/31/21/56/567312156.db2.gz IBPCTRJRDUYUEA-UHFFFAOYSA-N 0 3 392.253 3.096 10 0 GGAEHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1cc(F)c(Br)cc1Cl ZINC000476303087 567313449 /nfs/dbraw/zinc/31/34/49/567313449.db2.gz DZJVVWJBFWVZEL-XLKFXECMSA-N 0 3 375.669 3.454 10 0 GGAEHN Brc1cccc(OC2CCN(C[C@@H]3CCc4ncnn43)CC2)c1 ZINC000639585651 567313534 /nfs/dbraw/zinc/31/35/34/567313534.db2.gz OIDVDLFMNOCDEM-AWEZNQCLSA-N 0 3 377.286 3.071 10 0 GGAEHN COC(=O)c1cc(NC(=O)N[C@@H](C)CN2CCCCC2)ccc1Br ZINC000548410397 567314006 /nfs/dbraw/zinc/31/40/06/567314006.db2.gz FKVRKHNDQIRYCY-LBPRGKRZSA-N 0 3 398.301 3.232 10 0 GGAEHN CCO[C@@H]1C[C@@H](NC[C@H](O)COc2c(Cl)cccc2Cl)[C@@H]1SC ZINC000592169219 567319530 /nfs/dbraw/zinc/31/95/30/567319530.db2.gz MVMMQHHHGJXQKX-YDEYXMKJSA-N 0 3 380.337 3.232 10 0 GGAEHN O=C(CCNC1(c2cccc(Cl)c2)CCC1)NC(=O)NCC(F)(F)F ZINC000592183563 567320450 /nfs/dbraw/zinc/32/04/50/567320450.db2.gz KHHSDDOFUMHEDP-UHFFFAOYSA-N 0 3 377.794 3.087 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)N1CC[C@H]1c1ccc(Br)cc1 ZINC000660699787 567320834 /nfs/dbraw/zinc/32/08/34/567320834.db2.gz GGVROXFSGJQAIB-SJORKVTESA-N 0 3 396.329 3.016 10 0 GGAEHN Cc1ccc2c(c1Br)CN(C(=O)N[C@@H]1CCN(CC3CC3)C1)C2 ZINC000660703024 567320938 /nfs/dbraw/zinc/32/09/38/567320938.db2.gz NFKGPZAOZLSFCY-OAHLLOKOSA-N 0 3 378.314 3.267 10 0 GGAEHN CCN(C(=O)c1cn(-c2ccc(Br)cc2)nc1C)[C@@H]1CCN(C)C1 ZINC000617551897 567322179 /nfs/dbraw/zinc/32/21/79/567322179.db2.gz AXEWLXQLHXSSJS-MRXNPFEDSA-N 0 3 391.313 3.109 10 0 GGAEHN CCN(C(=O)c1cc2c([nH]1)c(Br)ccc2OC)[C@@H]1CCN(C)C1 ZINC000617557914 567322394 /nfs/dbraw/zinc/32/23/94/567322394.db2.gz WIGDZRWQNYWGOW-LLVKDONJSA-N 0 3 380.286 3.105 10 0 GGAEHN CCN(C(=O)[C@H](CCOC)Cc1cccc(Br)c1)[C@@H]1CCN(C)C1 ZINC000617555039 567322469 /nfs/dbraw/zinc/32/24/69/567322469.db2.gz OYWUGYQGSVULSK-SJLPKXTDSA-N 0 3 397.357 3.197 10 0 GGAEHN CCCOc1c(Br)cc(C(=O)N(CC)[C@@H]2CCN(C)C2)cc1OC ZINC000617560258 567323616 /nfs/dbraw/zinc/32/36/16/567323616.db2.gz KXANXTDWGJJRGM-CQSZACIVSA-N 0 3 399.329 3.413 10 0 GGAEHN CN(C(=O)NCCc1nc2cc(Cl)ccc2s1)[C@@H]1CCN(C2CC2)C1 ZINC000476441974 567324504 /nfs/dbraw/zinc/32/45/04/567324504.db2.gz USERHUYMNYXCLJ-CQSZACIVSA-N 0 3 378.929 3.370 10 0 GGAEHN CS(=O)(=O)NC[C@@H]1CCC[C@H]1NCc1ccc(-c2ccccc2Cl)o1 ZINC000500501045 567327267 /nfs/dbraw/zinc/32/72/67/567327267.db2.gz SUHLTUVIELSQCH-SUMWQHHRSA-N 0 3 382.913 3.408 10 0 GGAEHN Cc1cc(Br)c(CNC[C@@]2(C)CCC(=O)N2)cc1Br ZINC000527715958 567368868 /nfs/dbraw/zinc/36/88/68/567368868.db2.gz LOCAAQGHMOOLOU-CQSZACIVSA-N 0 3 390.119 3.278 10 0 GGAEHN CS[C@@H]1CN(C(=O)Nc2cnc(-c3ccc(Cl)s3)nc2)C[C@H]1N(C)C ZINC000592278249 567327733 /nfs/dbraw/zinc/32/77/33/567327733.db2.gz ONHDQPCCQXGPSL-DGCLKSJQSA-N 0 3 397.957 3.368 10 0 GGAEHN OC[C@H](NC[C@@H](O)Cc1cccc(Cl)c1)c1cccc(Br)c1 ZINC000568427348 567328823 /nfs/dbraw/zinc/32/88/23/567328823.db2.gz QWGYAEBLPOQVFI-IRXDYDNUSA-N 0 3 384.701 3.329 10 0 GGAEHN OC[C@@H](NC[C@H](O)Cc1cccc(Cl)c1)c1cccc(Br)c1 ZINC000568427347 567329063 /nfs/dbraw/zinc/32/90/63/567329063.db2.gz QWGYAEBLPOQVFI-IAGOWNOFSA-N 0 3 384.701 3.329 10 0 GGAEHN O=C(N[C@@H]1CCN(C2CC2)C1)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000660840924 567329258 /nfs/dbraw/zinc/32/92/58/567329258.db2.gz NELQBZONSBJYKX-CZUORRHYSA-N 0 3 396.354 3.273 10 0 GGAEHN CN(CCNC(=O)N[C@H]1CSCc2ccc(Br)cc21)C1CC1 ZINC000660839084 567329613 /nfs/dbraw/zinc/32/96/13/567329613.db2.gz MLHLDQZWDBEPTO-HNNXBMFYSA-N 0 3 384.343 3.130 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1cccc(Cl)c1Cl ZINC000617696580 567329968 /nfs/dbraw/zinc/32/99/68/567329968.db2.gz MBUADDJSXBIWEI-OAHLLOKOSA-N 0 3 379.287 3.490 10 0 GGAEHN Cc1ccc2c(c1Br)CN(C(=O)NC[C@@]1(N(C)C)CCSC1)C2 ZINC000660824428 567329948 /nfs/dbraw/zinc/32/99/48/567329948.db2.gz NOSGJUVFVIBSGV-KRWDZBQOSA-N 0 3 398.370 3.220 10 0 GGAEHN C[C@H](C(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1)c1ccc(Cl)s1 ZINC000617700766 567330209 /nfs/dbraw/zinc/33/02/09/567330209.db2.gz LASOWAIBXGEGKN-BBRMVZONSA-N 0 3 378.925 3.388 10 0 GGAEHN CN1CCC(NC(=O)N[C@H]2CSCc3ccc(Br)cc32)CC1 ZINC000660821806 567330385 /nfs/dbraw/zinc/33/03/85/567330385.db2.gz KDWQZADWWMLZDL-HNNXBMFYSA-N 0 3 384.343 3.130 10 0 GGAEHN OCc1ccc(CN2CC[C@H](Cc3cccc(I)c3)C2)o1 ZINC000568473144 567331750 /nfs/dbraw/zinc/33/17/50/567331750.db2.gz IOCWCARLIQNEKB-CQSZACIVSA-N 0 3 397.256 3.441 10 0 GGAEHN CNC(=O)Cc1nc(CS[C@@H]2CCCN(Cc3ccccc3)C2)cs1 ZINC000592354513 567332505 /nfs/dbraw/zinc/33/25/05/567332505.db2.gz JERGKNTVGVLPLB-QGZVFWFLSA-N 0 3 375.563 3.329 10 0 GGAEHN O=C(CCNC[C@H](O)COc1c(Cl)cccc1Cl)Nc1ccccc1 ZINC000568502115 567333050 /nfs/dbraw/zinc/33/30/50/567333050.db2.gz LOTGJOVXFCWEPE-AWEZNQCLSA-N 0 3 383.275 3.352 10 0 GGAEHN CC(C)(C)OC(=O)C1(CNCc2ccc(Br)cn2)CCOCC1 ZINC000592373111 567333713 /nfs/dbraw/zinc/33/37/13/567333713.db2.gz RHPCMUMNBZNRCY-UHFFFAOYSA-N 0 3 385.302 3.072 10 0 GGAEHN CCO[C@@H]1C[C@@H]([NH2+]Cc2cc(Br)c([O-])c(OC)c2)[C@@H]1SC ZINC000592375941 567333852 /nfs/dbraw/zinc/33/38/52/567333852.db2.gz UWTQUQIKXDUPHC-KYOSRNDESA-N 0 3 376.316 3.162 10 0 GGAEHN CCO[C@@H]1C[C@@H](N[C@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)[C@@H]1SC ZINC000592394618 567335252 /nfs/dbraw/zinc/33/52/52/567335252.db2.gz JYMJVMNOMSOUAP-NNIGNNQHSA-N 0 3 384.973 3.210 10 0 GGAEHN C[C@@H](NCC(C)(C)[C@@]1(O)CCOC1)c1ccccc1I ZINC000592398114 567335544 /nfs/dbraw/zinc/33/55/44/567335544.db2.gz OQJUNPYYFCKSRA-MLGOLLRUSA-N 0 3 389.277 3.119 10 0 GGAEHN Cc1cc(C(=O)N[C@@H]2CNCCC2(F)F)c2cc(Br)ccc2n1 ZINC000568510114 567335370 /nfs/dbraw/zinc/33/53/70/567335370.db2.gz BIUYXJIUOJHVTD-CQSZACIVSA-N 0 3 384.224 3.033 10 0 GGAEHN CC(C)[C@@H]1CCC[C@H](NCc2ccc(S(=O)(=O)N3CCOCC3)s2)C1 ZINC000527523602 567340824 /nfs/dbraw/zinc/34/08/24/567340824.db2.gz NFJPMMPNKVNDPU-CVEARBPZSA-N 0 3 386.583 3.073 10 0 GGAEHN O=C1C[C@@]2(CCN(Cc3cnc(-c4ccc(Br)cc4)s3)C2)CN1 ZINC000435061076 567340783 /nfs/dbraw/zinc/34/07/83/567340783.db2.gz XDYZYUWLARLCFB-KRWDZBQOSA-N 0 3 392.322 3.285 10 0 GGAEHN CC(C)[C@@H](NCc1ncc(I)s1)C1(CO)CC=CC1 ZINC000592526477 567344134 /nfs/dbraw/zinc/34/41/34/567344134.db2.gz AHQGCKKBSRPYAF-CYBMUJFWSA-N 0 3 392.306 3.191 10 0 GGAEHN COC(=O)CC[C@@H](N)C(=O)NC1(c2cccc(Br)c2)CCCCC1 ZINC000592539333 567345721 /nfs/dbraw/zinc/34/57/21/567345721.db2.gz MAHHXWKWBOUVGO-OAHLLOKOSA-N 0 3 397.313 3.005 10 0 GGAEHN CCN(C(=O)[C@H]1CCOc2ccc(Br)cc21)[C@H]1CCN(CC)C1 ZINC000617922949 567345942 /nfs/dbraw/zinc/34/59/42/567345942.db2.gz WBCLDPQNCFAARB-GJZGRUSLSA-N 0 3 381.314 3.258 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N(CC)[C@H]2CCN(CC)C2)cc1OC ZINC000617933048 567345974 /nfs/dbraw/zinc/34/59/74/567345974.db2.gz FAMVHGFGKTWHTP-AWEZNQCLSA-N 0 3 399.329 3.413 10 0 GGAEHN CCN(C(=O)CCc1ccc(OC)c(Br)c1)[C@H]1CCN(CC)C1 ZINC000617930926 567346036 /nfs/dbraw/zinc/34/60/36/567346036.db2.gz LUUQDUJXUSXHCS-HNNXBMFYSA-N 0 3 383.330 3.333 10 0 GGAEHN CCN(C(=O)c1cc2c([nH]1)c(Br)ccc2OC)[C@@H]1CCN(CC)C1 ZINC000617931028 567346049 /nfs/dbraw/zinc/34/60/49/567346049.db2.gz OFWVATFNQIFCOP-GFCCVEGCSA-N 0 3 394.313 3.495 10 0 GGAEHN CCN(C(=O)c1cc(OC)c(Br)c(OC)c1)[C@H]1CCN(CC)C1 ZINC000617931867 567346621 /nfs/dbraw/zinc/34/66/21/567346621.db2.gz FRDYSHHECNBQIO-ZDUSSCGKSA-N 0 3 385.302 3.023 10 0 GGAEHN C[C@H](NC(=O)N1CCc2ccc(F)c(Br)c2C1)C1=CCN(C)CC1 ZINC000527597077 567346808 /nfs/dbraw/zinc/34/68/08/567346808.db2.gz ZRESYOISEDFTMN-LBPRGKRZSA-N 0 3 396.304 3.306 10 0 GGAEHN CN(C)CCN(CCN(C)C)C(=O)Nc1cc(Cl)ccc1C(F)(F)F ZINC000548766718 567348566 /nfs/dbraw/zinc/34/85/66/567348566.db2.gz ADBPWPKQCKDNAL-UHFFFAOYSA-N 0 3 380.842 3.316 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)Nc1ccc2nccnc2c1Br ZINC000548779395 567349600 /nfs/dbraw/zinc/34/96/00/567349600.db2.gz XFTQMTLWMWMOOY-GFCCVEGCSA-N 0 3 392.301 3.388 10 0 GGAEHN CCCN1CC[C@@H](NC(=O)N[C@H]2CCOc3c(Br)cccc32)C1 ZINC000661127116 567349911 /nfs/dbraw/zinc/34/99/11/567349911.db2.gz HZCARYODKYNEQN-DOMZBBRYSA-N 0 3 382.302 3.056 10 0 GGAEHN CCCN1CC[C@H](NC(=O)N[C@H]2CCOc3c(Br)cccc32)C1 ZINC000661127123 567350052 /nfs/dbraw/zinc/35/00/52/567350052.db2.gz HZCARYODKYNEQN-WFASDCNBSA-N 0 3 382.302 3.056 10 0 GGAEHN NC[C@H](C(=O)N1CCc2ccc(F)c(Br)c2C1)c1ccccc1 ZINC000527617469 567350707 /nfs/dbraw/zinc/35/07/07/567350707.db2.gz MBSQPQIWLAHQLB-AWEZNQCLSA-N 0 3 377.257 3.215 10 0 GGAEHN O=C(CN[C@@H](CO)C1CCC1)Nc1ccc(Br)c(C(F)(F)F)c1 ZINC000661158980 567352747 /nfs/dbraw/zinc/35/27/47/567352747.db2.gz SYAJJWDHZULYBY-ZDUSSCGKSA-N 0 3 395.219 3.157 10 0 GGAEHN CNC(=O)CN1CCC(NCc2cc(Cl)c(OC(C)C)cc2Cl)CC1 ZINC000527638799 567354613 /nfs/dbraw/zinc/35/46/13/567354613.db2.gz YOJBGVFZSFKVOB-UHFFFAOYSA-N 0 3 388.339 3.081 10 0 GGAEHN O=C(c1ccncc1)N1CCC(NCc2ccsc2Br)CC1 ZINC000527639606 567354650 /nfs/dbraw/zinc/35/46/50/567354650.db2.gz IRGUXVPFVJLHOS-UHFFFAOYSA-N 0 3 380.311 3.300 10 0 GGAEHN CCOC(=O)CC1(NCc2cnc3ccc(Br)cn23)CCCC1 ZINC000435287966 567354943 /nfs/dbraw/zinc/35/49/43/567354943.db2.gz BHAQAIVMQZNKQX-UHFFFAOYSA-N 0 3 380.286 3.452 10 0 GGAEHN O=C(NCc1cc(Br)ccc1F)NC[C@H]1CCN1C1CCCC1 ZINC000527660452 567355929 /nfs/dbraw/zinc/35/59/29/567355929.db2.gz QLBHVENOGCXTTK-OAHLLOKOSA-N 0 3 384.293 3.404 10 0 GGAEHN Cc1cc(Br)c(CNCC2(O)CCOCC2)cc1Br ZINC000527652706 567356124 /nfs/dbraw/zinc/35/61/24/567356124.db2.gz KUOCQXRNPQHSKV-UHFFFAOYSA-N 0 3 393.119 3.151 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)NCc1ccc(Br)c(F)c1F ZINC000527653473 567356247 /nfs/dbraw/zinc/35/62/47/567356247.db2.gz UKKQPQPCGXIZOE-LLVKDONJSA-N 0 3 376.245 3.011 10 0 GGAEHN CC(C)(C)N1CCCN(C(=O)c2cc(Br)cc3nc[nH]c32)CC1 ZINC000548865093 567356645 /nfs/dbraw/zinc/35/66/45/567356645.db2.gz KADIBCUGXZYLJG-UHFFFAOYSA-N 0 3 379.302 3.272 10 0 GGAEHN CN(C)C[C@@H]1CCCCN1C(=O)Cc1c(F)ccc(Br)c1F ZINC000548868400 567357018 /nfs/dbraw/zinc/35/70/18/567357018.db2.gz YMXAUNIYRPYEKD-NSHDSACASA-N 0 3 375.257 3.213 10 0 GGAEHN CO[C@@H]1CCC[C@@H]([C@H](CO)NCC(=O)Nc2ccc(Cl)cc2Cl)C1 ZINC000661219366 567357224 /nfs/dbraw/zinc/35/72/24/567357224.db2.gz NFJCCSXDZZCTDJ-KFNAQCHYSA-N 0 3 375.296 3.088 10 0 GGAEHN CN(C)C[C@H]1CCCCN1C(=O)Cc1c(F)ccc(Br)c1F ZINC000548868399 567357140 /nfs/dbraw/zinc/35/71/40/567357140.db2.gz YMXAUNIYRPYEKD-LLVKDONJSA-N 0 3 375.257 3.213 10 0 GGAEHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1cc[nH]c(=O)c1Br ZINC000435345461 567357439 /nfs/dbraw/zinc/35/74/39/567357439.db2.gz FWAPCRJSORCCSW-HNNXBMFYSA-N 0 3 390.281 3.117 10 0 GGAEHN OC[C@H]1CCN(Cc2ccccc2)C[C@H]1NCc1ccsc1Br ZINC000527667557 567357648 /nfs/dbraw/zinc/35/76/48/567357648.db2.gz XTFVINVMEVAVNL-IAGOWNOFSA-N 0 3 395.366 3.483 10 0 GGAEHN Cn1cc(N2CCC[C@@H](NCc3ccc(Br)c(F)c3F)C2)cn1 ZINC000527664143 567358253 /nfs/dbraw/zinc/35/82/53/567358253.db2.gz DGHAKWAOFWIQCL-GFCCVEGCSA-N 0 3 385.256 3.219 10 0 GGAEHN OC[C@@H]1CCN(Cc2ccccc2)C[C@H]1NCc1ccsc1Br ZINC000527667554 567358329 /nfs/dbraw/zinc/35/83/29/567358329.db2.gz XTFVINVMEVAVNL-DLBZAZTESA-N 0 3 395.366 3.483 10 0 GGAEHN Cc1cc(Br)c(CNCCCn2ccnn2)cc1Br ZINC000527690342 567361459 /nfs/dbraw/zinc/36/14/59/567361459.db2.gz DZFSUGRFEBWICG-UHFFFAOYSA-N 0 3 388.107 3.291 10 0 GGAEHN CC(C)CS(=O)(=O)N1CCC(NCc2ccsc2Br)CC1 ZINC000527689475 567361939 /nfs/dbraw/zinc/36/19/39/567361939.db2.gz ANVSDKCXUKBIGR-UHFFFAOYSA-N 0 3 395.388 3.050 10 0 GGAEHN Cc1cc(Br)c(CNC[C@]2(O)CCO[C@H]2C)cc1Br ZINC000527698915 567364797 /nfs/dbraw/zinc/36/47/97/567364797.db2.gz ATECWAIBWDTDGI-IINYFYTJSA-N 0 3 393.119 3.150 10 0 GGAEHN O=C(NCc1ccc(Br)c(F)c1)NC[C@@H]1CCN1C1CCCC1 ZINC000527709672 567366743 /nfs/dbraw/zinc/36/67/43/567366743.db2.gz UXGWKFUPDSESTL-AWEZNQCLSA-N 0 3 384.293 3.404 10 0 GGAEHN COc1ccc(CNC(=O)NC[C@@H]2CCN2C2CCCC2)cc1Br ZINC000527715941 567367694 /nfs/dbraw/zinc/36/76/94/567367694.db2.gz KYERBGALDWROIF-HNNXBMFYSA-N 0 3 396.329 3.274 10 0 GGAEHN COc1ccc(Br)cc1CN(C)C(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000661397437 567370971 /nfs/dbraw/zinc/37/09/71/567370971.db2.gz PNWJFKWZJQRMEN-HNNXBMFYSA-N 0 3 398.345 3.472 10 0 GGAEHN O[C@@H](CNCc1cnc(-c2ccc(Br)cc2)s1)[C@H]1CCCO1 ZINC000527757254 567372218 /nfs/dbraw/zinc/37/22/18/567372218.db2.gz IUYMRJKHGJZZOB-LSDHHAIUSA-N 0 3 383.311 3.202 10 0 GGAEHN C[C@@H]1C[C@@H](NC(=O)NCc2ccc(Br)c(F)c2F)CCN1C ZINC000527807552 567375214 /nfs/dbraw/zinc/37/52/14/567375214.db2.gz LCDRZXWKNLNAKF-KOLCDFICSA-N 0 3 376.245 3.009 10 0 GGAEHN C[C@H]1C[C@H](NC(=O)NCc2cc(F)c(Br)cc2F)CCN1C ZINC000527808344 567375759 /nfs/dbraw/zinc/37/57/59/567375759.db2.gz MXQIYGJCPLNXTD-GXSJLCMTSA-N 0 3 376.245 3.009 10 0 GGAEHN Brc1ccccc1-n1cc(CNC[C@H]2CCN2C2CCCC2)nn1 ZINC000527813532 567377003 /nfs/dbraw/zinc/37/70/03/567377003.db2.gz XKXMMDXAFFRZOZ-MRXNPFEDSA-N 0 3 390.329 3.136 10 0 GGAEHN C[C@H]1C[C@H](NC(=O)NCc2cc(F)c(Br)cc2F)CN1C1CC1 ZINC000527812967 567377136 /nfs/dbraw/zinc/37/71/36/567377136.db2.gz LSQSWRNOCXDCJX-ONGXEEELSA-N 0 3 388.256 3.152 10 0 GGAEHN C[C@@H]1C[C@@H](NC(=O)NCc2ccc(Br)c(F)c2F)CN1C1CC1 ZINC000527814334 567377264 /nfs/dbraw/zinc/37/72/64/567377264.db2.gz SWAZBYGVLHIFRY-MWLCHTKSSA-N 0 3 388.256 3.152 10 0 GGAEHN C[C@H]1C[C@@H](NC(=O)NCc2cc(F)c(Br)cc2F)CN1C1CC1 ZINC000527812955 567377418 /nfs/dbraw/zinc/37/74/18/567377418.db2.gz LSQSWRNOCXDCJX-GXSJLCMTSA-N 0 3 388.256 3.152 10 0 GGAEHN CN(C)CC(C)(C)NC(=O)Nc1nnc(SCc2ccc(F)cc2)s1 ZINC000569078905 567378246 /nfs/dbraw/zinc/37/82/46/567378246.db2.gz STAACTHQGRZJKI-UHFFFAOYSA-N 0 3 383.518 3.431 10 0 GGAEHN C[C@H](CN[C@@H](C)c1cc(F)c(Br)cc1F)CN1CCOCC1 ZINC000527861366 567379811 /nfs/dbraw/zinc/37/98/11/567379811.db2.gz DFUTZSMNOVQYOT-NEPJUHHUSA-N 0 3 377.273 3.346 10 0 GGAEHN C[C@@H](NC[C@H](C)CN1CCOCC1)c1cc(F)c(Br)cc1F ZINC000527861369 567379986 /nfs/dbraw/zinc/37/99/86/567379986.db2.gz DFUTZSMNOVQYOT-NWDGAFQWSA-N 0 3 377.273 3.346 10 0 GGAEHN C[C@@H](CN[C@@H](C)c1cc(F)c(Br)cc1F)CN1CCOCC1 ZINC000527861371 567380618 /nfs/dbraw/zinc/38/06/18/567380618.db2.gz DFUTZSMNOVQYOT-RYUDHWBXSA-N 0 3 377.273 3.346 10 0 GGAEHN C[C@H](NC(=O)NC[C@@H]1CCN1C1CCCC1)c1ccc(Br)cn1 ZINC000527893888 567381557 /nfs/dbraw/zinc/38/15/57/567381557.db2.gz LBLCOTCFAXVTFG-WFASDCNBSA-N 0 3 381.318 3.221 10 0 GGAEHN CN(C(=O)c1n[nH]c(-c2ccccc2)c1Br)[C@@H]1CN2CCC1CC2 ZINC000569155650 567381982 /nfs/dbraw/zinc/38/19/82/567381982.db2.gz KKSDZACSUPOFGV-CQSZACIVSA-N 0 3 389.297 3.005 10 0 GGAEHN C[C@@H](NC[C@H]1CCCCN1CCO)c1cc(F)c(Br)cc1F ZINC000527900652 567383516 /nfs/dbraw/zinc/38/35/16/567383516.db2.gz DLAOACBYFUTWLM-VXGBXAGGSA-N 0 3 377.273 3.225 10 0 GGAEHN CN1CCC2(CC1)C[C@H](NC(=O)[C@@H]1C[C@@]1(C)Br)c1ccccc1O2 ZINC000527928955 567385104 /nfs/dbraw/zinc/38/51/04/567385104.db2.gz FBTGWCCJQKFXNZ-RLFYNMQTSA-N 0 3 393.325 3.264 10 0 GGAEHN C[C@@H]1C[C@H](C)C[N@@H+](CCCNC(=O)Cc2ccc(Br)cc2[O-])C1 ZINC000477279235 567385871 /nfs/dbraw/zinc/38/58/71/567385871.db2.gz HOGAWBDWGMTVKK-OKILXGFUSA-N 0 3 383.330 3.181 10 0 GGAEHN C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)Cc2ccc(Br)cc2[O-])C1 ZINC000477279235 567385873 /nfs/dbraw/zinc/38/58/73/567385873.db2.gz HOGAWBDWGMTVKK-OKILXGFUSA-N 0 3 383.330 3.181 10 0 GGAEHN C[C@H](NC(=O)NC[C@@H]1CCN1C1CCCCC1)c1ncc(Br)cn1 ZINC000527966954 567386771 /nfs/dbraw/zinc/38/67/71/567386771.db2.gz OMCLTJZIXBUPPV-WFASDCNBSA-N 0 3 396.333 3.006 10 0 GGAEHN C[C@H](NCc1ccc(Br)c(F)c1F)C1CCS(=O)(=O)CC1 ZINC000527983415 567387777 /nfs/dbraw/zinc/38/77/77/567387777.db2.gz DDRVFDOAZUDPIX-VIFPVBQESA-N 0 3 382.270 3.030 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1ccc(F)c(I)c1 ZINC000477309244 567388353 /nfs/dbraw/zinc/38/83/53/567388353.db2.gz OZMURLBMRKWJJS-NSHDSACASA-N 0 3 390.240 3.035 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000477370475 567391578 /nfs/dbraw/zinc/39/15/78/567391578.db2.gz CFHCIXWALBAVTB-CQSZACIVSA-N 0 3 381.314 3.032 10 0 GGAEHN Cn1cc(C[C@@H]2CCC[C@H]2NCC(=O)Nc2ccccc2Br)cn1 ZINC000661777583 567392553 /nfs/dbraw/zinc/39/25/53/567392553.db2.gz IFPOARYREGNIKF-GOEBONIOSA-N 0 3 391.313 3.122 10 0 GGAEHN O[C@@H](CN[C@H]1CCOc2c(Br)cccc21)COCc1ccccc1 ZINC000501501995 567392879 /nfs/dbraw/zinc/39/28/79/567392879.db2.gz IWCUJUVVDUVWSP-YJBOKZPZSA-N 0 3 392.293 3.440 10 0 GGAEHN O[C@H](CN[C@@H]1CCOc2c(Br)cccc21)COc1ccccc1 ZINC000501501067 567392919 /nfs/dbraw/zinc/39/29/19/567392919.db2.gz KVVCOPSDDMMCML-CXAGYDPISA-N 0 3 378.266 3.302 10 0 GGAEHN O[C@H](CN[C@@H]1CCOc2c(Br)cccc21)COCc1ccco1 ZINC000501517391 567394175 /nfs/dbraw/zinc/39/41/75/567394175.db2.gz GSDJHQHKZDMORK-MLGOLLRUSA-N 0 3 382.254 3.033 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])NC1CC[NH+](CC2CCCC2)CC1 ZINC000477431926 567395079 /nfs/dbraw/zinc/39/50/79/567395079.db2.gz PFCBHAUAWKPGDB-UHFFFAOYSA-N 0 3 395.341 3.468 10 0 GGAEHN CN(C)S(=O)(=O)c1ccc(CN[C@H]2C[C@@H](OC(C)(C)C)C23CCC3)s1 ZINC000661846564 567397179 /nfs/dbraw/zinc/39/71/79/567397179.db2.gz VOMSXSCQZCSZHC-LSDHHAIUSA-N 0 3 386.583 3.214 10 0 GGAEHN O=C(c1ccccc1)N1C[C@H](CNCc2ccc(Cl)s2)N2CC[C@H]1C2 ZINC000501648784 567401048 /nfs/dbraw/zinc/40/10/48/567401048.db2.gz HXKLKGNYYSERMH-HOTGVXAUSA-N 0 3 375.925 3.090 10 0 GGAEHN OCCN(Cc1cc(Br)cs1)C[C@@H](O)Cc1ccc(F)cc1 ZINC000549610491 567401645 /nfs/dbraw/zinc/40/16/45/567401645.db2.gz NKNKYNRJUFMBOY-HNNXBMFYSA-N 0 3 388.302 3.048 10 0 GGAEHN C[C@H](NCC(=O)Nc1cc(S(C)(=O)=O)ccc1Cl)C1CCC(F)CC1 ZINC000662000723 567402716 /nfs/dbraw/zinc/40/27/16/567402716.db2.gz HMTIMGWCYOPHSE-HIFPTAJRSA-N 0 3 390.908 3.188 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CCC([NH+]2CCCCC2)CC1 ZINC000477604643 567403517 /nfs/dbraw/zinc/40/35/17/567403517.db2.gz HFRPMCZPXIDRIF-UHFFFAOYSA-N 0 3 381.314 3.174 10 0 GGAEHN CCOC(=O)c1csc(CN[C@H](C)C2CCN(CC(F)(F)F)CC2)n1 ZINC000549688971 567404304 /nfs/dbraw/zinc/40/43/04/567404304.db2.gz UOAXIWQYYYUSHG-LLVKDONJSA-N 0 3 379.448 3.072 10 0 GGAEHN COc1ccc(CN2CCC(CNC(=O)[C@H]3C[C@]3(C)Br)CC2)cc1 ZINC000528280764 567407427 /nfs/dbraw/zinc/40/74/27/567407427.db2.gz QSXUXZGESVLSTR-MJGOQNOKSA-N 0 3 395.341 3.197 10 0 GGAEHN O=C(CSc1nnc(-c2ccc(Cl)s2)o1)NC1CCN(C2CC2)CC1 ZINC000569497230 567408884 /nfs/dbraw/zinc/40/88/84/567408884.db2.gz AHGNHGPOABNSAG-UHFFFAOYSA-N 0 3 398.941 3.287 10 0 GGAEHN CN(C(=O)N[C@H]1CCc2c1cccc2Br)[C@@H]1CCN(C2CC2)C1 ZINC000477689519 567409265 /nfs/dbraw/zinc/40/92/65/567409265.db2.gz JBZNZZQRZLARHQ-DYVFJYSZSA-N 0 3 378.314 3.315 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)CCc1nc2cc(Cl)ccc2s1 ZINC000593415984 567411764 /nfs/dbraw/zinc/41/17/64/567411764.db2.gz AQBRHBCPFGSEIV-CQSZACIVSA-N 0 3 381.929 3.109 10 0 GGAEHN O=C(N[C@H](CN1CCCC1)c1ccccc1)c1cc[nH]c(=O)c1Br ZINC000569548518 567412562 /nfs/dbraw/zinc/41/25/62/567412562.db2.gz GRECSLCRAUADKZ-OAHLLOKOSA-N 0 3 390.281 3.117 10 0 GGAEHN CCOc1cc(C[NH2+]C[C@@H](CO)Cc2ccco2)cc(Br)c1[O-] ZINC000569566793 567414132 /nfs/dbraw/zinc/41/41/32/567414132.db2.gz INRMTKKBXDLRSB-ZDUSSCGKSA-N 0 3 384.270 3.087 10 0 GGAEHN CC(C)(C)N1CC[C@@H](NCCCS(C)(=O)=O)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000569573903 567415773 /nfs/dbraw/zinc/41/57/73/567415773.db2.gz HKTFOBAXYOOYIY-SJORKVTESA-N 0 3 390.952 3.417 10 0 GGAEHN Cc1ccc2c(c1Br)CN(CCCN1CCN(C(C)C)CC1)C2 ZINC000662192810 567415897 /nfs/dbraw/zinc/41/58/97/567415897.db2.gz VADBOEKIZXGOAV-UHFFFAOYSA-N 0 3 380.374 3.489 10 0 GGAEHN C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)NC[C@@H]1CCCN1C ZINC000502124580 567420460 /nfs/dbraw/zinc/42/04/60/567420460.db2.gz CNBXVBIVKLGDMM-PWSUYJOCSA-N 0 3 375.694 3.080 10 0 GGAEHN COc1ccc(Br)cc1[C@H]1CCCN1C[C@@H]1CCC2(CNC2)O1 ZINC000662255202 567422048 /nfs/dbraw/zinc/42/20/48/567422048.db2.gz BCPVBNADHVJMPG-GOEBONIOSA-N 0 3 381.314 3.116 10 0 GGAEHN CN(C[C@@H]1CCN(C)C1)C(=O)c1scc(Br)c1Br ZINC000528431138 567422924 /nfs/dbraw/zinc/42/29/24/567422924.db2.gz HJRGNNXRKYRVBD-MRVPVSSYSA-N 0 3 396.148 3.297 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cnc(-c3c(F)cccc3F)s2)C[C@@H]1N(C)C ZINC000593560751 567423625 /nfs/dbraw/zinc/42/36/25/567423625.db2.gz HIUZPBBRCXOWAT-GXTWGEPZSA-N 0 3 383.489 3.206 10 0 GGAEHN CS[C@@H]1CN(c2nn3cc(C4CCCC4)nc3s2)C[C@@H]1N1CCCC1 ZINC000436428110 567424126 /nfs/dbraw/zinc/42/41/26/567424126.db2.gz JIWNGBLJOVZIDE-JKSUJKDBSA-N 0 3 377.583 3.464 10 0 GGAEHN CS[C@H]1CN(c2nn3cc(C4CCCC4)nc3s2)C[C@H]1N1CCCC1 ZINC000436428107 567424137 /nfs/dbraw/zinc/42/41/37/567424137.db2.gz JIWNGBLJOVZIDE-CVEARBPZSA-N 0 3 377.583 3.464 10 0 GGAEHN CCOCCOC[C@@H](O)CN[C@H](C)c1cc2cc(Br)ccc2o1 ZINC000477930354 567425907 /nfs/dbraw/zinc/42/59/07/567425907.db2.gz KKBMLJCPQKSNNY-DOMZBBRYSA-N 0 3 386.286 3.260 10 0 GGAEHN CN(C)Cc1ccc(S(=O)(=O)N[C@@H]2[C@@H]3Cc4cc(Cl)ccc4[C@@H]32)cc1 ZINC000528465485 567426106 /nfs/dbraw/zinc/42/61/06/567426106.db2.gz XSSNJWRAAZHXLY-CEXWTWQISA-N 0 3 376.909 3.018 10 0 GGAEHN CS[C@@H]1CN(C(=O)[C@@H]2CSC[C@H]2c2ccccc2)C[C@@H]1N1CCCC1 ZINC000593603764 567427107 /nfs/dbraw/zinc/42/71/07/567427107.db2.gz WNTUKGPBAQDGOL-ZSYWTGECSA-N 0 3 376.591 3.171 10 0 GGAEHN C[C@H](NC(=O)[C@H](C)N(C)[C@@H](CN)C(F)(F)F)c1ccc(Cl)cc1Cl ZINC000662329475 567427348 /nfs/dbraw/zinc/42/73/48/567427348.db2.gz KAWKLLBNJJTDSB-RVBZMBCESA-N 0 3 386.245 3.381 10 0 GGAEHN CN(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)[C@H](CN)C(F)(F)F ZINC000662327775 567427357 /nfs/dbraw/zinc/42/73/57/567427357.db2.gz MJMXUXMPDLCRFF-SNVBAGLBSA-N 0 3 377.716 3.119 10 0 GGAEHN CN(CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[C@H](CN)C(F)(F)F ZINC000662327814 567427655 /nfs/dbraw/zinc/42/76/55/567427655.db2.gz MVZVELOWNGUDLX-SNVBAGLBSA-N 0 3 377.716 3.119 10 0 GGAEHN CN(CC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1)[C@@H](CN)C(F)(F)F ZINC000662329433 567427748 /nfs/dbraw/zinc/42/77/48/567427748.db2.gz LRPDRJMTSAATHB-KBPBESRZSA-N 0 3 398.256 3.478 10 0 GGAEHN C[C@@H](CN1CCCCC1)NC(=O)Nc1cnc2c(Br)cccn12 ZINC000436484299 567428518 /nfs/dbraw/zinc/42/85/18/567428518.db2.gz DSTALELWHWROPA-LBPRGKRZSA-N 0 3 380.290 3.093 10 0 GGAEHN C[C@@H]1CN(C2CCOCC2)CCN1Cc1ccc(Br)c(F)c1F ZINC000528480967 567428817 /nfs/dbraw/zinc/42/88/17/567428817.db2.gz NLFADKNOIBCOHD-GFCCVEGCSA-N 0 3 389.284 3.412 10 0 GGAEHN COCC1(NCCS(=O)(=O)c2ccc(Br)cc2)CCCCC1 ZINC000662336430 567429028 /nfs/dbraw/zinc/42/90/28/567429028.db2.gz BYKFZHBBEBHTEZ-UHFFFAOYSA-N 0 3 390.343 3.162 10 0 GGAEHN C/C(=C/c1ccccc1C(F)(F)F)CN1CCC[C@H](CS(N)(=O)=O)C1 ZINC000502344836 567429285 /nfs/dbraw/zinc/42/92/85/567429285.db2.gz KAVKTFBEEOFTMW-XXYUJHKVSA-N 0 3 376.444 3.109 10 0 GGAEHN Cc1c(F)c(Br)ccc1C(=O)NCCCNCc1cccnc1 ZINC000662397387 567432957 /nfs/dbraw/zinc/43/29/57/567432957.db2.gz CDTDHYQJVKQEAK-UHFFFAOYSA-N 0 3 380.261 3.201 10 0 GGAEHN CN(C)CCOc1cccc(CNC(=O)Cc2cscc2Br)c1 ZINC000550218125 567434495 /nfs/dbraw/zinc/43/44/95/567434495.db2.gz XZEQQQDUDQGYEC-UHFFFAOYSA-N 0 3 397.338 3.310 10 0 GGAEHN COC1CCN(C2(CNC(=O)c3coc(Br)c3)CCCC2)CC1 ZINC000502450178 567436206 /nfs/dbraw/zinc/43/62/06/567436206.db2.gz GGKQPQYZDPAWGT-UHFFFAOYSA-N 0 3 385.302 3.196 10 0 GGAEHN O=C(c1sc2c(c1Br)CNC2)N1CCC[C@H]1CN1CCCCC1 ZINC000662442293 567436675 /nfs/dbraw/zinc/43/66/75/567436675.db2.gz ZUGPBEGWUKXMKX-LBPRGKRZSA-N 0 3 398.370 3.204 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)c1sc2c(c1Br)CNC2 ZINC000662450227 567437963 /nfs/dbraw/zinc/43/79/63/567437963.db2.gz LFXDIWBJZOBTOY-PHIMTYICSA-N 0 3 386.359 3.107 10 0 GGAEHN CC(C)N1CC[C@@H](N(C)C(=O)c2cc(=O)[nH]c3ccc(Br)cc32)C1 ZINC000457115198 567441496 /nfs/dbraw/zinc/44/14/96/567441496.db2.gz KTPNWJWCSLHTHZ-CYBMUJFWSA-N 0 3 392.297 3.258 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3ccc(C(F)(F)F)cc3Cl)[C@H]2C1 ZINC000502589738 567443578 /nfs/dbraw/zinc/44/35/78/567443578.db2.gz VNDPMINGJXPUEJ-LSDHHAIUSA-N 0 3 376.806 3.294 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@H]3C[C@@H]3c3ccc(Cl)cc3Cl)[C@H]2C1 ZINC000502567455 567443649 /nfs/dbraw/zinc/44/36/49/567443649.db2.gz BIZDDSPCONWQGE-MXSMSXNCSA-N 0 3 383.319 3.419 10 0 GGAEHN C[C@H](NC(=O)C1(NC2CC2)CCC1)c1cc2c(cc1Br)OCCO2 ZINC000662515497 567444318 /nfs/dbraw/zinc/44/43/18/567444318.db2.gz UETHEJJCRLIVSM-NSHDSACASA-N 0 3 395.297 3.072 10 0 GGAEHN COc1cc(C(=O)NCCN2[C@H](C)CCC[C@@H]2C)cc(OC)c1Br ZINC000593876440 567444461 /nfs/dbraw/zinc/44/44/61/567444461.db2.gz XYNGUOWDEJBOOC-BETUJISGSA-N 0 3 399.329 3.459 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)CNC(=O)c1ccc(Cl)c(Cl)c1 ZINC000593876403 567445319 /nfs/dbraw/zinc/44/53/19/567445319.db2.gz WJBINPUXOSGSST-BETUJISGSA-N 0 3 386.323 3.102 10 0 GGAEHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)NCC[C@H]1CCCO1 ZINC000619301498 567445472 /nfs/dbraw/zinc/44/54/72/567445472.db2.gz JQLXYXVWVQUMLF-QGZVFWFLSA-N 0 3 398.345 3.091 10 0 GGAEHN CN(C)CCN(Cc1ccccn1)C(=O)Cc1cscc1Br ZINC000550412967 567445634 /nfs/dbraw/zinc/44/56/34/567445634.db2.gz SOYQHTRWMLHDDH-UHFFFAOYSA-N 0 3 382.327 3.039 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3ccc(Br)c(Cl)c3)[C@H]2C1 ZINC000502646750 567445698 /nfs/dbraw/zinc/44/56/98/567445698.db2.gz HZXILISVHNGZDL-LSDHHAIUSA-N 0 3 387.705 3.038 10 0 GGAEHN NC1(C(=O)N2CCO[C@H](c3ccc(Br)cc3)C2)CC2(CCC2)C1 ZINC000662527766 567446949 /nfs/dbraw/zinc/44/69/49/567446949.db2.gz HGVDCXJRGXMZAA-HNNXBMFYSA-N 0 3 379.298 3.011 10 0 GGAEHN COC1CCN(C(C)(C)CNC(=O)c2csc(Br)c2)CC1 ZINC000593923336 567447481 /nfs/dbraw/zinc/44/74/81/567447481.db2.gz LPZUMWUZXLDRIZ-UHFFFAOYSA-N 0 3 375.332 3.130 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@@H](C)Oc3ccc(Cl)c(Cl)c3)[C@H]2C1 ZINC000502711067 567448415 /nfs/dbraw/zinc/44/84/15/567448415.db2.gz HRGARUBOPLOTIB-OAUYIBNBSA-N 0 3 387.307 3.082 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3ccc(Cl)c(C(F)(F)F)c3)[C@H]2C1 ZINC000502720473 567448947 /nfs/dbraw/zinc/44/89/47/567448947.db2.gz GXKAYCWIWJHVHJ-LSDHHAIUSA-N 0 3 376.806 3.294 10 0 GGAEHN O=C(NCCc1ccc(Br)cc1)Nc1ccc2c(c1)OCCNC2 ZINC000528711784 567449011 /nfs/dbraw/zinc/44/90/11/567449011.db2.gz GPFXKSBLOPIHCR-UHFFFAOYSA-N 0 3 390.281 3.295 10 0 GGAEHN COc1ccc(CN2CCC(C)(N3CCOCC3)CC2)c(Br)c1 ZINC000528730132 567451270 /nfs/dbraw/zinc/45/12/70/567451270.db2.gz RFVKWQZTJDRMEG-UHFFFAOYSA-N 0 3 383.330 3.144 10 0 GGAEHN Cc1cc(Cl)ccc1C1=CCN(C[C@@H]2CCCN(S(C)(=O)=O)C2)CC1 ZINC000528739979 567451510 /nfs/dbraw/zinc/45/15/10/567451510.db2.gz DOIMVNWSDDPKFH-INIZCTEOSA-N 0 3 382.957 3.409 10 0 GGAEHN C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1NCC(=O)Nc1ccc(Br)cc1Cl ZINC000528757497 567453151 /nfs/dbraw/zinc/45/31/51/567453151.db2.gz CFLJKKVSVQMAMR-AMDHYVTDSA-N 0 3 375.694 3.443 10 0 GGAEHN C[C@H]1O[C@@H](C)[C@H](C)[C@H]1NCC(=O)Nc1c(F)cc(F)cc1Br ZINC000528757968 567453560 /nfs/dbraw/zinc/45/35/60/567453560.db2.gz DFCKSMSHINLXPC-PJPCKVBYSA-N 0 3 377.229 3.067 10 0 GGAEHN O=C(CCN1CC[C@H]2CC[C@@H](C1)[S@@]2=O)Nc1cc(Cl)ccc1Cl ZINC000528781731 567454275 /nfs/dbraw/zinc/45/42/75/567454275.db2.gz CVGHJYNQRQGCRX-HEWAKGLMSA-N 0 3 375.321 3.307 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@H]1CCCCO1)c1ccc(Br)cn1 ZINC000570048125 567454531 /nfs/dbraw/zinc/45/45/31/567454531.db2.gz IIIPKQBDQXRDDU-OAHLLOKOSA-N 0 3 384.318 3.088 10 0 GGAEHN COc1cc(Br)ccc1CCCN1CC[C@H]2CC[C@@H](C1)[S@]2=O ZINC000528782158 567455045 /nfs/dbraw/zinc/45/50/45/567455045.db2.gz HVEJQRRELODTLQ-VVBPWWLESA-N 0 3 386.355 3.376 10 0 GGAEHN O=C(N[C@@H]1CCN(C2CCCCC2)C1)c1sc2c(c1Br)CNC2 ZINC000662668361 567455239 /nfs/dbraw/zinc/45/52/39/567455239.db2.gz LHUMUQVTOCHCLD-LLVKDONJSA-N 0 3 398.370 3.251 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)Cc2c(Cl)cccc2Cl)CC1 ZINC000478437110 567455960 /nfs/dbraw/zinc/45/59/60/567455960.db2.gz SMRDBLJHKJEOMC-UHFFFAOYSA-N 0 3 380.275 3.288 10 0 GGAEHN CCOC(=O)c1csc(CCN[C@@H](C)c2ccc(Br)cn2)n1 ZINC000619465804 567456238 /nfs/dbraw/zinc/45/62/38/567456238.db2.gz HJCYZFIJSVYXAT-JTQLQIEISA-N 0 3 384.299 3.371 10 0 GGAEHN O=C(CCN1CCC[C@@H]1c1ccc(=O)[nH]n1)Nc1ccc(Br)cc1 ZINC000528792859 567456655 /nfs/dbraw/zinc/45/66/55/567456655.db2.gz JRWMBOAATCUUGE-OAHLLOKOSA-N 0 3 391.269 3.110 10 0 GGAEHN CC[C@@H]1CC[C@H](C(=O)N(CCN(CC)CC)c2ccc(Br)cn2)O1 ZINC000570097552 567456670 /nfs/dbraw/zinc/45/66/70/567456670.db2.gz HTLUXIVUOXYBCY-HZPDHXFCSA-N 0 3 398.345 3.477 10 0 GGAEHN O=C(NC[C@@H]1CCN(c2cccc(Br)c2)C1)C1(NC2CC2)CCC1 ZINC000662696076 567456968 /nfs/dbraw/zinc/45/69/68/567456968.db2.gz HXQHFQAZNVWJIZ-AWEZNQCLSA-N 0 3 392.341 3.066 10 0 GGAEHN NC1(C(=O)NC[C@H]2CCN(c3cccc(Br)c3)C2)CC2(CCC2)C1 ZINC000662696065 567458166 /nfs/dbraw/zinc/45/81/66/567458166.db2.gz HPFFKZOFGGVUCD-CQSZACIVSA-N 0 3 392.341 3.053 10 0 GGAEHN O[C@@H](CNC[C@@H]1COc2ccccc2O1)COc1cc(Cl)ccc1Cl ZINC000550721335 567458576 /nfs/dbraw/zinc/45/85/76/567458576.db2.gz MDZSOHRYSCGVDK-UONOGXRCSA-N 0 3 384.259 3.163 10 0 GGAEHN CC(C)[C@@H](N)C(=O)N1CCc2cc(Br)c(Br)cc2C1 ZINC000662731847 567459508 /nfs/dbraw/zinc/45/95/08/567459508.db2.gz CXZLSAZZZILQQM-CYBMUJFWSA-N 0 3 390.119 3.080 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)CSc2ccccc2Cl)CC1 ZINC000478469520 567459802 /nfs/dbraw/zinc/45/98/02/567459802.db2.gz LQRPQRLGDRRVMJ-UHFFFAOYSA-N 0 3 377.897 3.185 10 0 GGAEHN CC(C)(C)n1cc(Br)c(C(=O)Nc2ccc3c(c2F)CCNC3)n1 ZINC000662776592 567460510 /nfs/dbraw/zinc/46/05/10/567460510.db2.gz MQIJJXPIDZSSHQ-UHFFFAOYSA-N 0 3 395.276 3.438 10 0 GGAEHN O[C@H](CNC[C@@H]1COc2ccccc2O1)COc1ccc(Cl)c(Cl)c1 ZINC000641938791 567460698 /nfs/dbraw/zinc/46/06/98/567460698.db2.gz GOJKROIEBNDJTO-TZMCWYRMSA-N 0 3 384.259 3.163 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)Cc2cc(Cl)ccc2Cl)CC1 ZINC000478491320 567461942 /nfs/dbraw/zinc/46/19/42/567461942.db2.gz RECDDTYCBDJPQX-UHFFFAOYSA-N 0 3 380.275 3.288 10 0 GGAEHN COc1cc(Br)ccc1CCCNC(=O)C1(NC2CC2)CCC1 ZINC000662798108 567462330 /nfs/dbraw/zinc/46/23/30/567462330.db2.gz AGLOUVCINZBMGU-UHFFFAOYSA-N 0 3 381.314 3.181 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCC1)Nc1ccccc1I ZINC000528856400 567462724 /nfs/dbraw/zinc/46/27/24/567462724.db2.gz YLSKLEAOUGIOHE-ZDUSSCGKSA-N 0 3 399.276 3.430 10 0 GGAEHN COc1ccc(Br)cc1C1(NC(=O)c2cccc3c2CNC3)CC1 ZINC000662819616 567463040 /nfs/dbraw/zinc/46/30/40/567463040.db2.gz JLBVQUPAGGZKMG-UHFFFAOYSA-N 0 3 387.277 3.480 10 0 GGAEHN O=C(N1CCC(Oc2cccc(Br)c2)CC1)C1(NC2CC2)CCC1 ZINC000662800752 567463110 /nfs/dbraw/zinc/46/31/10/567463110.db2.gz SONMCWUINFZJPA-UHFFFAOYSA-N 0 3 393.325 3.494 10 0 GGAEHN O=S(=O)(CCN[C@H]1CCc2ccccc2C1)c1cccc(Br)c1 ZINC000570155862 567463220 /nfs/dbraw/zinc/46/32/20/567463220.db2.gz RVPBLOMIRLZOIS-KRWDZBQOSA-N 0 3 394.334 3.370 10 0 GGAEHN CC1(C)CCC(CNCc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1 ZINC000502989002 567463480 /nfs/dbraw/zinc/46/34/80/567463480.db2.gz MXYNGAYCXQURGO-UHFFFAOYSA-N 0 3 386.583 3.075 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)N[C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000503026639 567465550 /nfs/dbraw/zinc/46/55/50/567465550.db2.gz NYLNMGJGCOIFJQ-MLGOLLRUSA-N 0 3 386.323 3.391 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NCc1ccccc1OC(F)F ZINC000550886283 567468091 /nfs/dbraw/zinc/46/80/91/567468091.db2.gz NQMNCFZWNGJHSO-NSHDSACASA-N 0 3 387.224 3.391 10 0 GGAEHN CC(C)N1CCC[C@H](NC(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000503067049 567468215 /nfs/dbraw/zinc/46/82/15/567468215.db2.gz ZRLQBAXIKKBSSS-NSHDSACASA-N 0 3 375.257 3.259 10 0 GGAEHN CN1CC[C@H](NC(=O)c2cc(O)cc(Br)c2)[C@H]1c1ccccc1 ZINC000528912356 567468507 /nfs/dbraw/zinc/46/85/07/567468507.db2.gz GCJUSKMEBSRSSN-DLBZAZTESA-N 0 3 375.266 3.330 10 0 GGAEHN COc1ccc([C@H](C)N[C@H](C)Cn2cc(Br)ccc2=O)cc1F ZINC000550940153 567469666 /nfs/dbraw/zinc/46/96/66/567469666.db2.gz SNKZXCFVRNBNOQ-NEPJUHHUSA-N 0 3 383.261 3.498 10 0 GGAEHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H]2C[C@@]2(C)Br)cc1 ZINC000528946437 567470969 /nfs/dbraw/zinc/47/09/69/567470969.db2.gz UIGNTBWTHHUVAO-SOLBZPMBSA-N 0 3 381.314 3.122 10 0 GGAEHN CC(C)N1CCN(c2cccc(NC(=O)[C@@H]3C[C@]3(C)Br)c2)CC1 ZINC000528944501 567471159 /nfs/dbraw/zinc/47/11/59/567471159.db2.gz NFSWGZPGQBYVDZ-WMZOPIPTSA-N 0 3 380.330 3.329 10 0 GGAEHN CN(CCNC(=O)c1cc(Br)cc2[nH]cnc21)Cc1ccccc1 ZINC000503187972 567472831 /nfs/dbraw/zinc/47/28/31/567472831.db2.gz GHHWIDKEDAVGPE-UHFFFAOYSA-N 0 3 387.281 3.187 10 0 GGAEHN CSCC[C@@H](N)C(=O)NCC1(c2cccc(OC(F)(F)F)c2)CCC1 ZINC000594448962 567476464 /nfs/dbraw/zinc/47/64/64/567476464.db2.gz SUPQNFHDEOXTTB-CQSZACIVSA-N 0 3 376.444 3.204 10 0 GGAEHN C[C@H]1CC[C@H](NCC(=O)Nc2ccc(I)cc2)CS1 ZINC000594503727 567481624 /nfs/dbraw/zinc/48/16/24/567481624.db2.gz IOWDWBRUXVZVDF-GWCFXTLKSA-N 0 3 390.290 3.103 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CNCC[C@@H](C)[S@@](C)=O ZINC000594498746 567481669 /nfs/dbraw/zinc/48/16/69/567481669.db2.gz VISNDRXNNMYRDT-VERVWZFWSA-N 0 3 384.343 3.190 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CNCC[C@@H](C)[S@](C)=O ZINC000594498745 567482049 /nfs/dbraw/zinc/48/20/49/567482049.db2.gz VISNDRXNNMYRDT-IPQOISQHSA-N 0 3 384.343 3.190 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)S(=O)(=O)c1cccc(Br)c1Cl ZINC000551168329 567482338 /nfs/dbraw/zinc/48/23/38/567482338.db2.gz XUUHFSXGGRHQER-PWSUYJOCSA-N 0 3 395.750 3.063 10 0 GGAEHN O=C(Cc1ccc(Br)cc1O)N1CCN(C2CCCCC2)CC1 ZINC000478776938 567482984 /nfs/dbraw/zinc/48/29/84/567482984.db2.gz WGWMVRZRUKEGNH-UHFFFAOYSA-N 0 3 381.314 3.174 10 0 GGAEHN CCCN1CC[C@@H](NC(=O)c2cc(C)n(-c3ccc(Br)cc3)n2)C1 ZINC000619901795 567486128 /nfs/dbraw/zinc/48/61/28/567486128.db2.gz ZJCAQJHNVQKLKT-OAHLLOKOSA-N 0 3 391.313 3.157 10 0 GGAEHN CC(C)N(Cc1ccccc1)C(=O)C(C)S(=O)(=O)c1ncc(Cl)s1 ZINC000663248544 567486770 /nfs/dbraw/zinc/48/67/70/567486770.db2.gz FUIYGXHZFNGONC-GFCCVEGCSA-N 0 3 386.926 3.396 10 0 GGAEHN C[C@H](CNC(=O)N[C@@H]1CCOc2c(Br)cccc21)N(C)C1CC1 ZINC000570464234 567488145 /nfs/dbraw/zinc/48/81/45/567488145.db2.gz OKIRZOHIHHOQIO-IAQYHMDHSA-N 0 3 382.302 3.055 10 0 GGAEHN CN(c1nnc(-c2ccc(F)cc2Br)n1C)[C@@H]1CCN(C2CC2)C1 ZINC000570486812 567489225 /nfs/dbraw/zinc/48/92/25/567489225.db2.gz KTBYSEVZPKIUDC-CYBMUJFWSA-N 0 3 394.292 3.057 10 0 GGAEHN COc1cc(CNC[C@@H]2CS(=O)(=O)c3ccccc32)cc(Cl)c1OC ZINC000570477421 567489625 /nfs/dbraw/zinc/48/96/25/567489625.db2.gz JGDJHMSMCUOFSR-CYBMUJFWSA-N 0 3 381.881 3.018 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NC[C@H]1CCC2(CCCCC2)O1 ZINC000551278344 567493916 /nfs/dbraw/zinc/49/39/16/567493916.db2.gz PZRMZICHQOJMSM-GOEBONIOSA-N 0 3 383.330 3.471 10 0 GGAEHN CN([C@@H](CN)C(F)(F)F)S(=O)(=O)c1ccc2nc(C(C)(C)C)sc2c1 ZINC000663310035 567494759 /nfs/dbraw/zinc/49/47/59/567494759.db2.gz GBZRWKNUSBXHAM-LBPRGKRZSA-N 0 3 395.472 3.104 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)N1CCc2cc(Cl)cc(Cl)c2C1 ZINC000437467817 567496063 /nfs/dbraw/zinc/49/60/63/567496063.db2.gz NKLPZLKLONFXBS-HNNXBMFYSA-N 0 3 386.323 3.172 10 0 GGAEHN CC(C)[C@@H](Cn1cccn1)NCc1nnc(-c2ccc(Br)cc2)[nH]1 ZINC000551317412 567498061 /nfs/dbraw/zinc/49/80/61/567498061.db2.gz XAQCUOFBSXKZCN-OAHLLOKOSA-N 0 3 389.301 3.245 10 0 GGAEHN Cc1cc(CNc2cc(N3CCOCC3)c(Br)cn2)cc(C)c1O ZINC000570592531 567498074 /nfs/dbraw/zinc/49/80/74/567498074.db2.gz PGUCFRZBBKIQBP-UHFFFAOYSA-N 0 3 392.297 3.037 10 0 GGAEHN CC(C)[C@H](Cn1cccn1)NCc1nnc(-c2ccc(Br)cc2)[nH]1 ZINC000551317411 567498459 /nfs/dbraw/zinc/49/84/59/567498459.db2.gz XAQCUOFBSXKZCN-HNNXBMFYSA-N 0 3 389.301 3.245 10 0 GGAEHN C[C@]1(Br)C[C@@H]1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000529221127 567499822 /nfs/dbraw/zinc/49/98/22/567499822.db2.gz JIQQEVLKWJNOOX-YZVRNYIASA-N 0 3 383.252 3.081 10 0 GGAEHN C[C@H](O)[C@H](NCCC(=O)Nc1ccc(Br)cc1)c1ccccc1 ZINC000663374688 567502770 /nfs/dbraw/zinc/50/27/70/567502770.db2.gz DYDNMUQIPPZKPO-UGSOOPFHSA-N 0 3 377.282 3.489 10 0 GGAEHN CN1CCC[C@@]2(CCN(C(=O)NCc3cc(F)cc(Br)c3)C2)C1 ZINC000457907717 567503037 /nfs/dbraw/zinc/50/30/37/567503037.db2.gz CCYPJTSNJYZMFR-QGZVFWFLSA-N 0 3 384.293 3.216 10 0 GGAEHN CC(C)N1CC[C@H](NC(=O)C(N)C(F)(F)F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000570680067 567504636 /nfs/dbraw/zinc/50/46/36/567504636.db2.gz IYPYZTIPMZQXGH-IHRRRGAJSA-N 0 3 381.801 3.009 10 0 GGAEHN OC1CCN(CCCNc2ncc(Br)c3ccc(F)cc32)CC1 ZINC000663403196 567505415 /nfs/dbraw/zinc/50/54/15/567505415.db2.gz QTZHDTJQSMOKMD-UHFFFAOYSA-N 0 3 382.277 3.395 10 0 GGAEHN CCCN1CCC(NS(=O)(=O)c2cccc(Br)c2Cl)CC1 ZINC000551445514 567507033 /nfs/dbraw/zinc/50/70/33/567507033.db2.gz OSZIYJGVGGFEQX-UHFFFAOYSA-N 0 3 395.750 3.255 10 0 GGAEHN C[C@H]1CN(C(=O)NCc2cc(F)cc(Br)c2)CCN(C2CC2)C1 ZINC000457958981 567508506 /nfs/dbraw/zinc/50/85/06/567508506.db2.gz NMEMMVHCUTYRGC-GFCCVEGCSA-N 0 3 384.293 3.214 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)Nc1ccc(Br)cc1Br ZINC000620321865 567511300 /nfs/dbraw/zinc/51/13/00/567511300.db2.gz QPNAWGKUAVSNFV-JTQLQIEISA-N 0 3 391.107 3.427 10 0 GGAEHN C[C@@H](CNC(=O)c1cc(Br)cc2[nH]cnc21)N1CCC[C@@H](C)C1 ZINC000503975996 567515980 /nfs/dbraw/zinc/51/59/80/567515980.db2.gz ZPESLIYYGXJIMM-NEPJUHHUSA-N 0 3 379.302 3.176 10 0 GGAEHN C[C@H](CNC(=O)c1cc(Br)cc2[nH]cnc21)N1CCCC[C@H]1C ZINC000503975639 567516392 /nfs/dbraw/zinc/51/63/92/567516392.db2.gz FXJPHXZYPLAZOX-VXGBXAGGSA-N 0 3 379.302 3.318 10 0 GGAEHN C[C@@H](CNC(=O)c1cc(Br)cc2[nH]cnc21)N1CCCC[C@@H]1C ZINC000503975638 567516698 /nfs/dbraw/zinc/51/66/98/567516698.db2.gz FXJPHXZYPLAZOX-RYUDHWBXSA-N 0 3 379.302 3.318 10 0 GGAEHN CCN(C(=O)NCC(C)(C)c1ccc(Br)cc1)[C@@H]1CCN(C)C1 ZINC000663714301 567524040 /nfs/dbraw/zinc/52/40/40/567524040.db2.gz RRNATKASMIYVNZ-MRXNPFEDSA-N 0 3 382.346 3.462 10 0 GGAEHN O=C1CCCN1CCCNCc1cc(Cl)ccc1I ZINC000594916552 567524762 /nfs/dbraw/zinc/52/47/62/567524762.db2.gz FOOYJVAHUKVADC-UHFFFAOYSA-N 0 3 392.668 3.047 10 0 GGAEHN C[C@@H](Cc1cc(Br)ccc1F)NC(=O)N1CCN2CCC1CC2 ZINC000551637277 567524807 /nfs/dbraw/zinc/52/48/07/567524807.db2.gz JSGXYLOEFQDWDL-LBPRGKRZSA-N 0 3 384.293 3.009 10 0 GGAEHN CC(C)Oc1ccc([C@@H](CNc2ncncc2Br)N(C)C)cc1 ZINC000570961423 567524980 /nfs/dbraw/zinc/52/49/80/567524980.db2.gz JWBOCUHQASMLOU-MRXNPFEDSA-N 0 3 379.302 3.163 10 0 GGAEHN CC(=O)N1CCC(NCc2cc(Cl)ccc2I)CC1 ZINC000594918398 567525628 /nfs/dbraw/zinc/52/56/28/567525628.db2.gz OCGRCQHYTRTGNQ-UHFFFAOYSA-N 0 3 392.668 3.045 10 0 GGAEHN CCN(C(=O)NCc1cc(OC)ccc1Br)[C@H]1CCN(CC)C1 ZINC000663743876 567527095 /nfs/dbraw/zinc/52/70/95/567527095.db2.gz WMEAFAKIPNCSQI-AWEZNQCLSA-N 0 3 384.318 3.083 10 0 GGAEHN Cc1nc(-c2ccc(CNC(=O)N[C@H]3CCN(CC4CC4)C3)s2)cs1 ZINC000594955297 567528477 /nfs/dbraw/zinc/52/84/77/567528477.db2.gz RLUXYKRQHXJKJQ-AWEZNQCLSA-N 0 3 376.551 3.464 10 0 GGAEHN CC1(C)CN[C@H]1C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1 ZINC000644055386 567528869 /nfs/dbraw/zinc/52/88/69/567528869.db2.gz ZCDKBPGZDUCIFM-INIZCTEOSA-N 0 3 380.275 3.140 10 0 GGAEHN CCN(C(=O)N[C@@H]1CCOc2ccc(Br)cc21)[C@@H]1CCN(CC)C1 ZINC000663786595 567530070 /nfs/dbraw/zinc/53/00/70/567530070.db2.gz IURUIHWXFPCLAT-GDBMZVCRSA-N 0 3 396.329 3.398 10 0 GGAEHN C[C@@H](NCC(=O)Nc1ccc(I)cc1)C1CC(F)(F)C1 ZINC000529556215 567531244 /nfs/dbraw/zinc/53/12/44/567531244.db2.gz RRKZJJOYSKPCTC-SECBINFHSA-N 0 3 394.203 3.253 10 0 GGAEHN CCCN(C)CC(C)(C)NC(=O)COc1ccc(Br)cc1C(C)=O ZINC000620621858 567531470 /nfs/dbraw/zinc/53/14/70/567531470.db2.gz YLGGUKPPAWZSGK-UHFFFAOYSA-N 0 3 399.329 3.267 10 0 GGAEHN Cc1cc(OCC(=O)NC2CCN(C3CC3)CC2)cc(C)c1Br ZINC000479403261 567531969 /nfs/dbraw/zinc/53/19/69/567531969.db2.gz ZOUWGEPQTQBOGQ-UHFFFAOYSA-N 0 3 381.314 3.188 10 0 GGAEHN OC1CCC(CNCc2c(F)ccc(I)c2F)CC1 ZINC000594992856 567532754 /nfs/dbraw/zinc/53/27/54/567532754.db2.gz ZHPRMTPIBLQMHD-UHFFFAOYSA-N 0 3 381.204 3.210 10 0 GGAEHN COc1cc(CNC[C@]2(C)CC2(F)F)cc(I)c1OC ZINC000594985720 567533185 /nfs/dbraw/zinc/53/31/85/567533185.db2.gz NTDIPYVRVKAAGM-ZDUSSCGKSA-N 0 3 397.203 3.443 10 0 GGAEHN CCN(C(=O)NCCc1cc(Br)ccc1F)[C@H]1CCN(CC)C1 ZINC000663826817 567533251 /nfs/dbraw/zinc/53/32/51/567533251.db2.gz URTUASZQEOTEQK-HNNXBMFYSA-N 0 3 386.309 3.256 10 0 GGAEHN CC1(C)CCCN[C@@H]1C(=O)Nc1ccc(I)cc1F ZINC000571061909 567534504 /nfs/dbraw/zinc/53/45/04/567534504.db2.gz JRKLLWKUOWZMBO-GFCCVEGCSA-N 0 3 376.213 3.147 10 0 GGAEHN Cc1cc(C(=O)NCC2(N(C)C)CCC2)nn1-c1ccc(Br)cc1 ZINC000438530775 567534637 /nfs/dbraw/zinc/53/46/37/567534637.db2.gz BUAKDQKVRMCCRT-UHFFFAOYSA-N 0 3 391.313 3.157 10 0 GGAEHN C[C@H](CSCCF)NCc1ccc(Br)cc1N1CCOCC1 ZINC000595020838 567535514 /nfs/dbraw/zinc/53/55/14/567535514.db2.gz AIUOHANZOWRLOH-CYBMUJFWSA-N 0 3 391.350 3.467 10 0 GGAEHN CC(C)(C)C(=O)NCCN[C@@H]1CCc2ccc(I)cc21 ZINC000595024440 567536097 /nfs/dbraw/zinc/53/60/97/567536097.db2.gz FHLOPVOHLYEAIP-CQSZACIVSA-N 0 3 386.277 3.030 10 0 GGAEHN CC(C)(C)C(=O)NCCN[C@H]1CCc2ccc(I)cc21 ZINC000595024439 567536196 /nfs/dbraw/zinc/53/61/96/567536196.db2.gz FHLOPVOHLYEAIP-AWEZNQCLSA-N 0 3 386.277 3.030 10 0 GGAEHN C[C@H](CCN[C@H]1CCc2ccc(I)cc21)[S@](C)=O ZINC000595021780 567536228 /nfs/dbraw/zinc/53/62/28/567536228.db2.gz GBALYKTZZHRAPX-RHXQLXPWSA-N 0 3 377.291 3.025 10 0 GGAEHN C[C@H](CSCCF)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O ZINC000595016913 567536279 /nfs/dbraw/zinc/53/62/79/567536279.db2.gz AWYBPXIJYMLGGS-DOMZBBRYSA-N 0 3 376.444 3.464 10 0 GGAEHN N[C@@H]1CN(C(=O)[C@@H]2CCc3cc(Br)ccc32)C[C@H]1c1ccccc1 ZINC000571088310 567536678 /nfs/dbraw/zinc/53/66/78/567536678.db2.gz GCQOGYNLHYFWKM-CEXWTWQISA-N 0 3 385.305 3.432 10 0 GGAEHN COC[C@@H](N[C@@H](C)c1ccccc1I)C1CCOCC1 ZINC000595075620 567540069 /nfs/dbraw/zinc/54/00/69/567540069.db2.gz ZWILDKYLYDRBBV-BLLLJJGKSA-N 0 3 389.277 3.383 10 0 GGAEHN C[C@@H]1CN(C)C[C@@H]1N[C@H](CO)c1ccc(Br)cc1C(F)(F)F ZINC000479513344 567540537 /nfs/dbraw/zinc/54/05/37/567540537.db2.gz DZUINVZZBVOLCW-BIGNPOOSSA-N 0 3 381.236 3.041 10 0 GGAEHN C[C@H](CCc1ccc(I)cc1)N[C@@H]1C[C@H](C)n2ncnc21 ZINC000595065633 567540735 /nfs/dbraw/zinc/54/07/35/567540735.db2.gz ISQPNSAKPQMLNB-TYNCELHUSA-N 0 3 396.276 3.499 10 0 GGAEHN COC[C@H](N[C@@H](C)c1ccccc1I)C1CCOCC1 ZINC000595075623 567540874 /nfs/dbraw/zinc/54/08/74/567540874.db2.gz ZWILDKYLYDRBBV-LRDDRELGSA-N 0 3 389.277 3.383 10 0 GGAEHN Cc1cncc(CCN[C@H](C)c2ccc(F)c(I)c2)n1 ZINC000595092292 567541557 /nfs/dbraw/zinc/54/15/57/567541557.db2.gz XDXVABIEEDRNLC-LLVKDONJSA-N 0 3 385.224 3.422 10 0 GGAEHN C[C@@H]1CCCN1C(=O)CCNC1(c2ccc(Br)cc2)CCOCC1 ZINC000438723966 567542080 /nfs/dbraw/zinc/54/20/80/567542080.db2.gz NAWXPHKDGGZKCL-OAHLLOKOSA-N 0 3 395.341 3.445 10 0 GGAEHN O=C(N[C@@H]1CCc2c1ccc(Cl)c2Cl)N[C@@H]1CCCN(CCCO)C1 ZINC000458383464 567543171 /nfs/dbraw/zinc/54/31/71/567543171.db2.gz ZRCINLPBAFPXFO-MLGOLLRUSA-N 0 3 386.323 3.127 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCCC1)c1ccccc1I ZINC000529719117 567544068 /nfs/dbraw/zinc/54/40/68/567544068.db2.gz QDAZPLZHTRSTLB-CQSZACIVSA-N 0 3 398.288 3.428 10 0 GGAEHN C[C@H](Sc1ccc(Br)cc1)C(=O)N[C@@H]1CNCCC1(F)F ZINC000571207141 567544842 /nfs/dbraw/zinc/54/48/42/567544842.db2.gz OZHUCJWPNPUSPH-JOYOIKCWSA-N 0 3 379.270 3.043 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3cc(Br)sc3Br)[C@@H]2C1 ZINC000644814050 567580550 /nfs/dbraw/zinc/58/05/50/567580550.db2.gz INCRDRAYXYOJML-VXNVDRBHSA-N 0 3 394.132 3.049 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1cc(F)cc(Br)c1 ZINC000620914167 567550140 /nfs/dbraw/zinc/55/01/40/567550140.db2.gz KNYWJIWHBCYNLM-MRXNPFEDSA-N 0 3 399.304 3.304 10 0 GGAEHN CC[C@@H]1CN(C(=O)c2cc(-c3ccc(Br)cc3)no2)C[C@H](C)N1 ZINC000620904038 567550559 /nfs/dbraw/zinc/55/05/59/567550559.db2.gz KPYPGRVYEDKYOS-SMDDNHRTSA-N 0 3 378.270 3.317 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1ccc(Br)cc1F ZINC000620913325 567550873 /nfs/dbraw/zinc/55/08/73/567550873.db2.gz AOHWBZDFFLYTOP-AWEZNQCLSA-N 0 3 399.304 3.304 10 0 GGAEHN CC[C@@H]1CN(C(=O)c2[nH]nc(-c3ccccc3)c2Br)C[C@H](C)N1 ZINC000620904652 567550957 /nfs/dbraw/zinc/55/09/57/567550957.db2.gz VLSZYFMEPUJUJD-WCQYABFASA-N 0 3 377.286 3.052 10 0 GGAEHN O=S1(=O)C[C@H](CNCCCc2c(F)cccc2Cl)Oc2ccccc21 ZINC000571285611 567552223 /nfs/dbraw/zinc/55/22/23/567552223.db2.gz DWCWHAHJQZJYKR-ZDUSSCGKSA-N 0 3 383.872 3.236 10 0 GGAEHN CCN(C(=O)NCC1(c2cccc(Br)c2)CC1)[C@H]1CCN(C)C1 ZINC000664136708 567552790 /nfs/dbraw/zinc/55/27/90/567552790.db2.gz VEGFCGNJOAQIPJ-INIZCTEOSA-N 0 3 380.330 3.216 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNc1ncc(Cn2cc(Br)cn2)s1 ZINC000664142629 567554265 /nfs/dbraw/zinc/55/42/65/567554265.db2.gz KVUDOOPTRXOXOJ-LBPRGKRZSA-N 0 3 384.347 3.435 10 0 GGAEHN C[C@H](N[C@H](CO)c1cccc(Br)c1)c1ccccc1-n1ccnn1 ZINC000552063086 567554774 /nfs/dbraw/zinc/55/47/74/567554774.db2.gz OPEHSEHPHLHUCE-SUMWQHHRSA-N 0 3 387.281 3.414 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1cnnn1-c1c(Cl)cccc1Cl ZINC000479729352 567555491 /nfs/dbraw/zinc/55/54/91/567555491.db2.gz KPVQGMXVZYNWJN-LBPRGKRZSA-N 0 3 382.295 3.178 10 0 GGAEHN Cc1cc(Br)cc(C)c1N1CCC[C@H](N[C@@H]2CN(C)C[C@@H]2C)C1=O ZINC000552095841 567557391 /nfs/dbraw/zinc/55/73/91/567557391.db2.gz GEMQNXDPCGRZNM-BHYGNILZSA-N 0 3 394.357 3.101 10 0 GGAEHN Cc1cc(Br)cc(C)c1N1CCC[C@H](N[C@@H]2CN(C)C[C@H]2C)C1=O ZINC000552095842 567558241 /nfs/dbraw/zinc/55/82/41/567558241.db2.gz GEMQNXDPCGRZNM-HYVNUMGLSA-N 0 3 394.357 3.101 10 0 GGAEHN CC1(C)CN([C@@H](CNC[C@@H](O)C(F)(F)F)c2ccc(Cl)cc2)CCO1 ZINC000644545386 567558593 /nfs/dbraw/zinc/55/85/93/567558593.db2.gz RATGDSKHERAYTJ-LSDHHAIUSA-N 0 3 380.838 3.005 10 0 GGAEHN CN1CCCC(C)(C)[C@H]1CNC(=O)c1cc(Br)cc2[nH]cnc21 ZINC000505096365 567558910 /nfs/dbraw/zinc/55/89/10/567558910.db2.gz LKRBSHXOTJNNSH-CQSZACIVSA-N 0 3 379.302 3.176 10 0 GGAEHN Cc1ccnc(NCc2ccc(CN3CC[C@H](O)C3)cc2)c1Br ZINC000664238112 567559021 /nfs/dbraw/zinc/55/90/21/567559021.db2.gz WGBQVBPKQDMIMW-INIZCTEOSA-N 0 3 376.298 3.331 10 0 GGAEHN COc1ccc2c(c1)[C@H](NC[C@H]1CCCCN1S(C)(=O)=O)CCCS2 ZINC000552097014 567559156 /nfs/dbraw/zinc/55/91/56/567559156.db2.gz PZRAJWSXBWXQGX-RHSMWYFYSA-N 0 3 384.567 3.026 10 0 GGAEHN Cc1cc(NCc2ccc(CN3CC[C@H](O)C3)cc2)ncc1Br ZINC000664235286 567559252 /nfs/dbraw/zinc/55/92/52/567559252.db2.gz DRQBMIJCIJTUIP-INIZCTEOSA-N 0 3 376.298 3.331 10 0 GGAEHN COc1ccc2c(c1)[C@@H](NC[C@@H]1CCCCN1S(C)(=O)=O)CCCS2 ZINC000552097016 567559490 /nfs/dbraw/zinc/55/94/90/567559490.db2.gz PZRAJWSXBWXQGX-YOEHRIQHSA-N 0 3 384.567 3.026 10 0 GGAEHN Cc1nc(C)c(Br)c(NCc2ccc(CN3CC[C@H](O)C3)cc2)n1 ZINC000664234744 567559480 /nfs/dbraw/zinc/55/94/80/567559480.db2.gz ACSHIXCVYRUPGB-INIZCTEOSA-N 0 3 391.313 3.035 10 0 GGAEHN CCN1CC[C@H]2OCCN(Cc3cc(Br)c(Cl)s3)[C@H]2C1 ZINC000552107022 567559590 /nfs/dbraw/zinc/55/95/90/567559590.db2.gz ZNYUDFOVBAOMPZ-QWHCGFSZSA-N 0 3 379.751 3.459 10 0 GGAEHN COc1cc(C(=O)NC[C@H]2CCN2C2CCCC2)cc(OC)c1Br ZINC000530026663 567561966 /nfs/dbraw/zinc/56/19/66/567561966.db2.gz MZFLZFSNGYCVKI-CQSZACIVSA-N 0 3 397.313 3.213 10 0 GGAEHN C[C@@H](N[C@H]1CCN(CC(=O)OC(C)(C)C)C1=O)c1ccc(Br)cc1 ZINC000595408187 567562414 /nfs/dbraw/zinc/56/24/14/567562414.db2.gz JBSDODUVVVPFSL-DOMZBBRYSA-N 0 3 397.313 3.042 10 0 GGAEHN COc1cc(C(=O)NC[C@@H]2CCN2C2CCCC2)cc(Br)c1OC ZINC000530025024 567562531 /nfs/dbraw/zinc/56/25/31/567562531.db2.gz CBGLBIPDZOTOCQ-AWEZNQCLSA-N 0 3 397.313 3.213 10 0 GGAEHN Cc1c(I)cccc1C(=O)NC[C@H]1CCN1C1CCCC1 ZINC000530022215 567562637 /nfs/dbraw/zinc/56/26/37/567562637.db2.gz DGGSRYIHGJVYSN-CQSZACIVSA-N 0 3 398.288 3.346 10 0 GGAEHN CN(C)C[C@@H](NC(=O)[C@@H]1C[C@H]1c1cncn1C)c1ccc(Cl)c(Cl)c1 ZINC000530034770 567563872 /nfs/dbraw/zinc/56/38/72/567563872.db2.gz XRZFSFHSRBYOCW-XJKCOSOUSA-N 0 3 381.307 3.250 10 0 GGAEHN CC(C)[C@@H]1CN(C(=O)c2c(F)c(F)c(Br)c(F)c2F)CCN1 ZINC000621161358 567565138 /nfs/dbraw/zinc/56/51/38/567565138.db2.gz XTLXLZVYPOATCH-ZETCQYMHSA-N 0 3 383.183 3.076 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cscc2Br)C[C@@H]1N1CCCC1 ZINC000552161477 567565127 /nfs/dbraw/zinc/56/51/27/567565127.db2.gz GKKRSMWHCJGORH-STQMWFEESA-N 0 3 375.357 3.162 10 0 GGAEHN COc1cc(Br)ccc1CNC[C@H](O)COCc1cccs1 ZINC000644625765 567565961 /nfs/dbraw/zinc/56/59/61/567565961.db2.gz RACDSQXTXMXLMB-AWEZNQCLSA-N 0 3 386.311 3.187 10 0 GGAEHN CN(C)C[C@@H]1CCCCN1C(=O)Cc1noc2ccc(Br)cc21 ZINC000644624864 567566363 /nfs/dbraw/zinc/56/63/63/567566363.db2.gz AHNWTDCYCYJNJI-ZDUSSCGKSA-N 0 3 380.286 3.076 10 0 GGAEHN COc1cc(Br)ccc1CNC[C@H](O)COc1ccccc1F ZINC000644625636 567566798 /nfs/dbraw/zinc/56/67/98/567566798.db2.gz BUENUCSWHAEWRX-AWEZNQCLSA-N 0 3 384.245 3.126 10 0 GGAEHN COC(=O)C[C@@](C)(NCCO[C@@H]1CC1(F)F)c1ccc(Br)cc1 ZINC000595484849 567566872 /nfs/dbraw/zinc/56/68/72/567566872.db2.gz SKCQQCSXGPHXSQ-UKRRQHHQSA-N 0 3 392.240 3.241 10 0 GGAEHN COC(=O)C[C@](C)(NCCO[C@H]1CC1(F)F)c1ccc(Br)cc1 ZINC000595484851 567567001 /nfs/dbraw/zinc/56/70/01/567567001.db2.gz SKCQQCSXGPHXSQ-ZFWWWQNUSA-N 0 3 392.240 3.241 10 0 GGAEHN COc1ccccc1CCN(C)C[C@H](O)COc1ccc(Br)cc1 ZINC000552196031 567567579 /nfs/dbraw/zinc/56/75/79/567567579.db2.gz NTGGZIQLUJKCOC-KRWDZBQOSA-N 0 3 394.309 3.372 10 0 GGAEHN Cn1cnc(CN2CC[C@H](Cc3cccc(I)c3)C2)c1 ZINC000595505985 567569748 /nfs/dbraw/zinc/56/97/48/567569748.db2.gz ATJWFMABEWKSPV-CQSZACIVSA-N 0 3 381.261 3.089 10 0 GGAEHN CC(C)N1CC[C@H](N(C)C(=O)N[C@@H]2CCOc3c(Br)cccc32)C1 ZINC000458728648 567570278 /nfs/dbraw/zinc/57/02/78/567570278.db2.gz MXNHJRPTDFZDMU-XJKSGUPXSA-N 0 3 396.329 3.397 10 0 GGAEHN CCN(C(=O)N[C@@H](C)Cc1ccc(F)c(Br)c1)[C@@H]1CCN(C)C1 ZINC000664460917 567570635 /nfs/dbraw/zinc/57/06/35/567570635.db2.gz KRGARASZJTZBQA-GXTWGEPZSA-N 0 3 386.309 3.255 10 0 GGAEHN CCN(C(=O)N[C@H](C)Cc1cc(Br)ccc1F)[C@@H]1CCN(C)C1 ZINC000664527801 567573457 /nfs/dbraw/zinc/57/34/57/567573457.db2.gz WHIULBRXTNFVFC-IUODEOHRSA-N 0 3 386.309 3.255 10 0 GGAEHN CN(CCNS(=O)(=O)c1ccc(F)c(Br)c1)C1CCCCC1 ZINC000439253326 567575978 /nfs/dbraw/zinc/57/59/78/567575978.db2.gz RZRSJPTUOOFHFC-UHFFFAOYSA-N 0 3 393.322 3.131 10 0 GGAEHN CCCN(CCN1CCCCC1)C(=O)N[C@@H](C)c1ncc(Br)cn1 ZINC000458828662 567576465 /nfs/dbraw/zinc/57/64/65/567576465.db2.gz FHNBYTYCJUYQHR-AWEZNQCLSA-N 0 3 398.349 3.208 10 0 GGAEHN COc1cc(CN[C@H]2CCC[C@@H]2Cc2cnn(C)c2)c(Br)cn1 ZINC000621321683 567577865 /nfs/dbraw/zinc/57/78/65/567577865.db2.gz TWUMNRPGXBZANI-CJNGLKHVSA-N 0 3 379.302 3.087 10 0 GGAEHN CCN1CC[C@H]2OCCN(c3nc4c(cccc4Br)s3)[C@H]2C1 ZINC000621321135 567578035 /nfs/dbraw/zinc/57/80/35/567578035.db2.gz RRJONHOQZVAZEB-QWHCGFSZSA-N 0 3 382.327 3.358 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3ccc(Br)c(C(F)(F)F)c3)[C@H]2C1 ZINC000644812435 567578547 /nfs/dbraw/zinc/57/85/47/567578547.db2.gz CSRWSBKHOVXQHP-MFKMUULPSA-N 0 3 377.204 3.244 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)CCCSc3ccc(Br)cc3)[C@@H]2C1 ZINC000644812075 567578826 /nfs/dbraw/zinc/57/88/26/567578826.db2.gz CUMAPMFORNWAMW-CZUORRHYSA-N 0 3 383.355 3.484 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)CCCSc3ccc(Br)cc3)[C@@H]2C1 ZINC000644812077 567578881 /nfs/dbraw/zinc/57/88/81/567578881.db2.gz CUMAPMFORNWAMW-XJKSGUPXSA-N 0 3 383.355 3.484 10 0 GGAEHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)Cc1c(F)ccc(Br)c1F ZINC000552333013 567579027 /nfs/dbraw/zinc/57/90/27/567579027.db2.gz QSTYWQDXSGJTOF-NWDGAFQWSA-N 0 3 387.268 3.355 10 0 GGAEHN C[C@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccc(F)c(Br)c1 ZINC000552333458 567579059 /nfs/dbraw/zinc/57/90/59/567579059.db2.gz FZEFTBRTUQSZKQ-AAEUAGOBSA-N 0 3 393.322 3.053 10 0 GGAEHN O[C@@H]1CCN(C2CCN(c3nc4c(cccc4Br)s3)CC2)C1 ZINC000621339969 567579663 /nfs/dbraw/zinc/57/96/63/567579663.db2.gz RPQDGBZAGZSAMW-GFCCVEGCSA-N 0 3 382.327 3.094 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Br)C(=O)N1CC[C@@H]2CN(C)C[C@@H]21 ZINC000644811327 567579606 /nfs/dbraw/zinc/57/96/06/567579606.db2.gz BBGPJJVKYOHXBV-WDMOLILDSA-N 0 3 387.705 3.032 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3cc(Br)sc3Br)[C@H]2C1 ZINC000644814042 567580501 /nfs/dbraw/zinc/58/05/01/567580501.db2.gz INCRDRAYXYOJML-APPZFPTMSA-N 0 3 394.132 3.049 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)c3cc(C(F)(F)F)ccc3Br)[C@@H]2C1 ZINC000644821005 567581103 /nfs/dbraw/zinc/58/11/03/567581103.db2.gz GPHWWPUORRHVGT-TVQRCGJNSA-N 0 3 377.204 3.244 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)CCOc3ccc(Cl)cc3Br)[C@@H]2C1 ZINC000644814329 567581189 /nfs/dbraw/zinc/58/11/89/567581189.db2.gz JOOKBSYJEUCYGQ-BXUZGUMPSA-N 0 3 387.705 3.034 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)CCCCOc3ccc(Br)cc3)[C@H]2C1 ZINC000644822156 567581238 /nfs/dbraw/zinc/58/12/38/567581238.db2.gz OYQPAINGXCVERK-PBHICJAKSA-N 0 3 381.314 3.161 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)CCc3nc4cc(Br)ccc4s3)[C@@H]2C1 ZINC000644818937 567581247 /nfs/dbraw/zinc/58/12/47/567581247.db2.gz OYSBVLCKEMGGHM-BXUZGUMPSA-N 0 3 394.338 3.154 10 0 GGAEHN CSc1ccc([C@@H](CNC(=O)N[C@H](CO)c2ccsc2)N(C)C)cc1 ZINC000458878932 567582009 /nfs/dbraw/zinc/58/20/09/567582009.db2.gz BWKZNNISOUQTPT-IAGOWNOFSA-N 0 3 379.551 3.106 10 0 GGAEHN Cc1c(C(=O)Nc2cc(Br)ccc2N(C)CCN(C)C)ccn1C ZINC000644834712 567582012 /nfs/dbraw/zinc/58/20/12/567582012.db2.gz VFECBFZRBKSFAN-UHFFFAOYSA-N 0 3 393.329 3.346 10 0 GGAEHN CSc1ccc([C@H](CNC(=O)N[C@H](CO)c2ccsc2)N(C)C)cc1 ZINC000458878934 567582280 /nfs/dbraw/zinc/58/22/80/567582280.db2.gz BWKZNNISOUQTPT-SJORKVTESA-N 0 3 379.551 3.106 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CC[C@H]2CN(C)C[C@@H]21 ZINC000644840328 567582204 /nfs/dbraw/zinc/58/22/04/567582204.db2.gz KHCQDWGLKRSAPR-KSSFIOAISA-N 0 3 375.314 3.079 10 0 GGAEHN CCCOc1c(Br)cc(CN2CC[C@H]3CN(C)C[C@@H]32)cc1OC ZINC000644840510 567582322 /nfs/dbraw/zinc/58/23/22/567582322.db2.gz KPCFUZIRFAJLII-HOCLYGCPSA-N 0 3 383.330 3.382 10 0 GGAEHN COc1cc(CN2CC[C@@H]3CN(C)C[C@H]32)cc(Br)c1OC(F)F ZINC000644839965 567582347 /nfs/dbraw/zinc/58/23/47/567582347.db2.gz HTTWSUXTRNETMQ-DGCLKSJQSA-N 0 3 391.256 3.195 10 0 GGAEHN COc1cc(CN2CC[C@H]3CN(C)C[C@@H]32)cc(Br)c1OC(F)F ZINC000644839964 567582566 /nfs/dbraw/zinc/58/25/66/567582566.db2.gz HTTWSUXTRNETMQ-AAEUAGOBSA-N 0 3 391.256 3.195 10 0 GGAEHN CN(C)C[C@@H](c1ccc(Cl)c(Cl)c1)N1C(=O)N[C@@H](CC(F)(F)F)C1=O ZINC000530215382 567584136 /nfs/dbraw/zinc/58/41/36/567584136.db2.gz WJWFSQNCUPDEPB-RYUDHWBXSA-N 0 3 398.212 3.469 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CC[C@@]3(C2)CCCN(C)C3)c1 ZINC000505585571 567584718 /nfs/dbraw/zinc/58/47/18/567584718.db2.gz FSRXPJWXIGMPIZ-KRWDZBQOSA-N 0 3 398.288 3.158 10 0 GGAEHN CN(C)C[C@@H](c1ccc(Cl)c(Cl)c1)N1C(=O)N[C@H](CC(F)(F)F)C1=O ZINC000530215380 567584983 /nfs/dbraw/zinc/58/49/83/567584983.db2.gz WJWFSQNCUPDEPB-NEPJUHHUSA-N 0 3 398.212 3.469 10 0 GGAEHN C[C@@]1(CNC[C@@H](O)c2ccccc2Br)COc2ccccc2O1 ZINC000530234315 567586451 /nfs/dbraw/zinc/58/64/51/567586451.db2.gz ASPRXWJDNFJUQC-CRAIPNDOSA-N 0 3 378.266 3.302 10 0 GGAEHN CN(C)C[C@@H](NC(=O)Cc1ccc(Br)cc1O)c1ccc(F)cc1 ZINC000552412736 567588363 /nfs/dbraw/zinc/58/83/63/567588363.db2.gz OMEVCSMXWZLDSH-MRXNPFEDSA-N 0 3 395.272 3.255 10 0 GGAEHN C[C@H](NCc1ccc(OCCN(C)C)cc1)c1ncc(Br)cn1 ZINC000644895160 567588229 /nfs/dbraw/zinc/58/82/29/567588229.db2.gz PTDOBZSRSRDLIS-ZDUSSCGKSA-N 0 3 379.302 3.030 10 0 GGAEHN O[C@H](CN[C@H](c1cccnc1)C1CC1)COc1cc(F)cc(Br)c1 ZINC000439458260 567589194 /nfs/dbraw/zinc/58/91/94/567589194.db2.gz SOBJVVHOTOYRQC-AEFFLSMTSA-N 0 3 395.272 3.464 10 0 GGAEHN COC[C@@H](NC[C@@H](O)COc1cc(F)cc(Br)c1)c1ccccc1 ZINC000439459967 567589225 /nfs/dbraw/zinc/58/92/25/567589225.db2.gz WZCSJAFWCSZWQO-SJLPKXTDSA-N 0 3 398.272 3.305 10 0 GGAEHN Cc1[nH]c(=O)c(Br)cc1C(=O)NCCN1CC=C(C(C)(C)C)CC1 ZINC000552461434 567590989 /nfs/dbraw/zinc/59/09/89/567590989.db2.gz QJICFAGIGOZFQZ-UHFFFAOYSA-N 0 3 396.329 3.266 10 0 GGAEHN Cc1c(C(=O)NC[C@]2(N(C)C)CCSC2)cnn1-c1ccccc1Cl ZINC000480275861 567593156 /nfs/dbraw/zinc/59/31/56/567593156.db2.gz DVUFPUQYQIUPAL-GOSISDBHSA-N 0 3 378.929 3.001 10 0 GGAEHN CCOC(=O)c1sc2ccsc2c1CNC(=O)C1(N)CC2(CCC2)C1 ZINC000595936550 567594449 /nfs/dbraw/zinc/59/44/49/567594449.db2.gz NYKWZHKSINMIMY-UHFFFAOYSA-N 0 3 378.519 3.417 10 0 GGAEHN CCN(C(=O)N[C@@H](c1cncc(Br)c1)C1CC1)[C@@H]1CCN(CC)C1 ZINC000664850176 567595050 /nfs/dbraw/zinc/59/50/50/567595050.db2.gz IJQGBCTZNRUKKS-IAGOWNOFSA-N 0 3 395.345 3.421 10 0 GGAEHN Cc1nccc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c1Br ZINC000530354406 567595187 /nfs/dbraw/zinc/59/51/87/567595187.db2.gz CXCSHUWXWIKKSM-RDJZCZTQSA-N 0 3 389.297 3.141 10 0 GGAEHN O=C(Nc1cc(F)c(I)c(F)c1)C1(NC2CC2)CCC1 ZINC000595934265 567595104 /nfs/dbraw/zinc/59/51/04/567595104.db2.gz ZUKKSIPKJPKFHL-UHFFFAOYSA-N 0 3 392.187 3.183 10 0 GGAEHN O=C(Cc1cscc1Br)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000552550125 567596136 /nfs/dbraw/zinc/59/61/36/567596136.db2.gz LHRMCAWYUCNGGT-HNNXBMFYSA-N 0 3 395.322 3.258 10 0 GGAEHN Cc1c(C)c(C)c(CS(=O)(=O)C(C)C(=O)NCC(F)(F)F)c(C)c1C ZINC000480329052 567597364 /nfs/dbraw/zinc/59/73/64/567597364.db2.gz GBJNYIYHCIUOBJ-AWEZNQCLSA-N 0 3 379.444 3.211 10 0 GGAEHN Brc1ccc([C@@H](Cc2ccccn2)NC[C@H]2COCCO2)cc1 ZINC000552575768 567597631 /nfs/dbraw/zinc/59/76/31/567597631.db2.gz HMYZUMJJXMZNND-ZWKOTPCHSA-N 0 3 377.282 3.133 10 0 GGAEHN Brc1ccc([C@H](Cc2ccccn2)NC[C@@H]2COCCO2)cc1 ZINC000552575764 567597773 /nfs/dbraw/zinc/59/77/73/567597773.db2.gz HMYZUMJJXMZNND-MSOLQXFVSA-N 0 3 377.282 3.133 10 0 GGAEHN O=C(N[C@@H]1CCc2c1ccc(F)c2Br)N1CC[C@H](N2CC=CC2)C1 ZINC000459072725 567598477 /nfs/dbraw/zinc/59/84/77/567598477.db2.gz SUZOEVMCLDXYQC-BLLLJJGKSA-N 0 3 394.288 3.231 10 0 GGAEHN O=C(NCC1(c2ccc(Br)s2)CCC1)N1CCN2CCC1CC2 ZINC000571988010 567603749 /nfs/dbraw/zinc/60/37/49/567603749.db2.gz YGJKZQIRYQUXKY-UHFFFAOYSA-N 0 3 398.370 3.422 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)NCCc1ccc(Cl)cc1Cl)CCO2 ZINC000645104646 567605848 /nfs/dbraw/zinc/60/58/48/567605848.db2.gz QRXKCKKIADTETB-UHFFFAOYSA-N 0 3 386.323 3.042 10 0 GGAEHN CCCN(C)CC(=O)N1CCC[C@H]1c1ccccc1I ZINC000505991529 567606227 /nfs/dbraw/zinc/60/62/27/567606227.db2.gz JAPRKCFDORKNGS-HNNXBMFYSA-N 0 3 386.277 3.297 10 0 GGAEHN CCCN(C)CC(=O)N1CCC[C@@H]1c1ccccc1I ZINC000505991530 567606526 /nfs/dbraw/zinc/60/65/26/567606526.db2.gz JAPRKCFDORKNGS-OAHLLOKOSA-N 0 3 386.277 3.297 10 0 GGAEHN CCN1CCC(NC(=O)NC2(c3cc(Br)ccc3OC)CC2)CC1 ZINC000645121366 567606946 /nfs/dbraw/zinc/60/69/46/567606946.db2.gz YVUAGJLOMQKQEF-UHFFFAOYSA-N 0 3 396.329 3.230 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)N1CCO[C@@]2(CCSC2)C1)c1ccsc1 ZINC000645141760 567608012 /nfs/dbraw/zinc/60/80/12/567608012.db2.gz RAYQUBBLJZLKCP-WMZOPIPTSA-N 0 3 383.583 3.049 10 0 GGAEHN [NH3+]C[C@H]1CC[C@H](C[N-]S(=O)(=O)c2c(Cl)cccc2Br)CC1 ZINC000572038567 567608238 /nfs/dbraw/zinc/60/82/38/567608238.db2.gz MHTFMAVSDXSYKH-XYPYZODXSA-N 0 3 395.750 3.146 10 0 GGAEHN C[C@H](CN[C@@H](c1ccc(Br)cc1)C(F)F)CN1CCN(C)CC1 ZINC000621751667 567608151 /nfs/dbraw/zinc/60/81/51/567608151.db2.gz LGAAISJNESQWBJ-CJNGLKHVSA-N 0 3 390.316 3.228 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)N1CCO[C@]2(CCSC2)C1)c1ccsc1 ZINC000645141758 567609099 /nfs/dbraw/zinc/60/90/99/567609099.db2.gz RAYQUBBLJZLKCP-FUHWJXTLSA-N 0 3 383.583 3.049 10 0 GGAEHN C[C@H](CCN1CCN(C)CC1)N[C@H](c1ccc(Br)cc1)C(F)F ZINC000621760695 567609984 /nfs/dbraw/zinc/60/99/84/567609984.db2.gz PYLSASPSTASJQZ-CZUORRHYSA-N 0 3 390.316 3.371 10 0 GGAEHN C[C@H](CCN1CCN(C)CC1)N[C@@H](c1ccc(Br)cc1)C(F)F ZINC000621760694 567610642 /nfs/dbraw/zinc/61/06/42/567610642.db2.gz PYLSASPSTASJQZ-CJNGLKHVSA-N 0 3 390.316 3.371 10 0 GGAEHN COC(=O)[C@H]1CC12CCN(Cc1nc3ccc(Br)cc3[nH]1)CC2 ZINC000480561895 567612320 /nfs/dbraw/zinc/61/23/20/567612320.db2.gz ZJQMKRRGKAGLNH-GFCCVEGCSA-N 0 3 378.270 3.101 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)NCCc1cc(Cl)cc(Cl)c1)CCO2 ZINC000645217505 567613367 /nfs/dbraw/zinc/61/33/67/567613367.db2.gz YOXFESLVFWWUMF-UHFFFAOYSA-N 0 3 386.323 3.042 10 0 GGAEHN CC(C)[C@@]1(CO)CCCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000645248238 567614013 /nfs/dbraw/zinc/61/40/13/567614013.db2.gz LVKDOVAUQIRLIR-KDOFPFPSSA-N 0 3 376.324 3.464 10 0 GGAEHN COCc1cc(Cl)cc(S(=O)(=O)N2CC[C@H]3CC[C@@H](C2)N3C(C)C)c1 ZINC000572170528 567618622 /nfs/dbraw/zinc/61/86/22/567618622.db2.gz VQNZVYXSPGJRSI-SJORKVTESA-N 0 3 386.945 3.122 10 0 GGAEHN Cn1cncc1CCN1CCC[C@@H]1c1ccc(I)cc1 ZINC000459363573 567618758 /nfs/dbraw/zinc/61/87/58/567618758.db2.gz RLZHFGVVWVZZIM-MRXNPFEDSA-N 0 3 381.261 3.404 10 0 GGAEHN Cn1cncc1CCN1CCC[C@H]1c1ccccc1I ZINC000459384652 567620041 /nfs/dbraw/zinc/62/00/41/567620041.db2.gz XZFYEFASXLUJOK-INIZCTEOSA-N 0 3 381.261 3.404 10 0 GGAEHN Brc1cccc(N2CC[C@@H](CNCc3cn4cccnc4n3)C2)c1 ZINC000459388565 567620694 /nfs/dbraw/zinc/62/06/94/567620694.db2.gz FZYCMDUMKACTIN-AWEZNQCLSA-N 0 3 386.297 3.108 10 0 GGAEHN CCC(CC)(NC[C@@H](O)CN1CCOCC1)c1ccc(Cl)c(Cl)c1 ZINC000440310375 567622587 /nfs/dbraw/zinc/62/25/87/567622587.db2.gz CPCNRZUCJLSHKA-OAHLLOKOSA-N 0 3 375.340 3.291 10 0 GGAEHN O=C(NCc1cc(Cl)ccc1Br)N1CC[C@H](N2CC=CC2)C1 ZINC000572238674 567623675 /nfs/dbraw/zinc/62/36/75/567623675.db2.gz WVEWXEJMRCNOAC-AWEZNQCLSA-N 0 3 384.705 3.258 10 0 GGAEHN CCOc1cc(C[NH2+]C2(CO)Cc3ccccc3C2)cc(Br)c1[O-] ZINC000459420328 567624279 /nfs/dbraw/zinc/62/42/79/567624279.db2.gz VZBAZPXGIUIYBH-UHFFFAOYSA-N 0 3 392.293 3.173 10 0 GGAEHN CCOc1cc(C[NH2+][C@@H](CO)Cc2ccc(F)cc2)cc(Br)c1[O-] ZINC000459430640 567624572 /nfs/dbraw/zinc/62/45/72/567624572.db2.gz FAYMUAQGUGEHDI-OAHLLOKOSA-N 0 3 398.272 3.386 10 0 GGAEHN CCO[C@@H]1C[C@H](NCc2nnc(-c3ccc(Br)cc3)[nH]2)[C@@H]1SC ZINC000459458901 567625992 /nfs/dbraw/zinc/62/59/92/567625992.db2.gz HMPVTYNLLDOHOZ-GUTXKFCHSA-N 0 3 397.342 3.233 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)c1c(F)c(F)c(Br)c(F)c1F ZINC000665529478 567628203 /nfs/dbraw/zinc/62/82/03/567628203.db2.gz LNOHKABUFRTUPM-ZETCQYMHSA-N 0 3 383.183 3.220 10 0 GGAEHN O=C(NC[C@@H](c1cccs1)N1CCCC1)C1(C(F)(F)F)CCOCC1 ZINC000665537180 567628934 /nfs/dbraw/zinc/62/89/34/567628934.db2.gz JCNSVFBZYPMMAK-ZDUSSCGKSA-N 0 3 376.444 3.360 10 0 GGAEHN Cc1nc(-c2ccc(CNC(=O)NC[C@@]3(N(C)C)CCSC3)s2)cs1 ZINC000530890421 567629957 /nfs/dbraw/zinc/62/99/57/567629957.db2.gz AYONZHQVTJYSSI-KRWDZBQOSA-N 0 3 396.607 3.417 10 0 GGAEHN Cc1nc(-c2ccc(CNC(=O)NC[C@]3(N(C)C)CCSC3)s2)cs1 ZINC000530890422 567630312 /nfs/dbraw/zinc/63/03/12/567630312.db2.gz AYONZHQVTJYSSI-QGZVFWFLSA-N 0 3 396.607 3.417 10 0 GGAEHN C[C@H](NCCNC(=O)c1ccccc1)c1ccc(I)cc1 ZINC000480792823 567631002 /nfs/dbraw/zinc/63/10/02/567631002.db2.gz OHWFUMYNYCOGTG-ZDUSSCGKSA-N 0 3 394.256 3.372 10 0 GGAEHN CCOc1cc(C[N@H+](C)CCCNC(=O)C2CCC2)cc(Br)c1[O-] ZINC000459506651 567631323 /nfs/dbraw/zinc/63/13/23/567631323.db2.gz LFAIVYZLRJAOPK-UHFFFAOYSA-N 0 3 399.329 3.292 10 0 GGAEHN CCOc1cc(C[N@@H+](C)CCCNC(=O)C2CCC2)cc(Br)c1[O-] ZINC000459506651 567631327 /nfs/dbraw/zinc/63/13/27/567631327.db2.gz LFAIVYZLRJAOPK-UHFFFAOYSA-N 0 3 399.329 3.292 10 0 GGAEHN Cn1cncc1CCN(CCc1ccc(Cl)cc1)C[C@@H](O)C(F)(F)F ZINC000459521073 567631983 /nfs/dbraw/zinc/63/19/83/567631983.db2.gz HCRGRSWBBMBJLO-MRXNPFEDSA-N 0 3 375.822 3.084 10 0 GGAEHN CC[C@@H]1CC[C@H](C)C[C@@H]1NCc1ccc(S(=O)(=O)N2CCOCC2)s1 ZINC000572341633 567632567 /nfs/dbraw/zinc/63/25/67/567632567.db2.gz XJKUNSXRPHCNMC-UXLLHSPISA-N 0 3 386.583 3.073 10 0 GGAEHN Cc1cc(C(=O)NCCN2CC[C@@H](C)C2)nn1-c1ccc(Br)cc1 ZINC000530949589 567632755 /nfs/dbraw/zinc/63/27/55/567632755.db2.gz YXIYXSYMNUSNID-CYBMUJFWSA-N 0 3 391.313 3.015 10 0 GGAEHN C[C@H](NC[C@H]1CCN(S(=O)(=O)c2cccs2)C1)c1cc(F)ccc1F ZINC000506630419 567633628 /nfs/dbraw/zinc/63/36/28/567633628.db2.gz LEVUPGMGJBGMES-QWHCGFSZSA-N 0 3 386.489 3.388 10 0 GGAEHN C[C@@H]1CN(CC(C)(C)O)CCN1c1ccc(Br)c(C(F)(F)F)n1 ZINC000553211697 567635068 /nfs/dbraw/zinc/63/50/68/567635068.db2.gz CIYGNHICOVNZLO-SNVBAGLBSA-N 0 3 396.251 3.144 10 0 GGAEHN CN1CCC[C@@H](N2CCN(c3nccc4cc(Br)ccc43)CC2)C1 ZINC000665701481 567636108 /nfs/dbraw/zinc/63/61/08/567636108.db2.gz VBCQNFMNEDNQCS-QGZVFWFLSA-N 0 3 389.341 3.214 10 0 GGAEHN O[C@@H]1CCC[C@@H]1N1CCN(c2nccc3cc(Br)ccc32)CC1 ZINC000665698148 567636149 /nfs/dbraw/zinc/63/61/49/567636149.db2.gz WNVQUHYWQXYWGE-DLBZAZTESA-N 0 3 376.298 3.033 10 0 GGAEHN O[C@H]1CCC[C@H]1N1CCN(c2nccc3cc(Br)ccc32)CC1 ZINC000665698151 567636213 /nfs/dbraw/zinc/63/62/13/567636213.db2.gz WNVQUHYWQXYWGE-SJORKVTESA-N 0 3 376.298 3.033 10 0 GGAEHN CCC[C@@H]1CN(Cc2nc3cc(Br)ccc3[nH]2)CCN1CCOC ZINC000480856292 567636390 /nfs/dbraw/zinc/63/63/90/567636390.db2.gz JYLOFFOUQSMSKS-OAHLLOKOSA-N 0 3 395.345 3.258 10 0 GGAEHN CCC[C@@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)CCN1CCOC ZINC000480856292 567636395 /nfs/dbraw/zinc/63/63/95/567636395.db2.gz JYLOFFOUQSMSKS-OAHLLOKOSA-N 0 3 395.345 3.258 10 0 GGAEHN CCOc1cc(C[N@H+](CCO)C2CCSCC2)cc(Br)c1[O-] ZINC000459567507 567638155 /nfs/dbraw/zinc/63/81/55/567638155.db2.gz IOVFHSXWADWKRQ-UHFFFAOYSA-N 0 3 390.343 3.243 10 0 GGAEHN CCOc1cc(C[N@@H+](CCO)C2CCSCC2)cc(Br)c1[O-] ZINC000459567507 567638160 /nfs/dbraw/zinc/63/81/60/567638160.db2.gz IOVFHSXWADWKRQ-UHFFFAOYSA-N 0 3 390.343 3.243 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)c2cnc(-c3ccc(F)c(F)c3)s2)CCSC1 ZINC000506728294 567640458 /nfs/dbraw/zinc/64/04/58/567640458.db2.gz BQJAXUKNAXXRDK-QGZVFWFLSA-N 0 3 383.489 3.255 10 0 GGAEHN CCOc1cc(CN2CC[C@]3(C2)CCC[N@H+](C)C3)cc(Br)c1[O-] ZINC000459597110 567640798 /nfs/dbraw/zinc/64/07/98/567640798.db2.gz VAYOFWJNNAWEHW-GOSISDBHSA-N 0 3 383.330 3.471 10 0 GGAEHN CCOc1cc(CN2CC[C@]3(C2)CCC[N@@H+](C)C3)cc(Br)c1[O-] ZINC000459597110 567640802 /nfs/dbraw/zinc/64/08/02/567640802.db2.gz VAYOFWJNNAWEHW-GOSISDBHSA-N 0 3 383.330 3.471 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)Nc1ccccc1I ZINC000596626527 567643751 /nfs/dbraw/zinc/64/37/51/567643751.db2.gz JIILTBQQAIVFSP-NSHDSACASA-N 0 3 387.265 3.286 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)Nc1ccccc1I ZINC000596626525 567644108 /nfs/dbraw/zinc/64/41/08/567644108.db2.gz JIILTBQQAIVFSP-LLVKDONJSA-N 0 3 387.265 3.286 10 0 GGAEHN CCCN1CCC[C@H]1CNC(=O)c1ccc(C)c(I)c1 ZINC000553332545 567644656 /nfs/dbraw/zinc/64/46/56/567644656.db2.gz HBVGLYRGKQGBBA-AWEZNQCLSA-N 0 3 386.277 3.204 10 0 GGAEHN OC[C@]1(O)CCCN(Cc2ccc(-c3ccc(Br)cc3)s2)C1 ZINC000459642865 567644853 /nfs/dbraw/zinc/64/48/53/567644853.db2.gz BYMOUBHJXHYTSL-KRWDZBQOSA-N 0 3 382.323 3.497 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000440910616 567647782 /nfs/dbraw/zinc/64/77/82/567647782.db2.gz DCYRXSSXGBEHGH-OCCSQVGLSA-N 0 3 390.325 3.454 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1 ZINC000440910614 567647965 /nfs/dbraw/zinc/64/79/65/567647965.db2.gz DCYRXSSXGBEHGH-GXTWGEPZSA-N 0 3 390.325 3.454 10 0 GGAEHN O=C(CCCc1nccs1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000622569592 567651177 /nfs/dbraw/zinc/65/11/77/567651177.db2.gz FNEHUESUJCXRAK-UHFFFAOYSA-N 0 3 375.460 3.387 10 0 GGAEHN CC1(C)Oc2ccsc2[C@@H](NC2CCN(CCC(F)(F)F)CC2)[C@@H]1O ZINC000459694295 567651344 /nfs/dbraw/zinc/65/13/44/567651344.db2.gz KZLPAWOXMRLUSU-HIFRSBDPSA-N 0 3 378.460 3.328 10 0 GGAEHN COc1ccc2c(c1)OCC[C@@H]2N[C@@H](C)Cn1cc(Br)ccc1=O ZINC000666093942 567654095 /nfs/dbraw/zinc/65/40/95/567654095.db2.gz VBUYAWWFSHQOEQ-LRDDRELGSA-N 0 3 393.281 3.121 10 0 GGAEHN CCCN1CCC(NS(=O)(=O)c2c(C)cc(Br)cc2C)CC1 ZINC000507021634 567654113 /nfs/dbraw/zinc/65/41/13/567654113.db2.gz OLRBYVUAEBWPDJ-UHFFFAOYSA-N 0 3 389.359 3.219 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NC1(c2ccc3c(c2)OCO3)CC1 ZINC000666119879 567655351 /nfs/dbraw/zinc/65/53/51/567655351.db2.gz FGLFYAJNWTWETC-GFCCVEGCSA-N 0 3 391.265 3.007 10 0 GGAEHN O=C(NCCN1CCCCC1)N[C@@H]1CCOc2c(Br)cccc21 ZINC000507047024 567655376 /nfs/dbraw/zinc/65/53/76/567655376.db2.gz QBAUTUCYPAIRND-OAHLLOKOSA-N 0 3 382.302 3.058 10 0 GGAEHN C[S@](=O)c1ccc(CN[C@@H]2CCO[C@H]2c2cncc(Br)c2)cc1 ZINC000459752751 567655942 /nfs/dbraw/zinc/65/59/42/567655942.db2.gz CBHJPQIJGZWNAQ-DGGJZMOXSA-N 0 3 395.322 3.201 10 0 GGAEHN COc1ccc([C@H](CO)CNCc2ccc(Br)cc2OC)cc1 ZINC000459752319 567656213 /nfs/dbraw/zinc/65/62/13/567656213.db2.gz OLMGKTOCVUMADX-HNNXBMFYSA-N 0 3 380.282 3.332 10 0 GGAEHN OC[C@@]1(O)CCCN(Cc2ccc(-c3ccccc3Br)cc2)C1 ZINC000459735585 567656760 /nfs/dbraw/zinc/65/67/60/567656760.db2.gz VTQGSLZVAQGMAR-LJQANCHMSA-N 0 3 376.294 3.435 10 0 GGAEHN C[C@H](NC(=O)CN1CCC[C@@H]([C@H]2CCOC2)C1)c1ccc(Br)cc1 ZINC000441201928 567657396 /nfs/dbraw/zinc/65/73/96/567657396.db2.gz HBZAEFXLNCRKKH-UAGQMJEPSA-N 0 3 395.341 3.375 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNS(=O)(=O)Cc1cccc(Br)c1 ZINC000553477885 567658009 /nfs/dbraw/zinc/65/80/09/567658009.db2.gz CRVJDTXGPFLEGT-OKILXGFUSA-N 0 3 389.359 3.131 10 0 GGAEHN Cc1cc(C(=O)NC[C@H](C)N2CCCC2)nn1-c1ccc(Br)cc1 ZINC000531429348 567658618 /nfs/dbraw/zinc/65/86/18/567658618.db2.gz WBYXZCBCNXWKPC-AWEZNQCLSA-N 0 3 391.313 3.157 10 0 GGAEHN CN(Cc1ccccc1Br)C(=O)CN1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000441290098 567659207 /nfs/dbraw/zinc/65/92/07/567659207.db2.gz UCCQASQMPGKCRS-NVXWUHKLSA-N 0 3 395.341 3.156 10 0 GGAEHN O=C(CN1CCC[C@H]([C@H]2CCOC2)C1)NCCc1cccc(Cl)c1Cl ZINC000441283195 567659537 /nfs/dbraw/zinc/65/95/37/567659537.db2.gz WJQIFXJXJCTASX-HOTGVXAUSA-N 0 3 385.335 3.401 10 0 GGAEHN Cc1c(Br)cncc1C(=O)NCCCN1CCc2ccccc2C1 ZINC000666224919 567659755 /nfs/dbraw/zinc/65/97/55/567659755.db2.gz XSKSUJGSCPMEKD-UHFFFAOYSA-N 0 3 388.309 3.331 10 0 GGAEHN C[C@@H]1CN(c2ccc(Br)c(C(F)(F)F)n2)CCN1CC(C)(C)O ZINC000553532381 567662367 /nfs/dbraw/zinc/66/23/67/567662367.db2.gz SIRMSIKKCGWJSO-SNVBAGLBSA-N 0 3 396.251 3.144 10 0 GGAEHN CCN(C(=O)Nc1cc(C(=O)OC)c(Br)cc1C)[C@H]1CCN(C)C1 ZINC000596902536 567663759 /nfs/dbraw/zinc/66/37/59/567663759.db2.gz DWBDGSVLIFMBMY-LBPRGKRZSA-N 0 3 398.301 3.102 10 0 GGAEHN CCN1CC[C@@H](NCCCS(=O)(=O)C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000572783459 567665442 /nfs/dbraw/zinc/66/54/42/567665442.db2.gz PWYJEUKARIDBKQ-MSOLQXFVSA-N 0 3 390.952 3.417 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000507218787 567666707 /nfs/dbraw/zinc/66/67/07/567666707.db2.gz MIFKGTZOBVNZHU-IUODEOHRSA-N 0 3 382.302 3.056 10 0 GGAEHN C[C@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccc(OC(F)(F)F)cc1 ZINC000507245359 567669736 /nfs/dbraw/zinc/66/97/36/567669736.db2.gz ZBCNPFIQOGLYIV-JSGCOSHPSA-N 0 3 380.432 3.050 10 0 GGAEHN CN(C(=O)Nc1ccncc1Br)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000507248140 567670934 /nfs/dbraw/zinc/67/09/34/567670934.db2.gz MRXWJKFMKADSJV-OAHLLOKOSA-N 0 3 389.297 3.004 10 0 GGAEHN Cn1nc2c(c1CNCCC(=O)Nc1cccc(Br)c1)CCCC2 ZINC000572871019 567671123 /nfs/dbraw/zinc/67/11/23/567671123.db2.gz RUVPPHPSQGSGIU-UHFFFAOYSA-N 0 3 391.313 3.180 10 0 GGAEHN CN(C(=O)Nc1ccncc1Br)[C@H]1CCN(Cc2ccccc2)C1 ZINC000507248139 567671520 /nfs/dbraw/zinc/67/15/20/567671520.db2.gz MRXWJKFMKADSJV-HNNXBMFYSA-N 0 3 389.297 3.004 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2ccc(Br)c(F)c2)C[C@@H]1N1CCCC1 ZINC000460101424 567672662 /nfs/dbraw/zinc/67/26/62/567672662.db2.gz FFMFHGLKNCOUGD-LSDHHAIUSA-N 0 3 387.318 3.240 10 0 GGAEHN CN(C[C@@H]1CCCN1C)C(=O)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000666400584 567672907 /nfs/dbraw/zinc/67/29/07/567672907.db2.gz NGKWOLBPNUZIKB-GOEBONIOSA-N 0 3 398.370 3.473 10 0 GGAEHN O=C(NC[C@H](O)CN1CCCCC1)c1cc(Br)c2ccccc2c1 ZINC000645833475 567673236 /nfs/dbraw/zinc/67/32/36/567673236.db2.gz OMLFEKVITXQMHU-INIZCTEOSA-N 0 3 391.309 3.179 10 0 GGAEHN CN(CCN1CCCC1)C(=O)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000666401206 567673720 /nfs/dbraw/zinc/67/37/20/567673720.db2.gz BWTHRWKOVSBNBR-MRXNPFEDSA-N 0 3 398.370 3.474 10 0 GGAEHN C[C@@H](NCCCN1CCC[C@@H]1C(=O)N(C)C)c1sccc1Br ZINC000531705951 567674467 /nfs/dbraw/zinc/67/44/67/567674467.db2.gz DZBFKBPPKHUTOO-TZMCWYRMSA-N 0 3 388.375 3.104 10 0 GGAEHN CCN1CCCN(C(=O)N[C@H]2CSCc3ccc(Br)cc32)CC1 ZINC000666402073 567674563 /nfs/dbraw/zinc/67/45/63/567674563.db2.gz UMCNTZHJWKICFE-INIZCTEOSA-N 0 3 398.370 3.474 10 0 GGAEHN CN1CC=C(CNC(=O)N[C@@H]2CSCc3ccc(Br)cc32)CC1 ZINC000666402090 567674579 /nfs/dbraw/zinc/67/45/79/567674579.db2.gz UWXLWFNJNFRVDN-MRXNPFEDSA-N 0 3 396.354 3.298 10 0 GGAEHN O=C(N[C@H]1CSCc2ccc(Br)cc21)N1CCN2CCC1CC2 ZINC000666402385 567674761 /nfs/dbraw/zinc/67/47/61/567674761.db2.gz XYDDLTZVVWDZNP-INIZCTEOSA-N 0 3 396.354 3.227 10 0 GGAEHN CCN(C(=O)Nc1cnn(-c2ccccc2Br)c1)[C@H]1CCN(C)C1 ZINC000666446833 567677364 /nfs/dbraw/zinc/67/73/64/567677364.db2.gz IMSBTSFPSJEKAT-AWEZNQCLSA-N 0 3 392.301 3.193 10 0 GGAEHN CCn1c(-c2cc(F)ccc2Br)nnc1N1CCCN(CC)CC1 ZINC000460195300 567677741 /nfs/dbraw/zinc/67/77/41/567677741.db2.gz RZWLRZYDEBZSFR-UHFFFAOYSA-N 0 3 396.308 3.399 10 0 GGAEHN CO[C@H]1C[C@H]2C[C@H](NCC(=O)Nc3ccc(Br)c(C)c3)C[C@H]2C1 ZINC000572994429 567679101 /nfs/dbraw/zinc/67/91/01/567679101.db2.gz JZZTVCDGNZPESR-WBIXOSHYSA-N 0 3 381.314 3.489 10 0 GGAEHN CCc1n[nH]c(C(=O)N(CCN2CCCCCC2)C(C)C)c1Br ZINC000553756304 567680105 /nfs/dbraw/zinc/68/01/05/567680105.db2.gz VGFQUDNNUFYRNK-UHFFFAOYSA-N 0 3 385.350 3.461 10 0 GGAEHN CN(CCNC(=O)NCc1ccc(Br)cc1C(F)(F)F)C1CC1 ZINC000481475652 567680258 /nfs/dbraw/zinc/68/02/58/567680258.db2.gz DGFVHOWYQPWIRB-UHFFFAOYSA-N 0 3 394.235 3.361 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)NCCCc1cccc(Br)c1 ZINC000645955686 567683285 /nfs/dbraw/zinc/68/32/85/567683285.db2.gz LJTMBRYMDWVOTQ-FCEWJHQRSA-N 0 3 395.341 3.030 10 0 GGAEHN Cc1ncc(CN2CC[C@H](Cc3cccc(I)c3)C2)n1C ZINC000597134504 567683574 /nfs/dbraw/zinc/68/35/74/567683574.db2.gz HIQVCRUQRTZFOL-OAHLLOKOSA-N 0 3 395.288 3.398 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)NCCCc1cccc(Br)c1 ZINC000645955687 567683632 /nfs/dbraw/zinc/68/36/32/567683632.db2.gz LJTMBRYMDWVOTQ-FRQCXROJSA-N 0 3 395.341 3.030 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)NCCCc1cccc(Br)c1 ZINC000645955688 567683925 /nfs/dbraw/zinc/68/39/25/567683925.db2.gz LJTMBRYMDWVOTQ-GPMSIDNRSA-N 0 3 395.341 3.030 10 0 GGAEHN CN1CC=C(CNC(=O)NCC2(Cc3ccc(Br)cc3)CC2)CC1 ZINC000666548042 567684537 /nfs/dbraw/zinc/68/45/37/567684537.db2.gz SWJZFAFQWKSVNC-UHFFFAOYSA-N 0 3 392.341 3.333 10 0 GGAEHN Cc1cc(I)cc(C(=O)N2CCC[C@@H]2CN(C)C)c1C ZINC000481521052 567685613 /nfs/dbraw/zinc/68/56/13/567685613.db2.gz QIEAKUHLCPBIFI-CQSZACIVSA-N 0 3 386.277 3.074 10 0 GGAEHN CCO[C@@H]1C[C@@](N)(C(=O)N[C@H](C)c2ccc(Br)cc2OC)C1(C)C ZINC000573088688 567686214 /nfs/dbraw/zinc/68/62/14/567686214.db2.gz YIGDUPPNLPJMQO-PZDGAKPMSA-N 0 3 399.329 3.167 10 0 GGAEHN CCOc1cc(C[NH2+][C@@H]2CCC[C@H]([S@@](C)=O)C2)cc(Br)c1[O-] ZINC000597184837 567687071 /nfs/dbraw/zinc/68/70/71/567687071.db2.gz QJYMHOCUCSNCCV-GPAUDHNESA-N 0 3 390.343 3.333 10 0 GGAEHN Cc1c([C@H](C)NC[C@@H]2CCCN2C)nnn1-c1cccc(Br)c1 ZINC000481551977 567687682 /nfs/dbraw/zinc/68/76/82/567687682.db2.gz KPQWMZWDYFABRS-LRDDRELGSA-N 0 3 378.318 3.083 10 0 GGAEHN Cc1c([C@@H](C)NC[C@@H]2CCCN2C)nnn1-c1cccc(Br)c1 ZINC000481551979 567687984 /nfs/dbraw/zinc/68/79/84/567687984.db2.gz KPQWMZWDYFABRS-WBMJQRKESA-N 0 3 378.318 3.083 10 0 GGAEHN Cc1nc([C@@H]2CCCN(Cc3nc4cc(Br)ccc4[nH]3)C2)n[nH]1 ZINC000460395167 567688321 /nfs/dbraw/zinc/68/83/21/567688321.db2.gz VFGDOOGPWPLMDT-LLVKDONJSA-N 0 3 375.274 3.132 10 0 GGAEHN Cc1n[nH]c([C@@H]2CCCN(Cc3nc4cc(Br)ccc4[nH]3)C2)n1 ZINC000460395167 567688330 /nfs/dbraw/zinc/68/83/30/567688330.db2.gz VFGDOOGPWPLMDT-LLVKDONJSA-N 0 3 375.274 3.132 10 0 GGAEHN CC(C)CC(CC(C)C)NCc1ccc(S(=O)(=O)N2CCOCC2)s1 ZINC000531936179 567689938 /nfs/dbraw/zinc/68/99/38/567689938.db2.gz DDZWIESARMENEE-UHFFFAOYSA-N 0 3 388.599 3.319 10 0 GGAEHN COC(=O)CCCN1CCC(NCc2sc(C)cc2Br)CC1 ZINC000597208756 567690253 /nfs/dbraw/zinc/69/02/53/567690253.db2.gz MYNADJAWPASBAD-UHFFFAOYSA-N 0 3 389.359 3.326 10 0 GGAEHN COC(=O)c1ccc(CNCC2(CC(N)=O)CCCCC2)c(Br)c1 ZINC000597239089 567691777 /nfs/dbraw/zinc/69/17/77/567691777.db2.gz JHXHKLBLVSUKKD-UHFFFAOYSA-N 0 3 397.313 3.151 10 0 GGAEHN NS(=O)(=O)c1ccc(OCCNC2(c3cccc(Cl)c3)CCC2)cc1 ZINC000646094891 567693290 /nfs/dbraw/zinc/69/32/90/567693290.db2.gz ZXBQZOQTGLMQKE-UHFFFAOYSA-N 0 3 380.897 3.035 10 0 GGAEHN O=C(c1cccc2c1CCNC2)N1CCc2ccc(F)c(Br)c2C1 ZINC000623232525 567694017 /nfs/dbraw/zinc/69/40/17/567694017.db2.gz PBMAUXOADRDKIG-UHFFFAOYSA-N 0 3 389.268 3.432 10 0 GGAEHN CC[C@H](NCCc1ccccc1O)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481669542 567694652 /nfs/dbraw/zinc/69/46/52/567694652.db2.gz VNFBINSQYAIWPF-INIZCTEOSA-N 0 3 382.913 3.237 10 0 GGAEHN C[C@H](CN1CCCCC1)NC(=O)N1CCc2cccc(Br)c2C1 ZINC000532051024 567695122 /nfs/dbraw/zinc/69/51/22/567695122.db2.gz ANXGBIREZLIHEA-CQSZACIVSA-N 0 3 380.330 3.391 10 0 GGAEHN CCCCN([C@@H]1CCN(CC(F)(F)F)C1=O)[C@@H]1CCc2ncsc2C1 ZINC000646129169 567695441 /nfs/dbraw/zinc/69/54/41/567695441.db2.gz YUMQMBHSMPUGIH-TZMCWYRMSA-N 0 3 375.460 3.266 10 0 GGAEHN CN(C)[C@]1(CNC(=O)NCc2csc(-c3ccccc3)n2)CCSC1 ZINC000481677766 567695663 /nfs/dbraw/zinc/69/56/63/567695663.db2.gz LZDBZQXOWLHTRO-SFHVURJKSA-N 0 3 376.551 3.047 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)NCc2csc(-c3ccccc3)n2)CCSC1 ZINC000481677759 567696236 /nfs/dbraw/zinc/69/62/36/567696236.db2.gz LZDBZQXOWLHTRO-GOSISDBHSA-N 0 3 376.551 3.047 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)CCOc1cccc(Br)c1 ZINC000573208541 567696835 /nfs/dbraw/zinc/69/68/35/567696835.db2.gz JWZQVOYLRZQKCN-SFHVURJKSA-N 0 3 389.293 3.303 10 0 GGAEHN Cn1ncc2ccc(CNC[C@H](O)COc3c(Cl)cccc3Cl)cc21 ZINC000573238070 567698351 /nfs/dbraw/zinc/69/83/51/567698351.db2.gz MDESSRTWLHJJLN-AWEZNQCLSA-N 0 3 380.275 3.410 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)NCC1(c2ccc(Br)s2)CCC1 ZINC000553945637 567701692 /nfs/dbraw/zinc/70/16/92/567701692.db2.gz HALZDQZIUFLEDC-LBPRGKRZSA-N 0 3 386.359 3.326 10 0 GGAEHN CCSc1ccc(Cl)cc1NC(=O)N1CN(CCN(C)C)C(=O)[C@H]1C ZINC000646263177 567702310 /nfs/dbraw/zinc/70/23/10/567702310.db2.gz CYFCKGWKRYRGJM-GFCCVEGCSA-N 0 3 384.933 3.036 10 0 GGAEHN CCSc1ccc(Cl)cc1NC(=O)N1CN(CCN(C)C)C(=O)[C@@H]1C ZINC000646263178 567703141 /nfs/dbraw/zinc/70/31/41/567703141.db2.gz CYFCKGWKRYRGJM-LBPRGKRZSA-N 0 3 384.933 3.036 10 0 GGAEHN Cc1cc(CNC2CCN(C(=O)c3ccco3)CC2)ncc1Br ZINC000623353032 567703191 /nfs/dbraw/zinc/70/31/91/567703191.db2.gz ZMRZCNNRWQITDE-UHFFFAOYSA-N 0 3 378.270 3.140 10 0 GGAEHN CC(C)Oc1cc(Cl)c(CNCCCN(C)S(C)(=O)=O)cc1Cl ZINC000623356690 567703349 /nfs/dbraw/zinc/70/33/49/567703349.db2.gz AHVQOMYWSZMDQH-UHFFFAOYSA-N 0 3 383.341 3.152 10 0 GGAEHN CN(CCN1CCCC1)C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000507790549 567705513 /nfs/dbraw/zinc/70/55/13/567705513.db2.gz AXUMYRUMLPGZNC-HNNXBMFYSA-N 0 3 382.302 3.010 10 0 GGAEHN CN(CCN1CCCC1)C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000507790551 567705664 /nfs/dbraw/zinc/70/56/64/567705664.db2.gz AXUMYRUMLPGZNC-OAHLLOKOSA-N 0 3 382.302 3.010 10 0 GGAEHN CCc1cc(Br)ccc1NC(=O)N1CCOC2(CCN(C)CC2)C1 ZINC000646309926 567706068 /nfs/dbraw/zinc/70/60/68/567706068.db2.gz LSMGDCNQHRWFRX-UHFFFAOYSA-N 0 3 396.329 3.340 10 0 GGAEHN CN(C[C@H]1CCCN(C)C1)C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000507793963 567706844 /nfs/dbraw/zinc/70/68/44/567706844.db2.gz XMYRQKVFTPAKQD-XJKSGUPXSA-N 0 3 396.329 3.256 10 0 GGAEHN CC(C)N1CCCN(C(=O)N[C@@H]2CCOc3c(Br)cccc32)CC1 ZINC000507813845 567707934 /nfs/dbraw/zinc/70/79/34/567707934.db2.gz UBFHETMWAWVCMX-MRXNPFEDSA-N 0 3 396.329 3.398 10 0 GGAEHN COC[C@@](C)(O)CNCc1cc(Br)c(C)cc1Br ZINC000623415726 567708460 /nfs/dbraw/zinc/70/84/60/567708460.db2.gz VMZZCZMDYVGTDJ-ZDUSSCGKSA-N 0 3 381.108 3.007 10 0 GGAEHN CS(=O)(=O)[C@H]1CCC[C@H](NCc2cccc(F)c2OCC(F)(F)F)C1 ZINC000623428397 567708547 /nfs/dbraw/zinc/70/85/47/567708547.db2.gz JCLIHXKPGWMPQM-STQMWFEESA-N 0 3 383.407 3.212 10 0 GGAEHN CC(C)N1CCCN(C(=O)N[C@H]2CCOc3c(Br)cccc32)CC1 ZINC000507813844 567708623 /nfs/dbraw/zinc/70/86/23/567708623.db2.gz UBFHETMWAWVCMX-INIZCTEOSA-N 0 3 396.329 3.398 10 0 GGAEHN CS(=O)(=O)[C@@H]1CCC[C@H](NCc2cccc(F)c2OCC(F)(F)F)C1 ZINC000623428396 567709029 /nfs/dbraw/zinc/70/90/29/567709029.db2.gz JCLIHXKPGWMPQM-QWHCGFSZSA-N 0 3 383.407 3.212 10 0 GGAEHN Cc1nc(-c2ccc(CNC(=O)N[C@H]3CN(C4CC4)C[C@@H]3C)s2)cs1 ZINC000532320213 567709457 /nfs/dbraw/zinc/70/94/57/567709457.db2.gz BBYGWLSJUBNBNG-NHYWBVRUSA-N 0 3 376.551 3.462 10 0 GGAEHN O=S1(=O)CCC(CCNCc2ccc(Cl)cc2Br)CC1 ZINC000507822843 567709557 /nfs/dbraw/zinc/70/95/57/567709557.db2.gz JQONHTCHPHMXHU-UHFFFAOYSA-N 0 3 380.735 3.407 10 0 GGAEHN O=S1(=O)CCC(CCNCc2ccc(Br)cc2Cl)CC1 ZINC000507825162 567709933 /nfs/dbraw/zinc/70/99/33/567709933.db2.gz SDWOYCUUUDDTRC-UHFFFAOYSA-N 0 3 380.735 3.407 10 0 GGAEHN COC(C)(C)CNCc1cc(Cl)cc(Cl)c1OCCN1CCOCC1 ZINC000623432839 567710029 /nfs/dbraw/zinc/71/00/29/567710029.db2.gz MLIBLPDQDLEFNI-UHFFFAOYSA-N 0 3 391.339 3.219 10 0 GGAEHN Cc1cc(CNCCCN2C(=O)COc3ccccc32)ncc1Br ZINC000623430830 567710585 /nfs/dbraw/zinc/71/05/85/567710585.db2.gz HTRAFGQLMDAAIF-UHFFFAOYSA-N 0 3 390.281 3.058 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N[C@H](Cc1ccccc1)CN(C)C ZINC000666893103 567711094 /nfs/dbraw/zinc/71/10/94/567711094.db2.gz DVHUPXBEILFMKZ-OAHLLOKOSA-N 0 3 376.298 3.055 10 0 GGAEHN C[C@H](Cc1ccc(Cl)cc1)N[C@H]1CCN(S(=O)(=O)c2ccccc2)C1 ZINC000554139826 567711631 /nfs/dbraw/zinc/71/16/31/567711631.db2.gz NBNWVXNRIQDMJX-QAPCUYQASA-N 0 3 378.925 3.324 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N[C@@H](Cc1ccccc1)CN(C)C ZINC000666893102 567711845 /nfs/dbraw/zinc/71/18/45/567711845.db2.gz DVHUPXBEILFMKZ-HNNXBMFYSA-N 0 3 376.298 3.055 10 0 GGAEHN Cc1cccc(NC(=O)N2CCOC3(CCN(C)CC3)C2)c1Br ZINC000646362257 567712013 /nfs/dbraw/zinc/71/20/13/567712013.db2.gz XKBKVRIADFFBRE-UHFFFAOYSA-N 0 3 382.302 3.086 10 0 GGAEHN O=S(=O)(c1ccccc1)N1CC[C@H](N[C@@H]2CCc3cc(Cl)ccc32)C1 ZINC000554140898 567712497 /nfs/dbraw/zinc/71/24/97/567712497.db2.gz PDQZYYCVOQGFSL-QFBILLFUSA-N 0 3 376.909 3.380 10 0 GGAEHN CNC(=O)C(C)(C)CNCc1cc(Br)c(C)cc1Br ZINC000623468709 567713408 /nfs/dbraw/zinc/71/34/08/567713408.db2.gz CPNBQJVXJQAPIN-UHFFFAOYSA-N 0 3 392.135 3.382 10 0 GGAEHN Cc1sc(Br)c(C(=O)Nc2ccc(=O)n(CCN(C)C)c2)c1C ZINC000507901422 567715078 /nfs/dbraw/zinc/71/50/78/567715078.db2.gz FUTYIRAIEUCRCH-UHFFFAOYSA-N 0 3 398.326 3.103 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)c1cc(Cl)ccc1Br ZINC000646443230 567717073 /nfs/dbraw/zinc/71/70/73/567717073.db2.gz DKYHGWOZFQJEDW-HUUCEWRRSA-N 0 3 387.705 3.038 10 0 GGAEHN Cc1cc(CN[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)ncc1Br ZINC000623513037 567717431 /nfs/dbraw/zinc/71/74/31/567717431.db2.gz GLZVBCKPWIUAHZ-CABCVRRESA-N 0 3 380.330 3.423 10 0 GGAEHN CCN(CC)CCN(CC(C)C)S(=O)(=O)c1cnccc1C(F)(F)F ZINC000442911052 567717496 /nfs/dbraw/zinc/71/74/96/567717496.db2.gz YJUCRMHKQIWNOD-UHFFFAOYSA-N 0 3 381.464 3.089 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)c1cc(Br)ccc1Cl ZINC000646449518 567718337 /nfs/dbraw/zinc/71/83/37/567718337.db2.gz OGOOMVWUCRONRR-GJZGRUSLSA-N 0 3 387.705 3.038 10 0 GGAEHN Cc1sc(Br)c(C(=O)N2CCOC[C@H]2[C@@H]2CCCN2C)c1C ZINC000646446001 567718439 /nfs/dbraw/zinc/71/84/39/567718439.db2.gz XLZQBTUJFRKWFD-STQMWFEESA-N 0 3 387.343 3.063 10 0 GGAEHN Cc1nc(-c2cccs2)sc1C(=O)N1CCOC[C@H]1[C@@H]1CCCN1C ZINC000646454806 567718562 /nfs/dbraw/zinc/71/85/62/567718562.db2.gz LKLVIBSPLXULIS-KBPBESRZSA-N 0 3 377.535 3.115 10 0 GGAEHN Cc1cc(C(=O)N2CCOC[C@@H]2[C@@H]2CCCN2C)c(C)cc1Br ZINC000646447138 567719017 /nfs/dbraw/zinc/71/90/17/567719017.db2.gz QLMUYGLXIZCTOL-DLBZAZTESA-N 0 3 381.314 3.001 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000646444102 567719095 /nfs/dbraw/zinc/71/90/95/567719095.db2.gz KFTHBEFBNDMUIY-ATLSCFEFSA-N 0 3 383.319 3.419 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)c1c(F)cccc1I ZINC000597859086 567719214 /nfs/dbraw/zinc/71/92/14/567719214.db2.gz RSKFXJHONSLQIR-JTQLQIEISA-N 0 3 390.240 3.033 10 0 GGAEHN Cc1cc(C(=O)N2CCOC[C@H]2[C@H]2CCCN2C)c(C)cc1Br ZINC000646447141 567719205 /nfs/dbraw/zinc/71/92/05/567719205.db2.gz QLMUYGLXIZCTOL-SJORKVTESA-N 0 3 381.314 3.001 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000646444099 567719403 /nfs/dbraw/zinc/71/94/03/567719403.db2.gz KFTHBEFBNDMUIY-AHCXZYCDSA-N 0 3 383.319 3.419 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1cc2cc(Br)ccc2o1 ZINC000646448276 567719470 /nfs/dbraw/zinc/71/94/70/567719470.db2.gz ZMJVCGTWFUYSBR-CABCVRRESA-N 0 3 393.281 3.131 10 0 GGAEHN COC[C@@](C)(O)CCNCc1cc(Br)c(C)cc1Br ZINC000623536210 567719509 /nfs/dbraw/zinc/71/95/09/567719509.db2.gz PGZCQOOHPLJEOU-AWEZNQCLSA-N 0 3 395.135 3.397 10 0 GGAEHN Cc1cccc(C(=O)NC[C@@H]2CCN2C(C)(C)C)c1I ZINC000597859862 567719711 /nfs/dbraw/zinc/71/97/11/567719711.db2.gz ZPLFRGMHWKVMEY-LBPRGKRZSA-N 0 3 386.277 3.202 10 0 GGAEHN Cc1c(I)cccc1C(=O)NC[C@H]1CCN1C(C)(C)C ZINC000597859604 567719875 /nfs/dbraw/zinc/71/98/75/567719875.db2.gz WBPNEBYYLFVXAP-GFCCVEGCSA-N 0 3 386.277 3.202 10 0 GGAEHN CC(C)Oc1cc(Cl)c(CNC[C@]2(OCCO)CCOC2)cc1Cl ZINC000623563799 567721996 /nfs/dbraw/zinc/72/19/96/567721996.db2.gz KHFLOLHMILMFHB-QGZVFWFLSA-N 0 3 378.296 3.038 10 0 GGAEHN O[C@H]1CCN(Cc2ccc(CNCc3ccsc3Br)cc2)C1 ZINC000623564204 567722484 /nfs/dbraw/zinc/72/24/84/567722484.db2.gz VRUXSWCKEGEKLS-INIZCTEOSA-N 0 3 381.339 3.367 10 0 GGAEHN CCN(C(=O)Nc1ccc2nccnc2c1Br)[C@H]1CCN(CC)C1 ZINC000667080063 567722580 /nfs/dbraw/zinc/72/25/80/567722580.db2.gz IXSUONZXMOPVAA-LBPRGKRZSA-N 0 3 392.301 3.340 10 0 GGAEHN C[C@H](N[C@@H](CO)c1cccc(Br)c1)c1cccc(-n2ccnn2)c1 ZINC000554370871 567724438 /nfs/dbraw/zinc/72/44/38/567724438.db2.gz CAUIUZBMGWSOOP-UGSOOPFHSA-N 0 3 387.281 3.414 10 0 GGAEHN C[C@@H](N[C@@H](CO)c1cccc(Br)c1)c1cccc(-n2ccnn2)c1 ZINC000554370868 567724619 /nfs/dbraw/zinc/72/46/19/567724619.db2.gz CAUIUZBMGWSOOP-ACJLOTCBSA-N 0 3 387.281 3.414 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)Nc1cnc2c(Br)cccn12 ZINC000667099473 567724755 /nfs/dbraw/zinc/72/47/55/567724755.db2.gz YBUMXOWMBUMEAV-LLVKDONJSA-N 0 3 380.290 3.091 10 0 GGAEHN Cc1cc(CNCC2(OCCO)CCC(F)(F)CC2)ncc1Br ZINC000623637664 567726025 /nfs/dbraw/zinc/72/60/25/567726025.db2.gz FAMAQLBCJNWJLR-UHFFFAOYSA-N 0 3 393.272 3.199 10 0 GGAEHN CCN(CC)c1ncc(CNCC2(OCCO)CCC(F)(F)CC2)s1 ZINC000623636436 567726533 /nfs/dbraw/zinc/72/65/33/567726533.db2.gz PMJCOWFCXPNOSD-UHFFFAOYSA-N 0 3 377.501 3.036 10 0 GGAEHN Cc1c(Br)cncc1CNCC1(OCCO)CCC(F)(F)CC1 ZINC000623637944 567726744 /nfs/dbraw/zinc/72/67/44/567726744.db2.gz PNMFRCORZHFLHG-UHFFFAOYSA-N 0 3 393.272 3.199 10 0 GGAEHN CN(C)CCNC(=O)c1ccc(NCc2ccsc2Br)cc1 ZINC000623632306 567726805 /nfs/dbraw/zinc/72/68/05/567726805.db2.gz UMPPDGPTODYRCP-UHFFFAOYSA-N 0 3 382.327 3.414 10 0 GGAEHN C[C@@H](NC[C@@H](CO)c1cccnc1)c1ccccc1I ZINC000554403578 567727110 /nfs/dbraw/zinc/72/71/10/567727110.db2.gz XKNHHOKBBHPFKW-OCCSQVGLSA-N 0 3 382.245 3.113 10 0 GGAEHN Cc1cc2c(o1)c(C(=O)NC[C@@H](O)CN1CCCCC1)ccc2Br ZINC000443059707 567727404 /nfs/dbraw/zinc/72/74/04/567727404.db2.gz CXXSDKDWUYLNRG-CYBMUJFWSA-N 0 3 395.297 3.080 10 0 GGAEHN COCc1ccc(CN[C@]2(CO)CCc3cc(Br)ccc3C2)o1 ZINC000623644801 567727558 /nfs/dbraw/zinc/72/75/58/567727558.db2.gz AWTCGYCAUDCZIV-GOSISDBHSA-N 0 3 380.282 3.198 10 0 GGAEHN CCCn1nccc1CN[C@@]1(CO)CCc2cc(Br)ccc2C1 ZINC000623645310 567727800 /nfs/dbraw/zinc/72/78/00/567727800.db2.gz XCNZNSOYWQDTIZ-SFHVURJKSA-N 0 3 378.314 3.065 10 0 GGAEHN Clc1ccc(N2CCO[C@@H](CNCc3cncc(Br)c3)C2)cc1 ZINC000623655370 567727855 /nfs/dbraw/zinc/72/78/55/567727855.db2.gz WELAMEGGDPBTSE-KRWDZBQOSA-N 0 3 396.716 3.493 10 0 GGAEHN CC(C)n1nccc1CN[C@]1(CO)CCc2cc(Br)ccc2C1 ZINC000623645220 567727990 /nfs/dbraw/zinc/72/79/90/567727990.db2.gz SPOHJBAIWOQNFH-GOSISDBHSA-N 0 3 378.314 3.236 10 0 GGAEHN CC(C)n1nccc1CN[C@@]1(CO)CCc2cc(Br)ccc2C1 ZINC000623645221 567728107 /nfs/dbraw/zinc/72/81/07/567728107.db2.gz SPOHJBAIWOQNFH-SFHVURJKSA-N 0 3 378.314 3.236 10 0 GGAEHN CCOc1ccc(CN[C@]2(CO)CCc3cc(Br)ccc3C2)nc1 ZINC000623644868 567728129 /nfs/dbraw/zinc/72/81/29/567728129.db2.gz CJIFPAVYNMCTTJ-LJQANCHMSA-N 0 3 391.309 3.252 10 0 GGAEHN COCc1ccc(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)o1 ZINC000623644802 567728135 /nfs/dbraw/zinc/72/81/35/567728135.db2.gz AWTCGYCAUDCZIV-SFHVURJKSA-N 0 3 380.282 3.198 10 0 GGAEHN CC[C@H](Cc1ccc(Br)cc1)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000667132743 567728167 /nfs/dbraw/zinc/72/81/67/567728167.db2.gz HOLDOHJZSHXGJR-QZTJIDSGSA-N 0 3 392.341 3.426 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)NCCc2c[nH]c3c2cccc3Cl)CCSC1 ZINC000623708459 567731922 /nfs/dbraw/zinc/73/19/22/567731922.db2.gz JWOAPYCJEOOJRQ-GOSISDBHSA-N 0 3 380.945 3.100 10 0 GGAEHN C[C@@H]1C[C@@H](c2ccc(Br)cc2)CN1C(=O)NC1CCN(C)CC1 ZINC000623704556 567732088 /nfs/dbraw/zinc/73/20/88/567732088.db2.gz ADEBZOALRQHVHB-UKRRQHHQSA-N 0 3 380.330 3.431 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)NCc2ccccc2CC(F)(F)F)CCSC1 ZINC000623708581 567732534 /nfs/dbraw/zinc/73/25/34/567732534.db2.gz NLKNFWJUPLRVEW-MRXNPFEDSA-N 0 3 375.460 3.028 10 0 GGAEHN COc1cc(Br)ccc1[C@@H]1CCCN1C(=O)NCCN(C)C1CC1 ZINC000623718710 567733125 /nfs/dbraw/zinc/73/31/25/567733125.db2.gz WEZFUCUSRMZUDZ-INIZCTEOSA-N 0 3 396.329 3.398 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1cccc(F)c1I ZINC000532755732 567733483 /nfs/dbraw/zinc/73/34/83/567733483.db2.gz AVPXQFATSZRNHX-NSHDSACASA-N 0 3 390.240 3.035 10 0 GGAEHN COc1cc(Br)ccc1[C@H]1CCCN1C(=O)NCCN(C)C1CC1 ZINC000623718711 567733417 /nfs/dbraw/zinc/73/34/17/567733417.db2.gz WEZFUCUSRMZUDZ-MRXNPFEDSA-N 0 3 396.329 3.398 10 0 GGAEHN C[C@H](CNC(=O)N1CCc2cc(F)cc(Br)c2C1)N(C)C1CC1 ZINC000623725783 567733690 /nfs/dbraw/zinc/73/36/90/567733690.db2.gz KMYJVWFARGAVNC-LLVKDONJSA-N 0 3 384.293 3.139 10 0 GGAEHN COc1cc(Br)ccc1[C@H]1CCCN1C(=O)NC[C@H]1CCCN1C ZINC000623716669 567733727 /nfs/dbraw/zinc/73/37/27/567733727.db2.gz WBPCSYRLUUMNGJ-GDBMZVCRSA-N 0 3 396.329 3.398 10 0 GGAEHN C[C@@H](CNC(=O)NCc1cc(F)c(Br)cc1F)N(C)C1CC1 ZINC000623726107 567733941 /nfs/dbraw/zinc/73/39/41/567733941.db2.gz YVYYVVSTCJARCY-VIFPVBQESA-N 0 3 376.245 3.009 10 0 GGAEHN CCN(C(=O)c1scc(C)c1I)[C@H]1CCN(CC)C1 ZINC000598040741 567734168 /nfs/dbraw/zinc/73/41/68/567734168.db2.gz RLXOJCSAKZPPNJ-NSHDSACASA-N 0 3 392.306 3.217 10 0 GGAEHN Brc1cccc2c1OCC[C@@H]2NC1CCN(c2cnccn2)CC1 ZINC000554559254 567736284 /nfs/dbraw/zinc/73/62/84/567736284.db2.gz COKJDNMSWMVPHY-INIZCTEOSA-N 0 3 389.297 3.321 10 0 GGAEHN Cc1ccc(CNC[C@H]2CN(Cc3ccncc3)CCO2)cc1Br ZINC000623781049 567737389 /nfs/dbraw/zinc/73/73/89/567737389.db2.gz GHTCKZSORWNTRL-SFHVURJKSA-N 0 3 390.325 3.143 10 0 GGAEHN C[C@@H](NC[C@@H]1CN(Cc2ccncc2)CCO1)c1ccc(Br)s1 ZINC000623782144 567737838 /nfs/dbraw/zinc/73/78/38/567737838.db2.gz KIALYYLOEQMQCH-UKRRQHHQSA-N 0 3 396.354 3.457 10 0 GGAEHN CN(C)CCN(CC(=O)N(C)C)C(=O)Nc1cc(Cl)c(Cl)c(Cl)c1 ZINC000667288407 567740688 /nfs/dbraw/zinc/74/06/88/567740688.db2.gz KILWMCODEHPMOF-UHFFFAOYSA-N 0 3 395.718 3.131 10 0 GGAEHN CN1CC[C@H](NCCS(=O)(=O)c2ccccc2)[C@@H]1c1ccc(Cl)cc1 ZINC000573884974 567742777 /nfs/dbraw/zinc/74/27/77/567742777.db2.gz CFVXLLFSLSVNNW-OALUTQOASA-N 0 3 378.925 3.149 10 0 GGAEHN C/C(=C\c1cccc(C(F)(F)F)c1)CNC[C@H]1CCCN1S(C)(=O)=O ZINC000554718592 567743632 /nfs/dbraw/zinc/74/36/32/567743632.db2.gz XGRXODKZMBOGLX-LRFDDAOPSA-N 0 3 376.444 3.122 10 0 GGAEHN Cc1ccc(Br)cc1[C@H](C)NCCS(=O)(=O)NC(C)(C)C ZINC000623877532 567744194 /nfs/dbraw/zinc/74/41/94/567744194.db2.gz DXKIKRNHFNMHHS-LBPRGKRZSA-N 0 3 377.348 3.126 10 0 GGAEHN O=C([C@H]1[C@@H]2COC[C@@H]21)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000667430180 567746685 /nfs/dbraw/zinc/74/66/85/567746685.db2.gz GTVKLFJRSPUFCH-HWWDLCQESA-N 0 3 383.319 3.310 10 0 GGAEHN Cc1ccc(Br)cc1[C@H](C)N[C@@H]1CCCN(c2ccn(C)n2)C1=O ZINC000623918601 567746721 /nfs/dbraw/zinc/74/67/21/567746721.db2.gz WITYJBBVHIUHKB-XJKSGUPXSA-N 0 3 391.313 3.337 10 0 GGAEHN Cc1ccc(Br)cc1[C@H](C)N[C@@H]1CCN(C2CCOCC2)C1=O ZINC000623918580 567746854 /nfs/dbraw/zinc/74/68/54/567746854.db2.gz VKFVQODARSFDBW-SUMWQHHRSA-N 0 3 381.314 3.188 10 0 GGAEHN Cc1ccc(CN(CCN(C)C)C(=O)c2cncc(Br)c2C)o1 ZINC000667426485 567746906 /nfs/dbraw/zinc/74/69/06/567746906.db2.gz GIQCDHGURMRDEB-UHFFFAOYSA-N 0 3 380.286 3.258 10 0 GGAEHN C[C@@H](Cc1ncc(C(F)(F)F)cc1Cl)NCC1(CS(C)(=O)=O)CC1 ZINC000623918746 567747088 /nfs/dbraw/zinc/74/70/88/567747088.db2.gz ZZSDFCHSGBCJQF-JTQLQIEISA-N 0 3 384.851 3.099 10 0 GGAEHN Cc1onc(-c2cccc(Br)c2)c1C(=O)N1CC[C@@H]2CN(C)C[C@@H]21 ZINC000646916513 567748462 /nfs/dbraw/zinc/74/84/62/567748462.db2.gz KCEMVDOBYPHGJA-HIFRSBDPSA-N 0 3 390.281 3.189 10 0 GGAEHN Cc1cnn(CCCCCN2CCN(c3ccc(Br)cn3)CC2)c1 ZINC000533049232 567748896 /nfs/dbraw/zinc/74/88/96/567748896.db2.gz HWBRKQHZRVZFHT-UHFFFAOYSA-N 0 3 392.345 3.342 10 0 GGAEHN Cc1ccc(Br)cc1[C@H](C)N[C@H]1C[C@H](C)N(c2cnn(C)c2)C1=O ZINC000623939310 567749029 /nfs/dbraw/zinc/74/90/29/567749029.db2.gz MHFCTNVDXJDWQY-DCGLDWPTSA-N 0 3 391.313 3.336 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)COc3ccc4ccccc4c3Br)[C@H]2C1 ZINC000646927860 567749347 /nfs/dbraw/zinc/74/93/47/567749347.db2.gz SJBIFXAYKXEOQK-ZBFHGGJFSA-N 0 3 389.293 3.144 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)c3ccc(Br)cc3C(F)(F)F)[C@@H]2C1 ZINC000646937719 567749845 /nfs/dbraw/zinc/74/98/45/567749845.db2.gz QYRNLLCUPSHMGW-TVQRCGJNSA-N 0 3 377.204 3.244 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(Br)c(F)c1C ZINC000667500468 567750463 /nfs/dbraw/zinc/75/04/63/567750463.db2.gz PUXPRONDNFJKRR-GFCCVEGCSA-N 0 3 388.281 3.129 10 0 GGAEHN C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@@H](C)C1(S(C)(=O)=O)CC1 ZINC000623982484 567751635 /nfs/dbraw/zinc/75/16/35/567751635.db2.gz WCVIUJHDVJRBKB-ZJUUUORDSA-N 0 3 384.851 3.240 10 0 GGAEHN O[C@]1(CNc2ncc(Br)cc2F)CCN(Cc2ccccc2)C1 ZINC000623990207 567751802 /nfs/dbraw/zinc/75/18/02/567751802.db2.gz XEZUANPQUAXPCK-KRWDZBQOSA-N 0 3 380.261 3.032 10 0 GGAEHN C[C@@H](CNC(=O)N[C@@H]1CCCN(C)C1)Sc1ccc(Br)cc1 ZINC000598258621 567752107 /nfs/dbraw/zinc/75/21/07/567752107.db2.gz NUNQOPMUQQWNKS-GXTWGEPZSA-N 0 3 386.359 3.323 10 0 GGAEHN C[C@H](c1ccccc1Br)N(C)CC(=O)NC1CCN(C2CC2)CC1 ZINC000533099959 567751941 /nfs/dbraw/zinc/75/19/41/567751941.db2.gz HLHSMDNTJMNRRV-CQSZACIVSA-N 0 3 394.357 3.185 10 0 GGAEHN C[C@H](CNC(=O)N[C@@H]1CCCN(C)C1)Sc1ccc(Br)cc1 ZINC000598258641 567752771 /nfs/dbraw/zinc/75/27/71/567752771.db2.gz NUNQOPMUQQWNKS-TZMCWYRMSA-N 0 3 386.359 3.323 10 0 GGAEHN C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@@H]1C[C@@H]2CCCCN2C1=O ZINC000623998032 567753037 /nfs/dbraw/zinc/75/30/37/567753037.db2.gz FITOVPOLLSAFPW-IFUGULHKSA-N 0 3 375.822 3.428 10 0 GGAEHN O=C([C@H]1CCCN(CCOc2ccc(Br)cc2)C1)N1CCCC1 ZINC000574066838 567753381 /nfs/dbraw/zinc/75/33/81/567753381.db2.gz LIOYVIQZMGQESB-HNNXBMFYSA-N 0 3 381.314 3.162 10 0 GGAEHN C[C@@H](Cc1ncc(C(F)(F)F)cc1Cl)NCCC(C)(C)S(C)(=O)=O ZINC000624000802 567753411 /nfs/dbraw/zinc/75/34/11/567753411.db2.gz MADRXUOHQWFANK-JTQLQIEISA-N 0 3 386.867 3.488 10 0 GGAEHN COC[C@H](C)CN[C@@H]1CCCN(c2c(C)cc(Br)cc2C)C1=O ZINC000554874375 567753967 /nfs/dbraw/zinc/75/39/67/567753967.db2.gz VTPVZINYANXLQA-MLGOLLRUSA-N 0 3 383.330 3.433 10 0 GGAEHN COC[C@@H](C)CN[C@H]1CCCN(c2c(C)cc(Br)cc2C)C1=O ZINC000554874374 567754346 /nfs/dbraw/zinc/75/43/46/567754346.db2.gz VTPVZINYANXLQA-LRDDRELGSA-N 0 3 383.330 3.433 10 0 GGAEHN CCS(=O)(=O)C1(CN[C@@H](C)Cc2ncc(C(F)(F)F)cc2Cl)CC1 ZINC000624016148 567755042 /nfs/dbraw/zinc/75/50/42/567755042.db2.gz PBQLWNMCSHMNBA-JTQLQIEISA-N 0 3 384.851 3.242 10 0 GGAEHN CCOc1cc(C[NH2+]CCCOC[C@@H]2CCCO2)cc(Br)c1[O-] ZINC000508615183 567757121 /nfs/dbraw/zinc/75/71/21/567757121.db2.gz MVDULSITMZXWOC-AWEZNQCLSA-N 0 3 388.302 3.229 10 0 GGAEHN COC(=O)C[C@@H](NC(=O)CN1[C@H](C)CC[C@@H]1C)c1cccc(Br)c1 ZINC000461976295 567757277 /nfs/dbraw/zinc/75/72/77/567757277.db2.gz CAHGGILYQNDQTD-DVOMOZLQSA-N 0 3 397.313 3.042 10 0 GGAEHN CC[C@H](Cc1ccccc1Br)C(=O)N[C@@H]1CNCCC1(F)F ZINC000647076222 567758530 /nfs/dbraw/zinc/75/85/30/567758530.db2.gz BVGZNKFDSLBXNA-BXUZGUMPSA-N 0 3 375.257 3.131 10 0 GGAEHN C[C@@H](N[C@@H]1CCN(c2ccc3nncn3n2)C1)c1ccc(Cl)cc1Cl ZINC000624114038 567760429 /nfs/dbraw/zinc/76/04/29/567760429.db2.gz RTMHAUFNJMUXSE-DGCLKSJQSA-N 0 3 377.279 3.361 10 0 GGAEHN C[C@H](N[C@H]1CCN(c2ccc3nncn3n2)C1)c1cc(Cl)ccc1Cl ZINC000624114373 567760528 /nfs/dbraw/zinc/76/05/28/567760528.db2.gz YZABAQJAGWOPME-AAEUAGOBSA-N 0 3 377.279 3.361 10 0 GGAEHN C[C@@H](N[C@@H]1CCN(c2ccc3nncn3n2)C1)c1cc(Cl)ccc1Cl ZINC000624114374 567760572 /nfs/dbraw/zinc/76/05/72/567760572.db2.gz YZABAQJAGWOPME-DGCLKSJQSA-N 0 3 377.279 3.361 10 0 GGAEHN Brc1cnn(C2CCN(Cc3ccnn3-c3ccncc3)CC2)c1 ZINC000667623074 567760788 /nfs/dbraw/zinc/76/07/88/567760788.db2.gz IJTAYKOURBBCGB-UHFFFAOYSA-N 0 3 387.285 3.063 10 0 GGAEHN CSC1(CNC(=O)Nc2csc(-c3ccccn3)n2)CCN(C)CC1 ZINC000554991144 567762191 /nfs/dbraw/zinc/76/21/91/567762191.db2.gz QIQFHDCBCUPGIN-UHFFFAOYSA-N 0 3 377.539 3.154 10 0 GGAEHN Fc1cc(CNC2CCN(C[C@H]3CCCO3)CC2)c(F)cc1Br ZINC000624160766 567764691 /nfs/dbraw/zinc/76/46/91/567764691.db2.gz KFJXVSWFPDTMNG-CQSZACIVSA-N 0 3 389.284 3.460 10 0 GGAEHN Brc1ccc(C2(NCCOC[C@H]3CCCO3)CCOCC2)cc1 ZINC000533352621 567765182 /nfs/dbraw/zinc/76/51/82/567765182.db2.gz UEFDNZWSYVTYFE-QGZVFWFLSA-N 0 3 384.314 3.240 10 0 GGAEHN Cc1c([C@@H](C)NC[C@@H]2COCCN2C)cnn1-c1ccc(Cl)cc1Cl ZINC000624173992 567765492 /nfs/dbraw/zinc/76/54/92/567765492.db2.gz PBOCIJUKNZONHL-IUODEOHRSA-N 0 3 383.323 3.469 10 0 GGAEHN Cc1c([C@H](C)NC[C@@H]2COCCN2C)cnn1-c1ccc(Cl)cc1Cl ZINC000624173993 567765560 /nfs/dbraw/zinc/76/55/60/567765560.db2.gz PBOCIJUKNZONHL-SWLSCSKDSA-N 0 3 383.323 3.469 10 0 GGAEHN C[C@H](NC[C@H]1COCCN1C)c1ccc(Br)cc1Br ZINC000624171794 567765567 /nfs/dbraw/zinc/76/55/67/567765567.db2.gz CKMMPGPQTDLPCS-JQWIXIFHSA-N 0 3 392.135 3.193 10 0 GGAEHN CCn1c(-c2ccc(Br)cc2)nnc1N1CCN(CC2CC2)CC1 ZINC000555101828 567767852 /nfs/dbraw/zinc/76/78/52/567767852.db2.gz BIOYMZMIGPRVAV-UHFFFAOYSA-N 0 3 390.329 3.260 10 0 GGAEHN Brc1ccccc1N1CC[C@H](NCc2ccnn2-c2ccccn2)C1 ZINC000647182494 567767953 /nfs/dbraw/zinc/76/79/53/567767953.db2.gz FXTPGBUTQUFXHF-HNNXBMFYSA-N 0 3 398.308 3.398 10 0 GGAEHN Brc1c[nH]nc1CN[C@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC000647184953 567768438 /nfs/dbraw/zinc/76/84/38/567768438.db2.gz KBVUHUFFBPMHJQ-HNNXBMFYSA-N 0 3 375.314 3.459 10 0 GGAEHN NC(=O)[C@@H]1CCC[C@H](NCc2cc(OC(F)F)ccc2Br)C1 ZINC000647185312 567768583 /nfs/dbraw/zinc/76/85/83/567768583.db2.gz XURULDYEZCIMBI-KOLCDFICSA-N 0 3 377.229 3.184 10 0 GGAEHN Cc1noc([C@@H]2OCC[C@@H]2N[C@H]2CCc3c2cc(Br)cc3F)n1 ZINC000624303925 567772395 /nfs/dbraw/zinc/77/23/95/567772395.db2.gz RRKIVIPFARAIRG-SOUVJXGZSA-N 0 3 382.233 3.387 10 0 GGAEHN Cc1noc([C@H]2OCC[C@H]2N[C@H](C)Cc2ccc(Br)c(F)c2)n1 ZINC000624303636 567772411 /nfs/dbraw/zinc/77/24/11/567772411.db2.gz INXNOTLJUSUSDQ-ZWZTZDBGSA-N 0 3 384.249 3.330 10 0 GGAEHN CN(C)C[C@H](NC(=O)CSCC(=O)OC(C)(C)C)c1ccc(Cl)cc1 ZINC000555231220 567775005 /nfs/dbraw/zinc/77/50/05/567775005.db2.gz OIZDERPNLSURNR-HNNXBMFYSA-N 0 3 386.945 3.134 10 0 GGAEHN CCCN1CC[C@H](NC(=O)NCc2cc(F)c(Br)cc2F)C1 ZINC000624380689 567776831 /nfs/dbraw/zinc/77/68/31/567776831.db2.gz OTTSUKJANUYCJG-NSHDSACASA-N 0 3 376.245 3.011 10 0 GGAEHN NCc1cccc2c1N(S(=O)(=O)c1cc(F)ccc1Br)CCC2 ZINC000624388917 567777460 /nfs/dbraw/zinc/77/74/60/567777460.db2.gz LMRFQTARSCJLRB-UHFFFAOYSA-N 0 3 399.285 3.188 10 0 GGAEHN NCc1cccc2c1N(S(=O)(=O)c1ccc(F)c(Br)c1)CCC2 ZINC000624389191 567777523 /nfs/dbraw/zinc/77/75/23/567777523.db2.gz TVTVTLGSEWCZNH-UHFFFAOYSA-N 0 3 399.285 3.188 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)C(C)(C)c1ccc(Br)c(C)c1 ZINC000574443196 567779244 /nfs/dbraw/zinc/77/92/44/567779244.db2.gz ROAQFIHKOIEYGJ-MRXNPFEDSA-N 0 3 397.357 3.262 10 0 GGAEHN CC(C)(CN[C@H]1CCCOc2ccc(Br)cc21)[C@]1(O)CCOC1 ZINC000647340233 567779585 /nfs/dbraw/zinc/77/95/85/567779585.db2.gz GKGPBQGLFMKOPJ-YJBOKZPZSA-N 0 3 384.314 3.430 10 0 GGAEHN CC(C)(CN[C@H](c1ccc(Br)cc1)[C@H]1CCCO1)[C@@]1(O)CCOC1 ZINC000647340685 567779651 /nfs/dbraw/zinc/77/96/51/567779651.db2.gz NCOHNRZEADDKNH-ZHALLVOQSA-N 0 3 398.341 3.436 10 0 GGAEHN COc1ccc(CN(C)C)cc1NC(=O)c1cnc(OC)c(Br)c1 ZINC000574565265 567785495 /nfs/dbraw/zinc/78/54/95/567785495.db2.gz NQSIBIIRPWWHCA-UHFFFAOYSA-N 0 3 394.269 3.175 10 0 GGAEHN Cc1cc(N2CCC[C@H](NCc3cc(F)ccc3Br)C2)n(C)n1 ZINC000444014986 567785542 /nfs/dbraw/zinc/78/55/42/567785542.db2.gz ZGFLWIGEIZPURY-HNNXBMFYSA-N 0 3 381.293 3.389 10 0 GGAEHN COc1c(Br)cccc1CN[C@H]1CCCN(c2cc(C)nn2C)C1 ZINC000444011480 567785659 /nfs/dbraw/zinc/78/56/59/567785659.db2.gz QAKGYQQQSWVKJE-HNNXBMFYSA-N 0 3 393.329 3.258 10 0 GGAEHN Cc1cc(N2CCC[C@@H](NCc3ccc(Br)c(F)c3)C2)n(C)n1 ZINC000444013899 567785681 /nfs/dbraw/zinc/78/56/81/567785681.db2.gz GLWTUZQCIDTSGL-CQSZACIVSA-N 0 3 381.293 3.389 10 0 GGAEHN Cc1cc(N2CCC[C@H](NCc3ccc(F)c(Br)c3)C2)n(C)n1 ZINC000444007663 567785838 /nfs/dbraw/zinc/78/58/38/567785838.db2.gz GXLJYOMNUZFYDN-AWEZNQCLSA-N 0 3 381.293 3.389 10 0 GGAEHN Cc1cc(N2CCC[C@@H](NCc3ccc(Br)cc3F)C2)n(C)n1 ZINC000444014638 567785912 /nfs/dbraw/zinc/78/59/12/567785912.db2.gz QGRKVVYTSYNNRI-OAHLLOKOSA-N 0 3 381.293 3.389 10 0 GGAEHN CS(=O)(=O)N1CCC[C@H](CN2CCC[C@H]2Cc2c(F)cccc2Cl)C1 ZINC000444060542 567787680 /nfs/dbraw/zinc/78/76/80/567787680.db2.gz VUPAWDGIMMFMJG-CABCVRRESA-N 0 3 388.936 3.158 10 0 GGAEHN COc1ccc(CCC(=O)N2CC[C@H](N3CCCC3)C2)c(Br)c1 ZINC000668008952 567787795 /nfs/dbraw/zinc/78/77/95/567787795.db2.gz JAUDCZCXMNHAQI-HNNXBMFYSA-N 0 3 381.314 3.087 10 0 GGAEHN O=C(c1c(F)c(F)c(Br)c(F)c1F)N1CC[C@@H](N2CCCC2)C1 ZINC000668009530 567788799 /nfs/dbraw/zinc/78/87/99/567788799.db2.gz YJRXYZRNXZXALD-MRVPVSSYSA-N 0 3 395.194 3.316 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)cc2F)[C@H](C)C1 ZINC000444083169 567790964 /nfs/dbraw/zinc/79/09/64/567790964.db2.gz JOKCQHAOPXTNEF-RISCZKNCSA-N 0 3 382.423 3.195 10 0 GGAEHN CN(C)c1ccc(CNCCC(=O)Nc2ccc(Br)cc2)cn1 ZINC000555612203 567791304 /nfs/dbraw/zinc/79/13/04/567791304.db2.gz RZIWNIFEHSKCFO-UHFFFAOYSA-N 0 3 377.286 3.029 10 0 GGAEHN COc1nc(NC[C@H]2CCCN(C)[C@H]2c2cccs2)ncc1Br ZINC000444083214 567791332 /nfs/dbraw/zinc/79/13/32/567791332.db2.gz KEYQFUJQIDLBIT-BXUZGUMPSA-N 0 3 397.342 3.226 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)cc2F)[C@@H](C)C1 ZINC000444083170 567791344 /nfs/dbraw/zinc/79/13/44/567791344.db2.gz JOKCQHAOPXTNEF-SMDDNHRTSA-N 0 3 382.423 3.195 10 0 GGAEHN CCO[C@@H]1C[C@H](NCc2ccc(OC)c(Br)c2)[C@@H]1n1cccn1 ZINC000555646982 567793623 /nfs/dbraw/zinc/79/36/23/567793623.db2.gz LPDQWEGQOGXXAG-UAGQMJEPSA-N 0 3 380.286 3.163 10 0 GGAEHN Cc1nn(C)c(C)c1C[C@H](C)NCc1cn2ccc(Br)cc2n1 ZINC000574764152 567796142 /nfs/dbraw/zinc/79/61/42/567796142.db2.gz LMZQUDXIEHFSHP-NSHDSACASA-N 0 3 376.302 3.168 10 0 GGAEHN COc1c(Br)cc(Cl)cc1NC(=O)N[C@H]1CNCCC1(F)F ZINC000574783119 567797721 /nfs/dbraw/zinc/79/77/21/567797721.db2.gz VZTFJJIBDRUAMJ-JTQLQIEISA-N 0 3 398.635 3.230 10 0 GGAEHN C[C@H](N[C@H]1CO[C@@H](C2CC2)C1)c1ccc(Br)cc1OCCCO ZINC000668183615 567799012 /nfs/dbraw/zinc/79/90/12/567799012.db2.gz KBKCPSLCPSEADU-XGWLTEMNSA-N 0 3 384.314 3.428 10 0 GGAEHN C[C@H](N[C@@H]1CO[C@H](C2CC2)C1)c1ccc(Br)cc1OCCCO ZINC000668183614 567799402 /nfs/dbraw/zinc/79/94/02/567799402.db2.gz KBKCPSLCPSEADU-NUTKFTJISA-N 0 3 384.314 3.428 10 0 GGAEHN CN(C)CCN(Cc1cnn2c1CCC2)Cc1ccc(Br)cc1 ZINC000668159236 567799685 /nfs/dbraw/zinc/79/96/85/567799685.db2.gz OEIYXVQTQQVPNN-UHFFFAOYSA-N 0 3 377.330 3.156 10 0 GGAEHN CS[C@@H]1CN(C(=O)C(C)(C)c2cccc(Br)c2)C[C@H]1N(C)C ZINC000534093234 567799752 /nfs/dbraw/zinc/79/97/52/567799752.db2.gz SFEXEBBQPLIWDU-HUUCEWRRSA-N 0 3 385.371 3.231 10 0 GGAEHN CN(CCN1CCCC1)C(=O)c1c(F)c(F)c(Br)c(F)c1F ZINC000668198381 567800627 /nfs/dbraw/zinc/80/06/27/567800627.db2.gz OLFSDYPOPIBXTE-UHFFFAOYSA-N 0 3 383.183 3.173 10 0 GGAEHN Cc1cn(C)nc1NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000668220996 567801518 /nfs/dbraw/zinc/80/15/18/567801518.db2.gz KQWIFIYSLVDXIV-UHFFFAOYSA-N 0 3 394.317 3.087 10 0 GGAEHN COc1ccc(CCC(=O)N(C)CC2CCN(C)CC2)c(Br)c1 ZINC000668234908 567802504 /nfs/dbraw/zinc/80/25/04/567802504.db2.gz YSQOGQOIOYGRJJ-UHFFFAOYSA-N 0 3 383.330 3.191 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1[nH]c2ccc(Cl)cc2c1Cl ZINC000647822075 567802766 /nfs/dbraw/zinc/80/27/66/567802766.db2.gz PXKLLSMZDSMQPA-CABCVRRESA-N 0 3 382.291 3.410 10 0 GGAEHN COC(=O)CCNC(=O)CCNCc1ccc(-c2cccc(Cl)c2)s1 ZINC000599007432 567802797 /nfs/dbraw/zinc/80/27/97/567802797.db2.gz JXVAYNIUIGZHPZ-UHFFFAOYSA-N 0 3 380.897 3.228 10 0 GGAEHN COC(=O)CCNC(=O)CCNCc1ccc(-c2ccc(Cl)cc2)s1 ZINC000599008389 567802959 /nfs/dbraw/zinc/80/29/59/567802959.db2.gz OOWQBEJXTHIPAU-UHFFFAOYSA-N 0 3 380.897 3.228 10 0 GGAEHN COC(=O)CCNC(=O)CCNCc1ccc(-c2ccccc2Cl)s1 ZINC000599007411 567803075 /nfs/dbraw/zinc/80/30/75/567803075.db2.gz JGYFYUKCUMOEGB-UHFFFAOYSA-N 0 3 380.897 3.228 10 0 GGAEHN C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)N1CCOC[C@H]1[C@H]1CCCN1C ZINC000647823521 567803454 /nfs/dbraw/zinc/80/34/54/567803454.db2.gz JREKJTKDSZUAKX-XWIAVFTESA-N 0 3 385.335 3.494 10 0 GGAEHN COC[C@H](CC1CCOCC1)NCC(=O)Nc1ccc(Br)c(C)c1 ZINC000668246221 567803493 /nfs/dbraw/zinc/80/34/93/567803493.db2.gz ZMEZBUMUXMASKG-INIZCTEOSA-N 0 3 399.329 3.117 10 0 GGAEHN COC(=O)c1csc([C@H](C)NCC2(OCCO)CCC(F)(F)CC2)c1 ZINC000599066446 567804504 /nfs/dbraw/zinc/80/45/04/567804504.db2.gz RLFFKIVAWWLAEG-LBPRGKRZSA-N 0 3 377.453 3.142 10 0 GGAEHN C[C@H](N[C@@H]1CCN(C2CCC2)C1=O)c1ccc(I)cc1 ZINC000599092948 567805091 /nfs/dbraw/zinc/80/50/91/567805091.db2.gz LBZDXQFUOJEIQR-XHDPSFHLSA-N 0 3 384.261 3.095 10 0 GGAEHN CCOC(=O)[C@@H]1CC[C@H](NCc2cc(Br)cnc2OC)C[C@@H]1C ZINC000599069665 567805298 /nfs/dbraw/zinc/80/52/98/567805298.db2.gz GMEZHIUHNMBEGP-TUKIKUTGSA-N 0 3 385.302 3.310 10 0 GGAEHN CC1(C)CN(CCC(=O)Nc2ccc(Br)cc2)C[C@]2(CCOC2)O1 ZINC000574951843 567805611 /nfs/dbraw/zinc/80/56/11/567805611.db2.gz IJVREXSADAVCFQ-SFHVURJKSA-N 0 3 397.313 3.048 10 0 GGAEHN C[C@H](NC[C@H]1CS(=O)(=O)c2ccccc21)c1cncc(Br)c1 ZINC000575003000 567807990 /nfs/dbraw/zinc/80/79/90/567807990.db2.gz ASWFJZZAUWPTAA-AAEUAGOBSA-N 0 3 381.295 3.066 10 0 GGAEHN Cc1nn(C)c(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c1Br ZINC000647984303 567808667 /nfs/dbraw/zinc/80/86/67/567808667.db2.gz PTDDHLWSBLVGIY-HIFRSBDPSA-N 0 3 392.301 3.058 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1CCC(=O)Nc1ccccc1Br ZINC000647995822 567809796 /nfs/dbraw/zinc/80/97/96/567809796.db2.gz KCLKVTIUWJYWSI-GOSISDBHSA-N 0 3 388.309 3.336 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)c1cc(Br)cc2[nH]c(=O)[nH]c21 ZINC000668430648 567810006 /nfs/dbraw/zinc/81/00/06/567810006.db2.gz LOZWBIVKAUXFGB-GHMZBOCLSA-N 0 3 395.301 3.024 10 0 GGAEHN CCN(C(=O)COC1(C)CNC1)[C@@H]1CCSc2ccc(Br)cc21 ZINC000648067642 567812545 /nfs/dbraw/zinc/81/25/45/567812545.db2.gz PZRKSNLBLBYWHF-CQSZACIVSA-N 0 3 399.354 3.213 10 0 GGAEHN CCN(C(=O)COC1(C)CNC1)[C@H]1CCSc2ccc(Br)cc21 ZINC000648067641 567812648 /nfs/dbraw/zinc/81/26/48/567812648.db2.gz PZRKSNLBLBYWHF-AWEZNQCLSA-N 0 3 399.354 3.213 10 0 GGAEHN COc1cc(CN(C)CC2CN(C)C2)cc(Br)c1OC(F)F ZINC000668538411 567812987 /nfs/dbraw/zinc/81/29/87/567812987.db2.gz ZXJUQTROYCYIDB-UHFFFAOYSA-N 0 3 379.245 3.053 10 0 GGAEHN NC[C@@H](C(=O)N1CCc2c(F)cc(Br)cc2C1)c1ccc(F)cc1 ZINC000648101775 567813121 /nfs/dbraw/zinc/81/31/21/567813121.db2.gz BSPYGSHEAUGQMC-MRXNPFEDSA-N 0 3 395.247 3.355 10 0 GGAEHN COc1c(Br)cc(Br)cc1CN(C)CC1CN(C)C1 ZINC000668538187 567813388 /nfs/dbraw/zinc/81/33/88/567813388.db2.gz VZIPSEDVONVSIO-UHFFFAOYSA-N 0 3 392.135 3.214 10 0 GGAEHN Cc1sc([C@@H](C)NC(=O)COC2(C)CNC2)nc1-c1ccc(Cl)cc1 ZINC000648097557 567813472 /nfs/dbraw/zinc/81/34/72/567813472.db2.gz UNBXKLAVYRAYQF-LLVKDONJSA-N 0 3 379.913 3.328 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1C[C@H](C)C(O)[C@@H](C)C1 ZINC000668554984 567813750 /nfs/dbraw/zinc/81/37/50/567813750.db2.gz VCOIKPOUECRRGA-STQMWFEESA-N 0 3 378.314 3.392 10 0 GGAEHN Cc1c(Br)cncc1C(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000668567898 567813856 /nfs/dbraw/zinc/81/38/56/567813856.db2.gz NKRRUUPUOVVCCG-CYBMUJFWSA-N 0 3 376.298 3.403 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1C[C@@H]2COC[C@@]2(C)C1 ZINC000668597161 567814058 /nfs/dbraw/zinc/81/40/58/567814058.db2.gz RNQJCJHAFZCKHG-CRAIPNDOSA-N 0 3 376.298 3.412 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1C[C@H]2COC[C@]2(C)C1 ZINC000668596270 567814067 /nfs/dbraw/zinc/81/40/67/567814067.db2.gz FMJMYYAEQKVNQW-YJBOKZPZSA-N 0 3 376.298 3.412 10 0 GGAEHN Cc1c2cc(C(=O)N(C)[C@@H]3CN4CCC3CC4)[nH]c2ccc1Br ZINC000668589145 567814324 /nfs/dbraw/zinc/81/43/24/567814324.db2.gz ZIEZEOLOSKRFJV-QGZVFWFLSA-N 0 3 376.298 3.405 10 0 GGAEHN CN[C@@H](CC(C)(C)C)C(=O)Nc1cc(Br)ccc1OCCOC ZINC000648150833 567814499 /nfs/dbraw/zinc/81/44/99/567814499.db2.gz CCQVRCCMLDPQAO-AWEZNQCLSA-N 0 3 387.318 3.437 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1C[C@H]2COC[C@@]2(C)C1 ZINC000668598575 567814830 /nfs/dbraw/zinc/81/48/30/567814830.db2.gz ZGZYDRNSIHRQJQ-MAUKXSAKSA-N 0 3 376.298 3.412 10 0 GGAEHN COc1cc(Br)c(CN[C@@H]2CCC[C@@H]2Cc2cnn(C)c2)cc1O ZINC000668610259 567814839 /nfs/dbraw/zinc/81/48/39/567814839.db2.gz RGFGUJGKYJEVML-CZUORRHYSA-N 0 3 394.313 3.398 10 0 GGAEHN Cc1ccc(CC(=O)N2CCCN(C[C@@H]3CCCO3)CC2)c(Br)c1 ZINC000648208430 567815313 /nfs/dbraw/zinc/81/53/13/567815313.db2.gz MXDGMEVIAQOLAZ-KRWDZBQOSA-N 0 3 395.341 3.013 10 0 GGAEHN Cc1ccc(-c2nnc(CCC(=O)NC[C@H](c3ccccc3)N(C)C)o2)cc1 ZINC000012807375 570221454 /nfs/dbraw/zinc/22/14/54/570221454.db2.gz IVDYSQGKTQVBCY-LJQANCHMSA-N 0 3 378.476 3.397 10 0 GGAEHN CN1CCCN(c2ccc(CNC(=O)c3ccc4c(c3)CCCC4)cn2)CC1 ZINC000048248866 570223146 /nfs/dbraw/zinc/22/31/46/570223146.db2.gz RQXVHLAWFLJAQD-UHFFFAOYSA-N 0 3 378.520 3.032 10 0 GGAEHN CCOC(=O)c1ccc2c(c1)[C@@H](N)C[C@@]1(CCN(C(=O)OC(C)(C)C)C1)O2 ZINC000725260153 570308251 /nfs/dbraw/zinc/30/82/51/570308251.db2.gz NMGAJQMNJMWMFJ-MGPUTAFESA-N 0 3 376.453 3.025 10 0 GGAEHN CCOC(=O)c1ccc2c(c1)[C@H](N)C[C@]1(CCN(C(=O)OC(C)(C)C)C1)O2 ZINC000725260155 570308532 /nfs/dbraw/zinc/30/85/32/570308532.db2.gz NMGAJQMNJMWMFJ-QRWLVFNGSA-N 0 3 376.453 3.025 10 0 GGAEHN CC(=O)c1ccc(-c2ccc3nc(C(=O)NCCN4CCCCC4)cn3c2)cc1 ZINC000034831100 570335081 /nfs/dbraw/zinc/33/50/81/570335081.db2.gz JIRNZWRYDITNFL-UHFFFAOYSA-N 0 3 390.487 3.420 10 0 GGAEHN Cc1nc(C(=O)NC2CCN(Cc3ccccc3)CC2)nn1-c1ccccc1C ZINC000034910554 570340508 /nfs/dbraw/zinc/34/05/08/570340508.db2.gz LWJGZYKTKWTAPL-UHFFFAOYSA-N 0 3 389.503 3.279 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)c1nc(Cc2ccccc2)n(-c2ccccc2)n1 ZINC000034911121 570340681 /nfs/dbraw/zinc/34/06/81/570340681.db2.gz JPXHTLOSXRUNIS-FQEVSTJZSA-N 0 3 389.503 3.072 10 0 GGAEHN CC[C@@H](C(=O)NCc1ccccc1)N1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000024835895 570342016 /nfs/dbraw/zinc/34/20/16/570342016.db2.gz ILSLJICGBDOEPC-CTNGQTDRSA-N 0 3 379.504 3.432 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)CC1CCN(C(=O)NC2CCCCC2)CC1 ZINC000035399192 570349662 /nfs/dbraw/zinc/34/96/62/570349662.db2.gz GTYBCVJGMFACDP-GOSISDBHSA-N 0 3 392.588 3.121 10 0 GGAEHN C[C@@H]1CN(Cc2ccccc2CNCc2c[nH]nc2-c2cccnc2)C[C@@H](C)O1 ZINC000237572822 570381261 /nfs/dbraw/zinc/38/12/61/570381261.db2.gz UUMRINVWULRCQU-QZTJIDSGSA-N 0 3 391.519 3.371 10 0 GGAEHN Cc1nn(C)c2ncc(CNCc3ccccc3CN3C[C@H](C)O[C@@H](C)C3)cc12 ZINC000237779034 570396010 /nfs/dbraw/zinc/39/60/10/570396010.db2.gz IVONGRWHXSYKIS-IRXDYDNUSA-N 0 3 393.535 3.176 10 0 GGAEHN Cc1ccccc1C(=O)c1cccn1CC(=O)NCCCN1CCCCCC1 ZINC000005143120 570426060 /nfs/dbraw/zinc/42/60/60/570426060.db2.gz ZIPHUWJMAIWJKE-UHFFFAOYSA-N 0 3 381.520 3.410 10 0 GGAEHN CC(=O)c1ccc(OCC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000241231142 570431476 /nfs/dbraw/zinc/43/14/76/570431476.db2.gz KSKUFYIAYDLGLJ-VGOFRKELSA-N 0 3 380.488 3.295 10 0 GGAEHN CCOC(=O)c1ccc(OC[C@@H](O)CN2CCC[C@H]2c2ccc(OC)cc2)cc1 ZINC000242389699 570432853 /nfs/dbraw/zinc/43/28/53/570432853.db2.gz ZZRPTXNTVANOOK-UGKGYDQZSA-N 0 3 399.487 3.449 10 0 GGAEHN Cc1cccc(N2CCN(CC[C@@H](C)NC(=O)COC3CCCCC3)CC2)c1 ZINC000044522110 570453559 /nfs/dbraw/zinc/45/35/59/570453559.db2.gz NYNBUPOGGGTMTC-HXUWFJFHSA-N 0 3 387.568 3.361 10 0 GGAEHN CN(C)CCNC(=O)c1ccc2c(c1)NC(=O)/C(=C\c1ccc(Cl)cc1)O2 ZINC000032958521 570461047 /nfs/dbraw/zinc/46/10/47/570461047.db2.gz BFBIFOAPROYCFG-WOJGMQOQSA-N 0 3 385.851 3.003 10 0 GGAEHN Cc1nc(C)n(C[C@@H]2CCCN(C[C@H]3CO[C@@H](c4ccc(Cl)cc4)O3)C2)n1 ZINC000252477007 570474062 /nfs/dbraw/zinc/47/40/62/570474062.db2.gz GMGJUBWBSBPKGX-LSTHTHJFSA-N 0 3 390.915 3.375 10 0 GGAEHN CCOC(=O)[C@H]1CCCN(C[C@@H](O)COc2ccc(OC)cc2C(C)(C)C)C1 ZINC000006576723 570480597 /nfs/dbraw/zinc/48/05/97/570480597.db2.gz WATXPUBQTSDBQD-DLBZAZTESA-N 0 3 393.524 3.008 10 0 GGAEHN CCCN(Cc1ccc(OC)c(OC)c1)C[C@H](O)COc1ccc(OC)cc1 ZINC000036095966 570535611 /nfs/dbraw/zinc/53/56/11/570535611.db2.gz LEWOVYLBLQSUKA-SFHVURJKSA-N 0 3 389.492 3.364 10 0 GGAEHN COc1ccc(OC[C@@H](O)CN(Cc2ccccc2C)C[C@H]2CCCO2)cc1 ZINC000036100017 570537966 /nfs/dbraw/zinc/53/79/66/570537966.db2.gz JMPCQSYIWZWKNS-NZQKXSOJSA-N 0 3 385.504 3.425 10 0 GGAEHN CCCC(=O)OC[C@@H](O)CN(Cc1ccccc1)Cc1ccc2c(c1)OCO2 ZINC000036103577 570539937 /nfs/dbraw/zinc/53/99/37/570539937.db2.gz NSFZPTZSGGLOEN-IBGZPJMESA-N 0 3 385.460 3.122 10 0 GGAEHN CC(C)CC(=O)Nc1ccc(N(C)C)c(CN(CCN(C)C)C(=O)C2CC2)c1 ZINC000006708182 570545688 /nfs/dbraw/zinc/54/56/88/570545688.db2.gz PLSHQZUAAWABJD-UHFFFAOYSA-N 0 3 388.556 3.037 10 0 GGAEHN COc1cc(CNC(=O)C2=CCN(Cc3cccc(C)c3)CC2)cc(OC)c1 ZINC000064818037 570553355 /nfs/dbraw/zinc/55/33/55/570553355.db2.gz IRFJRRNKCPEXQZ-UHFFFAOYSA-N 0 3 380.488 3.461 10 0 GGAEHN COc1ccc(OC[C@H](O)CN(Cc2ccc(OC)c(OC)c2)C2CC2)cc1 ZINC000036095841 570560679 /nfs/dbraw/zinc/56/06/79/570560679.db2.gz RMFSWBMNTHIEPQ-GOSISDBHSA-N 0 3 387.476 3.117 10 0 GGAEHN Cc1ccc(C(=O)N2CCC(CC(=O)NCCN3CCCCCC3)CC2)cc1 ZINC000032974200 570562729 /nfs/dbraw/zinc/56/27/29/570562729.db2.gz MUZUOISHBJRCQC-UHFFFAOYSA-N 0 3 385.552 3.230 10 0 GGAEHN O=C(CC1CCN(C(=O)Nc2ccccc2)CC1)NCCN1CCCCCC1 ZINC000064847179 570565434 /nfs/dbraw/zinc/56/54/34/570565434.db2.gz FTKBYDMARKFNMJ-UHFFFAOYSA-N 0 3 386.540 3.313 10 0 GGAEHN COc1cccc(CNCCOCCO)c1OCc1ccc(F)cc1Cl ZINC000010436394 570570501 /nfs/dbraw/zinc/57/05/01/570570501.db2.gz NGUGUJAIVPHHOF-UHFFFAOYSA-N 0 3 383.847 3.165 10 0 GGAEHN CCOc1ccc(CN(C)C[C@H](O)COCc2ccc(OC)cc2)cc1OC ZINC000006787513 570593027 /nfs/dbraw/zinc/59/30/27/570593027.db2.gz DUAQFJCCMHHOJY-IBGZPJMESA-N 0 3 389.492 3.112 10 0 GGAEHN COc1cccc(CN(C[C@@H](O)COCc2ccccc2)C[C@@H]2CCCO2)c1 ZINC000169677850 570597601 /nfs/dbraw/zinc/59/76/01/570597601.db2.gz CCSFFZXXRJDHTL-GGAORHGYSA-N 0 3 385.504 3.254 10 0 GGAEHN COc1ccc(CN(C[C@@H](O)COCc2ccccc2)C[C@@H]2CCCO2)cc1 ZINC000169678600 570598900 /nfs/dbraw/zinc/59/89/00/570598900.db2.gz DNBYZIGABNUDHN-GGAORHGYSA-N 0 3 385.504 3.254 10 0 GGAEHN COc1ccc(CN2CC[C@H]3[C@H](CCC(=O)N3Cc3cccnc3)C2)cc1C ZINC000012078402 570605648 /nfs/dbraw/zinc/60/56/48/570605648.db2.gz GQCYFZDSAFOPQA-RTWAWAEBSA-N 0 3 379.504 3.412 10 0 GGAEHN Cc1ccc(C(=O)N/C(=C/c2ccco2)C(=O)NCCN2CCCCC2)cc1C ZINC000006815088 570618143 /nfs/dbraw/zinc/61/81/43/570618143.db2.gz LZXQSCAKZKWBBZ-LTGZKZEYSA-N 0 3 395.503 3.269 10 0 GGAEHN O=C(COc1ccc2ccccc2c1CN1CCCCC1)NC[C@@H]1CCCO1 ZINC000006859676 570651154 /nfs/dbraw/zinc/65/11/54/570651154.db2.gz DGZORGKKIDMWGN-IBGZPJMESA-N 0 3 382.504 3.500 10 0 GGAEHN O=C1CCCN1c1ccc(CNCc2c[nH]nc2-c2ccc3c(c2)OCO3)cc1 ZINC000012433615 570661161 /nfs/dbraw/zinc/66/11/61/570661161.db2.gz KJKXJEQNBGFDHM-UHFFFAOYSA-N 0 3 390.443 3.222 10 0 GGAEHN CC[C@H]1CN(C(=O)CNC(=O)C2CCCC2)[C@@H](CC)CN1Cc1ccccc1 ZINC000229751289 570666425 /nfs/dbraw/zinc/66/64/25/570666425.db2.gz PRGBXSCJCNYYSE-SFTDATJTSA-N 0 3 385.552 3.194 10 0 GGAEHN CCN(Cc1ccncc1)[C@@H]1CCCN(C(=O)CSc2nc(C)cs2)C1 ZINC000012448062 570667274 /nfs/dbraw/zinc/66/72/74/570667274.db2.gz CLNZTLFXRGITAW-QGZVFWFLSA-N 0 3 390.578 3.452 10 0 GGAEHN COc1cccc(CN2CCC[C@]3(CCN(Cc4ccncc4)C3)C2=O)c1OC ZINC000012435540 570675440 /nfs/dbraw/zinc/67/54/40/570675440.db2.gz JHIVBUADAVVAPZ-HSZRJFAPSA-N 0 3 395.503 3.114 10 0 GGAEHN Cn1cc([C@@H]2NC(=O)CC[C@H]2NCc2cccc(OCc3ccccc3)c2)cn1 ZINC000275536160 570696170 /nfs/dbraw/zinc/69/61/70/570696170.db2.gz MHJMWKACSLTBRG-GGAORHGYSA-N 0 3 390.487 3.109 10 0 GGAEHN Cc1ccc2c(cc(NC(=O)C(C)C)cc2C(=O)NCCN2CCCCC2)n1 ZINC000065135999 570707418 /nfs/dbraw/zinc/70/74/18/570707418.db2.gz XZXIPPVXUMXBES-UHFFFAOYSA-N 0 3 382.508 3.353 10 0 GGAEHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1ccc(-c2ccncc2)[nH]c1=O ZINC000058132868 570710233 /nfs/dbraw/zinc/71/02/33/570710233.db2.gz XQQFRNOIKBAYOF-NRFANRHFSA-N 0 3 388.471 3.004 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)c1c(C)nn(-c2ccc(F)cc2)c1-n1cccc1 ZINC000006940129 570713231 /nfs/dbraw/zinc/71/32/31/570713231.db2.gz CPKKCFVRDHMOHX-IBGZPJMESA-N 0 3 395.482 3.325 10 0 GGAEHN CC(C)S(=O)(=O)C(C)C(=O)NCc1ccccc1COc1ccccc1 ZINC000058266457 570723719 /nfs/dbraw/zinc/72/37/19/570723719.db2.gz OSHRHKYDFTWQED-MRXNPFEDSA-N 0 3 375.490 3.094 10 0 GGAEHN CC(C)S(=O)(=O)C(C)C(=O)NCc1ccccc1OCc1ccccc1 ZINC000058264570 570723747 /nfs/dbraw/zinc/72/37/47/570723747.db2.gz JWLFUTNNFXYXFC-INIZCTEOSA-N 0 3 375.490 3.094 10 0 GGAEHN O=C(NCCN1CCCC1)c1ccc(-c2ccc(N3CCSCC3)nc2)cc1 ZINC000065178367 570724127 /nfs/dbraw/zinc/72/41/27/570724127.db2.gz WLVGJZMRAWSVQY-UHFFFAOYSA-N 0 3 396.560 3.127 10 0 GGAEHN CC(C)(C)NC(=O)c1ccc(C(=O)NCCCN2CCc3ccccc3C2)cc1 ZINC000058392063 570730820 /nfs/dbraw/zinc/73/08/20/570730820.db2.gz BVIFDZCINTZXDT-UHFFFAOYSA-N 0 3 393.531 3.393 10 0 GGAEHN CCC(=O)N1CCc2c1cccc2C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000065209952 570731383 /nfs/dbraw/zinc/73/13/83/570731383.db2.gz QMCOXEDKXZACPD-UHFFFAOYSA-N 0 3 391.515 3.380 10 0 GGAEHN CC(C)CN1CCCC[C@@H]1C(=O)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1 ZINC000058431896 570733623 /nfs/dbraw/zinc/73/36/23/570733623.db2.gz UIBOGNJVVSJTRI-OXJNMPFZSA-N 0 3 379.495 3.418 10 0 GGAEHN COc1ccc2[nH]c(=O)c(CCC(=O)N3CCN(C4CCCCC4)CC3)cc2c1 ZINC000065245524 570747145 /nfs/dbraw/zinc/74/71/45/570747145.db2.gz SOZMCCHZNMYQSY-UHFFFAOYSA-N 0 3 397.519 3.359 10 0 GGAEHN CC(C)[C@@H](CNC(=O)[C@H](C)Sc1nncs1)N1CCc2ccccc2C1 ZINC000052531757 570752462 /nfs/dbraw/zinc/75/24/62/570752462.db2.gz JLVGKBZWFYKPSA-WMLDXEAASA-N 0 3 390.578 3.218 10 0 GGAEHN CC(C)[C@@H](CNC(=O)[C@@H](C)Sc1nncs1)N1CCc2ccccc2C1 ZINC000052531755 570752476 /nfs/dbraw/zinc/75/24/76/570752476.db2.gz JLVGKBZWFYKPSA-RHSMWYFYSA-N 0 3 390.578 3.218 10 0 GGAEHN COc1cccc(NC(=O)c2cccnc2N2CCN[C@H](c3ccccc3)C2)c1 ZINC000065255828 570754348 /nfs/dbraw/zinc/75/43/48/570754348.db2.gz HTCDGVVYUJSZGE-NRFANRHFSA-N 0 3 388.471 3.493 10 0 GGAEHN COc1ccccc1NC(=O)c1ccnc(N2CCN[C@H](c3ccccc3)C2)c1 ZINC000065255901 570754354 /nfs/dbraw/zinc/75/43/54/570754354.db2.gz OSFCFOJRSOHHGV-FQEVSTJZSA-N 0 3 388.471 3.493 10 0 GGAEHN Cc1ccc(CNC(=O)c2cccnc2N2CCN[C@@H](c3ccccc3)C2)o1 ZINC000065255815 570754393 /nfs/dbraw/zinc/75/43/93/570754393.db2.gz QQAWNDUBPQWMEM-HXUWFJFHSA-N 0 3 376.460 3.064 10 0 GGAEHN Cc1cccc(CNC(=O)c2ccnc(N3CCN[C@H](c4ccccc4)C3)c2)c1 ZINC000065255943 570754651 /nfs/dbraw/zinc/75/46/51/570754651.db2.gz UVZAWWIAWXKCDK-QFIPXVFZSA-N 0 3 386.499 3.471 10 0 GGAEHN O=C(NCc1cccc(F)c1)c1ccnc(N2CCN[C@H](c3ccccc3)C2)c1 ZINC000065255947 570754658 /nfs/dbraw/zinc/75/46/58/570754658.db2.gz KCCHDGXECVGGAJ-NRFANRHFSA-N 0 3 390.462 3.302 10 0 GGAEHN O=C(NCc1ccc(F)cc1)c1ccc(N2CCN[C@H](c3ccccc3)C2)nc1 ZINC000065256090 570754759 /nfs/dbraw/zinc/75/47/59/570754759.db2.gz GRFCTYKYXDZNMJ-NRFANRHFSA-N 0 3 390.462 3.302 10 0 GGAEHN Cc1ccc(CNC(=O)c2ccc(N3CCN[C@@H](c4ccccc4)C3)nc2)cc1 ZINC000065256097 570754867 /nfs/dbraw/zinc/75/48/67/570754867.db2.gz ZBALYTVDLXZAGX-JOCHJYFZSA-N 0 3 386.499 3.471 10 0 GGAEHN CC(C)(C)C(=O)N1CCC(C(=O)NC2CCN(Cc3ccccc3)CC2)CC1 ZINC000032716585 570755715 /nfs/dbraw/zinc/75/57/15/570755715.db2.gz QUOJEPKREFWOSO-UHFFFAOYSA-N 0 3 385.552 3.052 10 0 GGAEHN Cc1cc(C(F)(F)F)nc(CCNc2ncnc3sc4c(c32)CCNC4)n1 ZINC000065395528 570765435 /nfs/dbraw/zinc/76/54/35/570765435.db2.gz FEAUWQVFBWZKAX-UHFFFAOYSA-N 0 3 394.426 3.109 10 0 GGAEHN O=C(NCCN1CCCCCC1)c1cn2ccnc(-c3ccc(F)cc3)c2n1 ZINC000065274531 570776949 /nfs/dbraw/zinc/77/69/49/570776949.db2.gz PQUWFZNOLKMQAP-UHFFFAOYSA-N 0 3 381.455 3.141 10 0 GGAEHN Cc1ccc(-c2nccn3cc(C(=O)NCCN4CCCCCC4)nc23)cc1 ZINC000065274584 570776993 /nfs/dbraw/zinc/77/69/93/570776993.db2.gz RAEKMEGIHZZWRG-UHFFFAOYSA-N 0 3 377.492 3.311 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)c1nc(-c2oc3ccc(OC)cc3c2C)no1 ZINC000065010333 570784531 /nfs/dbraw/zinc/78/45/31/570784531.db2.gz ROEQAGZXACWZRR-ZDUSSCGKSA-N 0 3 384.436 3.014 10 0 GGAEHN CC(=O)N1CCc2cc(-c3ccc(C(=O)NCCN4CCCC4)cc3)ccc21 ZINC000065026995 570789797 /nfs/dbraw/zinc/78/97/97/570789797.db2.gz WEXZIESILUSJCS-UHFFFAOYSA-N 0 3 377.488 3.088 10 0 GGAEHN COC1(c2nc(-c3cnccn3)no2)CCN(Cc2cc(C)ccc2C)CC1 ZINC000583615834 570801033 /nfs/dbraw/zinc/80/10/33/570801033.db2.gz APFXCGKOTKSRQB-UHFFFAOYSA-N 0 3 379.464 3.281 10 0 GGAEHN CC(=O)N[C@@H](CC(=O)N[C@@H](CN(C)C)c1ccccc1)c1ccc(Cl)cc1 ZINC000032781288 570809076 /nfs/dbraw/zinc/80/90/76/570809076.db2.gz XTFPDZIBEDPKLF-PMACEKPBSA-N 0 3 387.911 3.326 10 0 GGAEHN CC(C)C[C@H](N[C@@H](C)C(=O)Nc1cccc(S(N)(=O)=O)c1)c1ccccc1 ZINC000032806161 570822700 /nfs/dbraw/zinc/82/27/00/570822700.db2.gz IURZMOMMLGVOSA-KXBFYZLASA-N 0 3 389.521 3.038 10 0 GGAEHN Nc1c(-c2ccccn2)nsc1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000065149870 570839689 /nfs/dbraw/zinc/83/96/89/570839689.db2.gz UAPWORGIHIOMTI-UHFFFAOYSA-N 0 3 393.516 3.182 10 0 GGAEHN CCN1CCN(c2ccc(NC(=O)CCc3ccc4c(c3)OCO4)cc2C)CC1 ZINC000012543100 570843655 /nfs/dbraw/zinc/84/36/55/570843655.db2.gz XBMYANQUAJFQSE-UHFFFAOYSA-N 0 3 395.503 3.437 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)[C@@H]1CC(=O)N(c2ccc(F)c(Cl)c2)C1 ZINC000004711888 570857821 /nfs/dbraw/zinc/85/78/21/570857821.db2.gz GLZGXLACORESIS-RBSFLKMASA-N 0 3 395.906 3.211 10 0 GGAEHN CCOc1ccc(-n2c(SCCNCCO)nnc2-c2ccccc2)cc1 ZINC000003359382 570861297 /nfs/dbraw/zinc/86/12/97/570861297.db2.gz HWUZHNARPPAYPH-UHFFFAOYSA-N 0 3 384.505 3.007 10 0 GGAEHN COc1cc(OC)cc([C@H]2CCN(C3CCN(C(=O)c4ccco4)CC3)C2)c1 ZINC000170602809 570861799 /nfs/dbraw/zinc/86/17/99/570861799.db2.gz WJBUUCZBLOOOMI-INIZCTEOSA-N 0 3 384.476 3.391 10 0 GGAEHN CCC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccc3c(c2)OCCO3)cc1 ZINC000032899639 570895397 /nfs/dbraw/zinc/89/53/97/570895397.db2.gz CIAQBADRSAMMIY-MAUKXSAKSA-N 0 3 385.460 3.141 10 0 GGAEHN Cc1sc2ccn(C)c(=O)c2c1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000097151664 570899688 /nfs/dbraw/zinc/89/96/88/570899688.db2.gz VGBZQFCEVULDBC-UHFFFAOYSA-N 0 3 395.528 3.303 10 0 GGAEHN COc1ccc(OC[C@H](O)CN(Cc2ccccc2C)C[C@@H]2CCCO2)cc1 ZINC000104973099 570910666 /nfs/dbraw/zinc/91/06/66/570910666.db2.gz JMPCQSYIWZWKNS-OFNKIYASSA-N 0 3 385.504 3.425 10 0 GGAEHN CC(C)c1noc(CCCC(=O)NCC(C)(C)N2CCc3ccccc3C2)n1 ZINC000046786911 570933991 /nfs/dbraw/zinc/93/39/91/570933991.db2.gz FWSQLFDYDJHQSV-UHFFFAOYSA-N 0 3 384.524 3.469 10 0 GGAEHN CCc1cc(-c2csc(S(=O)(=O)NCCCN3CCC(C)CC3)c2)on1 ZINC000033290299 570958232 /nfs/dbraw/zinc/95/82/32/570958232.db2.gz CVTVTYXZYVZLJL-UHFFFAOYSA-N 0 3 397.566 3.366 10 0 GGAEHN CCOC(=O)[C@@H]1CCCN(C[C@H](O)COc2ccc(OC)cc2C(C)(C)C)C1 ZINC000004144404 570963768 /nfs/dbraw/zinc/96/37/68/570963768.db2.gz WATXPUBQTSDBQD-SJORKVTESA-N 0 3 393.524 3.008 10 0 GGAEHN CN1CCCN(c2ccc(NC(=O)N(C[C@@H]3CCOC3)C3CC3)cc2F)CC1 ZINC000047561384 570964505 /nfs/dbraw/zinc/96/45/05/570964505.db2.gz MELCYVXPEUGSKS-INIZCTEOSA-N 0 3 390.503 3.000 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1 ZINC000106575737 570965302 /nfs/dbraw/zinc/96/53/02/570965302.db2.gz NIXFYENLBYHNMA-DLBZAZTESA-N 0 3 378.948 3.340 10 0 GGAEHN O=C(NCCN1CCCCC1)c1ccc(-c2nccnc2N2CCCCC2)cc1 ZINC000033313163 570972079 /nfs/dbraw/zinc/97/20/79/570972079.db2.gz RVZOPJSYJQVQHK-UHFFFAOYSA-N 0 3 393.535 3.350 10 0 GGAEHN CN(C)CCNC(=O)c1cccc(CNC(=O)Nc2ccc(C3CC3)c(F)c2)c1 ZINC000252509031 570979717 /nfs/dbraw/zinc/97/97/17/570979717.db2.gz YBLUWJUFNYHJSW-UHFFFAOYSA-N 0 3 398.482 3.316 10 0 GGAEHN C[C@H](C(=O)Nc1ccc2ccccc2c1)N1CCC[C@@H](CN2CCN(C)CC2)C1 ZINC000108144661 570984634 /nfs/dbraw/zinc/98/46/34/570984634.db2.gz PQCGSWLXBDABCF-UXHICEINSA-N 0 3 394.563 3.126 10 0 GGAEHN O=C(CN1CCC[C@H](c2nc[nH]n2)C1)Nc1cccc(Oc2ccccc2)c1 ZINC000252533080 570989771 /nfs/dbraw/zinc/98/97/71/570989771.db2.gz FUTKMIKYMLKKQW-INIZCTEOSA-N 0 3 377.448 3.415 10 0 GGAEHN COc1ccc(C(=O)Nc2cccc(CNCCCN3CCCC3=O)c2)cc1 ZINC000012777087 571030512 /nfs/dbraw/zinc/03/05/12/571030512.db2.gz FHVQSWULENWBTI-UHFFFAOYSA-N 0 3 381.476 3.050 10 0 GGAEHN O=C(Nc1cc(-c2cccs2)[nH]n1)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000616333083 651895695 /nfs/dbraw/zinc/89/56/95/651895695.db2.gz SUUXCBAOMOVQPA-NXEZZACHSA-N 0 3 375.372 3.061 10 0 GGAEHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CCN(c2ccc(F)cc2)CC1 ZINC000053540700 1406434772 /nfs/dbraw/zinc/43/47/72/1406434772.db2.gz AVSBSEYJEUDPGE-QFIPXVFZSA-N 0 3 396.510 3.494 10 0 GGAEHN CC[NH+](CC)[C@@H](CNC(=O)c1cc(NC(C)=O)ccc1[O-])c1cccc(OC)c1 ZINC000055164046 1406896859 /nfs/dbraw/zinc/89/68/59/1406896859.db2.gz ANNVCNLRGDTETM-FQEVSTJZSA-N 0 3 399.491 3.172 10 0 GGAEHN COCCN(CCOC)C[C@H](O)CO[C@@H](c1ccccc1)c1ccccc1C ZINC000006940299 1398576217 /nfs/dbraw/zinc/57/62/17/1398576217.db2.gz CNHBVPIBRBYILG-GMAHTHKFSA-N 0 3 387.520 3.057 10 0 GGAEHN O=C(NCc1cc(-c2ccccc2)no1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000043239737 1403732634 /nfs/dbraw/zinc/73/26/34/1403732634.db2.gz BKGXUIFQWRALFQ-LJQANCHMSA-N 0 3 376.460 3.415 10 0 GGAEHN CCOC(=O)COc1cccc(NC(=O)N2CCN(CCC(C)(C)C)CC2)c1 ZINC000056590981 1407371371 /nfs/dbraw/zinc/37/13/71/1407371371.db2.gz BHEWYHJAGMVXJH-UHFFFAOYSA-N 0 3 391.512 3.214 10 0 GGAEHN CCN1CCN(Cc2ccccc2CNC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2)CC1 ZINC000046940113 1404645225 /nfs/dbraw/zinc/64/52/25/1404645225.db2.gz FLJVGPDUZNBSJD-PKTZIBPZSA-N 0 3 395.522 3.383 10 0 GGAEHN CCN1CCN(Cc2ccccc2CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)CC1 ZINC000046940115 1404645732 /nfs/dbraw/zinc/64/57/32/1404645732.db2.gz FLJVGPDUZNBSJD-XZOQPEGZSA-N 0 3 395.522 3.383 10 0 GGAEHN C[C@@H]1CN(c2ccccc2NC(=O)N2CCN(C3CCCC3)CC2)C[C@H](C)O1 ZINC000047809182 1404957867 /nfs/dbraw/zinc/95/78/67/1404957867.db2.gz DODKXWAGNZWNTG-HDICACEKSA-N 0 3 386.540 3.392 10 0 GGAEHN COc1ccccc1[C@H](CNCc1ccc(C(N)=O)cc1)NC(=O)OC(C)(C)C ZINC000048750343 1405280862 /nfs/dbraw/zinc/28/08/62/1405280862.db2.gz DQKMPCCENLWYHM-SFHVURJKSA-N 0 3 399.491 3.150 10 0 GGAEHN COc1ccccc1[C@H](CNCc1cnc(N2CCCC2)nc1)N1CCCCC1 ZINC000048777534 1405289637 /nfs/dbraw/zinc/28/96/37/1405289637.db2.gz AWRKVOOLTIAMLN-NRFANRHFSA-N 0 3 395.551 3.402 10 0 GGAEHN CS(=O)(=O)Cc1ccc(CNCc2ccc(OCc3ccncc3)cc2)cc1 ZINC000048779873 1405290152 /nfs/dbraw/zinc/29/01/52/1405290152.db2.gz CLUYDUWYATUMBP-UHFFFAOYSA-N 0 3 396.512 3.495 10 0 GGAEHN CCOc1c(Br)cc(Br)cc1CN[C@@H]1CCN(C)C1 ZINC000049084878 1405339889 /nfs/dbraw/zinc/33/98/89/1405339889.db2.gz CXJXQKKCPCMSRX-GFCCVEGCSA-N 0 3 392.135 3.404 10 0 GGAEHN C#CCN1CCC(C(=O)NC[C@@H](c2c(F)cccc2Cl)N2CCCC2)CC1 ZINC000057170622 1407543004 /nfs/dbraw/zinc/54/30/04/1407543004.db2.gz BSEBCFQSLNVGSD-IBGZPJMESA-N 0 3 391.918 3.077 10 0 GGAEHN O=C(NC[C@H](c1ccccc1)N1CCCC1)[C@@H]1CCC(=O)N1Cc1ccccc1 ZINC000062075182 1408206246 /nfs/dbraw/zinc/20/62/46/1408206246.db2.gz DSZNANLKABQAPL-FCHUYYIVSA-N 0 3 391.515 3.131 10 0 GGAEHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)[C@@H]1CCC(=O)N1c1ccccc1 ZINC000062355635 1408241999 /nfs/dbraw/zinc/24/19/99/1408241999.db2.gz WUQODCSZYGQOGM-SFTDATJTSA-N 0 3 377.488 3.135 10 0 GGAEHN Cc1ccc([C@@H](CNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)N(C)C)cc1 ZINC000062361520 1408243065 /nfs/dbraw/zinc/24/30/65/1408243065.db2.gz DDQANJZUZJYMER-QZTJIDSGSA-N 0 3 375.513 3.113 10 0 GGAEHN C[C@@H](NCc1ccc(OCC(N)=O)cc1)c1ccc(OCC(F)(F)F)cc1 ZINC000063558957 1408371753 /nfs/dbraw/zinc/37/17/53/1408371753.db2.gz DEZUQFMHPIKJGN-CYBMUJFWSA-N 0 3 382.382 3.343 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)CCCn1cncn1)c1ccc(C(F)(F)F)cc1 ZINC000065217537 1408653852 /nfs/dbraw/zinc/65/38/52/1408653852.db2.gz HKTISOLIIJJBOT-QGZVFWFLSA-N 0 3 397.445 3.276 10 0 GGAEHN CCOC(=O)COc1cccc(NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c1 ZINC000065360967 1408663596 /nfs/dbraw/zinc/66/35/96/1408663596.db2.gz FWFGEROVEAEAEF-FQEVSTJZSA-N 0 3 399.491 3.361 10 0 GGAEHN Cc1ccc([C@H](CNC(=O)N2CCN(Cc3ccccc3)CC2)N(C)C)cc1 ZINC000065467329 1408673066 /nfs/dbraw/zinc/67/30/66/1408673066.db2.gz CLESMZCOLFAMRZ-QFIPXVFZSA-N 0 3 380.536 3.125 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)N[C@H](C)COCC(F)(F)F)c1ccsc1 ZINC000065483908 1408677182 /nfs/dbraw/zinc/67/71/82/1408677182.db2.gz FTNBWXGBGAHCFL-OCCSQVGLSA-N 0 3 381.464 3.398 10 0 GGAEHN CN(C)CCN(Cc1ccccc1F)C(=O)N[C@@H]1CCO[C@H]1c1ccccc1 ZINC000176552729 1428361213 /nfs/dbraw/zinc/36/12/13/1428361213.db2.gz CQBFFAVAIKVKPT-RTWAWAEBSA-N 0 3 385.483 3.429 10 0 GGAEHN Cc1nn(-c2ccc(F)cc2)c(C)c1CNC[C@@H](O)COc1ccc(F)cc1 ZINC000067252460 1409053305 /nfs/dbraw/zinc/05/33/05/1409053305.db2.gz GXSAHKHHMCOYTA-LJQANCHMSA-N 0 3 387.430 3.297 10 0 GGAEHN O[C@@H](CNCc1ccc2c(c1)OCCO2)COc1ccc(C(F)(F)F)cc1 ZINC000067255191 1409054925 /nfs/dbraw/zinc/05/49/25/1409054925.db2.gz CXOIHXVONCRNAP-HNNXBMFYSA-N 0 3 383.366 3.006 10 0 GGAEHN O[C@H](CNCc1ccc2c(c1)OCCO2)COc1ccc(C(F)(F)F)cc1 ZINC000067255188 1409054966 /nfs/dbraw/zinc/05/49/66/1409054966.db2.gz CXOIHXVONCRNAP-OAHLLOKOSA-N 0 3 383.366 3.006 10 0 GGAEHN COc1c(Cl)cc(Cl)cc1CNCc1ccnc(N2CCN(C)CC2)c1 ZINC000067449084 1409121907 /nfs/dbraw/zinc/12/19/07/1409121907.db2.gz HBMHPUOJKFUXOJ-UHFFFAOYSA-N 0 3 395.334 3.439 10 0 GGAEHN COc1ccc([C@H](CNC(=O)N[C@@H](C)c2c(C)nn(C)c2C)N2CCCC2)cc1 ZINC000067536105 1409151180 /nfs/dbraw/zinc/15/11/80/1409151180.db2.gz LDDXLUZZZSDHDF-YWZLYKJASA-N 0 3 399.539 3.243 10 0 GGAEHN COc1ccccc1[C@@H](C)NC(=O)[C@H](C)N1CCN(CC2CCCCC2)CC1 ZINC000067649320 1409198471 /nfs/dbraw/zinc/19/84/71/1409198471.db2.gz BGKMYJCDJJAYBE-MOPGFXCFSA-N 0 3 387.568 3.459 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)N[C@H](C)COCC(F)(F)F)c1ccsc1 ZINC000067710394 1409212346 /nfs/dbraw/zinc/21/23/46/1409212346.db2.gz FTNBWXGBGAHCFL-TZMCWYRMSA-N 0 3 381.464 3.398 10 0 GGAEHN C[C@H](NCc1ccc(OCC(N)=O)cc1)c1ccc(OCC(F)(F)F)cc1 ZINC000067978482 1409268571 /nfs/dbraw/zinc/26/85/71/1409268571.db2.gz DEZUQFMHPIKJGN-ZDUSSCGKSA-N 0 3 382.382 3.343 10 0 GGAEHN CCN1CCc2c(cccc2-n2nnc(C(=O)Nc3ccc(F)cc3)c2C)C1 ZINC000069564919 1409653340 /nfs/dbraw/zinc/65/33/40/1409653340.db2.gz MUWUWSGOCILGOD-UHFFFAOYSA-N 0 3 379.439 3.345 10 0 GGAEHN C[C@H](NCc1ccc(OCC(N)=O)cc1)c1cccc(OCc2ccccn2)c1 ZINC000069755667 1409692213 /nfs/dbraw/zinc/69/22/13/1409692213.db2.gz FQUXGQRCLSFWIO-KRWDZBQOSA-N 0 3 391.471 3.376 10 0 GGAEHN Cc1c(C(=O)NC2CC2)nnn1-c1cccc2c1CCN(Cc1ccccc1)C2 ZINC000069878023 1409720069 /nfs/dbraw/zinc/72/00/69/1409720069.db2.gz LHPZCKIOIFNYTO-UHFFFAOYSA-N 0 3 387.487 3.026 10 0 GGAEHN Cc1nn(C)c(Cl)c1CNCc1ccccc1CN1C[C@@H](C)O[C@H](C)C1 ZINC000079761704 1409987940 /nfs/dbraw/zinc/98/79/40/1409987940.db2.gz HQQDFLMDTLSJEY-HUUCEWRRSA-N 0 3 376.932 3.281 10 0 GGAEHN O=C(Nc1ccccc1)NC1CCN(Cc2ccc(-n3cncn3)cc2)CC1 ZINC000092480732 1410159941 /nfs/dbraw/zinc/15/99/41/1410159941.db2.gz FLFOMUOSMJTVOQ-UHFFFAOYSA-N 0 3 376.464 3.053 10 0 GGAEHN CCN1CCN(Cc2ccc(NCc3cn(C)nc3-c3cccnc3)cc2)CC1 ZINC000098171557 1410436375 /nfs/dbraw/zinc/43/63/75/1410436375.db2.gz CUATUTURWIPHSZ-UHFFFAOYSA-N 0 3 390.535 3.232 10 0 GGAEHN C[C@H](CNC(=O)NCc1cnn(Cc2ccccc2)c1)N(C)Cc1ccccc1 ZINC000111470639 1411971859 /nfs/dbraw/zinc/97/18/59/1411971859.db2.gz BUQZJBXAOIDSEN-LJQANCHMSA-N 0 3 391.519 3.251 10 0 GGAEHN C[C@H](CNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N1CCCC1)N(C)Cc1ccccc1 ZINC000112297553 1412126606 /nfs/dbraw/zinc/12/66/06/1412126606.db2.gz HXUZXMRCPAKTAO-NRSPTQNISA-N 0 3 385.552 3.052 10 0 GGAEHN COc1ccc([C@H](CO)N(C)C[C@@H](O)c2ccc(Br)cc2)cc1 ZINC000112995802 1412251856 /nfs/dbraw/zinc/25/18/56/1412251856.db2.gz HLOCHYDSGNLTEP-ZWKOTPCHSA-N 0 3 380.282 3.157 10 0 GGAEHN CN(C)Cc1ccc(N2CCN(C(=O)CC(C)(C)c3ccccc3)CC2)nc1 ZINC000114413767 1412428131 /nfs/dbraw/zinc/42/81/31/1412428131.db2.gz RMWXJGBQPKOPQG-UHFFFAOYSA-N 0 3 380.536 3.160 10 0 GGAEHN CCN(C(C)=O)c1nc(CNCC2(N3CCSCC3)CCCCC2)cs1 ZINC000115617978 1412735448 /nfs/dbraw/zinc/73/54/48/1412735448.db2.gz GJKAWOOYTZSIIO-UHFFFAOYSA-N 0 3 396.626 3.357 10 0 GGAEHN Ic1ccc(CN2CCN[C@H](c3ccccc3)C2)cc1 ZINC000115905907 1412814085 /nfs/dbraw/zinc/81/40/85/1412814085.db2.gz KAMVSYIZIFAOTP-KRWDZBQOSA-N 0 3 378.257 3.438 10 0 GGAEHN COc1cc(OC)cc([C@@H](O)CNCc2cc(Br)ccc2F)c1 ZINC000118451312 1413161781 /nfs/dbraw/zinc/16/17/81/1413161781.db2.gz HTRSCGZQBAXYEC-KRWDZBQOSA-N 0 3 384.245 3.429 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)N3CCO[C@@H](c4ccccc4)C3)cc2)CC1 ZINC000118766210 1413217379 /nfs/dbraw/zinc/21/73/79/1413217379.db2.gz UWSYXSRGHKGCIH-JOCHJYFZSA-N 0 3 379.504 3.042 10 0 GGAEHN C[C@H]1CN(Cc2ccc(CNCc3ccc4c(c3)OCCO4)cc2)C[C@H](C)O1 ZINC000119682988 1413530517 /nfs/dbraw/zinc/53/05/17/1413530517.db2.gz CJPADUVPXZIXRT-ROUUACIJSA-N 0 3 382.504 3.357 10 0 GGAEHN COc1ccc(CN2CC[C@H](N3CCOCC3)C2)cc1OCc1ccccc1 ZINC000120950374 1413957269 /nfs/dbraw/zinc/95/72/69/1413957269.db2.gz FBKBCXQHRZTRQT-NRFANRHFSA-N 0 3 382.504 3.181 10 0 GGAEHN CC[C@@H](COC)[NH2+]Cc1cccc([N-]S(=O)(=O)c2ccc(OC)cc2)c1 ZINC000121727892 1414237744 /nfs/dbraw/zinc/23/77/44/1414237744.db2.gz AGJSDSSFGGFZEP-INIZCTEOSA-N 0 3 378.494 3.011 10 0 GGAEHN COC[C@H]([NH2+]Cc1cccc([N-]S(=O)(=O)c2ccc(OC)cc2)c1)C1CC1 ZINC000121733590 1414240053 /nfs/dbraw/zinc/24/00/53/1414240053.db2.gz GPOHZUUCFRYLCX-FQEVSTJZSA-N 0 3 390.505 3.011 10 0 GGAEHN COc1ccccc1CN(CCO)C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000122208084 1414388485 /nfs/dbraw/zinc/38/84/85/1414388485.db2.gz FQSOYMCYVPNTBB-OAQYLSRUSA-N 0 3 397.519 3.036 10 0 GGAEHN CC(C)N1CCN(c2ccc(C(=O)N3CC[C@@H](C)[C@@H](n4ccnc4)C3)cc2)CC1 ZINC000123407316 1414720717 /nfs/dbraw/zinc/72/07/17/1414720717.db2.gz CTDPOZHFPCWLHQ-KNQAVFIVSA-N 0 3 395.551 3.137 10 0 GGAEHN O=c1[nH]c2ccccc2cc1CNC[C@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000123444056 1414733839 /nfs/dbraw/zinc/73/38/39/1414733839.db2.gz CUIHFVXJZRVQMH-INIZCTEOSA-N 0 3 392.377 3.489 10 0 GGAEHN COc1cc(CNc2cccc(CN3CCN(C)CC3)c2)cc(OC)c1OC ZINC000123982760 1414862288 /nfs/dbraw/zinc/86/22/88/1414862288.db2.gz GSHDHCLIMKPPIG-UHFFFAOYSA-N 0 3 385.508 3.072 10 0 GGAEHN COc1ccc(CN(C)C(=O)CN2CC[C@@H](Cc3ccccc3)C2)cc1OC ZINC000124249508 1414919910 /nfs/dbraw/zinc/91/99/10/1414919910.db2.gz FGQALWLAIRDUPR-FQEVSTJZSA-N 0 3 382.504 3.227 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN[C@H](C)CO[C@H]1CCOC1 ZINC000126515565 1415475756 /nfs/dbraw/zinc/47/57/56/1415475756.db2.gz FSLDJWLRPBPCTG-ACJLOTCBSA-N 0 3 394.313 3.227 10 0 GGAEHN Cc1nn(C)c(OCC(F)(F)F)c1CN1CC[C@@H](CNc2cccc(C)n2)C1 ZINC000128284958 1415955005 /nfs/dbraw/zinc/95/50/05/1415955005.db2.gz STNUIPXGIPHKOI-HNNXBMFYSA-N 0 3 397.445 3.307 10 0 GGAEHN O[C@@H](CNCc1ccc(N2CCCC2)nc1)COc1ccc(C(F)(F)F)cc1 ZINC000131570661 1416577814 /nfs/dbraw/zinc/57/78/14/1416577814.db2.gz CSPARFXTHCNTCZ-KRWDZBQOSA-N 0 3 395.425 3.230 10 0 GGAEHN CN1CCN(c2ncc(CN[C@H](Cc3ccccc3)c3ccccc3)cn2)CC1 ZINC000133596964 1416915245 /nfs/dbraw/zinc/91/52/45/1416915245.db2.gz BKZGAEFKBMDEPJ-HSZRJFAPSA-N 0 3 387.531 3.302 10 0 GGAEHN CN1CCN(c2ncc(CN[C@H](c3ccc(F)cc3F)C(C)(C)C)cn2)CC1 ZINC000134410908 1417066523 /nfs/dbraw/zinc/06/65/23/1417066523.db2.gz FBCVABATMAOLEQ-LJQANCHMSA-N 0 3 389.494 3.384 10 0 GGAEHN C[C@@H](NCc1cnc(N2CCN(C)CC2)nc1)c1ccc(OCC2CC2)c(F)c1 ZINC000134412727 1417066733 /nfs/dbraw/zinc/06/67/33/1417066733.db2.gz DGQXHNDYCWVZBJ-MRXNPFEDSA-N 0 3 399.514 3.007 10 0 GGAEHN O=C(C1CCCC1)N1CC[C@@H](NCc2cc3c(c(Br)c2)OCO3)C1 ZINC000134560445 1417086981 /nfs/dbraw/zinc/08/69/81/1417086981.db2.gz BJXNOVREEBDSQG-CQSZACIVSA-N 0 3 395.297 3.059 10 0 GGAEHN Clc1nc2ccccn2c1CNC[C@@H](c1cccs1)N1CCOCC1 ZINC000139263455 1417454551 /nfs/dbraw/zinc/45/45/51/1417454551.db2.gz HJUFLYNCKWZZIZ-AWEZNQCLSA-N 0 3 376.913 3.212 10 0 GGAEHN C[C@H](NC(=O)[C@H](C)N1CCN(C[C@@H]2CCOC2)CC1)c1cccc2ccccc21 ZINC000178831548 1429186789 /nfs/dbraw/zinc/18/67/89/1429186789.db2.gz FQOSTXVUTLBGMM-UFYCRDLUSA-N 0 3 395.547 3.060 10 0 GGAEHN C[C@@H](NCc1ccc(-n2cncn2)c(F)c1)c1cccc(N2CCOC2=O)c1 ZINC000142697400 1417595612 /nfs/dbraw/zinc/59/56/12/1417595612.db2.gz FRZDQNFDOIKTOG-CQSZACIVSA-N 0 3 381.411 3.214 10 0 GGAEHN CCCn1nc(C)c(CNC[C@@H](O)c2cc(Cl)c3c(c2)OCCO3)c1C ZINC000150970484 1417845953 /nfs/dbraw/zinc/84/59/53/1417845953.db2.gz ALYNPXJHJQWYQG-QGZVFWFLSA-N 0 3 379.888 3.158 10 0 GGAEHN C[C@H]1CN(c2ccc(CNCc3c[nH]nc3-c3ccccc3F)cn2)CCO1 ZINC000151536177 1418017244 /nfs/dbraw/zinc/01/72/44/1418017244.db2.gz CHJDZUIIHAWAFH-HNNXBMFYSA-N 0 3 381.455 3.126 10 0 GGAEHN Cc1cc(Br)cc(CN2CCC(C(=O)N3CCCC3)CC2)c1O ZINC000179634195 1429482608 /nfs/dbraw/zinc/48/26/08/1429482608.db2.gz ZREDGWQKWGYZIU-UHFFFAOYSA-N 0 3 381.314 3.298 10 0 GGAEHN Cc1cc(Br)cc(C[NH+]2CCC(C(=O)N3CCCC3)CC2)c1[O-] ZINC000179634195 1429482612 /nfs/dbraw/zinc/48/26/12/1429482612.db2.gz ZREDGWQKWGYZIU-UHFFFAOYSA-N 0 3 381.314 3.298 10 0 GGAEHN COc1ccc([C@@H](CNC(=O)N[C@H](CCO)c2ccccc2)N2CCCC2)cc1 ZINC000152757652 1422238157 /nfs/dbraw/zinc/23/81/57/1422238157.db2.gz BWAKXRXFFKPRTL-FGZHOGPDSA-N 0 3 397.519 3.255 10 0 GGAEHN CC[C@H](CNC(=O)N[C@H](CCO)c1ccccc1)N1CCc2ccccc2C1 ZINC000153482762 1422561070 /nfs/dbraw/zinc/56/10/70/1422561070.db2.gz BDICNLWBCMJEBZ-FGZHOGPDSA-N 0 3 381.520 3.246 10 0 GGAEHN CN(CC1CCOCC1)[C@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1 ZINC000155881587 1423575701 /nfs/dbraw/zinc/57/57/01/1423575701.db2.gz CWUQIHBOJXJBMF-QFIPXVFZSA-N 0 3 396.487 3.131 10 0 GGAEHN CCN1CCN(Cc2ccc(NCc3ccc(N4CCCC4)nc3)cc2)CC1 ZINC000156350209 1423792015 /nfs/dbraw/zinc/79/20/15/1423792015.db2.gz BTGUFEGKTNAOJK-UHFFFAOYSA-N 0 3 379.552 3.431 10 0 GGAEHN CC(C)(C)OC(=O)N1CCC[C@H](N[C@@H](CO)c2cccc(Br)c2)C1 ZINC000156741124 1423857749 /nfs/dbraw/zinc/85/77/49/1423857749.db2.gz YQLIGGJUIOOURO-HOTGVXAUSA-N 0 3 399.329 3.472 10 0 GGAEHN CC(C)c1ccc([C@H](C)CC(=O)NCCCN2CCC[C@@H]2C(=O)N(C)C)cc1 ZINC000158137774 1424176389 /nfs/dbraw/zinc/17/63/89/1424176389.db2.gz AHXGGPYHCZDVKN-WIYYLYMNSA-N 0 3 387.568 3.363 10 0 GGAEHN CN1CCN(c2cc(CNCc3cc(F)cc(C(F)(F)F)c3)ccn2)CC1 ZINC000162049984 1424811978 /nfs/dbraw/zinc/81/19/78/1424811978.db2.gz AFYGQMAAVHFUOR-UHFFFAOYSA-N 0 3 382.405 3.281 10 0 GGAEHN COC(=O)c1ccc(C)c(NC(=O)[C@@H](C)N2CCN(C3CCCCC3)CC2)c1 ZINC000162879438 1424898574 /nfs/dbraw/zinc/89/85/74/1424898574.db2.gz FHNVEUGHPDFPCR-QGZVFWFLSA-N 0 3 387.524 3.059 10 0 GGAEHN COC[C@H]1CN(C(C)=O)CC12CCN(Cc1ccccc1C(F)(F)F)CC2 ZINC000169782738 1425255577 /nfs/dbraw/zinc/25/55/77/1425255577.db2.gz WQJMMWXVPZNINR-QGZVFWFLSA-N 0 3 384.442 3.412 10 0 GGAEHN CN(C(=O)OC(C)(C)C)C1CCN(C[C@H](O)COc2ccc(Cl)cc2)CC1 ZINC000170959924 1425417368 /nfs/dbraw/zinc/41/73/68/1425417368.db2.gz QWMAHLKUTUGIMZ-KRWDZBQOSA-N 0 3 398.931 3.411 10 0 GGAEHN O=S(=O)([N-]C1CC[NH+](CC2CCCC2)CC1)c1ccc(Cl)nc1Cl ZINC000171089168 1425476616 /nfs/dbraw/zinc/47/66/16/1425476616.db2.gz WORGOLWHTQYXQR-UHFFFAOYSA-N 0 3 392.352 3.321 10 0 GGAEHN CN(C)C[C@@H]1CN(C(=O)Nc2ncc(Cc3ccccc3Cl)s2)CCO1 ZINC000172047251 1425881892 /nfs/dbraw/zinc/88/18/92/1425881892.db2.gz BYSJCBNNXHXQPB-CQSZACIVSA-N 0 3 394.928 3.182 10 0 GGAEHN CN(C)C[C@H]1CN(C(=O)Nc2ncc(Cc3ccccc3Cl)s2)CCO1 ZINC000172047257 1425882040 /nfs/dbraw/zinc/88/20/40/1425882040.db2.gz BYSJCBNNXHXQPB-AWEZNQCLSA-N 0 3 394.928 3.182 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)N[C@@H](C)c3nc4ccccc4[nH]3)cc2)CC1 ZINC000172049891 1425882268 /nfs/dbraw/zinc/88/22/68/1425882268.db2.gz MKWGOYQURRVZQP-INIZCTEOSA-N 0 3 377.492 3.196 10 0 GGAEHN COc1cccc(CNC(=O)[C@@H](C)N[C@@H](C)c2ccc(-n3cccn3)cc2)c1 ZINC000174368783 1427124230 /nfs/dbraw/zinc/12/42/30/1427124230.db2.gz GPKLCWUEVNEDFN-DLBZAZTESA-N 0 3 378.476 3.236 10 0 GGAEHN C[C@@H](N[C@H](C)c1ccc(-n2cccn2)cc1)C(=O)NCCc1ccc(F)cc1 ZINC000174373354 1427126101 /nfs/dbraw/zinc/12/61/01/1427126101.db2.gz DKLQKSOWLJWJDS-IAGOWNOFSA-N 0 3 380.467 3.409 10 0 GGAEHN C[C@@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)NC(=O)Nc1ccccc1F ZINC000174375214 1427126830 /nfs/dbraw/zinc/12/68/30/1427126830.db2.gz GFSIBDVFWKMTHP-LSDHHAIUSA-N 0 3 395.438 3.399 10 0 GGAEHN C[C@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)NC(=O)Nc1ccccc1 ZINC000174374944 1427127172 /nfs/dbraw/zinc/12/71/72/1427127172.db2.gz FIFXMTWURYYHPB-HOTGVXAUSA-N 0 3 377.448 3.260 10 0 GGAEHN CN1CCOc2ccc(NC(=O)NC[C@H](c3ccccc3)N3CCCC3)cc21 ZINC000175079612 1427535144 /nfs/dbraw/zinc/53/51/44/1427535144.db2.gz CSMBKBSFRJWGBV-HXUWFJFHSA-N 0 3 380.492 3.474 10 0 GGAEHN Cc1ccc(C(=O)N(C)C)cc1NC(=O)N1CCN([C@H]2C[C@H]3CC[C@@H]2C3)CC1 ZINC000175196597 1427593425 /nfs/dbraw/zinc/59/34/25/1427593425.db2.gz GWBQBDGKMQBQQL-QKLQHJQFSA-N 0 3 384.524 3.035 10 0 GGAEHN Cc1cc(NC(=O)N2CCN([C@H]3C[C@H]4CC[C@@H]3C4)CC2)ccc1C(=O)N(C)C ZINC000175410215 1427738972 /nfs/dbraw/zinc/73/89/72/1427738972.db2.gz BWYLYLDGQLLSIV-QKLQHJQFSA-N 0 3 384.524 3.035 10 0 GGAEHN COc1cccc(CS(=O)(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c1 ZINC000175844179 1427925942 /nfs/dbraw/zinc/92/59/42/1427925942.db2.gz NNJYGGLEKWXHOY-PXNSSMCTSA-N 0 3 388.533 3.168 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)Nc3ccc4c(c3)CCCC(=O)N4)cc2)CC1 ZINC000175998913 1428020766 /nfs/dbraw/zinc/02/07/66/1428020766.db2.gz XITNQQCVOVTGRB-UHFFFAOYSA-N 0 3 392.503 3.356 10 0 GGAEHN C[C@H](NCC(=O)N(C)CCOc1ccccc1F)c1ccc(-n2cccn2)cc1 ZINC000180843484 1430066540 /nfs/dbraw/zinc/06/65/40/1430066540.db2.gz HTCHOHQGQXFTIT-KRWDZBQOSA-N 0 3 396.466 3.199 10 0 GGAEHN CCN1CCN(Cc2ccc(NS(=O)(=O)/C=C/c3ccccc3)cc2)CC1 ZINC000180936319 1430124444 /nfs/dbraw/zinc/12/44/44/1430124444.db2.gz IXRIEYSZLQEJEW-SFQUDFHCSA-N 0 3 385.533 3.237 10 0 GGAEHN C[C@H](NCCn1c(=O)oc2cccnc21)c1ccc(OCC(F)(F)F)cc1 ZINC000180949274 1430130611 /nfs/dbraw/zinc/13/06/11/1430130611.db2.gz RESDKXNWMSIRPB-LBPRGKRZSA-N 0 3 381.354 3.281 10 0 GGAEHN CC[C@H](NCCNC(=O)C1N=CC=CC1=O)c1cc(F)cc(Br)c1 ZINC000181963190 1430389122 /nfs/dbraw/zinc/38/91/22/1430389122.db2.gz ABOFYBJSEUBLQQ-HYEKCJMVSA-N 0 3 396.260 3.155 10 0 GGAEHN O[C@H](COc1cccc2ccccc21)CN1CCCN(c2ccccn2)CC1 ZINC000183850264 1430804839 /nfs/dbraw/zinc/80/48/39/1430804839.db2.gz YHXJKLDVXOTTMN-FQEVSTJZSA-N 0 3 377.488 3.187 10 0 GGAEHN O[C@@H](COc1cccc2ccccc21)CN1CCCN(c2ccccn2)CC1 ZINC000183850244 1430804962 /nfs/dbraw/zinc/80/49/62/1430804962.db2.gz YHXJKLDVXOTTMN-HXUWFJFHSA-N 0 3 377.488 3.187 10 0 GGAEHN CN1CCN(CCC(C)(C)NC(=O)[C@H]2C[C@@H]2c2ccc3ccccc3c2)CC1 ZINC000184199925 1430855463 /nfs/dbraw/zinc/85/54/63/1430855463.db2.gz HMQBTJZZIJGPIC-YADHBBJMSA-N 0 3 379.548 3.476 10 0 GGAEHN COc1cccc(CN2C[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)[C@H]3C2)c1OC ZINC000184239541 1430860835 /nfs/dbraw/zinc/86/08/35/1430860835.db2.gz GQRIOBMWLZOXPG-BHYGNILZSA-N 0 3 376.497 3.439 10 0 GGAEHN [O-]c1ccc2cc(Br)ccc2c1C[N@@H+]1CCO[C@]2(CCOC2)C1 ZINC000184292164 1430869308 /nfs/dbraw/zinc/86/93/08/1430869308.db2.gz PJEZUUZZHCKORM-GOSISDBHSA-N 0 3 378.266 3.299 10 0 GGAEHN [O-]c1ccc2cc(Br)ccc2c1C[N@H+]1CCO[C@]2(CCOC2)C1 ZINC000184292164 1430869309 /nfs/dbraw/zinc/86/93/09/1430869309.db2.gz PJEZUUZZHCKORM-GOSISDBHSA-N 0 3 378.266 3.299 10 0 GGAEHN CC[C@@H](N[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1nc(C)cs1 ZINC000184346784 1430875933 /nfs/dbraw/zinc/87/59/33/1430875933.db2.gz DJUNIBGCGBNIAG-BHIYHBOVSA-N 0 3 386.565 3.271 10 0 GGAEHN CC(C)CCn1cccc1CNCc1cccc(N2CCCS2(=O)=O)c1 ZINC000185096093 1431060067 /nfs/dbraw/zinc/06/00/67/1431060067.db2.gz CIGREVKRBISYCZ-UHFFFAOYSA-N 0 3 375.538 3.364 10 0 GGAEHN CC[C@H](NCc1cccc(N2CCCS2(=O)=O)c1)c1ccc2c(c1)CCO2 ZINC000185295583 1431102878 /nfs/dbraw/zinc/10/28/78/1431102878.db2.gz DTFCCRCOLLTSIS-FQEVSTJZSA-N 0 3 386.517 3.402 10 0 GGAEHN COc1ccc(C[C@@H](C)C[NH2+][C@H](c2nc(-c3nc[n-]n3)no2)C(C)C)cc1F ZINC000185306980 1431107724 /nfs/dbraw/zinc/10/77/24/1431107724.db2.gz CVJIXAKMVRKPML-WBMJQRKESA-N 0 3 388.447 3.168 10 0 GGAEHN COc1ccccc1[C@H](CNC(=O)N1CCCN(C2CC2)CC1)OC(C)C ZINC000185769860 1431230261 /nfs/dbraw/zinc/23/02/61/1431230261.db2.gz ZJPCRECTUXKCEO-FQEVSTJZSA-N 0 3 375.513 3.041 10 0 GGAEHN COC(=O)c1ccc(CN2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)[C@H]3C2)cc1F ZINC000186027336 1431313726 /nfs/dbraw/zinc/31/37/26/1431313726.db2.gz RGUYATHVHRIYPM-ZVZYQTTQSA-N 0 3 392.471 3.347 10 0 GGAEHN COc1c(C)cnc(CN2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)[C@@H]3C2)c1C ZINC000186031843 1431314845 /nfs/dbraw/zinc/31/48/45/1431314845.db2.gz NENDYIDOMYQCIY-BBWFWOEESA-N 0 3 375.513 3.442 10 0 GGAEHN COC(=O)c1ccc(CN2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)[C@H]3C2)s1 ZINC000186033454 1431315570 /nfs/dbraw/zinc/31/55/70/1431315570.db2.gz BMGWOFFHHCPJGU-QEJZJMRPSA-N 0 3 380.510 3.270 10 0 GGAEHN CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(C[C@H](O)c3ccc(F)c(F)c3)C[C@H]12 ZINC000186038298 1431317184 /nfs/dbraw/zinc/31/71/84/1431317184.db2.gz LSTMNBJZYBNANX-NONVJHHQSA-N 0 3 382.451 3.233 10 0 GGAEHN O=C(NC1CCC(Oc2ncccc2Cl)CC1)N1CCCN(C2CC2)CC1 ZINC000187515322 1431753394 /nfs/dbraw/zinc/75/33/94/1431753394.db2.gz VLBZYHNTWFBPSQ-UHFFFAOYSA-N 0 3 392.931 3.305 10 0 GGAEHN Cc1cc(C)c(N2CC[C@@H](N3CCC(Cc4nccn4C)CC3)C2=O)c(C)c1 ZINC000190525939 1432398001 /nfs/dbraw/zinc/39/80/01/1432398001.db2.gz VTPWFQSSYRVNPH-HXUWFJFHSA-N 0 3 380.536 3.405 10 0 GGAEHN COc1cc(C)cc(CNC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000190607651 1432419210 /nfs/dbraw/zinc/41/92/10/1432419210.db2.gz FMAKSIKJPBZGIR-QFIPXVFZSA-N 0 3 397.519 3.094 10 0 GGAEHN CCc1nc(C2CCN(CC(=O)N(C)[C@@H](C)c3ccc(F)c(F)c3)CC2)n[nH]1 ZINC000190665645 1432436654 /nfs/dbraw/zinc/43/66/54/1432436654.db2.gz IOQUXOHHJOPBBT-ZDUSSCGKSA-N 0 3 391.466 3.044 10 0 GGAEHN CCc1n[nH]c(C2CCN(CC(=O)N(C)[C@@H](C)c3ccc(F)c(F)c3)CC2)n1 ZINC000190665645 1432436655 /nfs/dbraw/zinc/43/66/55/1432436655.db2.gz IOQUXOHHJOPBBT-ZDUSSCGKSA-N 0 3 391.466 3.044 10 0 GGAEHN CCc1nnc(C2CCN(CC(=O)N(C)[C@@H](C)c3ccc(F)c(F)c3)CC2)[nH]1 ZINC000190665645 1432436658 /nfs/dbraw/zinc/43/66/58/1432436658.db2.gz IOQUXOHHJOPBBT-ZDUSSCGKSA-N 0 3 391.466 3.044 10 0 GGAEHN CCN1CCN(Cc2ccc(NC(=O)c3ccc(NC(=O)OC)cc3)cc2)CC1 ZINC000192550075 1432858244 /nfs/dbraw/zinc/85/82/44/1432858244.db2.gz YLIXRJKQNKYGRS-UHFFFAOYSA-N 0 3 396.491 3.255 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)c2cc(N3CCCC3)ccn2)C1 ZINC000192600501 1432864574 /nfs/dbraw/zinc/86/45/74/1432864574.db2.gz HXFRHYVTNLOHDO-KRWDZBQOSA-N 0 3 399.564 3.041 10 0 GGAEHN CNC(=O)c1cccc(NC(=O)[C@H](C)SCCN(C)Cc2ccccc2)c1 ZINC000193626523 1433030678 /nfs/dbraw/zinc/03/06/78/1433030678.db2.gz GPJMSZJTGIUTPS-INIZCTEOSA-N 0 3 385.533 3.238 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)[C@H]1CCCCC(=O)N1)c1ccc(C(F)(F)F)cc1 ZINC000193921903 1433085096 /nfs/dbraw/zinc/08/50/96/1433085096.db2.gz HKBAEDFNCQRKGG-IAGOWNOFSA-N 0 3 399.457 3.263 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)[C@@H]1CCCCC(=O)N1)c1ccc(C(F)(F)F)cc1 ZINC000193921854 1433085174 /nfs/dbraw/zinc/08/51/74/1433085174.db2.gz HKBAEDFNCQRKGG-IRXDYDNUSA-N 0 3 399.457 3.263 10 0 GGAEHN c1ccc(N2CCOCC2)c(CNCc2ccc(OC[C@H]3CCCO3)cc2)c1 ZINC000236716929 1433376678 /nfs/dbraw/zinc/37/66/78/1433376678.db2.gz HKWRZZJNKFEJLV-JOCHJYFZSA-N 0 3 382.504 3.371 10 0 GGAEHN CN(C)C(=O)c1ccc(CNC[C@@H](c2c(F)cccc2Cl)N2CCCC2)[nH]1 ZINC000237067240 1433387639 /nfs/dbraw/zinc/38/76/39/1433387639.db2.gz DFLLUTDLVKDVEG-SFHVURJKSA-N 0 3 392.906 3.436 10 0 GGAEHN COc1ccccc1[C@@H](CNC(=O)[C@H]1Cc2ccccc2CN1)N1CCCCC1 ZINC000237204388 1433392597 /nfs/dbraw/zinc/39/25/97/1433392597.db2.gz GOGRHACESMCQAL-FGZHOGPDSA-N 0 3 393.531 3.053 10 0 GGAEHN COc1cc2c(c(CNC[C@H](c3cccc(C)c3)N3CCOCC3)c1)O[C@H](C)C2 ZINC000237400278 1433400909 /nfs/dbraw/zinc/40/09/09/1433400909.db2.gz HMKCLKMKTHEDCV-WZONZLPQSA-N 0 3 396.531 3.490 10 0 GGAEHN COc1cccc(CN(C[C@@H](O)COCc2ccccc2)C[C@H]2CCCO2)c1 ZINC000245279100 1433455903 /nfs/dbraw/zinc/45/59/03/1433455903.db2.gz CCSFFZXXRJDHTL-FYYLOGMGSA-N 0 3 385.504 3.254 10 0 GGAEHN COC(=O)c1ccc(OCCN2CC[C@@H](C)[C@H](n3ccnc3)C2)c(Cl)c1 ZINC000245571533 1433486899 /nfs/dbraw/zinc/48/68/99/1433486899.db2.gz GSYSBSUEBLWKAB-RHSMWYFYSA-N 0 3 377.872 3.285 10 0 GGAEHN C[C@H](C(=O)N1c2ccccc2CC[C@@H]1C)N1CCC[C@@H](Cc2nccn2C)C1 ZINC000245808888 1433520601 /nfs/dbraw/zinc/52/06/01/1433520601.db2.gz BXASEDOWLBMWTF-OTWHNJEPSA-N 0 3 380.536 3.431 10 0 GGAEHN CC(C)(C)OC(=O)N[C@@H]1CC[C@H]2CN(Cc3ccc(N4CCCC4)nc3)C[C@H]21 ZINC000248591994 1433810229 /nfs/dbraw/zinc/81/02/29/1433810229.db2.gz HHMKWAKXDQZQOR-IPMKNSEASA-N 0 3 386.540 3.417 10 0 GGAEHN COc1ccc(OC)c(CN2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)[C@@H]3C2)c1 ZINC000248613077 1433811381 /nfs/dbraw/zinc/81/13/81/1433811381.db2.gz QWRTZHPYSCICAT-QGTPRVQTSA-N 0 3 376.497 3.439 10 0 GGAEHN COC(=O)c1ccc(CN2C[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)[C@@H]3C2)cc1F ZINC000248614603 1433811625 /nfs/dbraw/zinc/81/16/25/1433811625.db2.gz RGUYATHVHRIYPM-YXJHDRRASA-N 0 3 392.471 3.347 10 0 GGAEHN CNC(=O)c1cccc(NC(=O)[C@H](C)N[C@H](C[C@H]2CCOC2)c2ccccc2)c1 ZINC000248716772 1433817299 /nfs/dbraw/zinc/81/72/99/1433817299.db2.gz FECYZXSBTISHHP-CSODHUTKSA-N 0 3 395.503 3.131 10 0 GGAEHN C[C@H](N[C@H]1CCCC[C@H]1C(N)=O)C(=O)Nc1ccccc1Cc1ccccc1 ZINC000249085762 1433834606 /nfs/dbraw/zinc/83/46/06/1433834606.db2.gz BQVVCGWGOAFKAC-SCWSEQNSSA-N 0 3 379.504 3.238 10 0 GGAEHN CC(C)(C)OC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C[C@@H](O)COCc1ccco1 ZINC000249392844 1433842501 /nfs/dbraw/zinc/84/25/01/1433842501.db2.gz AJFWVKJUCWOJJW-ISARSNTHSA-N 0 3 379.497 3.132 10 0 GGAEHN COCCO[C@H]1CN(C2CCN(C(=O)NC(C)(C)C)CC2)C12CCCCC2 ZINC000257182698 1433893982 /nfs/dbraw/zinc/89/39/82/1433893982.db2.gz PXEWOAAZJZHGFT-SFHVURJKSA-N 0 3 381.561 3.009 10 0 GGAEHN CC(C)OCCN1CCC(NC(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)CC1 ZINC000267003673 1434398107 /nfs/dbraw/zinc/39/81/07/1434398107.db2.gz DMVWQTAPTAGFIS-SFHVURJKSA-N 0 3 399.539 3.122 10 0 GGAEHN CCc1nc2ccccc2c(C(=O)Nc2ccc(=O)n(CCN(C)C)c2)c1C ZINC000270090390 1434701858 /nfs/dbraw/zinc/70/18/58/1434701858.db2.gz AMTJBNMUJKJLMX-UHFFFAOYSA-N 0 3 378.476 3.081 10 0 GGAEHN CC[C@H](N[C@H](C)C(=O)Nc1cccc(NC(C)=O)c1)c1ccc2c(c1)OCCO2 ZINC000271635825 1434840744 /nfs/dbraw/zinc/84/07/44/1434840744.db2.gz FEHKWPZCTDDSEH-KUHUBIRLSA-N 0 3 397.475 3.484 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cnc3c(C)cc(F)cc3c2O)C[C@@H]1N1CCCC1 ZINC000275080116 1435114882 /nfs/dbraw/zinc/11/48/82/1435114882.db2.gz DYXXGDWXAGGITF-DLBZAZTESA-N 0 3 389.496 3.040 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cnc3c(C)cc(F)cc3c2O)C[C@@H]1N1CCCC1 ZINC000275080124 1435114887 /nfs/dbraw/zinc/11/48/87/1435114887.db2.gz DYXXGDWXAGGITF-IRXDYDNUSA-N 0 3 389.496 3.040 10 0 GGAEHN CC(C)OCCN1CCC(N2C(=O)N[C@H](c3ccc4ccccc4c3)C2=O)CC1 ZINC000277147304 1435268913 /nfs/dbraw/zinc/26/89/13/1435268913.db2.gz AQNFEDDCMVGVGV-OAQYLSRUSA-N 0 3 395.503 3.322 10 0 GGAEHN CCS(=O)(=O)c1ccc(CNC2CCN(CCc3ccccc3)CC2)s1 ZINC000280521738 1435672879 /nfs/dbraw/zinc/67/28/79/1435672879.db2.gz HUVLSYIDDMSFKK-UHFFFAOYSA-N 0 3 392.590 3.338 10 0 GGAEHN COc1ccc(OCc2ccccn2)c(CN[C@H]2Cc3ccccc3[C@@H]2O)c1 ZINC000172068415 1126076855 /nfs/dbraw/zinc/07/68/55/1126076855.db2.gz PKBSQDQAXOMQJX-GMAHTHKFSA-N 0 3 376.456 3.417 10 0 GGAEHN COc1ccccc1-c1ncc(CN[C@@](C)(CO)Cc2ccccc2F)cn1 ZINC000631234279 1126101616 /nfs/dbraw/zinc/10/16/16/1126101616.db2.gz FZDPDKRZBJMKIS-JOCHJYFZSA-N 0 3 381.451 3.375 10 0 GGAEHN Cc1nn(-c2ccncc2)cc1CN[C@@H](Cc1ccccc1)[C@@H](O)C(F)(F)F ZINC000680121101 1126105563 /nfs/dbraw/zinc/10/55/63/1126105563.db2.gz QYMJUBHYXDSRSS-RBUKOAKNSA-N 0 3 390.409 3.200 10 0 GGAEHN OC[C@]1(NCc2cc(F)ncc2F)CCc2cc(Br)ccc2C1 ZINC000862480340 1126113022 /nfs/dbraw/zinc/11/30/22/1126113022.db2.gz CVRVFNLPDQAMJH-KRWDZBQOSA-N 0 3 383.236 3.132 10 0 GGAEHN Cc1nn(C)c2nc(Cl)c(CN[C@](C)(CO)Cc3ccccc3F)cc12 ZINC000865714209 1126114513 /nfs/dbraw/zinc/11/45/13/1126114513.db2.gz INBJTCVZMHNFGL-IBGZPJMESA-N 0 3 376.863 3.153 10 0 GGAEHN C[C@@H](O)c1ncc(CN[C@@](C)(CO)Cc2ccc(Br)cc2)s1 ZINC000865714885 1126114631 /nfs/dbraw/zinc/11/46/31/1126114631.db2.gz FUKJNROBMGXHRG-BDJLRTHQSA-N 0 3 385.327 3.042 10 0 GGAEHN CCc1onc(C)c1CN[C@]1(CO)CCc2cc(Br)ccc2C1 ZINC001171949481 1126148588 /nfs/dbraw/zinc/14/85/88/1126148588.db2.gz SNKXOOADPUPXDK-GOSISDBHSA-N 0 3 379.298 3.318 10 0 GGAEHN COC(=O)c1cc(CN[C@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)ccc1C ZINC001308035465 1126162314 /nfs/dbraw/zinc/16/23/14/1126162314.db2.gz QJUXDOQESXIZCS-QZTJIDSGSA-N 0 3 381.394 3.406 10 0 GGAEHN COC(=O)c1ccc(OC)c(CN[C@@](C)(CO)Cc2ccc(Cl)cc2)c1 ZINC001473839479 1126199840 /nfs/dbraw/zinc/19/98/40/1126199840.db2.gz BVEUWDRXVPLDBH-HXUWFJFHSA-N 0 3 377.868 3.219 10 0 GGAEHN COC(=O)c1ccc2[nH]c(CN[C@@](C)(CO)Cc3ccc(Cl)cc3)nc2c1 ZINC001648469588 1126250895 /nfs/dbraw/zinc/25/08/95/1126250895.db2.gz KSCUWFBGBAQSFQ-HXUWFJFHSA-N 0 3 387.867 3.086 10 0 GGAEHN C[C@](CO)(Cc1ccc(F)cc1)NCc1cn2cc(Br)ccc2n1 ZINC001654940742 1126254949 /nfs/dbraw/zinc/25/49/49/1126254949.db2.gz PTNNZESFLGEODW-GOSISDBHSA-N 0 3 392.272 3.319 10 0 GGAEHN Cc1ccc(-c2noc(CCC(=O)NC[C@H](c3ccccc3)N(C)C)n2)cc1 ZINC000016599863 210191550 /nfs/dbraw/zinc/19/15/50/210191550.db2.gz LWHFEISSOAZBLL-LJQANCHMSA-N 0 3 378.476 3.397 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)C1=Cc2cc(Br)ccc2OC1 ZINC000015786378 210170764 /nfs/dbraw/zinc/17/07/64/210170764.db2.gz XXOUCPZILQGRMA-CYBMUJFWSA-N 0 3 379.298 3.216 10 0 GGAEHN O=C(Cn1c(=O)oc2cc(Cl)ccc21)NC1CCN(Cc2ccccc2)CC1 ZINC000015766479 210167604 /nfs/dbraw/zinc/16/76/04/210167604.db2.gz OSSXOJAKBXSDIC-UHFFFAOYSA-N 0 3 399.878 3.029 10 0 GGAEHN Cc1oc2ncnc(N3CCCCC3)c2c1C(=O)NCCN1C[C@H](C)C[C@@H](C)C1 ZINC000015727610 210164025 /nfs/dbraw/zinc/16/40/25/210164025.db2.gz BOFVIDYWLXDPJP-HZPDHXFCSA-N 0 3 399.539 3.229 10 0 GGAEHN COc1ccc([C@H](CNC(=O)c2ccc3c(c2)NC(=O)[C@@H](C)S3)N(C)C)cc1 ZINC000015387853 210156354 /nfs/dbraw/zinc/15/63/54/210156354.db2.gz CCKDCWXGOYKCJJ-ACJLOTCBSA-N 0 3 399.516 3.161 10 0 GGAEHN C[C@@]1(C2CCN(Cc3cccc(Oc4ccccc4)c3)CC2)NC(=O)NC1=O ZINC000014994383 210140792 /nfs/dbraw/zinc/14/07/92/210140792.db2.gz HWKJLZXWGOEZKR-QFIPXVFZSA-N 0 3 379.460 3.289 10 0 GGAEHN CCOC(=O)[C@@]1(Cc2ccccc2)CCCN(Cc2cccc(OCCO)c2)C1 ZINC000014959349 210132987 /nfs/dbraw/zinc/13/29/87/210132987.db2.gz SBGJUJXKYVLOBV-XMMPIXPASA-N 0 3 397.515 3.446 10 0 GGAEHN COC[C@H](C)N1CCC2(CC1)C(=O)N(Cc1ccc3ccccc3c1)C(=O)N2C ZINC000014531528 210118823 /nfs/dbraw/zinc/11/88/23/210118823.db2.gz GPPPXNJEGYCWRI-KRWDZBQOSA-N 0 3 395.503 3.103 10 0 GGAEHN CN(C)Cc1ccc(C(=O)Nc2nc3ccc(S(C)(=O)=O)cc3s2)cc1 ZINC000014120187 210103850 /nfs/dbraw/zinc/10/38/50/210103850.db2.gz GGQJNZUMOKSGQB-UHFFFAOYSA-N 0 3 389.502 3.014 10 0 GGAEHN CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2ccc3cc[nH]c3c2)CC1 ZINC000013819777 210091702 /nfs/dbraw/zinc/09/17/02/210091702.db2.gz KXAHJMMPIMPUFG-GOSISDBHSA-N 0 3 375.538 3.443 10 0 GGAEHN CCOc1cccc(CNCCOCCO)c1OCc1ccccc1Cl ZINC000013717471 210083245 /nfs/dbraw/zinc/08/32/45/210083245.db2.gz BTCKMTSFVCJEHC-UHFFFAOYSA-N 0 3 379.884 3.416 10 0 GGAEHN C[C@@H]1C[C@H](C)CN(CC(=O)N(C)CC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000013056186 210049142 /nfs/dbraw/zinc/04/91/42/210049142.db2.gz QJVKAERWPJKSHR-BETUJISGSA-N 0 3 386.323 3.368 10 0 GGAEHN CN(C)Cc1ccc(CNC(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)cc1 ZINC000012978386 210038551 /nfs/dbraw/zinc/03/85/51/210038551.db2.gz YRJMTIKQPCLEFZ-UHFFFAOYSA-N 0 3 392.478 3.492 10 0 GGAEHN O=c1nc(CSC2=NCCN2)[nH]c2scc(-c3ccc(Cl)cc3)c21 ZINC000012851118 210018886 /nfs/dbraw/zinc/01/88/86/210018886.db2.gz PPIOYDMQVHDVQC-UHFFFAOYSA-N 0 3 376.894 3.497 10 0 GGAEHN O=C(CN1CCC[C@@H](C(F)(F)F)C1)NC1CCN(Cc2ccccc2)CC1 ZINC000012811500 210013094 /nfs/dbraw/zinc/01/30/94/210013094.db2.gz FNVCHDXPNYSLNN-QGZVFWFLSA-N 0 3 383.458 3.042 10 0 GGAEHN CCN1CCN(c2ccc(NC(=O)C[C@H]3OC(=O)c4ccccc43)cc2C)CC1 ZINC000008429282 209781993 /nfs/dbraw/zinc/78/19/93/209781993.db2.gz RLKKKICXKNYABP-OAQYLSRUSA-N 0 3 393.487 3.377 10 0 GGAEHN O=C(Cc1ccc(Cl)c(Cl)c1)N1CCc2[nH]cnc2[C@@H]1CN1CCCC1 ZINC000026375892 209242794 /nfs/dbraw/zinc/24/27/94/209242794.db2.gz CJLJXCDVYJKDTR-KRWDZBQOSA-N 0 3 393.318 3.481 10 0 GGAEHN O=C(Cc1ccc(Cl)c(Cl)c1)N1CCc2nc[nH]c2[C@@H]1CN1CCCC1 ZINC000026375892 209242798 /nfs/dbraw/zinc/24/27/98/209242798.db2.gz CJLJXCDVYJKDTR-KRWDZBQOSA-N 0 3 393.318 3.481 10 0 GGAEHN O=C(/C=C\c1ccc(Cl)c(C(F)(F)F)c1)NC[C@@H]1CN2CCC[C@@H]2CO1 ZINC000096402092 209240684 /nfs/dbraw/zinc/24/06/84/209240684.db2.gz YBWAXKXVGNZOIE-GNXSNYGWSA-N 0 3 388.817 3.351 10 0 GGAEHN O=C(/C=C\c1ccc2c(c1)OCCO2)NCCCN1CCc2ccccc2C1 ZINC000096291433 209240391 /nfs/dbraw/zinc/24/03/91/209240391.db2.gz GJCTUUVJYPBPQJ-CLFYSBASSA-N 0 3 378.472 3.036 10 0 GGAEHN CCCNC(=O)c1ccc(N(C)[C@H](CN2CC[C@H](O)C2)c2ccccc2)cc1 ZINC000003828595 209229606 /nfs/dbraw/zinc/22/96/06/209229606.db2.gz FHFHNAQEPILWDK-FCHUYYIVSA-N 0 3 381.520 3.071 10 0 GGAEHN CC(C)OC(=O)C1(C(=O)OC(C)C)CC(N[C@H](C)[C@H]2COc3ccccc32)C1 ZINC000359906092 209201412 /nfs/dbraw/zinc/20/14/12/209201412.db2.gz VVJMZHJZJZRIQZ-CRAIPNDOSA-N 0 3 389.492 3.193 10 0 GGAEHN O=c1c2cc(Cl)ccc2nc(N2CCNCC2)n1Cc1ccccc1Cl ZINC000040351902 209195192 /nfs/dbraw/zinc/19/51/92/209195192.db2.gz SNTQYLNZMWSCCC-UHFFFAOYSA-N 0 3 389.286 3.161 10 0 GGAEHN COc1ccc(Br)cc1CN[C@@H]1CCCN(c2cccnn2)C1 ZINC000107303911 209160718 /nfs/dbraw/zinc/16/07/18/209160718.db2.gz MKCKVWJMCMSASJ-OAHLLOKOSA-N 0 3 377.286 3.006 10 0 GGAEHN CCN1CCC[C@@H](CN(C)C(=O)c2ccncc2Cl)[C@@H]1c1cnn(C)c1 ZINC000328636969 209151476 /nfs/dbraw/zinc/15/14/76/209151476.db2.gz VVJDGEOJMSFSPB-KBXCAEBGSA-N 0 3 375.904 3.014 10 0 GGAEHN FC(F)(F)Cn1ccnc1CNC[C@@H]1CCc2nc(C(F)(F)F)cn2C1 ZINC000328630323 209151311 /nfs/dbraw/zinc/15/13/11/209151311.db2.gz JGGHTLVUSVLPIW-JTQLQIEISA-N 0 3 381.324 3.013 10 0 GGAEHN CCN1CCC[C@@H](CN(C)C(=O)c2ccc(Cl)cn2)[C@@H]1c1cnn(C)c1 ZINC000328633027 209151051 /nfs/dbraw/zinc/15/10/51/209151051.db2.gz SHBKRBZBHZSHGK-KBXCAEBGSA-N 0 3 375.904 3.014 10 0 GGAEHN Cc1ccc(CNC[C@@H]2CC(=O)N(C)[C@H]2c2cnn(-c3ccc(F)cc3)c2)nc1 ZINC000328604180 209144013 /nfs/dbraw/zinc/14/40/13/209144013.db2.gz ISHXRWCIIZLGQL-KSFYIVLOSA-N 0 3 393.466 3.024 10 0 GGAEHN CN1CCN(CCCNC(=O)C2(c3ccc(F)cc3)CC2)[C@@H](c2ccccc2)C1 ZINC000033136108 209138829 /nfs/dbraw/zinc/13/88/29/209138829.db2.gz HAFAWDRLFRNEDK-JOCHJYFZSA-N 0 3 395.522 3.352 10 0 GGAEHN CCN1CCC(N(C)C(=O)CCc2nc(-c3cccc(Cl)c3F)no2)CC1 ZINC000097377859 211364499 /nfs/dbraw/zinc/36/44/99/211364499.db2.gz BABLSDVHSPJPKV-UHFFFAOYSA-N 0 3 394.878 3.404 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)CSc1nccnc1Oc1ccccc1 ZINC000096332621 211335198 /nfs/dbraw/zinc/33/51/98/211335198.db2.gz HRRIHLMRDMRSCE-MRXNPFEDSA-N 0 3 386.521 3.352 10 0 GGAEHN CCN(CC)C(=O)[C@@H]1C[C@@H](NC(=O)c2ccsc2)CN1C1CCCCC1 ZINC000096163936 211316973 /nfs/dbraw/zinc/31/69/73/211316973.db2.gz XSOOSFFGFKYQAP-AEFFLSMTSA-N 0 3 377.554 3.122 10 0 GGAEHN C[C@H]1CCCCN1Cc1cccc(NC(=O)NCc2cnn3cccnc23)c1 ZINC000096148110 211309561 /nfs/dbraw/zinc/30/95/61/211309561.db2.gz NKRWDIMZBOLWSN-INIZCTEOSA-N 0 3 378.480 3.425 10 0 GGAEHN Cc1nc(CN2CCOCC23CCN(Cc2cccc(F)c2)CC3)cs1 ZINC000096093376 211301148 /nfs/dbraw/zinc/30/11/48/211301148.db2.gz BZKDMLXEJIITGW-UHFFFAOYSA-N 0 3 375.513 3.458 10 0 GGAEHN CN1CCN(CC2(C)CCN(Cc3cc(Cl)cc4c3OCOC4)CC2)CC1 ZINC000096014167 211294440 /nfs/dbraw/zinc/29/44/40/211294440.db2.gz GUVSHBLLSBFAKL-UHFFFAOYSA-N 0 3 393.959 3.056 10 0 GGAEHN C[C@@H](CNC(=O)CCN(C)c1ccncc1)Oc1ccccc1Br ZINC000095997722 211293002 /nfs/dbraw/zinc/29/30/02/211293002.db2.gz HOLCPBBXWNLDGZ-AWEZNQCLSA-N 0 3 392.297 3.254 10 0 GGAEHN CC(C)[C@@H](NC(=O)CN(C)C(C)C)c1ccccc1NC(=O)CN(C)C(C)C ZINC000095976322 211290655 /nfs/dbraw/zinc/29/06/55/211290655.db2.gz OQDUVTYCJXGWNF-JOCHJYFZSA-N 0 3 390.572 3.119 10 0 GGAEHN COC(=O)C1CCN(CCCNC(=O)Nc2ccc(Cl)c(Cl)c2)CC1 ZINC000095950819 211285790 /nfs/dbraw/zinc/28/57/90/211285790.db2.gz YGJOKROFKAWOPJ-UHFFFAOYSA-N 0 3 388.295 3.390 10 0 GGAEHN COC(=O)[C@H]1CCCCC[C@H]1NCC(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000095941462 211284152 /nfs/dbraw/zinc/28/41/52/211284152.db2.gz LZGDYCAXOSWHCU-LSDHHAIUSA-N 0 3 388.386 3.235 10 0 GGAEHN CCOC(=O)[C@@H]1CN(Cc2ccccc2)C[C@@]12CCOc1c(OC)cccc12 ZINC000095831150 211282581 /nfs/dbraw/zinc/28/25/81/211282581.db2.gz NFONKAWVVRIRND-WMZHIEFXSA-N 0 3 381.472 3.411 10 0 GGAEHN CCN1CCc2nc[nH]c2C12CCN(Cc1cc3c(cc1OC)CCC3)CC2 ZINC000095497501 211249642 /nfs/dbraw/zinc/24/96/42/211249642.db2.gz RESMGWCDZHICHP-UHFFFAOYSA-N 0 3 380.536 3.276 10 0 GGAEHN CCOC(CNC(=O)c1cccc(CN2CCCC2)c1)(OCC)c1ccccn1 ZINC000095464921 211245679 /nfs/dbraw/zinc/24/56/79/211245679.db2.gz WSWFQUOTGRDFQF-UHFFFAOYSA-N 0 3 397.519 3.333 10 0 GGAEHN O=C(OCc1ccccc1)C1CN(C(=O)c2cccc(CN3CCCC3)c2)C1 ZINC000095467386 211245087 /nfs/dbraw/zinc/24/50/87/211245087.db2.gz YRLLZLCCWORJED-UHFFFAOYSA-N 0 3 378.472 3.098 10 0 GGAEHN CC(C)c1ccccc1NC(=O)[C@H](C)N1CCN(C2CCN(C)CC2)[C@H](C)C1 ZINC000095456055 211242626 /nfs/dbraw/zinc/24/26/26/211242626.db2.gz KARPIIIHJYUWBH-MOPGFXCFSA-N 0 3 386.584 3.237 10 0 GGAEHN NC(=O)[C@H](CNCc1ccccc1OCc1ccccn1)Cc1ccc(F)cc1 ZINC000095452873 211242581 /nfs/dbraw/zinc/24/25/81/211242581.db2.gz YDRUTUUAAAVDDL-IBGZPJMESA-N 0 3 393.462 3.234 10 0 GGAEHN COc1ccc([C@@H]2CN(Cc3ccnc4ccccc34)C[C@H]2NC(C)=O)cc1 ZINC000091586988 211195729 /nfs/dbraw/zinc/19/57/29/211195729.db2.gz FCFXJMFSPYITJO-JTHBVZDNSA-N 0 3 375.472 3.348 10 0 GGAEHN CCCCCCN1CC2(CCN(C(=O)CN3CCCCCC3)CC2)OC1=O ZINC000077408385 211132206 /nfs/dbraw/zinc/13/22/06/211132206.db2.gz HXJOKPNLDXNGMS-UHFFFAOYSA-N 0 3 379.545 3.256 10 0 GGAEHN CCOc1cc(CNCCNc2ccc(C)nn2)ccc1OCC(F)(F)F ZINC000072230530 211083996 /nfs/dbraw/zinc/08/39/96/211083996.db2.gz YOTCCCPNJQAOAW-UHFFFAOYSA-N 0 3 384.402 3.327 10 0 GGAEHN COc1c(C)cnc(CN2CC[C@]3(C2)CCCN(Cc2cccnc2)C3=O)c1C ZINC000072166494 211080902 /nfs/dbraw/zinc/08/09/02/211080902.db2.gz PVSPXAUPPIRNNH-QHCPKHFHSA-N 0 3 394.519 3.117 10 0 GGAEHN COc1c(C)cnc(CN2CC[C@@]3(C2)CCCN(Cc2cccnc2)C3=O)c1C ZINC000072166493 211080165 /nfs/dbraw/zinc/08/01/65/211080165.db2.gz PVSPXAUPPIRNNH-HSZRJFAPSA-N 0 3 394.519 3.117 10 0 GGAEHN CCc1nc(C)c([C@H]2CN(C)C[C@@H]2C(=O)NCc2oc3ccccc3c2C)[nH]1 ZINC000072125699 211071358 /nfs/dbraw/zinc/07/13/58/211071358.db2.gz ZWBZRJXKWGKCNF-IRXDYDNUSA-N 0 3 380.492 3.297 10 0 GGAEHN Cc1c(CNCCC(=O)Nc2cc(C)ccc2C)c2ccccc2n1CC(N)=O ZINC000067908581 211029142 /nfs/dbraw/zinc/02/91/42/211029142.db2.gz XAYQDMDXVNUJFT-UHFFFAOYSA-N 0 3 392.503 3.170 10 0 GGAEHN COc1ccc([C@@H](CNC(=O)N[C@H](C)c2c(C)nn(C)c2C)N2CCCC2)cc1 ZINC000067536106 211011522 /nfs/dbraw/zinc/01/15/22/211011522.db2.gz LDDXLUZZZSDHDF-FOIQADDNSA-N 0 3 399.539 3.243 10 0 GGAEHN O=C(Nc1ccc(OC(F)(F)F)cc1)c1ccc(=O)n(CCN2CCCC2)c1 ZINC000064760519 210946104 /nfs/dbraw/zinc/94/61/04/210946104.db2.gz RXCCJUXKRKVBJD-UHFFFAOYSA-N 0 3 395.381 3.095 10 0 GGAEHN Cc1c(C(=O)NC2CCCC2)nnn1-c1cccc2c1CCN(CC1CC1)C2 ZINC000071890381 210745297 /nfs/dbraw/zinc/74/52/97/210745297.db2.gz ZYATZYGDAZLRMW-UHFFFAOYSA-N 0 3 379.508 3.016 10 0 GGAEHN O=C(CCn1c(Cc2ccc(F)cc2)nc2ccccc21)NCCN1CCCC1 ZINC000037396876 210740339 /nfs/dbraw/zinc/74/03/39/210740339.db2.gz CFCXKZVZGYQKCZ-UHFFFAOYSA-N 0 3 394.494 3.368 10 0 GGAEHN O=C(NCCN1CCCCC1)c1ccc(-c2cc(N3CCCCC3)ncn2)cc1 ZINC000035454007 210686596 /nfs/dbraw/zinc/68/65/96/210686596.db2.gz MDOLUDWWFCUVST-UHFFFAOYSA-N 0 3 393.535 3.350 10 0 GGAEHN O=C(CC1CCN(C(=O)Nc2cccc(Cl)c2)CC1)NCCN1CCCC1 ZINC000035528875 210689101 /nfs/dbraw/zinc/68/91/01/210689101.db2.gz ZFEUIWFORPRPLI-UHFFFAOYSA-N 0 3 392.931 3.186 10 0 GGAEHN Cc1ccc(C(=O)N2CCC(CC(=O)NCCN3CCCC[C@H]3C)CC2)cc1 ZINC000032974204 210609656 /nfs/dbraw/zinc/60/96/56/210609656.db2.gz HJLAYXBJGWVOQW-LJQANCHMSA-N 0 3 385.552 3.228 10 0 GGAEHN CCN1CCN(CCCNc2ncnc3onc(-c4ccc(C)cc4)c32)CC1 ZINC000021715106 210390170 /nfs/dbraw/zinc/39/01/70/210390170.db2.gz XQROVHUEUVSKCF-UHFFFAOYSA-N 0 3 380.496 3.033 10 0 GGAEHN CCCN1CCN(CCCNc2ncnc3onc(-c4ccc(C)cc4)c32)CC1 ZINC000021715096 210389216 /nfs/dbraw/zinc/38/92/16/210389216.db2.gz JZRQUCZWCQPHIV-UHFFFAOYSA-N 0 3 394.523 3.423 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)C1CCN(c2ccc(-c3cccs3)nn2)CC1 ZINC000021538830 210385681 /nfs/dbraw/zinc/38/56/81/210385681.db2.gz YXCLDSCUXQZTLX-KRWDZBQOSA-N 0 3 399.564 3.022 10 0 GGAEHN Cc1ccc([C@H](CC(=O)NCCN2CCCC2)N2Cc3ccccc3C2=O)cc1 ZINC000021530746 210383730 /nfs/dbraw/zinc/38/37/30/210383730.db2.gz JNFLQVWSFVQNDR-QFIPXVFZSA-N 0 3 391.515 3.294 10 0 GGAEHN Cc1ccc2c(c1)c(N1CCCC1=O)c(C(=O)NCCN1CCCC[C@H]1C)n2C ZINC000021529967 210383239 /nfs/dbraw/zinc/38/32/39/210383239.db2.gz DJZZYQJDZWGYHA-QGZVFWFLSA-N 0 3 396.535 3.218 10 0 GGAEHN Cc1cc(C)n(C[C@H](C)N2CCC(n3nccc3NC(=O)CC(C)C)CC2)n1 ZINC000020868931 210365690 /nfs/dbraw/zinc/36/56/90/210365690.db2.gz LLERWYJSWCRSLN-SFHVURJKSA-N 0 3 386.544 3.407 10 0 GGAEHN COc1cc(CNCCO)cc(Br)c1OCc1ccc(C)cc1 ZINC000020873809 210365697 /nfs/dbraw/zinc/36/56/97/210365697.db2.gz JBDNRPAEXPRKPF-UHFFFAOYSA-N 0 3 380.282 3.427 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)c1cnn(-c2ccc(C)cc2)c1-n1cccc1 ZINC000020933672 210371169 /nfs/dbraw/zinc/37/11/69/210371169.db2.gz QYQXEQJCNFCOBI-LJQANCHMSA-N 0 3 377.492 3.186 10 0 GGAEHN COc1cc2c(cc1CN[C@H]1CCCN(C3Cc4ccccc4C3)C1)OCO2 ZINC000020534966 210346577 /nfs/dbraw/zinc/34/65/77/210346577.db2.gz WRMGWHUTUDFWJW-IBGZPJMESA-N 0 3 380.488 3.145 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)CCCn1c2ccccc2n2cccc2c1=O ZINC000020489807 210340850 /nfs/dbraw/zinc/34/08/50/210340850.db2.gz GRRHXIZOBKOAMY-SFHVURJKSA-N 0 3 394.519 3.025 10 0 GGAEHN O=C(c1ccc(N2CCN[C@H](c3ccccc3)C2)nc1)N1CCc2ccccc2C1 ZINC000039229354 136153749 /nfs/dbraw/zinc/15/37/49/136153749.db2.gz YDCAWDIGDBMNBJ-QHCPKHFHSA-N 0 3 398.510 3.431 10 0 GGAEHN O=C(c1cccc2[nH]cc(CN3CCCC3)c21)N1CCN(c2ccccn2)CC1 ZINC000065135808 136159536 /nfs/dbraw/zinc/15/95/36/136159536.db2.gz XJSQAKNANZZUIF-UHFFFAOYSA-N 0 3 389.503 3.121 10 0 GGAEHN Cc1cccc(CNC(=O)c2ccc(N3CCN[C@H](c4ccccc4)C3)nc2)c1 ZINC000065256114 136162068 /nfs/dbraw/zinc/16/20/68/136162068.db2.gz AVBKRLQJMQMOEN-QFIPXVFZSA-N 0 3 386.499 3.471 10 0 GGAEHN COc1cc2c(cc1OC)CN([C@@H]1CCCN(c3ncnc4[nH]ccc43)C1)CC2 ZINC000072149037 136167106 /nfs/dbraw/zinc/16/71/06/136167106.db2.gz VIPJENVMOJBLCL-QGZVFWFLSA-N 0 3 393.491 3.002 10 0 GGAEHN CCN1CCN(c2cc(CN[C@@H](C)c3ccccc3-n3cccn3)ccn2)CC1 ZINC000095407529 136179036 /nfs/dbraw/zinc/17/90/36/136179036.db2.gz JPYOEWODUICNCI-IBGZPJMESA-N 0 3 390.535 3.260 10 0 GGAEHN COc1cccc(N2C[C@H](C(=O)Nc3cnccc3N3CCCCC3)CC2=O)c1 ZINC000095958977 136182740 /nfs/dbraw/zinc/18/27/40/136182740.db2.gz DAJFEMWBQPIAGY-MRXNPFEDSA-N 0 3 394.475 3.072 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)c1cnn(-c2ccc(Br)cc2)c1 ZINC000072012916 222204656 /nfs/dbraw/zinc/20/46/56/222204656.db2.gz BLZFMTFIPPOHBX-INIZCTEOSA-N 0 3 393.329 3.341 10 0 GGAEHN CC(C)C[C@H](CN(C)C)NC(=O)c1cnn(-c2ccc(Br)cc2)c1 ZINC000072012917 222204841 /nfs/dbraw/zinc/20/48/41/222204841.db2.gz BLZFMTFIPPOHBX-MRXNPFEDSA-N 0 3 393.329 3.341 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1 ZINC000252467476 524107015 /nfs/dbraw/zinc/10/70/15/524107015.db2.gz NIXFYENLBYHNMA-IAGOWNOFSA-N 0 3 378.948 3.340 10 0 GGAEHN COc1ccc([C@H](O)CN2CCC(N3Cc4ccccc4NC3=O)CC2)cc1 ZINC000033876514 525375793 /nfs/dbraw/zinc/37/57/93/525375793.db2.gz OVPWQOQFTIDOQX-OAQYLSRUSA-N 0 3 381.476 3.241 10 0 GGAEHN CCN1CCCC[C@H]1CNC(=O)c1c(F)cccc1I ZINC000120030033 564300831 /nfs/dbraw/zinc/30/08/31/564300831.db2.gz QJCUXHIJTBAJGY-NSHDSACASA-N 0 3 390.240 3.035 10 0 GGAEHN CN(C)C[C@H](NC(=O)c1ccc(I)cc1)c1ccccc1 ZINC000042301980 564444859 /nfs/dbraw/zinc/44/48/59/564444859.db2.gz GKMJCMAIAMFMOI-INIZCTEOSA-N 0 3 394.256 3.324 10 0 GGAEHN Cc1cccc(C(=O)NCCN2CCCC[C@H]2C)c1I ZINC000047144295 564514674 /nfs/dbraw/zinc/51/46/74/564514674.db2.gz ZBMFOEMARPCMHB-CYBMUJFWSA-N 0 3 386.277 3.204 10 0 GGAEHN CC(C)N(CCN(C)C)C(=O)c1ncc(Br)cc1Br ZINC000185234585 565187854 /nfs/dbraw/zinc/18/78/54/565187854.db2.gz CYLBWRSSWILXSA-UHFFFAOYSA-N 0 3 393.123 3.019 10 0 GGAEHN C[C@H](Cc1cnccn1)NCc1ccc(I)cc1Cl ZINC000501378546 567383640 /nfs/dbraw/zinc/38/36/40/567383640.db2.gz RBJWKMJJKJONKO-SNVBAGLBSA-N 0 3 387.652 3.455 10 0 GGAEHN CC(C)CN1CCC[C@@H](O)[C@H](NC(=O)c2ccc(OCc3ccccc3)cc2)C1 ZINC000015671886 560230371 /nfs/dbraw/zinc/23/03/71/560230371.db2.gz BAQWUTIFVPDILP-DHIUTWEWSA-N 0 3 396.531 3.477 10 0 biogenic GGAEHN C[C@]1(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1(Cl)Cl ZINC000115158288 564186825 /nfs/dbraw/zinc/18/68/25/564186825.db2.gz XVEWZKYVCMZUGY-FUHWJXTLSA-N 0 3 385.335 3.132 10 0 GGAEHN Cc1ccc(C(=O)N(C)C[C@@H]2CCCN(C)C2)cc1I ZINC000115432349 564192914 /nfs/dbraw/zinc/19/29/14/564192914.db2.gz CFSLYTVWLKYXJY-CYBMUJFWSA-N 0 3 386.277 3.013 10 0 GGAEHN CCOCCCN1CC[C@@H](NS(=O)(=O)c2cccc(Cl)c2C)[C@H](C)C1 ZINC000115591900 564196269 /nfs/dbraw/zinc/19/62/69/564196269.db2.gz CXWDQKSIHFSDQX-RHSMWYFYSA-N 0 3 388.961 3.064 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N(C)C[C@H]1CCCN(C)C1 ZINC000115803386 564199733 /nfs/dbraw/zinc/19/97/33/564199733.db2.gz NBGWOLLJMXYGEZ-ZBFHGGJFSA-N 0 3 382.346 3.363 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)c2cc(Br)sc2Br)C1 ZINC000116749127 564216143 /nfs/dbraw/zinc/21/61/43/564216143.db2.gz WBRWYKSPTBOLQR-SSDOTTSWSA-N 0 3 382.121 3.049 10 0 GGAEHN CN(C)C[C@H]1CN(C(=O)CSCc2ccc(Cl)cc2Cl)CCO1 ZINC000116796747 564217062 /nfs/dbraw/zinc/21/70/62/564217062.db2.gz TWKKLOWLUUJVRG-AWEZNQCLSA-N 0 3 377.337 3.016 10 0 GGAEHN CCCn1cc(CNCCC(=O)Nc2cc(Br)ccc2C)cn1 ZINC000116917729 564219730 /nfs/dbraw/zinc/21/97/30/564219730.db2.gz IDULNDVKUDBCSW-UHFFFAOYSA-N 0 3 379.302 3.482 10 0 GGAEHN CCCn1cc(CNCCC(=O)Nc2ccc(Br)cc2C)cn1 ZINC000116915880 564220203 /nfs/dbraw/zinc/22/02/03/564220203.db2.gz AIKXNFBFPWJGDG-UHFFFAOYSA-N 0 3 379.302 3.482 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c1 ZINC000119253696 564262187 /nfs/dbraw/zinc/26/21/87/564262187.db2.gz FJARZDFSIGWKCV-CZUORRHYSA-N 0 3 398.288 3.156 10 0 GGAEHN C[C@H](CC(=O)c1cccc(Br)c1)C(=O)N1CCC(N(C)C)CC1 ZINC000119698746 564283897 /nfs/dbraw/zinc/28/38/97/564283897.db2.gz UFTHNRFHSRBMEG-CYBMUJFWSA-N 0 3 381.314 3.211 10 0 GGAEHN Cc1nc(-c2ccc(S(=O)(=O)N3CCC(N4CCCC4)CC3)s2)cs1 ZINC000119732868 564285744 /nfs/dbraw/zinc/28/57/44/564285744.db2.gz LDLGNULMHIJTQA-UHFFFAOYSA-N 0 3 397.591 3.429 10 0 GGAEHN CN(C(=O)CSCC(F)(F)F)c1ccc(OCCN2CCCC2)cc1 ZINC000120173418 564308099 /nfs/dbraw/zinc/30/80/99/564308099.db2.gz ZQOWSAMPOSGYCW-UHFFFAOYSA-N 0 3 376.444 3.420 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)C[C@H](C)c1ccc(Br)cc1 ZINC000120613526 564328891 /nfs/dbraw/zinc/32/88/91/564328891.db2.gz ITHZISLLQZBICB-WMLDXEAASA-N 0 3 383.330 3.170 10 0 GGAEHN CC[C@H]1CN(CC2=Cc3cc(Br)ccc3OC2)CCN1C[C@@H](C)O ZINC000120743693 564334991 /nfs/dbraw/zinc/33/49/91/564334991.db2.gz FIONXEZLYHWOOH-KDOFPFPSSA-N 0 3 395.341 3.002 10 0 GGAEHN C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)CSCc1cc(-c2cccs2)on1 ZINC000120952576 564345253 /nfs/dbraw/zinc/34/52/53/564345253.db2.gz YWSOKRPIQPMVBB-ZFWWWQNUSA-N 0 3 379.551 3.435 10 0 GGAEHN Cc1cc(S(=O)(=O)NC2CCN(CCc3ccccc3)CC2)c(C)s1 ZINC000030380789 564379939 /nfs/dbraw/zinc/37/99/39/564379939.db2.gz ALWVSXXLSYAMSB-UHFFFAOYSA-N 0 3 378.563 3.350 10 0 GGAEHN CC(C)C[C@H](CNC(=O)c1c(F)cccc1I)N(C)C ZINC000121666454 564380752 /nfs/dbraw/zinc/38/07/52/564380752.db2.gz BVVHVOQJALTPQO-LLVKDONJSA-N 0 3 392.256 3.136 10 0 GGAEHN C[C@H](NC[C@@H](O)COc1ccc(Br)cc1)c1ccc2c(c1)OCO2 ZINC000030536005 564382624 /nfs/dbraw/zinc/38/26/24/564382624.db2.gz VAPVULBAABRVHJ-SWLSCSKDSA-N 0 3 394.265 3.268 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)c1cccc(I)c1C ZINC000121800803 564387783 /nfs/dbraw/zinc/38/77/83/564387783.db2.gz BVSZJCIJTLEFKQ-CYBMUJFWSA-N 0 3 386.277 3.156 10 0 GGAEHN C[C@@H](O)CN1CCN(CCSc2ccnc3cc(Cl)ccc32)C[C@@H]1C ZINC000121998923 564396376 /nfs/dbraw/zinc/39/63/76/564396376.db2.gz FLDYVWYDMKUIDA-LSDHHAIUSA-N 0 3 379.957 3.367 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)c2cc(COc3ccc(Cl)cc3Cl)on2)C1 ZINC000122306134 564409108 /nfs/dbraw/zinc/40/91/08/564409108.db2.gz LAAIVSIHAMCNLJ-LBPRGKRZSA-N 0 3 384.263 3.337 10 0 GGAEHN COCCCOC1CCN(C[C@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000122432996 564414143 /nfs/dbraw/zinc/41/41/43/564414143.db2.gz RZHPOEMUEWBBSL-AWEZNQCLSA-N 0 3 392.323 3.251 10 0 GGAEHN C[C@@H](NCc1cc(Br)cs1)c1ccc(S(N)(=O)=O)cc1 ZINC000036954961 564419669 /nfs/dbraw/zinc/41/96/69/564419669.db2.gz LAQJIGISRDECDS-SECBINFHSA-N 0 3 375.313 3.009 10 0 GGAEHN O[C@H](COCCOc1ccc(Cl)cc1)CN1CCC[C@H](C(F)(F)F)C1 ZINC000037200144 564420546 /nfs/dbraw/zinc/42/05/46/564420546.db2.gz UEVFWOBSABNDMR-ZFWWWQNUSA-N 0 3 381.822 3.371 10 0 GGAEHN Cc1ccc(O[C@H](C)C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c(Br)c1 ZINC000122747259 564426103 /nfs/dbraw/zinc/42/61/03/564426103.db2.gz KRJPFIPKBWKIBN-KFWWJZLASA-N 0 3 383.330 3.466 10 0 GGAEHN COc1ccc(CCC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1Br ZINC000122792694 564427879 /nfs/dbraw/zinc/42/78/79/564427879.db2.gz DBOXILBSCXYPAQ-HIFRSBDPSA-N 0 3 383.330 3.331 10 0 GGAEHN COc1c(Br)cc(Br)cc1CN[C@H]1CCCN(C)C1 ZINC000040672893 564427980 /nfs/dbraw/zinc/42/79/80/564427980.db2.gz NFQYRXCUPJEGDI-LBPRGKRZSA-N 0 3 392.135 3.404 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)COc2ccc(Br)cc2Cl)CCN1C ZINC000122835658 564428649 /nfs/dbraw/zinc/42/86/49/564428649.db2.gz PGINIWWQLYZYBW-YPMHNXCESA-N 0 3 389.721 3.422 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)COc2ccc(Br)cc2Cl)CCN1C ZINC000122835445 564428821 /nfs/dbraw/zinc/42/88/21/564428821.db2.gz PGINIWWQLYZYBW-WCQYABFASA-N 0 3 389.721 3.422 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)c2cnn(-c3cccc(Br)c3)c2)CCN1C ZINC000122973186 564434455 /nfs/dbraw/zinc/43/44/55/564434455.db2.gz SHXSRTMPHAQZGU-BBRMVZONSA-N 0 3 391.313 3.190 10 0 GGAEHN C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000123142198 564439444 /nfs/dbraw/zinc/43/94/44/564439444.db2.gz VXPKBQHUMKTQLA-HIFRSBDPSA-N 0 3 396.304 3.175 10 0 GGAEHN COc1c(Br)cc(Br)cc1CN[C@@H](C)[C@@H](C)CO ZINC000123221986 564442068 /nfs/dbraw/zinc/44/20/68/564442068.db2.gz NVKAHMBBUDBCAR-IUCAKERBSA-N 0 3 381.108 3.327 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)Cc2nc(-c3cccc(Br)c3)no2)CCN1C ZINC000123224906 564442784 /nfs/dbraw/zinc/44/27/84/564442784.db2.gz VWRPDPOCSYGJAQ-DOMZBBRYSA-N 0 3 379.302 3.414 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1OC ZINC000123378122 564446804 /nfs/dbraw/zinc/44/68/04/564446804.db2.gz MBDMBVRVLOKSRX-OCCSQVGLSA-N 0 3 399.329 3.411 10 0 GGAEHN COc1cc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc(OC)c1Br ZINC000123603333 564454643 /nfs/dbraw/zinc/45/46/43/564454643.db2.gz JZZWPAACFYCSMW-YPMHNXCESA-N 0 3 385.302 3.021 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)c2ccc(-n3cc(Br)cn3)cc2)CCN1C ZINC000123847555 564463094 /nfs/dbraw/zinc/46/30/94/564463094.db2.gz FHBVTSMQCDDYRE-SUMWQHHRSA-N 0 3 391.313 3.190 10 0 GGAEHN C[C@@H](C(=O)N(CCN(C)C)Cc1ccc(Br)cc1)C1CCOCC1 ZINC000123982698 564468303 /nfs/dbraw/zinc/46/83/03/564468303.db2.gz ANSKRXVADXVZPT-OAHLLOKOSA-N 0 3 397.357 3.402 10 0 GGAEHN Cc1sc2ncnc(SCC(=O)N(C)[C@@H]3CCN(C)[C@H](C)C3)c2c1C ZINC000124224708 564474944 /nfs/dbraw/zinc/47/49/44/564474944.db2.gz SQYSOTWYDDVWBA-BXUZGUMPSA-N 0 3 378.567 3.341 10 0 GGAEHN Cc1ccc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1I ZINC000124613591 564487407 /nfs/dbraw/zinc/48/74/07/564487407.db2.gz ZMFKRQOEMUWCFC-TZMCWYRMSA-N 0 3 386.277 3.154 10 0 GGAEHN CC(C(=O)N1C[C@H](C)C[C@H](C)C1)S(=O)(=O)Cc1csc(C(C)(C)C)n1 ZINC000046184856 564498005 /nfs/dbraw/zinc/49/80/05/564498005.db2.gz XSIKPRNTJNPQNT-HZSPNIEDSA-N 0 3 386.583 3.248 10 0 GGAEHN CCOc1c(Br)cc(C(=O)NCCN2CCCC[C@@H]2C)cc1OC ZINC000046858548 564508826 /nfs/dbraw/zinc/50/88/26/564508826.db2.gz YLLJBQXLWPELMA-ZDUSSCGKSA-N 0 3 399.329 3.461 10 0 GGAEHN CN(C)C[C@@H](NC(=O)[C@@H]1COc2ccc(Br)cc21)c1ccccc1 ZINC000125388006 564513183 /nfs/dbraw/zinc/51/31/83/564513183.db2.gz CICYRVGQZUGFIE-IAGOWNOFSA-N 0 3 389.293 3.344 10 0 GGAEHN Cc1sc2ncnc(SCC(=O)NCCN3CCCC[C@@H]3C)c2c1C ZINC000047142642 564513897 /nfs/dbraw/zinc/51/38/97/564513897.db2.gz AKIJSGTUCSSHNT-LBPRGKRZSA-N 0 3 378.567 3.391 10 0 GGAEHN CN(C)CCOc1ccc(CNC(=O)c2ccc(Br)cc2)cc1 ZINC000048354422 564537122 /nfs/dbraw/zinc/53/71/22/564537122.db2.gz GXOPLSGNKLRPRB-UHFFFAOYSA-N 0 3 377.282 3.320 10 0 GGAEHN CN(C)Cc1cccc(NC(=O)C(=O)NCc2ccc(Cl)cc2Cl)c1 ZINC000048653077 564543756 /nfs/dbraw/zinc/54/37/56/564543756.db2.gz DPMBPTAKNGMSDC-UHFFFAOYSA-N 0 3 380.275 3.310 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)Nc2ccc(I)cc2C)C1 ZINC000048769343 564545387 /nfs/dbraw/zinc/54/53/87/564545387.db2.gz AMWMDFVKDWKEAN-CYBMUJFWSA-N 0 3 387.265 3.205 10 0 GGAEHN CN1CCC[C@@H](NC(=O)Nc2ccc(Br)cc2Br)C1 ZINC000048769864 564545427 /nfs/dbraw/zinc/54/54/27/564545427.db2.gz BUWMUXCJOXNAFP-SNVBAGLBSA-N 0 3 391.107 3.427 10 0 GGAEHN C[NH+](C)CCOc1ccccc1C(=O)Nc1cc(Br)ccc1[O-] ZINC000126612354 564554990 /nfs/dbraw/zinc/55/49/90/564554990.db2.gz OJQJJAOJGOJFFY-UHFFFAOYSA-N 0 3 379.254 3.347 10 0 GGAEHN Cc1nc(C)n(C[C@@H]2CCCN(CCOc3ccccc3Br)C2)n1 ZINC000126677896 564558272 /nfs/dbraw/zinc/55/82/72/564558272.db2.gz NEBHCZLQTJLZIF-MRXNPFEDSA-N 0 3 393.329 3.448 10 0 GGAEHN O=C(C(=O)N1CC[C@H]2[C@H](CCCN2C2CC2)C1)c1ccc(Br)cc1 ZINC000126753787 564560932 /nfs/dbraw/zinc/56/09/32/564560932.db2.gz BKHXIKPEGXIPBY-PBHICJAKSA-N 0 3 391.309 3.107 10 0 GGAEHN CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)NC[C@@H]1CCCN1C ZINC000126798519 564562691 /nfs/dbraw/zinc/56/26/91/564562691.db2.gz NCLDJDPTWJZFHL-LBPRGKRZSA-N 0 3 387.311 3.058 10 0 GGAEHN C[C@H](CNC(=O)CSCc1ccc(Br)cc1F)N1CCCC1 ZINC000051342892 564563902 /nfs/dbraw/zinc/56/39/02/564563902.db2.gz BQGVRAKFEDSMMJ-GFCCVEGCSA-N 0 3 389.334 3.422 10 0 GGAEHN O=C(CSCc1ccc(Br)cc1F)NCCN1CCCC1 ZINC000051468369 564564966 /nfs/dbraw/zinc/56/49/66/564564966.db2.gz UPBIBXBPNZIFRF-UHFFFAOYSA-N 0 3 375.307 3.033 10 0 GGAEHN Cc1cscc1NC(=O)C(=O)NC[C@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000126861790 564566032 /nfs/dbraw/zinc/56/60/32/564566032.db2.gz AIIHMJSZYYQPTA-CJNGLKHVSA-N 0 3 377.535 3.256 10 0 GGAEHN CC[C@@H](Cc1ccccc1Br)C(=O)Nc1cnn(CCN(C)C)c1 ZINC000127453152 564584094 /nfs/dbraw/zinc/58/40/94/564584094.db2.gz INWOMMRMRCKNSR-AWEZNQCLSA-N 0 3 393.329 3.415 10 0 GGAEHN COc1ccc(Br)c(CN[C@H]2CCCN(c3cccnn3)C2)c1 ZINC000127756682 564595549 /nfs/dbraw/zinc/59/55/49/564595549.db2.gz WBKZETPEOUZARA-AWEZNQCLSA-N 0 3 377.286 3.006 10 0 GGAEHN CCc1csc([C@@H]2CCCN(Cc3cnc(N4CCOCC4)s3)C2)n1 ZINC000127897694 564599887 /nfs/dbraw/zinc/59/98/87/564599887.db2.gz CUCIMXSFVMOBBE-CQSZACIVSA-N 0 3 378.567 3.378 10 0 GGAEHN CCc1csc([C@H]2CCCN(Cc3cnc(N4CCOCC4)s3)C2)n1 ZINC000127897907 564600169 /nfs/dbraw/zinc/60/01/69/564600169.db2.gz CUCIMXSFVMOBBE-AWEZNQCLSA-N 0 3 378.567 3.378 10 0 GGAEHN O=S(=O)([N-]CC[NH2+]C1CC(c2ccccc2F)C1)c1ccc(Cl)s1 ZINC000127928037 564600998 /nfs/dbraw/zinc/60/09/98/564600998.db2.gz JFNULMPTDSQZCH-UHFFFAOYSA-N 0 3 388.917 3.355 10 0 GGAEHN O=C(CNC1(c2ccc(Br)cc2)CCOCC1)NC1CCCC1 ZINC000054394241 564604693 /nfs/dbraw/zinc/60/46/93/564604693.db2.gz ZHOOICOMPFRBOD-UHFFFAOYSA-N 0 3 381.314 3.103 10 0 GGAEHN CC(C(=O)NC1CCC(C)CC1)S(=O)(=O)Cc1nc(C(C)(C)C)cs1 ZINC000128026910 564604809 /nfs/dbraw/zinc/60/48/09/564604809.db2.gz YLNSDPJUKAFXBY-MOKVOYLWSA-N 0 3 386.583 3.439 10 0 GGAEHN CC(C(=O)N1C[C@H](C)C[C@H](C)C1)S(=O)(=O)Cc1nc(C(C)(C)C)cs1 ZINC000128039430 564604968 /nfs/dbraw/zinc/60/49/68/564604968.db2.gz YXNPWONZJUQMHD-HZSPNIEDSA-N 0 3 386.583 3.248 10 0 GGAEHN CCN1CCC[C@H](NC(=O)N[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000054814943 564609844 /nfs/dbraw/zinc/60/98/44/564609844.db2.gz HKNPPRQEXQHMAO-DZGCQCFKSA-N 0 3 382.302 3.056 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000054817064 564610255 /nfs/dbraw/zinc/61/02/55/564610255.db2.gz IATCLQRMOITSCY-XJKSGUPXSA-N 0 3 396.329 3.446 10 0 GGAEHN O=C(CN1CCCSCC1)NC[C@@H](c1ccccc1Cl)N1CCCC1 ZINC000129274382 564643870 /nfs/dbraw/zinc/64/38/70/564643870.db2.gz HEICOELSRBPLIS-SFHVURJKSA-N 0 3 381.973 3.032 10 0 GGAEHN O[C@@H](COc1ccc(Cl)cc1Br)CN1CCCSCC1 ZINC000129366763 564646803 /nfs/dbraw/zinc/64/68/03/564646803.db2.gz YUHGPOYKWMJCGE-GFCCVEGCSA-N 0 3 380.735 3.281 10 0 GGAEHN CN(C)CCn1ccc(NC(=O)C(C)(C)c2cccc(Br)c2)n1 ZINC000522585214 564652899 /nfs/dbraw/zinc/65/28/99/564652899.db2.gz JDABYZZXKZMJPV-UHFFFAOYSA-N 0 3 379.302 3.124 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)N(C)Cc1ccc(Br)o1 ZINC000057203977 564663640 /nfs/dbraw/zinc/66/36/40/564663640.db2.gz AZPMCLVJHHFBIW-HNNXBMFYSA-N 0 3 394.313 3.356 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)NCc1csc(Br)c1 ZINC000057202485 564663723 /nfs/dbraw/zinc/66/37/23/564663723.db2.gz KBIJLTYNRXZOQN-HNNXBMFYSA-N 0 3 396.354 3.483 10 0 GGAEHN COC(=O)c1ccc(C(=O)NC[C@H]2CCCN(C)[C@H]2c2cccs2)s1 ZINC000130029270 564667959 /nfs/dbraw/zinc/66/79/59/564667959.db2.gz HRIWTCGPEOKXTE-MLGOLLRUSA-N 0 3 378.519 3.409 10 0 GGAEHN Brc1cc(CNC[C@@H]2COc3ccccc3O2)cc2c1OCO2 ZINC000057681580 564671664 /nfs/dbraw/zinc/67/16/64/564671664.db2.gz PRXIQFHTECXRTF-GFCCVEGCSA-N 0 3 378.222 3.107 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)Nc2nnc(-c3cccc(Br)c3)s2)C1 ZINC000130424515 564681066 /nfs/dbraw/zinc/68/10/66/564681066.db2.gz MQOOWUUTFJGPCD-GFCCVEGCSA-N 0 3 396.314 3.135 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)c2cc(COc3c(Cl)cccc3Cl)on2)C1 ZINC000130454216 564681815 /nfs/dbraw/zinc/68/18/15/564681815.db2.gz RGYMRIQZYVEETG-NSHDSACASA-N 0 3 384.263 3.337 10 0 GGAEHN O[C@H](Cn1nnc2cc(Cl)c(Cl)cc21)CN1CCc2ccccc2C1 ZINC000130601379 564686851 /nfs/dbraw/zinc/68/68/51/564686851.db2.gz TYBHLWGDRVCKCJ-AWEZNQCLSA-N 0 3 377.275 3.157 10 0 GGAEHN CCC[C@@H](C(=O)NCC1(c2ccc(Br)cc2)CCOCC1)N(C)C ZINC000130685019 564688663 /nfs/dbraw/zinc/68/86/63/564688663.db2.gz QJMWBRWYKFJXPF-KRWDZBQOSA-N 0 3 397.357 3.344 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)Cc1c[nH]c2cccc(Br)c12 ZINC000130771063 564691489 /nfs/dbraw/zinc/69/14/89/564691489.db2.gz KKZOBJXKMTXDPE-CYBMUJFWSA-N 0 3 378.314 3.464 10 0 GGAEHN CN(C)CCOc1ccccc1C(=O)NCc1sccc1Br ZINC000060455007 564699380 /nfs/dbraw/zinc/69/93/80/564699380.db2.gz OASCVWDDSQYLPK-UHFFFAOYSA-N 0 3 383.311 3.381 10 0 GGAEHN O=C(CN1CCCN(C2CC2)CC1)Nc1cc(C(F)(F)F)ccc1Cl ZINC000061040943 564704241 /nfs/dbraw/zinc/70/42/41/564704241.db2.gz BBGCFAMOOYWYGN-UHFFFAOYSA-N 0 3 375.822 3.467 10 0 GGAEHN Cc1ccc(CN(Cc2ccco2)C[C@H]2CCCN(S(C)(=O)=O)C2)s1 ZINC000131191752 564704649 /nfs/dbraw/zinc/70/46/49/564704649.db2.gz PSRCHIWBRYQAFM-MRXNPFEDSA-N 0 3 382.551 3.323 10 0 GGAEHN CCN1CCN(Cc2ccc(NC(=O)c3coc(Br)c3)cc2)CC1 ZINC000061570470 564707185 /nfs/dbraw/zinc/70/71/85/564707185.db2.gz QXAZUKGWZHEOIR-UHFFFAOYSA-N 0 3 392.297 3.432 10 0 GGAEHN OC[C@@]1(NC[C@@H](O)COc2c(Cl)cccc2Cl)CCc2ccccc21 ZINC000132316631 564739560 /nfs/dbraw/zinc/73/95/60/564739560.db2.gz YGCDLOKNQIPRLO-KUHUBIRLSA-N 0 3 382.287 3.157 10 0 GGAEHN O[C@H](COC[C@@H]1CCCO1)CN1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000132859033 564754750 /nfs/dbraw/zinc/75/47/50/564754750.db2.gz CFGGATKKCTZRGK-BPUTZDHNSA-N 0 3 390.307 3.003 10 0 GGAEHN O=C(N[C@@H]1CCOc2ccc(Br)cc21)N1CC[C@H](N2CCCC2)C1 ZINC000066188032 564756922 /nfs/dbraw/zinc/75/69/22/564756922.db2.gz DNIFRZGNBXBTQF-GOEBONIOSA-N 0 3 394.313 3.152 10 0 GGAEHN CN(C)CCn1ccc(NC(=O)Nc2cc(F)cc(Br)c2F)n1 ZINC000490473860 564773371 /nfs/dbraw/zinc/77/33/71/564773371.db2.gz XUXSYWHMFAECQM-UHFFFAOYSA-N 0 3 388.216 3.129 10 0 GGAEHN CC(C(=O)N[C@H](C)c1ccccc1)S(=O)(=O)Cc1csc(C2CC2)n1 ZINC000134654374 564810848 /nfs/dbraw/zinc/81/08/48/564810848.db2.gz UNWZXTFWBNTXNN-OLZOCXBDSA-N 0 3 378.519 3.201 10 0 GGAEHN CC(C(=O)N[C@@H](C)c1ccccc1)S(=O)(=O)Cc1csc(C2CC2)n1 ZINC000134654351 564810918 /nfs/dbraw/zinc/81/09/18/564810918.db2.gz UNWZXTFWBNTXNN-STQMWFEESA-N 0 3 378.519 3.201 10 0 GGAEHN C[N@H+](CC[N-]S(=O)(=O)c1sccc1Br)C1CCCCC1 ZINC000068346270 564815551 /nfs/dbraw/zinc/81/55/51/564815551.db2.gz ZJXDNYAPIBHLNG-UHFFFAOYSA-N 0 3 381.361 3.053 10 0 GGAEHN C[N@@H+](CC[N-]S(=O)(=O)c1sccc1Br)C1CCCCC1 ZINC000068346270 564815555 /nfs/dbraw/zinc/81/55/55/564815555.db2.gz ZJXDNYAPIBHLNG-UHFFFAOYSA-N 0 3 381.361 3.053 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)c2[nH]nc(-c3ccccc3)c2Br)C1 ZINC000068461860 564819726 /nfs/dbraw/zinc/81/97/26/564819726.db2.gz GZPHCGMKGLMICM-CYBMUJFWSA-N 0 3 377.286 3.053 10 0 GGAEHN Cc1ncc(CS(=O)(=O)C(C)C(=O)N(Cc2ccccc2)C(C)C)s1 ZINC000069217557 564836172 /nfs/dbraw/zinc/83/61/72/564836172.db2.gz BWHVGQPCZWGMEQ-AWEZNQCLSA-N 0 3 380.535 3.192 10 0 GGAEHN CCN(CC)C(=O)C1CCN(CCOc2cccc(Br)c2)CC1 ZINC000069681675 564842559 /nfs/dbraw/zinc/84/25/59/564842559.db2.gz IZKDJHMTEGQNQA-UHFFFAOYSA-N 0 3 383.330 3.408 10 0 GGAEHN COCCN(CC(F)F)C(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1 ZINC000074538321 564863284 /nfs/dbraw/zinc/86/32/84/564863284.db2.gz SBXIBEAAVVVPSR-XJKSGUPXSA-N 0 3 375.485 3.054 10 0 GGAEHN CCC[C@@H](C(=O)N1CCN(C(=O)c2c(Cl)cccc2Cl)CC1)N(C)C ZINC000137697975 564864032 /nfs/dbraw/zinc/86/40/32/564864032.db2.gz CGPSWVRZTCKOOA-HNNXBMFYSA-N 0 3 386.323 3.008 10 0 GGAEHN C[C@H](c1ccccc1Br)N1CCC[C@H](C(=O)N2CCOCC2)C1 ZINC000139704746 564870238 /nfs/dbraw/zinc/87/02/38/564870238.db2.gz NDADAJDBVKQMPW-CABCVRRESA-N 0 3 381.314 3.081 10 0 GGAEHN COc1c(Br)cc(Br)cc1CNC[C@@H]1CCC[C@H]1O ZINC000091316090 564870455 /nfs/dbraw/zinc/87/04/55/564870455.db2.gz HODWTLUAIQAROF-TVQRCGJNSA-N 0 3 393.119 3.471 10 0 GGAEHN C[C@H]1CCCN(CCNC(=O)CSCc2cc(-c3cccs3)on2)C1 ZINC000140279287 564871307 /nfs/dbraw/zinc/87/13/07/564871307.db2.gz GLNNJXNZQVOYDR-AWEZNQCLSA-N 0 3 379.551 3.484 10 0 GGAEHN COC[C@](C)(CCO)NCc1ccc(Br)c(Br)c1 ZINC000150872813 564894745 /nfs/dbraw/zinc/89/47/45/564894745.db2.gz GDBKMWNGYDFXHG-ZDUSSCGKSA-N 0 3 381.108 3.089 10 0 GGAEHN CN(C)[C@H](CNc1cc(Br)cc(F)c1C(N)=O)Cc1ccccc1 ZINC000094131835 564897455 /nfs/dbraw/zinc/89/74/55/564897455.db2.gz HKXODJNSZDAYHH-AWEZNQCLSA-N 0 3 394.288 3.272 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)CCCOc1ccc(Cl)cc1Cl ZINC000097529363 564908547 /nfs/dbraw/zinc/90/85/47/564908547.db2.gz ABIQBMHPHRBXMQ-OAHLLOKOSA-N 0 3 389.323 3.379 10 0 GGAEHN COc1c(Br)cc(CN[C@H]2CCCOC2)cc1Br ZINC000103956766 564952119 /nfs/dbraw/zinc/95/21/19/564952119.db2.gz QAEYUNHYPYKLAU-JTQLQIEISA-N 0 3 379.092 3.489 10 0 GGAEHN CCN1CCN(CCC(=O)N[C@H](C)c2c(Cl)ccc(F)c2Cl)CC1 ZINC000101649235 564919654 /nfs/dbraw/zinc/91/96/54/564919654.db2.gz RAFCJUVZEBXYMG-GFCCVEGCSA-N 0 3 376.303 3.337 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)Cc2cc(Cl)cc(Cl)c2)[C@H](C)C1 ZINC000151515406 564924431 /nfs/dbraw/zinc/92/44/31/564924431.db2.gz ZCRJDZAVPAJDJI-MLGOLLRUSA-N 0 3 379.353 3.485 10 0 GGAEHN Cc1[nH]c(=S)sc1CC(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000102648111 564931750 /nfs/dbraw/zinc/93/17/50/564931750.db2.gz WFXDKTZWLKQPNJ-CHWSQXEVSA-N 0 3 383.583 3.004 10 0 GGAEHN O=S(=O)(c1ccc(F)cc1C(F)(F)F)N1CCC(N2CCCC2)CC1 ZINC000103155519 564944018 /nfs/dbraw/zinc/94/40/18/564944018.db2.gz HERDHGSGNZEIBC-UHFFFAOYSA-N 0 3 380.407 3.093 10 0 GGAEHN O=C(Nc1ccc(Br)cn1)C1CCN(CCc2ccccn2)CC1 ZINC000103469116 564948553 /nfs/dbraw/zinc/94/85/53/564948553.db2.gz SPVCZFGQKWFWBE-UHFFFAOYSA-N 0 3 389.297 3.132 10 0 GGAEHN Cn1nccc1C1CCN(CCC(=O)Nc2ccccc2Br)CC1 ZINC000103473402 564948924 /nfs/dbraw/zinc/94/89/24/564948924.db2.gz SZPGCTCQLQLCBI-UHFFFAOYSA-N 0 3 391.313 3.391 10 0 GGAEHN O=C(CCN1CC[C@@H](Oc2cccnc2)C1)Nc1ccc(Br)cc1 ZINC000152421253 564958986 /nfs/dbraw/zinc/95/89/86/564958986.db2.gz AKPAZYFPWTVAQL-QGZVFWFLSA-N 0 3 390.281 3.326 10 0 GGAEHN C[C@@H](Cc1ccccc1Br)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000152610494 564965148 /nfs/dbraw/zinc/96/51/48/564965148.db2.gz VXXDGFYHJAHONZ-GOEBONIOSA-N 0 3 378.314 3.036 10 0 GGAEHN C[C@H](Cc1ccccc1Br)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000152610400 564965309 /nfs/dbraw/zinc/96/53/09/564965309.db2.gz VXXDGFYHJAHONZ-ZBFHGGJFSA-N 0 3 378.314 3.036 10 0 GGAEHN Cc1nc(CS(=O)(=O)C(C)C(=O)N[C@H](C)c2ccc(Cl)cc2)cs1 ZINC000105523173 564967884 /nfs/dbraw/zinc/96/78/84/564967884.db2.gz DKZCLUIZTGIZNJ-MNOVXSKESA-N 0 3 386.926 3.286 10 0 GGAEHN O=C(NC[C@H](O)CN1CCCCC1)Nc1ccc(Cl)cc1Br ZINC000152864633 564974921 /nfs/dbraw/zinc/97/49/21/564974921.db2.gz GBDNLZRWUNIVKE-LBPRGKRZSA-N 0 3 390.709 3.071 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1ccc(Cl)cc1Br ZINC000152894890 564976495 /nfs/dbraw/zinc/97/64/95/564976495.db2.gz JTAOBUCCKSTKPL-LBPRGKRZSA-N 0 3 390.709 3.335 10 0 GGAEHN COc1ccc(Br)cc1CN(C)[C@H]1CCCN(c2cccnn2)C1 ZINC000106077971 564976816 /nfs/dbraw/zinc/97/68/16/564976816.db2.gz TVUMQSSZCUACPF-INIZCTEOSA-N 0 3 391.313 3.349 10 0 GGAEHN Cc1cnn([C@@H]2CCCN(C[C@H](O)COc3ccc(Br)cc3)C2)c1 ZINC000106222956 564980129 /nfs/dbraw/zinc/98/01/29/564980129.db2.gz OOOIRNZZGSXBLF-SJORKVTESA-N 0 3 394.313 3.031 10 0 GGAEHN O[C@H](COc1ccc(Cl)cc1Cl)CN1CCC(Cn2cccn2)CC1 ZINC000106182426 564980525 /nfs/dbraw/zinc/98/05/25/564980525.db2.gz MEMBZFSKANQKSE-INIZCTEOSA-N 0 3 384.307 3.342 10 0 GGAEHN O=C(CSCc1cc(-c2cccs2)on1)N[C@@H]1CCN(CC2CC2)C1 ZINC000108302683 565010056 /nfs/dbraw/zinc/01/00/56/565010056.db2.gz COTIMVZEDKSYHU-CQSZACIVSA-N 0 3 377.535 3.237 10 0 GGAEHN C[C@H](CNC(=O)N1CC[C@@H](N(C)C)C1)Sc1ccc(Br)cc1 ZINC000109404862 565025348 /nfs/dbraw/zinc/02/53/48/565025348.db2.gz MGFSJEOPFHMOSG-TZMCWYRMSA-N 0 3 386.359 3.275 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1ccc(Br)cc1Cl ZINC000110086619 565036122 /nfs/dbraw/zinc/03/61/22/565036122.db2.gz GATYMIGHWWURGE-LBPRGKRZSA-N 0 3 390.709 3.335 10 0 GGAEHN Clc1ccc2c(c1)[C@@H](NC[C@]1(N3CCOCC3)CCSC1)CCCO2 ZINC000154392288 565037099 /nfs/dbraw/zinc/03/70/99/565037099.db2.gz AYKKUMSQMCPREJ-PKOBYXMFSA-N 0 3 382.957 3.351 10 0 GGAEHN CN(Cc1cc(Br)cs1)C[C@H](O)CN(C)Cc1ccccc1 ZINC000110430408 565041018 /nfs/dbraw/zinc/04/10/18/565041018.db2.gz AIONCVBETCSZMR-MRXNPFEDSA-N 0 3 383.355 3.435 10 0 GGAEHN CN(Cc1cc(Br)cs1)C[C@@H](O)CN(C)Cc1ccccc1 ZINC000110430405 565041056 /nfs/dbraw/zinc/04/10/56/565041056.db2.gz AIONCVBETCSZMR-INIZCTEOSA-N 0 3 383.355 3.435 10 0 GGAEHN CCN1CCC[C@H](NC(=O)c2ccc(Br)cc2Br)C1 ZINC000154491526 565041430 /nfs/dbraw/zinc/04/14/30/565041430.db2.gz WHAKRSGZFHZRBU-NSHDSACASA-N 0 3 390.119 3.426 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N1CC[C@H](N2CCCC2)C1 ZINC000110517561 565041569 /nfs/dbraw/zinc/04/15/69/565041569.db2.gz CSXJIVAAHMKMNV-HNNXBMFYSA-N 0 3 390.325 3.409 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)Nc2cc(Br)ccc2N2CCCC2)C1 ZINC000154610299 565046736 /nfs/dbraw/zinc/04/67/36/565046736.db2.gz CVDMOWXMFDCTKA-AWEZNQCLSA-N 0 3 381.318 3.217 10 0 GGAEHN C[C@@H](CC(=O)Nc1cccc(Br)c1)NCc1cccnc1N(C)C ZINC000154717599 565050312 /nfs/dbraw/zinc/05/03/12/565050312.db2.gz RMOPJTRKRUGYML-ZDUSSCGKSA-N 0 3 391.313 3.417 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)c1cn(-c2ccc(Br)cc2)cn1 ZINC000154744494 565051665 /nfs/dbraw/zinc/05/16/65/565051665.db2.gz WDCFWDOLMKEOSC-INIZCTEOSA-N 0 3 391.313 3.191 10 0 GGAEHN O=C1[C@@H](NC2(c3ccc(Cl)cc3)CCOCC2)CCN1CC(F)(F)F ZINC000111232208 565052203 /nfs/dbraw/zinc/05/22/03/565052203.db2.gz LQPGCZBAXMIJQF-AWEZNQCLSA-N 0 3 376.806 3.099 10 0 GGAEHN COc1ccc(CN(C)[C@@H]2CCCN(c3cccnn3)C2)cc1Br ZINC000155042705 565060198 /nfs/dbraw/zinc/06/01/98/565060198.db2.gz ULUDWXXRRMSASL-OAHLLOKOSA-N 0 3 391.313 3.349 10 0 GGAEHN CCc1nc2n(n1)C[C@H](N[C@@H](C)C(=O)Nc1cc(Cl)ccc1Cl)CC2 ZINC000112550788 565064326 /nfs/dbraw/zinc/06/43/26/565064326.db2.gz BJYQWOBJUKIVDQ-CMPLNLGQSA-N 0 3 382.295 3.079 10 0 GGAEHN CCN1CCN(C[C@H](C)CNc2ncnc3ccc(Br)cc32)CC1 ZINC000112964941 565067396 /nfs/dbraw/zinc/06/73/96/565067396.db2.gz JYJXQFMUTZOARX-CQSZACIVSA-N 0 3 392.345 3.078 10 0 GGAEHN C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cc2c(cc(Br)cc2F)[nH]1 ZINC000113226209 565068481 /nfs/dbraw/zinc/06/84/81/565068481.db2.gz AWKRYEABENXYLG-CMPLNLGQSA-N 0 3 380.261 3.378 10 0 GGAEHN C[C@@H]1CN2CCC[C@@H]2CN1Cc1nc(-c2cc(Br)cs2)no1 ZINC000113266951 565068625 /nfs/dbraw/zinc/06/86/25/565068625.db2.gz DYHFLPLHINMCNH-ZYHUDNBSSA-N 0 3 383.315 3.229 10 0 GGAEHN C[C@@H]1CN2CCC[C@@H]2CN1Cc1nnc(-c2ccccc2Br)o1 ZINC000113270477 565068690 /nfs/dbraw/zinc/06/86/90/565068690.db2.gz SJUMBQHLCUTQCA-CHWSQXEVSA-N 0 3 377.286 3.168 10 0 GGAEHN C[C@H]1CN2CCC[C@@H]2CN1Cc1nc(Cc2cccc(Br)c2)no1 ZINC000113266897 565068761 /nfs/dbraw/zinc/06/87/61/565068761.db2.gz CBERCYMUCLCDIV-XJKSGUPXSA-N 0 3 391.313 3.091 10 0 GGAEHN CN(C)Cc1cccc(C(=O)N2CCN(Cc3ccc(Cl)s3)CC2)c1 ZINC000155519731 565068786 /nfs/dbraw/zinc/06/87/86/565068786.db2.gz DRQALTKZLMYEGE-UHFFFAOYSA-N 0 3 377.941 3.421 10 0 GGAEHN O=S(=O)(Cc1ccccc1C(F)(F)F)N1CCC(N2CCCC2)CC1 ZINC000113280019 565068887 /nfs/dbraw/zinc/06/88/87/565068887.db2.gz MTWBEVVNUHJHFN-UHFFFAOYSA-N 0 3 376.444 3.095 10 0 GGAEHN CCCN1CCC(CNS(=O)(=O)Cc2ccccc2C(F)(F)F)CC1 ZINC000113285661 565068946 /nfs/dbraw/zinc/06/89/46/565068946.db2.gz FONZQIAQIGQSMX-UHFFFAOYSA-N 0 3 378.460 3.247 10 0 GGAEHN COCCN1CCC(NC(=O)N[C@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000113604649 565070635 /nfs/dbraw/zinc/07/06/35/565070635.db2.gz WKBZMBVMEJQBKD-INIZCTEOSA-N 0 3 386.323 3.391 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)Nc3cncc(Br)c3)cc2)CC1 ZINC000155973005 565073560 /nfs/dbraw/zinc/07/35/60/565073560.db2.gz WIUMWNCMKDSTSK-UHFFFAOYSA-N 0 3 389.297 3.238 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(Br)s1 ZINC000114319408 565073990 /nfs/dbraw/zinc/07/39/90/565073990.db2.gz NRYXCHLWEIBGEZ-CQSZACIVSA-N 0 3 381.339 3.342 10 0 GGAEHN CC(C)C[C@H](NC(=O)Nc1ccc(Cl)cc1Cl)C(=O)NCCN(C)C ZINC000156127274 565075343 /nfs/dbraw/zinc/07/53/43/565075343.db2.gz KNBJJLWMBQZWKV-HNNXBMFYSA-N 0 3 389.327 3.207 10 0 GGAEHN CN(Cc1cscn1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000369286182 565085292 /nfs/dbraw/zinc/08/52/92/565085292.db2.gz YXVMPAMUKPVLBD-UHFFFAOYSA-N 0 3 376.448 3.090 10 0 GGAEHN O=C(CCN1CCC(c2c[nH]cn2)CC1)Nc1ccccc1Br ZINC000369341831 565087846 /nfs/dbraw/zinc/08/78/46/565087846.db2.gz FXDINIAUMJDPDE-UHFFFAOYSA-N 0 3 377.286 3.380 10 0 GGAEHN CCCCCNC(=O)C(C)S(=O)(=O)Cc1sc(C)nc1C(F)(F)F ZINC000183708537 565089591 /nfs/dbraw/zinc/08/95/91/565089591.db2.gz WNOMCMPGKRNMKQ-SECBINFHSA-N 0 3 386.461 3.080 10 0 GGAEHN Cc1nc(C(F)(F)F)c(CS(=O)(=O)C(C)C(=O)NC2CCCCC2)s1 ZINC000183710458 565090010 /nfs/dbraw/zinc/09/00/10/565090010.db2.gz SSIYKXQGEYKVCC-SECBINFHSA-N 0 3 398.472 3.223 10 0 GGAEHN CN1CCC(CC(=O)Nc2ccc(F)cc2I)CC1 ZINC000292010416 565092230 /nfs/dbraw/zinc/09/22/30/565092230.db2.gz UIZWTCGFUHGFOW-UHFFFAOYSA-N 0 3 376.213 3.101 10 0 GGAEHN Cc1ccc(C)c(OC[C@H](O)CN[C@H](CO)c2cccc(Br)c2)c1 ZINC000183886032 565100886 /nfs/dbraw/zinc/10/08/86/565100886.db2.gz AJRLHQHTNRKVMZ-QZTJIDSGSA-N 0 3 394.309 3.129 10 0 GGAEHN Cc1ccccc1NC(=O)CCN[C@@H](CO)c1cccc(Br)c1 ZINC000183898187 565101443 /nfs/dbraw/zinc/10/14/43/565101443.db2.gz UHQKVVSHYFRKBE-KRWDZBQOSA-N 0 3 377.282 3.409 10 0 GGAEHN OC[C@@H](NCCCOc1ccc2c(c1)OCO2)c1cccc(Br)c1 ZINC000183901179 565102527 /nfs/dbraw/zinc/10/25/27/565102527.db2.gz MCEMVVVNFYICMI-MRXNPFEDSA-N 0 3 394.265 3.270 10 0 GGAEHN Cc1cc2cc(C(=O)NC[C@H](O)CN3CCCCC3)oc2c(Br)c1 ZINC000184030658 565110584 /nfs/dbraw/zinc/11/05/84/565110584.db2.gz ULIXMZGMSUZJMK-AWEZNQCLSA-N 0 3 395.297 3.080 10 0 GGAEHN COc1c(CNCCCc2ccc(Br)cc2OC)c(C)nn1C ZINC000184276187 565124981 /nfs/dbraw/zinc/12/49/81/565124981.db2.gz KRNFWOCUSRVZSX-UHFFFAOYSA-N 0 3 382.302 3.231 10 0 GGAEHN COc1cc(Br)ccc1CN(C)C1CCN(c2cnccn2)CC1 ZINC000370041450 565125429 /nfs/dbraw/zinc/12/54/29/565125429.db2.gz QHIICCIYRUHDRI-UHFFFAOYSA-N 0 3 391.313 3.349 10 0 GGAEHN C[C@@](O)(CN1CCC(c2ncc[nH]2)CC1)c1ccc(Br)cc1F ZINC000292670925 565127674 /nfs/dbraw/zinc/12/76/74/565127674.db2.gz BDVVXFYGWVOBHM-QGZVFWFLSA-N 0 3 382.277 3.398 10 0 GGAEHN Cc1noc([C@H]2CCCN(C[C@](C)(O)c3ccc(Br)cc3F)C2)n1 ZINC000292689001 565129535 /nfs/dbraw/zinc/12/95/35/565129535.db2.gz AHZYSMZYMYNEFF-SJCJKPOMSA-N 0 3 398.276 3.367 10 0 GGAEHN COc1ccc([C@H](C)NC(=O)N2CCN3CCC2CC3)cc1Br ZINC000370212008 565132970 /nfs/dbraw/zinc/13/29/70/565132970.db2.gz GBYLWRDLBLGAIR-LBPRGKRZSA-N 0 3 382.302 3.008 10 0 GGAEHN C[C@@](O)(CN1CCC(n2ccnc2)CC1)c1ccc(Br)cc1F ZINC000292765305 565133431 /nfs/dbraw/zinc/13/34/31/565133431.db2.gz JEPOINUHYJGSRL-QGZVFWFLSA-N 0 3 382.277 3.329 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1ccc(Cl)cc1OC(F)F ZINC000184397123 565133851 /nfs/dbraw/zinc/13/38/51/565133851.db2.gz SABKCJCHAUPVPQ-LBPRGKRZSA-N 0 3 377.819 3.174 10 0 GGAEHN C[C@H]1CN(CCCCNC(=O)Cc2ccc(Br)s2)C[C@H](C)O1 ZINC000268025962 565138076 /nfs/dbraw/zinc/13/80/76/565138076.db2.gz SVSHTXKWEFYKFO-STQMWFEESA-N 0 3 389.359 3.059 10 0 GGAEHN C[C@@H]1CN(CCCCNC(=O)Cc2ccc(Br)s2)C[C@@H](C)O1 ZINC000268025961 565138246 /nfs/dbraw/zinc/13/82/46/565138246.db2.gz SVSHTXKWEFYKFO-CHWSQXEVSA-N 0 3 389.359 3.059 10 0 GGAEHN CCC[C@H](C(=O)N1CCO[C@H](c2ccc(F)c(Br)c2)C1)N(C)C ZINC000184493563 565139069 /nfs/dbraw/zinc/13/90/69/565139069.db2.gz OWIFTSXIQANQIQ-CVEARBPZSA-N 0 3 387.293 3.218 10 0 GGAEHN COc1ccc(-c2nc(C)c([C@H](C)NC[C@H](C)CS(C)(=O)=O)s2)cc1 ZINC000184787754 565156502 /nfs/dbraw/zinc/15/65/02/565156502.db2.gz CUTQRPOEHYPAPO-STQMWFEESA-N 0 3 382.551 3.458 10 0 GGAEHN CCc1sc(C(=O)Nc2ccc(=O)n(CCN(C)C)c2)cc1Br ZINC000293398917 565165665 /nfs/dbraw/zinc/16/56/65/565165665.db2.gz GQARIIAFUSCRPI-UHFFFAOYSA-N 0 3 398.326 3.049 10 0 GGAEHN Cn1ccnc1CNC1(Cc2ccc(F)cc2Br)CCOCC1 ZINC000293431754 565167510 /nfs/dbraw/zinc/16/75/10/565167510.db2.gz BGIYFXZVEKZCRQ-UHFFFAOYSA-N 0 3 382.277 3.203 10 0 GGAEHN Cc1cnn([C@H]2CCN(C[C@@](C)(O)c3ccc(Br)cc3F)C2)c1 ZINC000293533496 565173357 /nfs/dbraw/zinc/17/33/57/565173357.db2.gz JPHXTEPBZBHEJR-WMLDXEAASA-N 0 3 382.277 3.248 10 0 GGAEHN CN1CC[C@H](NCc2ccc(S(C)(=O)=O)cc2)[C@@H]1c1ccc(Cl)cc1 ZINC000371205900 565182455 /nfs/dbraw/zinc/18/24/55/565182455.db2.gz CECDGMBMLSSIKY-OALUTQOASA-N 0 3 378.925 3.279 10 0 GGAEHN CN1CC[C@H](NCc2ccc(S(C)(=O)=O)cc2)[C@H]1c1ccc(Cl)cc1 ZINC000371205901 565182613 /nfs/dbraw/zinc/18/26/13/565182613.db2.gz CECDGMBMLSSIKY-RBUKOAKNSA-N 0 3 378.925 3.279 10 0 GGAEHN C[C@H](Cc1ccc(F)c(Br)c1)C(=O)Nc1cnn(CCN(C)C)c1 ZINC000159116832 565195567 /nfs/dbraw/zinc/19/55/67/565195567.db2.gz XMLYBMFLLRMIMK-GFCCVEGCSA-N 0 3 397.292 3.164 10 0 GGAEHN CN(C)CCn1cc(NC(=O)c2ccc(Br)cc2Cl)ccc1=O ZINC000270041320 565206746 /nfs/dbraw/zinc/20/67/46/565206746.db2.gz APELOEJBHFNPGH-UHFFFAOYSA-N 0 3 398.688 3.078 10 0 GGAEHN CN(C)CCn1cc(NC(=O)c2cc(Cl)ccc2Br)ccc1=O ZINC000270061273 565208142 /nfs/dbraw/zinc/20/81/42/565208142.db2.gz FITHVDXGJOYACL-UHFFFAOYSA-N 0 3 398.688 3.078 10 0 GGAEHN C[C@H](NCc1cc(Br)cc(Br)c1N)[C@H]1CCCO1 ZINC000185776381 565220687 /nfs/dbraw/zinc/22/06/87/565220687.db2.gz LPYVAKVJMKDZRK-QPUJVOFHSA-N 0 3 378.108 3.451 10 0 GGAEHN NC(=O)[C@@H](N[C@H]1CCOC2(CCSCC2)C1)c1cccc(Br)c1 ZINC000270597818 565223804 /nfs/dbraw/zinc/22/38/04/565223804.db2.gz KQJGNWKMLOMLEQ-GJZGRUSLSA-N 0 3 399.354 3.010 10 0 GGAEHN NC(=O)[C@@H](N[C@@H]1CCOC2(CCSCC2)C1)c1cccc(Br)c1 ZINC000270597812 565224172 /nfs/dbraw/zinc/22/41/72/565224172.db2.gz KQJGNWKMLOMLEQ-CABCVRRESA-N 0 3 399.354 3.010 10 0 GGAEHN C[C@@H]1CN(CCCCNC(=O)Cc2cscc2Br)C[C@@H](C)O1 ZINC000294856340 565232286 /nfs/dbraw/zinc/23/22/86/565232286.db2.gz GIQPJSMISUQIPY-CHWSQXEVSA-N 0 3 389.359 3.059 10 0 GGAEHN CC(C)N1CCN(C2CCN(Cc3cccc(Br)c3)CC2)CC1 ZINC000270932575 565233307 /nfs/dbraw/zinc/23/33/07/565233307.db2.gz QHOLZJUTOHTSQU-UHFFFAOYSA-N 0 3 380.374 3.440 10 0 GGAEHN COc1cc(Br)c(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1OC ZINC000294876873 565233892 /nfs/dbraw/zinc/23/38/92/565233892.db2.gz HTNQTRLMHPHSFC-NEPJUHHUSA-N 0 3 385.302 3.021 10 0 GGAEHN C[C@H]1CN(Cc2nnc(-c3ccccc3Br)o2)CCN(C2CC2)C1 ZINC000294952325 565236960 /nfs/dbraw/zinc/23/69/60/565236960.db2.gz AWKAOUGREHFUAN-ZDUSSCGKSA-N 0 3 391.313 3.415 10 0 GGAEHN Cn1cc(CCCN[C@H](c2ccc(Br)cc2)c2cncnc2)cn1 ZINC000186163521 565243558 /nfs/dbraw/zinc/24/35/58/565243558.db2.gz GEFWGPYVYMESNY-GOSISDBHSA-N 0 3 386.297 3.284 10 0 GGAEHN CCN(Cc1cccc(Br)c1)C(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C ZINC000372570451 565245053 /nfs/dbraw/zinc/24/50/53/565245053.db2.gz LFCSDGFIXVJUTH-JTDSTZFVSA-N 0 3 395.341 3.330 10 0 GGAEHN C[C@@H](CN[C@@H](c1ccc(Br)cc1)c1cncnc1)N(C)C1CC1 ZINC000186177637 565245242 /nfs/dbraw/zinc/24/52/42/565245242.db2.gz YLGDXGHEVCIOCK-UGSOOPFHSA-N 0 3 375.314 3.401 10 0 GGAEHN Brc1ccc([C@H](NCCCO[C@H]2CCOC2)c2cncnc2)cc1 ZINC000186246048 565249815 /nfs/dbraw/zinc/24/98/15/565249815.db2.gz CRFKYXMHURKUPV-ROUUACIJSA-N 0 3 392.297 3.114 10 0 GGAEHN Brc1ccc([C@@H](NCCCO[C@H]2CCOC2)c2cncnc2)cc1 ZINC000186246069 565250055 /nfs/dbraw/zinc/25/00/55/565250055.db2.gz CRFKYXMHURKUPV-ZWKOTPCHSA-N 0 3 392.297 3.114 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)c1cc(Br)ccc1Br ZINC000186275208 565251029 /nfs/dbraw/zinc/25/10/29/565251029.db2.gz DZZYHDHDPFBKLF-JTQLQIEISA-N 0 3 376.092 3.036 10 0 GGAEHN Brc1ccc([C@H](N[C@@H]2CCc3n[nH]cc3C2)c2cncnc2)cc1 ZINC000186287545 565251919 /nfs/dbraw/zinc/25/19/19/565251919.db2.gz LKVHLNARCSGWND-AEFFLSMTSA-N 0 3 384.281 3.199 10 0 GGAEHN Brc1ccc([C@@H](N[C@H]2CCc3n[nH]cc3C2)c2cncnc2)cc1 ZINC000186287595 565252413 /nfs/dbraw/zinc/25/24/13/565252413.db2.gz LKVHLNARCSGWND-FUHWJXTLSA-N 0 3 384.281 3.199 10 0 GGAEHN CS(=O)(=O)[C@@H]1CCC[C@H](N[C@@H]2CCOc3c(Br)cccc32)C1 ZINC000271496360 565255947 /nfs/dbraw/zinc/25/59/47/565255947.db2.gz MLADHOVTYVKFHK-YWPYICTPSA-N 0 3 388.327 3.218 10 0 GGAEHN CCO[C@H]1C[C@@H](NCc2cc(Br)cc3c2OCC3)C12CCOCC2 ZINC000186508056 565264245 /nfs/dbraw/zinc/26/42/45/565264245.db2.gz BMFKOHYMRZEBCR-SJORKVTESA-N 0 3 396.325 3.448 10 0 GGAEHN COc1cc(C[NH2+]C2CCN(CC(F)(F)F)CC2)cc(Br)c1[O-] ZINC000271913499 565272504 /nfs/dbraw/zinc/27/25/04/565272504.db2.gz YJBKUADYCDDOQD-UHFFFAOYSA-N 0 3 397.235 3.280 10 0 GGAEHN O=C(CSCC(F)(F)F)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000373416395 565283775 /nfs/dbraw/zinc/28/37/75/565283775.db2.gz HMHXEZJJCUMGIT-UHFFFAOYSA-N 0 3 378.382 3.203 10 0 GGAEHN O=C(NCc1ccccc1CN1CC[C@@H](O)C1)c1csc(Br)c1 ZINC000272739685 565295767 /nfs/dbraw/zinc/29/57/67/565295767.db2.gz BYDDXTBUNJRCII-OAHLLOKOSA-N 0 3 395.322 3.007 10 0 GGAEHN CCC[C@@H](C(=O)NCc1cc(Br)ccc1OC(F)F)N(C)C ZINC000161892418 565296092 /nfs/dbraw/zinc/29/60/92/565296092.db2.gz AUDSZUOBVPQRJM-LBPRGKRZSA-N 0 3 379.245 3.397 10 0 GGAEHN COc1c(Br)cccc1CN(C)[C@@H]1CCCN(c2cccnn2)C1 ZINC000186939638 565296487 /nfs/dbraw/zinc/29/64/87/565296487.db2.gz ZYDCYFRGDYPJBQ-OAHLLOKOSA-N 0 3 391.313 3.349 10 0 GGAEHN C[C@H](CC(=O)NCCCCN1CCN(C)CC1)c1ccc(Br)cc1 ZINC000161901298 565297629 /nfs/dbraw/zinc/29/76/29/565297629.db2.gz DIJQPVSHDFEJDG-MRXNPFEDSA-N 0 3 396.373 3.087 10 0 GGAEHN C[C@H](NC(=O)N[C@H]1CCOc2ccc(Br)cc21)C1=CCN(C)CC1 ZINC000272855924 565299160 /nfs/dbraw/zinc/29/91/60/565299160.db2.gz UPXYMQCEFHHMFU-LRDDRELGSA-N 0 3 394.313 3.222 10 0 GGAEHN Cc1cnn(CCN2CCC(C(=O)Nc3ccccc3Br)CC2)c1 ZINC000373956083 565312070 /nfs/dbraw/zinc/31/20/70/565312070.db2.gz ZJCXMUXJHZAQGK-UHFFFAOYSA-N 0 3 391.313 3.305 10 0 GGAEHN COc1c(Br)cccc1CN[C@@H]1CCc2nnc(C(C)C)n2C1 ZINC000187177853 565314575 /nfs/dbraw/zinc/31/45/75/565314575.db2.gz VNSVJWAKKGKSHG-CYBMUJFWSA-N 0 3 379.302 3.277 10 0 GGAEHN Cc1ccc(S(=O)(=O)C[C@@H](C)N[C@H]2CCOC3(CCSCC3)C2)cc1 ZINC000273540803 565324933 /nfs/dbraw/zinc/32/49/33/565324933.db2.gz YCVSZTSQXSPXRQ-SJORKVTESA-N 0 3 383.579 3.192 10 0 GGAEHN O=C(CCN1CCC(c2c[nH]cn2)CC1)Nc1cccc(Br)c1 ZINC000374199374 565325312 /nfs/dbraw/zinc/32/53/12/565325312.db2.gz HFAYLDGKBANUAA-UHFFFAOYSA-N 0 3 377.286 3.380 10 0 GGAEHN Nc1c(Br)cc(Br)cc1CN[C@@H]1CCCC[C@@H]1O ZINC000187355399 565326561 /nfs/dbraw/zinc/32/65/61/565326561.db2.gz RYWCHWWNANEEBB-NEPJUHHUSA-N 0 3 378.108 3.187 10 0 GGAEHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)NCCc1ccccc1Br ZINC000273621706 565327680 /nfs/dbraw/zinc/32/76/80/565327680.db2.gz RFIGYRIQALKIBW-AWEZNQCLSA-N 0 3 382.346 3.363 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)NCc1ccc(Br)cc1OC ZINC000187585645 565343196 /nfs/dbraw/zinc/34/31/96/565343196.db2.gz NOYKJYAVAPFLKW-OAHLLOKOSA-N 0 3 384.318 3.083 10 0 GGAEHN O[C@@H]1[C@@H](CNCc2cc(Br)cc3c2OCC3)CCC12CCOCC2 ZINC000374672268 565351218 /nfs/dbraw/zinc/35/12/18/565351218.db2.gz CFMAXPVIIZOCHI-RDTXWAMCSA-N 0 3 396.325 3.041 10 0 GGAEHN CN(C)CCN(Cc1ccco1)C(=O)N[C@@H](c1nccs1)C(F)(F)F ZINC000297142049 565358286 /nfs/dbraw/zinc/35/82/86/565358286.db2.gz ZLDXVPMURNCIMS-LBPRGKRZSA-N 0 3 376.404 3.113 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1 ZINC000187843846 565358659 /nfs/dbraw/zinc/35/86/59/565358659.db2.gz ROCPTWWPAWYKHB-DOMZBBRYSA-N 0 3 384.318 3.082 10 0 GGAEHN C[C@H](NC(=O)CN(C)[C@@]1(CO)CC[C@@H](C)C1)c1ccc(Br)cc1 ZINC000188002934 565369519 /nfs/dbraw/zinc/36/95/19/565369519.db2.gz NRAHRCUIOARXMC-GLJUWKHASA-N 0 3 383.330 3.109 10 0 GGAEHN CCOc1cc(CN[C@@H]2COc3ccccc3[C@@H]2O)cc(Br)c1O ZINC000297405822 565370751 /nfs/dbraw/zinc/37/07/51/565370751.db2.gz KVBQDVSSOYKBGW-PBHICJAKSA-N 0 3 394.265 3.138 10 0 GGAEHN O=S1(=O)CCC[C@H](CN2CCC[C@@H]2Cc2ccc(Br)cc2)C1 ZINC000375360436 565383193 /nfs/dbraw/zinc/38/31/93/565383193.db2.gz HWJZGGHJMOCHQV-NVXWUHKLSA-N 0 3 386.355 3.281 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)c1scc(C)c1I ZINC000188222925 565388221 /nfs/dbraw/zinc/38/82/21/565388221.db2.gz LQCJPCDGXOMAID-NSHDSACASA-N 0 3 392.306 3.217 10 0 GGAEHN COCc1nc2n(n1)CCC[C@H]2N[C@@H](C)Cc1ccc(Br)cc1 ZINC000188248727 565390891 /nfs/dbraw/zinc/39/08/91/565390891.db2.gz OIYRTSWQKJAHJT-SWLSCSKDSA-N 0 3 379.302 3.243 10 0 GGAEHN O=C(CN1CC[C@@H](N2CCCC2)C1)Nc1c(Cl)cccc1C(F)(F)F ZINC000170745494 565391080 /nfs/dbraw/zinc/39/10/80/565391080.db2.gz DTNHAPRITRYHFY-GFCCVEGCSA-N 0 3 375.822 3.467 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)CCc2ncc(-c3ccccc3Br)o2)C1 ZINC000170855830 565395535 /nfs/dbraw/zinc/39/55/35/565395535.db2.gz MMDLJYKTHDEWRH-CYBMUJFWSA-N 0 3 392.297 3.199 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)C1 ZINC000170862743 565395679 /nfs/dbraw/zinc/39/56/79/565395679.db2.gz NTNXJSQJILHWCR-CYBMUJFWSA-N 0 3 377.897 3.430 10 0 GGAEHN CCCOc1c(Br)cc(C(=O)N2CC[C@@H](N(C)C)C2)cc1OC ZINC000170861729 565395798 /nfs/dbraw/zinc/39/57/98/565395798.db2.gz IGVVEAPYWJMWAF-CYBMUJFWSA-N 0 3 385.302 3.023 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)COc2ccc3cc(Br)ccc3c2)C1 ZINC000170865581 565395830 /nfs/dbraw/zinc/39/58/30/565395830.db2.gz DDTVVERSRWORFN-INIZCTEOSA-N 0 3 377.282 3.144 10 0 GGAEHN CSc1ccc([C@@H](CNC(=O)NCCCc2nccs2)N(C)C)cc1 ZINC000298013166 565395976 /nfs/dbraw/zinc/39/59/76/565395976.db2.gz PBCHZRWOYHXMLO-MRXNPFEDSA-N 0 3 378.567 3.400 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)c2csc(-c3cc(Br)cs3)n2)C1 ZINC000170864674 565396082 /nfs/dbraw/zinc/39/60/82/565396082.db2.gz BKFQZQMMXFYOPU-SNVBAGLBSA-N 0 3 386.340 3.410 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)Cc2csc(-c3cccc(Br)c3)n2)C1 ZINC000170858089 565396145 /nfs/dbraw/zinc/39/61/45/565396145.db2.gz DDRZFWWPUNXHNW-OAHLLOKOSA-N 0 3 394.338 3.278 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)Cc2csc(-c3cccc(Br)c3)n2)C1 ZINC000170858090 565396204 /nfs/dbraw/zinc/39/62/04/565396204.db2.gz DDRZFWWPUNXHNW-HNNXBMFYSA-N 0 3 394.338 3.278 10 0 GGAEHN CN(Cc1csc(Br)c1)C1CCN(CCn2cccn2)CC1 ZINC000170942226 565399562 /nfs/dbraw/zinc/39/95/62/565399562.db2.gz JLBBZIQGDYBHFG-UHFFFAOYSA-N 0 3 383.359 3.304 10 0 GGAEHN Brc1ccc(-n2cc(CN3CCC[C@@H]3Cn3ccnc3)cn2)cc1 ZINC000188402858 565399660 /nfs/dbraw/zinc/39/96/60/565399660.db2.gz MXTYAYCOGXELOR-GOSISDBHSA-N 0 3 386.297 3.496 10 0 GGAEHN Brc1ccc(-n2cc(CN3CCC[C@H]3Cn3ccnc3)cn2)cc1 ZINC000188402884 565399805 /nfs/dbraw/zinc/39/98/05/565399805.db2.gz MXTYAYCOGXELOR-SFHVURJKSA-N 0 3 386.297 3.496 10 0 GGAEHN O=C(NCCc1ccsc1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000375670401 565400038 /nfs/dbraw/zinc/40/00/38/565400038.db2.gz BNHJODFXHSDURW-UHFFFAOYSA-N 0 3 375.460 3.395 10 0 GGAEHN Cn1cncc1CCN1CCC(C(=O)Nc2ccccc2Br)CC1 ZINC000298236096 565406463 /nfs/dbraw/zinc/40/64/63/565406463.db2.gz BVRVQAOEZUYIJH-UHFFFAOYSA-N 0 3 391.313 3.076 10 0 GGAEHN CCOc1cc(C[NH2+][C@H]2CCC[C@H](C(=O)N(C)C)C2)cc(Br)c1[O-] ZINC000298327274 565409824 /nfs/dbraw/zinc/40/98/24/565409824.db2.gz IQHJBQZTPCMXRR-KBPBESRZSA-N 0 3 399.329 3.290 10 0 GGAEHN CCOc1cc(C[NH2+][C@@H]2CCC[C@@H](C(=O)N(C)C)C2)cc(Br)c1[O-] ZINC000298327301 565409917 /nfs/dbraw/zinc/40/99/17/565409917.db2.gz IQHJBQZTPCMXRR-ZIAGYGMSSA-N 0 3 399.329 3.290 10 0 GGAEHN CCOc1cc(C[NH2+]CCCOC2CCOCC2)cc(Br)c1[O-] ZINC000298359761 565410450 /nfs/dbraw/zinc/41/04/50/565410450.db2.gz KCNRECIKZJFMKF-UHFFFAOYSA-N 0 3 388.302 3.229 10 0 GGAEHN O=C(CSCC(=O)c1ccc(Cl)cc1)NC1CC(N2CCCCC2)C1 ZINC000376009776 565417827 /nfs/dbraw/zinc/41/78/27/565417827.db2.gz YTPDFOFNJJPUQH-UHFFFAOYSA-N 0 3 380.941 3.389 10 0 GGAEHN O=C(NCc1ccc2c(c1)C[NH2+]C2)c1[n-]nc(-c2ccccc2)c1Br ZINC000188713564 565419479 /nfs/dbraw/zinc/41/94/79/565419479.db2.gz OMJIZFGMOOPUKH-UHFFFAOYSA-N 0 3 397.276 3.372 10 0 GGAEHN CC(C)(C)N1CC[C@@H](NCCS(C)(=O)=O)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000298535744 565419512 /nfs/dbraw/zinc/41/95/12/565419512.db2.gz MQIQKQKVBVHWHQ-CVEARBPZSA-N 0 3 376.925 3.027 10 0 GGAEHN Brc1ccc(N2CC[C@@H](CNCc3cn4cccnc4n3)C2)cc1 ZINC000298532737 565419714 /nfs/dbraw/zinc/41/97/14/565419714.db2.gz SGNXGWZHIDIVPY-AWEZNQCLSA-N 0 3 386.297 3.108 10 0 GGAEHN CCOc1cc(CNCC[S@@](=O)C(C)(C)C)cc(Br)c1O ZINC000298575915 565421385 /nfs/dbraw/zinc/42/13/85/565421385.db2.gz XIJCIWRGTYTOBO-OAQYLSRUSA-N 0 3 378.332 3.190 10 0 GGAEHN CC[C@@H]1CN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCS1 ZINC000376099170 565421446 /nfs/dbraw/zinc/42/14/46/565421446.db2.gz XLCMHQSAALIWOD-YMAMQOFZSA-N 0 3 379.492 3.329 10 0 GGAEHN C[C@H]1CN(Cc2ccc(Br)c(F)c2)CC[C@H]1N1CCN(C)CC1 ZINC000376202798 565426351 /nfs/dbraw/zinc/42/63/51/565426351.db2.gz FQBTYZPWHDKKQH-KBXCAEBGSA-N 0 3 384.337 3.046 10 0 GGAEHN C[C@@H]1CSCCN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000376232283 565427174 /nfs/dbraw/zinc/42/71/74/565427174.db2.gz MQWXGOHUTFSAHG-GRTSSRMGSA-N 0 3 379.492 3.186 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)N[C@@H](C)c2ccc(Br)cc2OC)C1 ZINC000188893040 565430974 /nfs/dbraw/zinc/43/09/74/565430974.db2.gz ITSPCJSLUGIALD-GXTWGEPZSA-N 0 3 384.318 3.302 10 0 GGAEHN CCn1cnnc1[C@H]1CCCN(CCOc2cc(F)cc(Br)c2)C1 ZINC000188927534 565433330 /nfs/dbraw/zinc/43/33/30/565433330.db2.gz NLJPFMRXZQJQDR-ZDUSSCGKSA-N 0 3 397.292 3.458 10 0 GGAEHN CCn1cnnc1C1CCN(CCOc2cc(F)cc(Br)c2)CC1 ZINC000188974768 565436102 /nfs/dbraw/zinc/43/61/02/565436102.db2.gz PUKGVGKBWNMBRC-UHFFFAOYSA-N 0 3 397.292 3.458 10 0 GGAEHN CCOc1cc(C[NH2+]C[C@H](O)c2ccccc2OC)cc(Br)c1[O-] ZINC000299064586 565437612 /nfs/dbraw/zinc/43/76/12/565437612.db2.gz UAQXADBHMAVKSO-HNNXBMFYSA-N 0 3 396.281 3.385 10 0 GGAEHN O=C(CCCCOc1ccc(Br)cc1)N1CCN2CCC[C@H]2C1 ZINC000171716555 565446623 /nfs/dbraw/zinc/44/66/23/565446623.db2.gz QQTOMVDLKOXNII-INIZCTEOSA-N 0 3 381.314 3.305 10 0 GGAEHN O[C@H](COc1cccc(Br)c1)CN1CCC([C@H]2CCCO2)CC1 ZINC000189170269 565449275 /nfs/dbraw/zinc/44/92/75/565449275.db2.gz MBTFWIDDFWOXDT-FUHWJXTLSA-N 0 3 384.314 3.080 10 0 GGAEHN O=C(NCCCNCc1cnn2ccccc12)c1cccc(Br)c1 ZINC000171763742 565449707 /nfs/dbraw/zinc/44/97/07/565449707.db2.gz ZLBXZYHEZFTYQK-UHFFFAOYSA-N 0 3 387.281 3.007 10 0 GGAEHN O=C(c1n[nH]c2ccc(Br)cc21)N1CCC[C@@H]1CN1CCCCC1 ZINC000171776202 565450267 /nfs/dbraw/zinc/45/02/67/565450267.db2.gz OWMMUBFRXMFAQZ-CQSZACIVSA-N 0 3 391.313 3.416 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1ccc(OC(F)F)c(Cl)c1 ZINC000171908275 565456143 /nfs/dbraw/zinc/45/61/43/565456143.db2.gz YSGXRSWVLCRYHG-LBPRGKRZSA-N 0 3 377.819 3.174 10 0 GGAEHN CC(C)(CNC(=O)N1CCN2CCC[C@@H]2C1)c1cccc(Br)c1 ZINC000171906465 565456980 /nfs/dbraw/zinc/45/69/80/565456980.db2.gz BJFOPNYIUPJXQW-MRXNPFEDSA-N 0 3 380.330 3.216 10 0 GGAEHN O=C(NC[C@H]1CCCSC1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000376979144 565461829 /nfs/dbraw/zinc/46/18/29/565461829.db2.gz NEUHJGPKPIYSML-LRVUVFPRSA-N 0 3 379.492 3.234 10 0 GGAEHN C[C@@H](NC(=O)N1CCO[C@@H](CN(C)C)C1)c1cc(F)c(Cl)cc1Cl ZINC000172115590 565466880 /nfs/dbraw/zinc/46/68/80/565466880.db2.gz WPOMSYXQVVLWPK-MNOVXSKESA-N 0 3 378.275 3.166 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)Nc2cc(Br)c(OC)cc2OC)C1 ZINC000189621977 565478628 /nfs/dbraw/zinc/47/86/28/565478628.db2.gz DJKUDDIHFJMQBO-LLVKDONJSA-N 0 3 386.290 3.072 10 0 GGAEHN CN(C)CCN1CCC(Nc2ccc3cc(Br)ccc3n2)CC1 ZINC000301336091 565479228 /nfs/dbraw/zinc/47/92/28/565479228.db2.gz DBHWDQXMUKXABY-UHFFFAOYSA-N 0 3 377.330 3.435 10 0 GGAEHN Cc1ccc(NC(=O)[C@@H](C)N2CCCN(C3CC3)CC2)c(Br)c1 ZINC000172346870 565479860 /nfs/dbraw/zinc/47/98/60/565479860.db2.gz DYJGIRCYIPDPPP-CQSZACIVSA-N 0 3 380.330 3.255 10 0 GGAEHN O=C(CN1CCCN(C2CC2)CC1)Nc1ccc(Br)cc1Cl ZINC000172347274 565480065 /nfs/dbraw/zinc/48/00/65/565480065.db2.gz FJJASSCEYSSGIY-UHFFFAOYSA-N 0 3 386.721 3.211 10 0 GGAEHN CCCN1CCCN(c2cnn(-c3ccc(Cl)cc3)c(=O)c2Cl)CC1 ZINC000301401726 565483589 /nfs/dbraw/zinc/48/35/89/565483589.db2.gz QQUGISFKVYZFLH-UHFFFAOYSA-N 0 3 381.307 3.461 10 0 GGAEHN CN1CC[C@H](NC(=O)Nc2cccnc2Br)[C@@H]1c1ccccc1 ZINC000189740507 565484482 /nfs/dbraw/zinc/48/44/82/565484482.db2.gz UKIMKWHBIKRURQ-ZFWWWQNUSA-N 0 3 375.270 3.411 10 0 GGAEHN Cc1cnn(CCN2CCC(C(=O)Nc3ccc(Br)cc3)CC2)c1 ZINC000377571870 565485649 /nfs/dbraw/zinc/48/56/49/565485649.db2.gz ZFMODZBMMDUPOG-UHFFFAOYSA-N 0 3 391.313 3.305 10 0 GGAEHN C[C@H]1COCC[C@@H]1NCc1coc(-c2ccc(I)cc2)n1 ZINC000277302079 565488236 /nfs/dbraw/zinc/48/82/36/565488236.db2.gz CLPJAIHTPJMHJJ-NHYWBVRUSA-N 0 3 398.244 3.461 10 0 GGAEHN CC(C)S(=O)(=O)CCCN[C@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000377663782 565491610 /nfs/dbraw/zinc/49/16/10/565491610.db2.gz COJINOBBVBFXKM-IRXDYDNUSA-N 0 3 376.925 3.027 10 0 GGAEHN CC[C@H](CO)N1CCN(c2ccc3cc(Br)c(F)cc3n2)CC1 ZINC000301531066 565493813 /nfs/dbraw/zinc/49/38/13/565493813.db2.gz HRYJAFWOZXOINS-CYBMUJFWSA-N 0 3 382.277 3.029 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1 ZINC000189887166 565494551 /nfs/dbraw/zinc/49/45/51/565494551.db2.gz YJGBZAHXJACVNS-SGMGOOAPSA-N 0 3 396.329 3.443 10 0 GGAEHN CCC[C@@H]1CN(c2ncnc3ccc(Br)cc32)CCN1CCOC ZINC000301934883 565519784 /nfs/dbraw/zinc/51/97/84/565519784.db2.gz QOVMWWLFWDMMNA-OAHLLOKOSA-N 0 3 393.329 3.329 10 0 GGAEHN C[C@H]1CN(C(=O)c2cc(Cl)sc2Cl)CC[C@H]1N1CCN(C)CC1 ZINC000378322008 565521072 /nfs/dbraw/zinc/52/10/72/565521072.db2.gz ZPEQVGMOUUQHIC-WCQYABFASA-N 0 3 376.353 3.153 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2ccc(Br)s2)n1 ZINC000190354382 565525867 /nfs/dbraw/zinc/52/58/67/565525867.db2.gz CYPCRAUSGSZIMN-UHFFFAOYSA-N 0 3 375.313 3.476 10 0 GGAEHN COC[C@@](C)(O)CN[C@H](C)c1ccc(Br)cc1Br ZINC000382575253 565543246 /nfs/dbraw/zinc/54/32/46/565543246.db2.gz VJFXVJWQHIKIKZ-RNCFNFMXSA-N 0 3 381.108 3.260 10 0 GGAEHN Cc1csc(C(=O)N[C@@H](CC(C)C)CN(C)C)c1I ZINC000190381149 565527754 /nfs/dbraw/zinc/52/77/54/565527754.db2.gz VDSRAMLYSUXFDA-NSHDSACASA-N 0 3 394.322 3.367 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC[C@@H](O)COCc1ccco1 ZINC000190438534 565532152 /nfs/dbraw/zinc/53/21/52/565532152.db2.gz TWOBLEZJRWFXFX-TZMCWYRMSA-N 0 3 384.270 3.279 10 0 GGAEHN CN(Cc1cccnc1)C[C@H]1CCN(Cc2cncc(Br)c2)C1 ZINC000190481181 565535601 /nfs/dbraw/zinc/53/56/01/565535601.db2.gz SYSXFCCYXMOKDP-MRXNPFEDSA-N 0 3 375.314 3.193 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)Nc2cccnc2Cl)C1 ZINC000190499043 565536542 /nfs/dbraw/zinc/53/65/42/565536542.db2.gz AIMGAMIZWRHGCM-CYBMUJFWSA-N 0 3 379.917 3.486 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)Nc2cccnc2Cl)C1 ZINC000190499018 565536791 /nfs/dbraw/zinc/53/67/91/565536791.db2.gz AIMGAMIZWRHGCM-ZDUSSCGKSA-N 0 3 379.917 3.486 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)Nc2ccnc(Cl)c2)C1 ZINC000190509049 565537997 /nfs/dbraw/zinc/53/79/97/565537997.db2.gz ILYXMVJVZQITDZ-ZDUSSCGKSA-N 0 3 379.917 3.486 10 0 GGAEHN C[C@H](CCN1CCN(C)CC1)Nc1ccc2cccc(Br)c2n1 ZINC000302231273 565538160 /nfs/dbraw/zinc/53/81/60/565538160.db2.gz CCMKFCOZCFYBDU-CQSZACIVSA-N 0 3 377.330 3.435 10 0 GGAEHN CC[C@@H](C)[N@H+](C)CC[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000380108714 565540139 /nfs/dbraw/zinc/54/01/39/565540139.db2.gz OPBJAKUZNWWNEB-SNVBAGLBSA-N 0 3 383.739 3.111 10 0 GGAEHN CC[C@@H](C)[N@@H+](C)CC[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000380108714 565540142 /nfs/dbraw/zinc/54/01/42/565540142.db2.gz OPBJAKUZNWWNEB-SNVBAGLBSA-N 0 3 383.739 3.111 10 0 GGAEHN CCCc1ncc(C(=O)N2CC[C@H](CN(C)Cc3scnc3C)C2)s1 ZINC000190548299 565541740 /nfs/dbraw/zinc/54/17/40/565541740.db2.gz UXKVQNDZJYUIOE-CQSZACIVSA-N 0 3 378.567 3.455 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(C)c(Br)c2)[C@H](C)C1 ZINC000173263602 565542230 /nfs/dbraw/zinc/54/22/30/565542230.db2.gz IYCMZUBYFKUCMG-CZUORRHYSA-N 0 3 389.359 3.108 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1cc(Cl)c(F)c(Cl)c1 ZINC000190577646 565543603 /nfs/dbraw/zinc/54/36/03/565543603.db2.gz UWYVZCJUISSFJL-LLVKDONJSA-N 0 3 376.259 3.014 10 0 GGAEHN CN(Cc1cccnc1)C[C@H]1CCN(C(=O)c2coc(Br)c2)C1 ZINC000190587769 565543922 /nfs/dbraw/zinc/54/39/22/565543922.db2.gz CSLUEKDWMMPXIE-CQSZACIVSA-N 0 3 378.270 3.031 10 0 GGAEHN CN(Cc1cccnc1)C[C@H]1CCN(C(=O)c2ccccc2Br)C1 ZINC000190611260 565546184 /nfs/dbraw/zinc/54/61/84/565546184.db2.gz JMSOMCCWFVQPDL-MRXNPFEDSA-N 0 3 388.309 3.438 10 0 GGAEHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)c2ccccc2Br)C1 ZINC000190611238 565546436 /nfs/dbraw/zinc/54/64/36/565546436.db2.gz JMSOMCCWFVQPDL-INIZCTEOSA-N 0 3 388.309 3.438 10 0 GGAEHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)c2sccc2Br)C1 ZINC000190664414 565550255 /nfs/dbraw/zinc/55/02/55/565550255.db2.gz SAGCHSPEWABUKS-AWEZNQCLSA-N 0 3 394.338 3.500 10 0 GGAEHN C[C@H](NC(=O)N(CCN(C)C)C[C@H]1CCCO1)c1ccccc1Br ZINC000173400737 565554837 /nfs/dbraw/zinc/55/48/37/565554837.db2.gz WHYCWWVAKXJYJB-LSDHHAIUSA-N 0 3 398.345 3.262 10 0 GGAEHN C[C@H](NC(=O)N(CCN(C)C)C[C@@H]1CCCO1)c1ccccc1Br ZINC000173400710 565555075 /nfs/dbraw/zinc/55/50/75/565555075.db2.gz WHYCWWVAKXJYJB-GJZGRUSLSA-N 0 3 398.345 3.262 10 0 GGAEHN CCN1CC[C@H](NC(=O)c2cc(Br)sc2Br)C1 ZINC000389962977 565555121 /nfs/dbraw/zinc/55/51/21/565555121.db2.gz GEWPZUKGNOJCJE-ZETCQYMHSA-N 0 3 382.121 3.097 10 0 GGAEHN C[C@@H](NC(=O)N(CCN(C)C)C[C@@H]1CCCO1)c1ccccc1Br ZINC000173400724 565555222 /nfs/dbraw/zinc/55/52/22/565555222.db2.gz WHYCWWVAKXJYJB-CABCVRRESA-N 0 3 398.345 3.262 10 0 GGAEHN CN1CCC(C(=O)N2CCC[C@H]2c2ccc(I)cc2)CC1 ZINC000173456369 565558960 /nfs/dbraw/zinc/55/89/60/565558960.db2.gz VBOGNGWTVIWVDJ-INIZCTEOSA-N 0 3 398.288 3.297 10 0 GGAEHN Cn1ncc(Br)c1CNCCCc1nc(-c2ccncc2)cs1 ZINC000278490105 565562412 /nfs/dbraw/zinc/56/24/12/565562412.db2.gz LYOUCKICGKKWDO-UHFFFAOYSA-N 0 3 392.326 3.424 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)C(=O)Nc2cc(Cl)c(F)c(Cl)c2)CCN1C ZINC000190836746 565563540 /nfs/dbraw/zinc/56/35/40/565563540.db2.gz HRJNPZIRLMXTKJ-KOLCDFICSA-N 0 3 376.259 3.012 10 0 GGAEHN Cc1cc(N2CCC[C@H](N[C@H](C)c3cc(Br)ncc3F)C2)n(C)n1 ZINC000278530392 565564439 /nfs/dbraw/zinc/56/44/39/565564439.db2.gz UBOSYBCWYOTQJN-OLZOCXBDSA-N 0 3 396.308 3.345 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)CCNc2ncc(C(F)(F)F)cc2Cl)C1 ZINC000173562398 565566801 /nfs/dbraw/zinc/56/68/01/565566801.db2.gz PIPDOAKDVYPAPJ-GFCCVEGCSA-N 0 3 378.826 3.156 10 0 GGAEHN COc1ccc([C@@H](C)NC(=O)N2CC[C@@H](N3CC=CC3)C2)cc1Br ZINC000173558878 565567491 /nfs/dbraw/zinc/56/74/91/565567491.db2.gz DMOHCRZONXHYKG-UKRRQHHQSA-N 0 3 394.313 3.174 10 0 GGAEHN CCN1CCCC[C@@H]1CNC(=O)N1CCN(Cc2ccc(Cl)s2)CC1 ZINC000303425625 565569853 /nfs/dbraw/zinc/56/98/53/565569853.db2.gz AOGKTGBVXMUYQP-OAHLLOKOSA-N 0 3 384.977 3.103 10 0 GGAEHN CC[C@@H](Cc1cccc(Br)c1)C(=O)NC[C@@H]1CCCN1CCOC ZINC000303679883 565574334 /nfs/dbraw/zinc/57/43/34/565574334.db2.gz MBOSZSXXNSTVQZ-WMZOPIPTSA-N 0 3 397.357 3.245 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N(C)[C@@H]1CCCN(C)C1 ZINC000303906173 565574690 /nfs/dbraw/zinc/57/46/90/565574690.db2.gz LWHCAYZDHDJYCX-CQSZACIVSA-N 0 3 378.314 3.265 10 0 GGAEHN OC1(CNc2cncc(Br)c2)CCN(Cc2ccccc2)CC1 ZINC000397562198 565575143 /nfs/dbraw/zinc/57/51/43/565575143.db2.gz YASGSHLTHNYQMZ-UHFFFAOYSA-N 0 3 376.298 3.283 10 0 GGAEHN OC1(CNc2ccc(Br)cn2)CCN(Cc2ccccc2)CC1 ZINC000397553177 565575577 /nfs/dbraw/zinc/57/55/77/565575577.db2.gz GQORYBUWAGEFCO-UHFFFAOYSA-N 0 3 376.298 3.283 10 0 GGAEHN C[C@H]1C[C@H](NCc2c(Br)cnn2C)CCN1C(=O)OC(C)(C)C ZINC000278824091 565580016 /nfs/dbraw/zinc/58/00/16/565580016.db2.gz UGQKFLAJMOUWLX-NWDGAFQWSA-N 0 3 387.322 3.060 10 0 GGAEHN C[C@H](NCC[C@]1(O)CCOC1)c1ccc(Br)cc1Br ZINC000404197927 565583154 /nfs/dbraw/zinc/58/31/54/565583154.db2.gz GLIIXXAAZWTVOF-HZMBPMFUSA-N 0 3 393.119 3.404 10 0 GGAEHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1nscc1Br ZINC000404838203 565583816 /nfs/dbraw/zinc/58/38/16/565583816.db2.gz NRAVQQQVQNRNBF-CYBMUJFWSA-N 0 3 380.311 3.300 10 0 GGAEHN O=C(NC1CCN(Cc2ccccc2)CC1)c1nscc1Br ZINC000404882420 565584083 /nfs/dbraw/zinc/58/40/83/565584083.db2.gz CCWDYBYGDQHPPX-UHFFFAOYSA-N 0 3 380.311 3.300 10 0 GGAEHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1nscc1Br ZINC000404838204 565584244 /nfs/dbraw/zinc/58/42/44/565584244.db2.gz NRAVQQQVQNRNBF-ZDUSSCGKSA-N 0 3 380.311 3.300 10 0 GGAEHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1nscc1Br ZINC000404927054 565584475 /nfs/dbraw/zinc/58/44/75/565584475.db2.gz IAWKMDGEPVTJBV-CQSZACIVSA-N 0 3 380.311 3.473 10 0 GGAEHN CCN(CC)[C@H]1CCN(S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000314434107 565587532 /nfs/dbraw/zinc/58/75/32/565587532.db2.gz FXSHSINIVHLVGS-NSHDSACASA-N 0 3 395.750 3.207 10 0 GGAEHN C[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCOc3c(Br)cccc32)CN1C1CC1 ZINC000407954840 565588188 /nfs/dbraw/zinc/58/81/88/565588188.db2.gz FNYRGRZATBURLX-XHBSWPGZSA-N 0 3 394.313 3.197 10 0 GGAEHN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCN2CCCC[C@H]2C1 ZINC000408023572 565591086 /nfs/dbraw/zinc/59/10/86/565591086.db2.gz UCPFCKFWWNBUGF-HNNXBMFYSA-N 0 3 389.297 3.150 10 0 GGAEHN COCCCN1CCC(NC(=O)c2ccc(Br)c(C)c2F)CC1 ZINC000279198325 565600250 /nfs/dbraw/zinc/60/02/50/565600250.db2.gz JPLDMCNHKYEYKH-UHFFFAOYSA-N 0 3 387.293 3.127 10 0 GGAEHN C[C@H]1CN(C(=O)Nc2cc(Cl)c(Cl)cn2)CCN1C1CCN(C)CC1 ZINC000408257779 565601008 /nfs/dbraw/zinc/60/10/08/565601008.db2.gz VVVVXDZXZCTGEU-LBPRGKRZSA-N 0 3 386.327 3.021 10 0 GGAEHN COCC[C@H](COC)NCc1ccc(OC(F)(F)F)c(Br)c1 ZINC000320281270 565602021 /nfs/dbraw/zinc/60/20/21/565602021.db2.gz ZODIWOPNTDQNAX-LLVKDONJSA-N 0 3 386.208 3.489 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CCC[C@H](N(C)C)C1 ZINC000191439812 565604673 /nfs/dbraw/zinc/60/46/73/565604673.db2.gz VOMQHWVFVBYFSH-JSGCOSHPSA-N 0 3 384.318 3.254 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CCN2CCC[C@@H]2C1 ZINC000191444676 565604896 /nfs/dbraw/zinc/60/48/96/565604896.db2.gz LYWFAOVMUXHARM-TZMCWYRMSA-N 0 3 382.302 3.008 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CCC[C@@H](N(C)C)C1 ZINC000191439861 565605328 /nfs/dbraw/zinc/60/53/28/565605328.db2.gz VOMQHWVFVBYFSH-TZMCWYRMSA-N 0 3 384.318 3.254 10 0 GGAEHN COc1cc(Br)ccc1C(=O)N1CCc2ccccc2[C@@H]1CN ZINC000321904444 565606440 /nfs/dbraw/zinc/60/64/40/565606440.db2.gz VNRGTPAAISTOOG-INIZCTEOSA-N 0 3 375.266 3.156 10 0 GGAEHN COc1ccc(C(=O)N2CCc3ccccc3[C@H]2CN)cc1Br ZINC000321858597 565606914 /nfs/dbraw/zinc/60/69/14/565606914.db2.gz LVGYLCKZGJYXOF-MRXNPFEDSA-N 0 3 375.266 3.156 10 0 GGAEHN CCOc1cc(CN2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)cc(Br)c1[O-] ZINC000321827378 565607178 /nfs/dbraw/zinc/60/71/78/565607178.db2.gz BQKYAKRTTIIXMK-HOCLYGCPSA-N 0 3 383.330 3.470 10 0 GGAEHN CCOc1cc(CN2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc(Br)c1[O-] ZINC000321827378 565607180 /nfs/dbraw/zinc/60/71/80/565607180.db2.gz BQKYAKRTTIIXMK-HOCLYGCPSA-N 0 3 383.330 3.470 10 0 GGAEHN O=C(CN1CCCC[C@@H]1[C@@H]1CCC[C@H]1O)Nc1ccc(Br)cc1 ZINC000322656194 565610240 /nfs/dbraw/zinc/61/02/40/565610240.db2.gz ZJADWMRICATEQQ-GVDBMIGSSA-N 0 3 381.314 3.403 10 0 GGAEHN COc1ccc(Br)cc1C(=O)N1CCc2ccccc2[C@H]1CN ZINC000323564103 565613756 /nfs/dbraw/zinc/61/37/56/565613756.db2.gz UVINYDWGQMLZSC-MRXNPFEDSA-N 0 3 375.266 3.156 10 0 GGAEHN COc1ccc(CN[C@H]2CCCN(c3ncccn3)C2)c(Br)c1 ZINC000323584392 565614203 /nfs/dbraw/zinc/61/42/03/565614203.db2.gz ZWEXUSHMAFUXPP-AWEZNQCLSA-N 0 3 377.286 3.006 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)Nc2ccccc2I)CCN1C ZINC000174234806 565622772 /nfs/dbraw/zinc/62/27/72/565622772.db2.gz RHPKSNWFVUDEQK-NWDGAFQWSA-N 0 3 387.265 3.238 10 0 GGAEHN C[C@@H](CCc1ccc(Br)cc1)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000174255844 565625049 /nfs/dbraw/zinc/62/50/49/565625049.db2.gz RVHHWWWEFCITCD-YJBOKZPZSA-N 0 3 392.341 3.426 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)Nc2ccc(I)cc2)CCN1C ZINC000174288755 565627429 /nfs/dbraw/zinc/62/74/29/565627429.db2.gz PFOQJZUAVDHQRB-BXUZGUMPSA-N 0 3 387.265 3.238 10 0 GGAEHN Cc1csc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1I ZINC000191764487 565630127 /nfs/dbraw/zinc/63/01/27/565630127.db2.gz PTKARVCXFWIUBD-MNOVXSKESA-N 0 3 392.306 3.216 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)NCCc2cc(Br)ccc2F)CCN1C ZINC000174362825 565630565 /nfs/dbraw/zinc/63/05/65/565630565.db2.gz HAGOJXPLKYSYHE-IUODEOHRSA-N 0 3 386.309 3.255 10 0 GGAEHN Cc1cc(N2CCC[C@H](N[C@@H](C)c3ccc(Br)cc3)C2=O)n(C)n1 ZINC000174344401 565631267 /nfs/dbraw/zinc/63/12/67/565631267.db2.gz AGHSOHKOGSPROC-BBRMVZONSA-N 0 3 391.313 3.337 10 0 GGAEHN Cc1nn(C)c(CNc2ccccc2CN2CCC(O)CC2)c1Br ZINC000279766573 565633097 /nfs/dbraw/zinc/63/30/97/565633097.db2.gz FQMFFIJTYMRDMN-UHFFFAOYSA-N 0 3 393.329 3.060 10 0 GGAEHN CCCCN(C)CCNC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000409705971 565635913 /nfs/dbraw/zinc/63/59/13/565635913.db2.gz CSZGTWVFBOVSJV-OAHLLOKOSA-N 0 3 384.318 3.304 10 0 GGAEHN COc1ccc(Br)cc1CNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000174458059 565637003 /nfs/dbraw/zinc/63/70/03/565637003.db2.gz OATREGISFQJPFK-IUODEOHRSA-N 0 3 384.318 3.082 10 0 GGAEHN COc1ccc(Br)cc1CNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000174458098 565637876 /nfs/dbraw/zinc/63/78/76/565637876.db2.gz OATREGISFQJPFK-WFASDCNBSA-N 0 3 384.318 3.082 10 0 GGAEHN CC(C)(CNC(=O)N1CC[C@H](N2CC=CC2)C1)c1cccc(Br)c1 ZINC000174572577 565644464 /nfs/dbraw/zinc/64/44/64/565644464.db2.gz QNXIWFIDCPGPCF-KRWDZBQOSA-N 0 3 392.341 3.382 10 0 GGAEHN CN(C)C1(CN(C)C(=O)Cc2c(F)ccc(Br)c2F)CCC1 ZINC000409943463 565650930 /nfs/dbraw/zinc/65/09/30/565650930.db2.gz QMTOYBOYUCAKMG-UHFFFAOYSA-N 0 3 375.257 3.213 10 0 GGAEHN O=C(N[C@H]1CCc2c1cccc2Br)N1CC[C@@H](N2CC=CC2)C1 ZINC000174666578 565651424 /nfs/dbraw/zinc/65/14/24/565651424.db2.gz WSXFMPNFRBGVHK-DYVFJYSZSA-N 0 3 376.298 3.092 10 0 GGAEHN CN1CCN([C@H]2CCCCN(Cc3csc(-c4ccsc4)n3)C2)CC1 ZINC000174903629 565665903 /nfs/dbraw/zinc/66/59/03/565665903.db2.gz ZOCBWBGDXLCCBF-SFHVURJKSA-N 0 3 376.595 3.474 10 0 GGAEHN CN(C(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O)[C@H]1CN2CCC1CC2 ZINC000329514708 565668261 /nfs/dbraw/zinc/66/82/61/565668261.db2.gz YFMNKEMUBXAUMR-HOCLYGCPSA-N 0 3 379.913 3.345 10 0 GGAEHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)N[C@@H]1C[C@H]1c1ccccc1Br ZINC000280418634 565670432 /nfs/dbraw/zinc/67/04/32/565670432.db2.gz AHORFLJXQKNOIE-JWZBEHFJSA-N 0 3 380.330 3.287 10 0 GGAEHN CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1csc(I)c1 ZINC000174982322 565670987 /nfs/dbraw/zinc/67/09/87/565670987.db2.gz QIDQPZCQUNXJDW-VXGBXAGGSA-N 0 3 390.290 3.052 10 0 GGAEHN O=C(NCC1(c2cccc(Br)c2)CC1)N1CC[C@H](N2CC=CC2)C1 ZINC000174977214 565671033 /nfs/dbraw/zinc/67/10/33/565671033.db2.gz OKJUZCGINFFARW-KRWDZBQOSA-N 0 3 390.325 3.136 10 0 GGAEHN CCSCC[C@H](C)N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280564324 565681745 /nfs/dbraw/zinc/68/17/45/565681745.db2.gz JULGOJFOESRXHA-WDEREUQCSA-N 0 3 395.388 3.279 10 0 GGAEHN COC(=O)c1cccc(NC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1Br ZINC000192424478 565689841 /nfs/dbraw/zinc/68/98/41/565689841.db2.gz ZITBVENEWJJSGX-NEPJUHHUSA-N 0 3 398.301 3.182 10 0 GGAEHN C[C@@H](NCCc1ccsc1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280739806 565692893 /nfs/dbraw/zinc/69/28/93/565692893.db2.gz OYPZBSFYVOVDID-SNVBAGLBSA-N 0 3 389.340 3.051 10 0 GGAEHN CCN1CCC[C@H]1CN(C)Cc1nc(-c2cccc(Br)c2)no1 ZINC000175345085 565693882 /nfs/dbraw/zinc/69/38/82/565693882.db2.gz AFVICNRSUIIJKY-HNNXBMFYSA-N 0 3 379.302 3.415 10 0 GGAEHN Cc1ccncc1CNCCC(=O)N(C)Cc1ccccc1Br ZINC000280777962 565694717 /nfs/dbraw/zinc/69/47/17/565694717.db2.gz FMSMHGZPDOSDLN-UHFFFAOYSA-N 0 3 376.298 3.291 10 0 GGAEHN O=C(NC[C@H](c1cccs1)N1CCCC1)[C@H]1CCCN1c1nccs1 ZINC000192516419 565696820 /nfs/dbraw/zinc/69/68/20/565696820.db2.gz ZGSNLSMRYXGPCM-HUUCEWRRSA-N 0 3 376.551 3.127 10 0 GGAEHN CN1CCC[C@H](CNC(=O)NC[C@H](O)c2ccsc2)[C@@H]1c1cccs1 ZINC000175515085 565703985 /nfs/dbraw/zinc/70/39/85/565703985.db2.gz SWQGSYSHJXDRTB-UKPHBRMFSA-N 0 3 379.551 3.225 10 0 GGAEHN CCOC(=O)[C@@H]1CC[C@H](N[C@@H](C)c2ccc(S(=O)(=O)C(F)F)cc2)C1 ZINC000280979964 565706487 /nfs/dbraw/zinc/70/64/87/565706487.db2.gz JAPJEPNKDQQIPI-YUTCNCBUSA-N 0 3 375.437 3.065 10 0 GGAEHN CC(C)N1CCN(CCCN2CCc3cccc(Br)c3C2)CC1 ZINC000192743000 565707843 /nfs/dbraw/zinc/70/78/43/565707843.db2.gz MHPGAHHBKBPNLE-UHFFFAOYSA-N 0 3 380.374 3.223 10 0 GGAEHN CC(C)(CN1CCCC1)NC(=O)c1c(F)cccc1I ZINC000411088705 565710411 /nfs/dbraw/zinc/71/04/11/565710411.db2.gz VFIGDHQRGJHXQZ-UHFFFAOYSA-N 0 3 390.240 3.035 10 0 GGAEHN O=C(NC[C@@H](O)CN1CCCCC1)N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000192803290 565711005 /nfs/dbraw/zinc/71/10/05/565711005.db2.gz HISXFGKGMDJTNY-GDBMZVCRSA-N 0 3 383.945 3.023 10 0 GGAEHN CC(C)CSCCN[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000281094634 565712343 /nfs/dbraw/zinc/71/23/43/565712343.db2.gz KKCRHERBSXFZAH-NSHDSACASA-N 0 3 395.388 3.136 10 0 GGAEHN CCN(CC)C(=O)[C@H]1CCCN1CCC(=O)Nc1ccccc1Br ZINC000411194734 565716527 /nfs/dbraw/zinc/71/65/27/565716527.db2.gz HGOGDZAPTRPFGE-MRXNPFEDSA-N 0 3 396.329 3.111 10 0 GGAEHN CCN(CC)C(=O)[C@@H]1CCCN1CCC(=O)Nc1ccccc1Br ZINC000411194732 565716602 /nfs/dbraw/zinc/71/66/02/565716602.db2.gz HGOGDZAPTRPFGE-INIZCTEOSA-N 0 3 396.329 3.111 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2C[C@H]2c2ccc(Br)cc2)CCN1C ZINC000281181741 565716662 /nfs/dbraw/zinc/71/66/62/565716662.db2.gz FFHQSJJEFWANSG-VDNDLQMASA-N 0 3 380.330 3.429 10 0 GGAEHN CC(C)C(=O)N1CCC(N[C@H](C)C(=O)Nc2ccccc2Br)CC1 ZINC000192887583 565717676 /nfs/dbraw/zinc/71/76/76/565717676.db2.gz JUMGLNNODPPQPF-CYBMUJFWSA-N 0 3 396.329 3.013 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(S(=O)(=O)c2ccc(Cl)cc2)C1 ZINC000192932804 565720226 /nfs/dbraw/zinc/72/02/26/565720226.db2.gz KGPBUZOHQSZPSN-AWEZNQCLSA-N 0 3 399.969 3.248 10 0 GGAEHN C[C@H](NCCC(=O)NC(=O)NCC(F)(F)F)c1ccc(Cl)c(Cl)c1 ZINC000411435812 565730343 /nfs/dbraw/zinc/73/03/43/565730343.db2.gz FFPNXIFUTNUDRD-QMMMGPOBSA-N 0 3 386.201 3.422 10 0 GGAEHN Cc1ccsc1[C@H](CO)NCCC(=O)Nc1ccc(Br)cc1 ZINC000411561563 565735254 /nfs/dbraw/zinc/73/52/54/565735254.db2.gz BBQDPMCITXSVIT-AWEZNQCLSA-N 0 3 383.311 3.471 10 0 GGAEHN Cc1ccsc1[C@H](CO)NCCC(=O)Nc1cccc(Br)c1 ZINC000411563688 565736372 /nfs/dbraw/zinc/73/63/72/565736372.db2.gz FHVGHVQVHAPAIU-AWEZNQCLSA-N 0 3 383.311 3.471 10 0 GGAEHN Cc1ccsc1[C@H](CO)NCCC(=O)Nc1ccccc1Br ZINC000411572447 565736967 /nfs/dbraw/zinc/73/69/67/565736967.db2.gz QVWQSVZIBWSNIY-AWEZNQCLSA-N 0 3 383.311 3.471 10 0 GGAEHN O=C(NCCNCc1c[nH]c(-c2ccccc2)n1)c1cccc(Br)c1 ZINC000175994952 565740280 /nfs/dbraw/zinc/74/02/80/565740280.db2.gz JHNIQMDKVJVYCC-UHFFFAOYSA-N 0 3 399.292 3.359 10 0 GGAEHN O=C(NCCNCc1cnc(-c2ccccc2)[nH]1)c1cccc(Br)c1 ZINC000175994952 565740284 /nfs/dbraw/zinc/74/02/84/565740284.db2.gz JHNIQMDKVJVYCC-UHFFFAOYSA-N 0 3 399.292 3.359 10 0 GGAEHN C[C@H](C(=O)NC[C@H]1CCCN(C)[C@@H]1c1cccs1)N(C)CC(F)(F)F ZINC000193343154 565745717 /nfs/dbraw/zinc/74/57/17/565745717.db2.gz XPWXTVMAYSDLHP-NFAWXSAZSA-N 0 3 377.476 3.130 10 0 GGAEHN CN(C(=O)CCN[C@](C)(CO)c1ccc(Br)cc1)c1ccccc1 ZINC000411714885 565746549 /nfs/dbraw/zinc/74/65/49/565746549.db2.gz AABOTZBBFUYYNC-LJQANCHMSA-N 0 3 391.309 3.299 10 0 GGAEHN C[C@H](CN[C@@H]1CCN(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1)S(C)(=O)=O ZINC000411702597 565746693 /nfs/dbraw/zinc/74/66/93/565746693.db2.gz ZJYSRUVBBZPNQV-JLZZUVOBSA-N 0 3 390.952 3.416 10 0 GGAEHN C[C@H](CN[C@H]1CCN(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1)S(C)(=O)=O ZINC000411702599 565746790 /nfs/dbraw/zinc/74/67/90/565746790.db2.gz ZJYSRUVBBZPNQV-OAUYIBNBSA-N 0 3 390.952 3.416 10 0 GGAEHN C[C@@](CO)(NCCC(=O)Nc1ccccc1)c1ccc(Br)cc1 ZINC000411716593 565748231 /nfs/dbraw/zinc/74/82/31/565748231.db2.gz GORXJWRRBIHITM-SFHVURJKSA-N 0 3 377.282 3.275 10 0 GGAEHN CN(Cc1cccs1)C(=O)CN[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000411749913 565749265 /nfs/dbraw/zinc/74/92/65/565749265.db2.gz PRNPBZWOGOLEBL-MJGOQNOKSA-N 0 3 377.941 3.395 10 0 GGAEHN Cc1nc(-c2ccc(S(=O)(=O)[N-]Cc3ccc4c(c3)C[NH2+]C4)s2)cs1 ZINC000193429710 565750215 /nfs/dbraw/zinc/75/02/15/565750215.db2.gz LVYYUUHKJKVJDP-UHFFFAOYSA-N 0 3 391.543 3.262 10 0 GGAEHN O=S(=O)(/C=C/c1ccc(Br)cc1)NCc1ccc2c(c1)CNC2 ZINC000193433370 565751658 /nfs/dbraw/zinc/75/16/58/565751658.db2.gz YASYMHMXDHLAOA-BQYQJAHWSA-N 0 3 393.306 3.143 10 0 GGAEHN COc1cc(C[NH2+]C2CCN(c3nccs3)CC2)cc(Br)c1[O-] ZINC000282132553 565766448 /nfs/dbraw/zinc/76/64/48/565766448.db2.gz GJJQOXVLQZHHFW-UHFFFAOYSA-N 0 3 398.326 3.378 10 0 GGAEHN COC(=O)[C@H]1CSCCN(CCC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000412080746 565769601 /nfs/dbraw/zinc/76/96/01/565769601.db2.gz QGIBKFZNPPFGDC-LLVKDONJSA-N 0 3 391.320 3.160 10 0 GGAEHN CCN1CC[C@@H](N(C)C(=O)CSCC(=O)c2ccc(Cl)cc2)[C@H](C)C1 ZINC000176430514 565771725 /nfs/dbraw/zinc/77/17/25/565771725.db2.gz GYZMJNPDEFOWMX-RHSMWYFYSA-N 0 3 382.957 3.445 10 0 GGAEHN CC(C)(C)CCN1CCN(C[C@H](O)COc2cccc(Br)c2)CC1 ZINC000193825668 565778212 /nfs/dbraw/zinc/77/82/12/565778212.db2.gz CDOLONXWJZBQNE-KRWDZBQOSA-N 0 3 399.373 3.243 10 0 GGAEHN CC[C@H]1CN2CCC[C@@H]2CN1C(=O)CSCC(=O)c1ccc(Cl)cc1 ZINC000176517058 565779649 /nfs/dbraw/zinc/77/96/49/565779649.db2.gz PIOGZNGZDSCQQV-DLBZAZTESA-N 0 3 380.941 3.341 10 0 GGAEHN O=C(Cc1cnccc1Cl)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000412299249 565779667 /nfs/dbraw/zinc/77/96/67/565779667.db2.gz OKHDDSZPVHZWPU-UHFFFAOYSA-N 0 3 375.822 3.199 10 0 GGAEHN O=C(NC1CCN(C2CC2)CC1)N[C@@H]1CCOc2c(Br)cccc21 ZINC000282466882 565780887 /nfs/dbraw/zinc/78/08/87/565780887.db2.gz HNZONOQWFDUEPK-MRXNPFEDSA-N 0 3 394.313 3.199 10 0 GGAEHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000282497977 565782544 /nfs/dbraw/zinc/78/25/44/565782544.db2.gz OPFGKTMKQNPZLD-DAXOMENPSA-N 0 3 396.329 3.254 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CCOc3c(Br)cccc32)CCN1C ZINC000282570346 565786101 /nfs/dbraw/zinc/78/61/01/565786101.db2.gz VPGQVDZNUXAYKH-IOASZLSFSA-N 0 3 396.329 3.397 10 0 GGAEHN COc1c(Br)cccc1CNC[C@@H]1CCC2(CCOCC2)[C@H]1O ZINC000282580198 565787703 /nfs/dbraw/zinc/78/77/03/565787703.db2.gz BIMQSRYKWRGRJQ-YOEHRIQHSA-N 0 3 384.314 3.115 10 0 GGAEHN COc1c(Br)cccc1CNC[C@@H]1CCC2(CCOCC2)[C@@H]1O ZINC000282580194 565787815 /nfs/dbraw/zinc/78/78/15/565787815.db2.gz BIMQSRYKWRGRJQ-WMLDXEAASA-N 0 3 384.314 3.115 10 0 GGAEHN COc1sc(CNC[C@@H]2CCC3(CCOCC3)[C@@H]2O)cc1Br ZINC000282692942 565792468 /nfs/dbraw/zinc/79/24/68/565792468.db2.gz LIGBDKQRDZBCNL-SMDDNHRTSA-N 0 3 390.343 3.177 10 0 GGAEHN COc1cc(OCCN(C)C)ccc1NC(=O)c1coc(Br)c1 ZINC000412564749 565796137 /nfs/dbraw/zinc/79/61/37/565796137.db2.gz PGVCDNVZKRBQMK-UHFFFAOYSA-N 0 3 383.242 3.243 10 0 GGAEHN CN(C)CCOc1ccccc1C(=O)NCCc1ccc(Br)s1 ZINC000194140160 565796835 /nfs/dbraw/zinc/79/68/35/565796835.db2.gz CIRYWZOJATWQDI-UHFFFAOYSA-N 0 3 397.338 3.424 10 0 GGAEHN COc1ccc(Br)cc1CNC[C@@H]1CCC2(CCOCC2)[C@@H]1O ZINC000282903129 565801702 /nfs/dbraw/zinc/80/17/02/565801702.db2.gz UKHBHFRHKHFXOK-SUMWQHHRSA-N 0 3 384.314 3.115 10 0 GGAEHN CN(CC1CCN(C)CC1)S(=O)(=O)c1c(Cl)cccc1Br ZINC000282925880 565803259 /nfs/dbraw/zinc/80/32/59/565803259.db2.gz HTLDIROOZQMPJF-UHFFFAOYSA-N 0 3 395.750 3.065 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)S(=O)(=O)c1c(Cl)cccc1Br ZINC000282936396 565804216 /nfs/dbraw/zinc/80/42/16/565804216.db2.gz IJELOEHSJZOHJP-MFKMUULPSA-N 0 3 395.750 3.063 10 0 GGAEHN CC1CCN(C(=O)CNC2(c3ccc(Br)cc3)CCOCC2)CC1 ZINC000194312105 565808199 /nfs/dbraw/zinc/80/81/99/565808199.db2.gz OAQMORSMRPUZDX-UHFFFAOYSA-N 0 3 395.341 3.303 10 0 GGAEHN Cc1cc(CN[C@@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1Br ZINC000283286597 565815201 /nfs/dbraw/zinc/81/52/01/565815201.db2.gz MKWJHJLZDWMWAF-LBPRGKRZSA-N 0 3 383.311 3.256 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)[C@@H](C)NC(=O)c1cccc(Cl)c1Cl ZINC000176980040 565819351 /nfs/dbraw/zinc/81/93/51/565819351.db2.gz CMUAQFAHTHDDQV-CHWSQXEVSA-N 0 3 386.323 3.054 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)CSc1ncnc2sc(C)c(C)c21 ZINC000176995261 565821830 /nfs/dbraw/zinc/82/18/30/565821830.db2.gz LMLLUVIPEVHQQP-AWEZNQCLSA-N 0 3 378.567 3.343 10 0 GGAEHN Cc1n[nH]c(C(=O)NC2CCN(Cc3cccc(Br)c3)CC2)c1C ZINC000412976219 565826861 /nfs/dbraw/zinc/82/68/61/565826861.db2.gz VUPSHUPTWYGSJZ-UHFFFAOYSA-N 0 3 391.313 3.183 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N[C@H]2CCCN(CC)C2)cc1OC ZINC000194625402 565827674 /nfs/dbraw/zinc/82/76/74/565827674.db2.gz SZSPNPPXYQKMHD-ZDUSSCGKSA-N 0 3 385.302 3.071 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)c1ccc(COc2cccc(Br)c2)o1 ZINC000194695218 565831309 /nfs/dbraw/zinc/83/13/09/565831309.db2.gz YDIAZSGRQVXBBK-AWEZNQCLSA-N 0 3 393.281 3.445 10 0 GGAEHN CCc1c(C(=O)NC[C@@H]2CCCN2C)cnn1-c1ccc(Br)cc1 ZINC000194695576 565831376 /nfs/dbraw/zinc/83/13/76/565831376.db2.gz BQQXWMUSWWCCGC-HNNXBMFYSA-N 0 3 391.313 3.021 10 0 GGAEHN O=C(Cc1csc(Cc2cccc(Cl)c2)n1)N1CCN2CCC1CC2 ZINC000194893388 565845844 /nfs/dbraw/zinc/84/58/44/565845844.db2.gz AMUSLBKOVDWSFS-UHFFFAOYSA-N 0 3 375.925 3.236 10 0 GGAEHN O=S(=O)(CCC(F)(F)F)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1 ZINC000284265374 565847523 /nfs/dbraw/zinc/84/75/23/565847523.db2.gz LBWIIIURQKDHHV-MQVJKMGUSA-N 0 3 376.444 3.054 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)NCc1ccc(OC)c(Br)c1 ZINC000177463002 565853066 /nfs/dbraw/zinc/85/30/66/565853066.db2.gz FNOVOSJBVPGMJR-AWEZNQCLSA-N 0 3 384.318 3.083 10 0 GGAEHN C[C@@H]1CCN(C(=O)c2[nH]nc3ccc(Br)cc32)C[C@H]1n1ccnc1 ZINC000177486355 565855042 /nfs/dbraw/zinc/85/50/42/565855042.db2.gz LHYIOEHRZVSJKX-IAQYHMDHSA-N 0 3 388.269 3.245 10 0 GGAEHN C[C@H]1CCN(C(=O)c2[nH]nc3ccc(Br)cc32)C[C@H]1n1ccnc1 ZINC000177486373 565855097 /nfs/dbraw/zinc/85/50/97/565855097.db2.gz LHYIOEHRZVSJKX-XHDPSFHLSA-N 0 3 388.269 3.245 10 0 GGAEHN CCCCOC[C@@H](O)CN1CCC(Oc2cccc(Br)c2)CC1 ZINC000195218464 565866300 /nfs/dbraw/zinc/86/63/00/565866300.db2.gz RZNSPBHWXFQLOP-INIZCTEOSA-N 0 3 386.330 3.470 10 0 GGAEHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)N1CCN2CCC[C@H]2C1 ZINC000177698607 565868038 /nfs/dbraw/zinc/86/80/38/565868038.db2.gz MIIHNTOURGXDCN-ZDUSSCGKSA-N 0 3 381.929 3.086 10 0 GGAEHN CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)N1CCN2CCC[C@H]2C1 ZINC000177697424 565868085 /nfs/dbraw/zinc/86/80/85/565868085.db2.gz CGSCIDVAWGXZSH-AWEZNQCLSA-N 0 3 381.929 3.086 10 0 GGAEHN CN(C(=O)NCc1cc(Cl)cc(Br)c1)[C@@H]1CCN(C2CC2)C1 ZINC000413701011 565868951 /nfs/dbraw/zinc/86/89/51/565868951.db2.gz LGBITAIOHOVZML-OAHLLOKOSA-N 0 3 386.721 3.481 10 0 GGAEHN O=C(Nc1nc(SCc2ccccc2)ns1)N1CCN2CCC[C@@H]2C1 ZINC000177710259 565869536 /nfs/dbraw/zinc/86/95/36/565869536.db2.gz XLBWDJXDOVRHKO-CQSZACIVSA-N 0 3 375.523 3.142 10 0 GGAEHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)ccc1I ZINC000177814675 565875213 /nfs/dbraw/zinc/87/52/13/565875213.db2.gz MOBLCSOWXWHSHC-KGLIPLIRSA-N 0 3 398.288 3.298 10 0 GGAEHN C[C@H](N[C@H](CO)c1cccc(Br)c1)C1CN(C(=O)OC(C)(C)C)C1 ZINC000284912383 565876736 /nfs/dbraw/zinc/87/67/36/565876736.db2.gz CQOXEEFNWKRILC-BLLLJJGKSA-N 0 3 399.329 3.328 10 0 GGAEHN CN1C(=O)CC[C@H](N[C@@H]2CCCc3c4cc(Br)ccc4[nH]c32)C1=O ZINC000333462996 565882341 /nfs/dbraw/zinc/88/23/41/565882341.db2.gz GVYYEOUHUYAFJC-CABCVRRESA-N 0 3 390.281 3.045 10 0 GGAEHN CN1C(=O)CC[C@@H](N[C@H]2CCCc3c4cc(Br)ccc4[nH]c32)C1=O ZINC000333463000 565882936 /nfs/dbraw/zinc/88/29/36/565882936.db2.gz GVYYEOUHUYAFJC-LSDHHAIUSA-N 0 3 390.281 3.045 10 0 GGAEHN O=C(Cc1ccc(Cl)s1)NCC1(O)CCN(Cc2ccccc2)CC1 ZINC000413985187 565884629 /nfs/dbraw/zinc/88/46/29/565884629.db2.gz VPWWBLIMXZNLDF-UHFFFAOYSA-N 0 3 378.925 3.087 10 0 GGAEHN Cc1cc(Br)ccc1NC(=O)CN1CCC(c2ccn[nH]2)CC1 ZINC000195506262 565888701 /nfs/dbraw/zinc/88/87/01/565888701.db2.gz ATDGCHINMIXIAY-UHFFFAOYSA-N 0 3 377.286 3.299 10 0 GGAEHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)Nc1cc(N(C)C)c(Br)cn1 ZINC000333647142 565889914 /nfs/dbraw/zinc/88/99/14/565889914.db2.gz JWZNBGOAMXVOPZ-CHWSQXEVSA-N 0 3 396.333 3.001 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NC[C@@H](c1ccco1)N1CCCC1 ZINC000414057969 565891159 /nfs/dbraw/zinc/89/11/59/565891159.db2.gz SSEVCNRXDWHMEN-ZBFHGGJFSA-N 0 3 394.313 3.019 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NC[C@H](c1ccco1)N1CCCC1 ZINC000414057965 565891317 /nfs/dbraw/zinc/89/13/17/565891317.db2.gz SSEVCNRXDWHMEN-GDBMZVCRSA-N 0 3 394.313 3.019 10 0 GGAEHN COc1ccc(OC)c([C@H](C)N[C@@H](C)Cn2cc(Br)ccc2=O)c1 ZINC000414058284 565891354 /nfs/dbraw/zinc/89/13/54/565891354.db2.gz GXHGYERRLKSAHB-STQMWFEESA-N 0 3 395.297 3.367 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NC[C@@H](c1ccco1)N1CCCC1 ZINC000414057967 565891501 /nfs/dbraw/zinc/89/15/01/565891501.db2.gz SSEVCNRXDWHMEN-HOCLYGCPSA-N 0 3 394.313 3.019 10 0 GGAEHN CCOCc1ccc(CN[C@H](C)Cn2cc(Br)ccc2=O)cc1 ZINC000414071272 565891895 /nfs/dbraw/zinc/89/18/95/565891895.db2.gz SZBMJFMVVJYCNU-CQSZACIVSA-N 0 3 379.298 3.326 10 0 GGAEHN COc1cccc(C2(N[C@@H](C)Cn3cc(Br)ccc3=O)CC2)c1 ZINC000414093775 565894566 /nfs/dbraw/zinc/89/45/66/565894566.db2.gz HPSOKNQBALWZML-ZDUSSCGKSA-N 0 3 377.282 3.287 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@H](C)[C@H]1OCCc2sccc21 ZINC000414138765 565897850 /nfs/dbraw/zinc/89/78/50/565897850.db2.gz KIDTVFKYIDQEHT-PSTGCABASA-N 0 3 397.338 3.353 10 0 GGAEHN CO[C@@](C)(CN[C@@H](C)Cn1cc(Br)ccc1=O)c1ccccc1 ZINC000414146441 565899035 /nfs/dbraw/zinc/89/90/35/565899035.db2.gz LEYZXDRTQAZYOQ-KSSFIOAISA-N 0 3 379.298 3.151 10 0 GGAEHN CCN1CCC[C@H](NC(=O)c2cc(Br)cc(Br)c2)C1 ZINC000219671202 565901842 /nfs/dbraw/zinc/90/18/42/565901842.db2.gz FFOZQUZLAJTORN-ZDUSSCGKSA-N 0 3 390.119 3.426 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)c1ccc(Br)cc1Br ZINC000219301905 565901891 /nfs/dbraw/zinc/90/18/91/565901891.db2.gz KNPFEYUEILPKGH-NSHDSACASA-N 0 3 390.119 3.378 10 0 GGAEHN CC(C)C[C@@H]1C[C@H]1N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000414187262 565902087 /nfs/dbraw/zinc/90/20/87/565902087.db2.gz QHNIHDMZCFIWDI-ZKYQVNSYSA-N 0 3 375.332 3.182 10 0 GGAEHN C[C@H](NC[C@@]1(O)CCOC1)c1ccc(Br)cc1Br ZINC000222427422 565904702 /nfs/dbraw/zinc/90/47/02/565904702.db2.gz ODGFYOWWHPGYML-ZANVPECISA-N 0 3 379.092 3.014 10 0 GGAEHN NS(=O)(=O)c1ccc(CN[C@H]2CCCc3ccccc32)cc1Br ZINC000414233983 565905639 /nfs/dbraw/zinc/90/56/39/565905639.db2.gz CDOANOOYLIDKOU-INIZCTEOSA-N 0 3 395.322 3.264 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)c1cc(Br)cc(Br)c1 ZINC000222902316 565905883 /nfs/dbraw/zinc/90/58/83/565905883.db2.gz CXYQSQWAYFOINC-CYBMUJFWSA-N 0 3 390.119 3.378 10 0 GGAEHN COC[C@H](O)CCN[C@H](C)c1ccc(Br)cc1Br ZINC000222709136 565906157 /nfs/dbraw/zinc/90/61/57/565906157.db2.gz KWXHHCNWBBEOHZ-MWLCHTKSSA-N 0 3 381.108 3.260 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)c1cc(Br)cc(Br)c1 ZINC000222902253 565906338 /nfs/dbraw/zinc/90/63/38/565906338.db2.gz CXYQSQWAYFOINC-ZDUSSCGKSA-N 0 3 390.119 3.378 10 0 GGAEHN CC(C)(CCN[C@H]1CCc2c1ccc(F)c2Br)S(C)(=O)=O ZINC000414260275 565906668 /nfs/dbraw/zinc/90/66/68/565906668.db2.gz NANYAQKPRMNQIW-ZDUSSCGKSA-N 0 3 378.307 3.378 10 0 GGAEHN C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)N1CCN2CCC[C@@H]2C1 ZINC000178225594 565906864 /nfs/dbraw/zinc/90/68/64/565906864.db2.gz SNGKSWRINBVDOO-TZMCWYRMSA-N 0 3 384.293 3.009 10 0 GGAEHN C[C@@H]1CN(CCC2CCN(C(=O)[C@]3(C)CC3(Cl)Cl)CC2)C[C@@H](C)O1 ZINC000178234704 565906995 /nfs/dbraw/zinc/90/69/95/565906995.db2.gz NFUFTEMLIXUFID-CPUCHLNUSA-N 0 3 377.356 3.308 10 0 GGAEHN Cc1ccc([C@@H](C)NCc2ccc(S(N)(=O)=O)c(Br)c2)cc1 ZINC000414297785 565908199 /nfs/dbraw/zinc/90/81/99/565908199.db2.gz SNJSTPLGNKSGHX-GFCCVEGCSA-N 0 3 383.311 3.256 10 0 GGAEHN Cc1cccc(C(=O)N[C@H](CC(C)C)CN(C)C)c1I ZINC000223506261 565908654 /nfs/dbraw/zinc/90/86/54/565908654.db2.gz XCZLRMTVEOJKDG-CYBMUJFWSA-N 0 3 388.293 3.306 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1C[C@H](O)COc1cc(Cl)ccc1Cl ZINC000178285848 565910810 /nfs/dbraw/zinc/91/08/10/565910810.db2.gz SSWARQJNBDKYHL-CVEARBPZSA-N 0 3 384.307 3.403 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1Cc1cc2c(c(Br)c1)OCO2 ZINC000178290265 565910958 /nfs/dbraw/zinc/91/09/58/565910958.db2.gz FCHUMQWQJDVLMQ-AWEZNQCLSA-N 0 3 378.270 3.347 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1[C@@H](C)C(=O)Nc1cccc(Br)c1 ZINC000178311029 565912396 /nfs/dbraw/zinc/91/23/96/565912396.db2.gz NUKTYOULGOBBEG-GUYCJALGSA-N 0 3 391.313 3.446 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1Cc1cc2c(cc1Br)OCO2 ZINC000178301869 565912547 /nfs/dbraw/zinc/91/25/47/565912547.db2.gz OXXKXEDXDADJJL-AWEZNQCLSA-N 0 3 378.270 3.347 10 0 GGAEHN OC[C@H](NC1CCN(Cc2ccccn2)CC1)c1cccc(Br)c1 ZINC000414375175 565918440 /nfs/dbraw/zinc/91/84/40/565918440.db2.gz DWTRDSJPUDCLTC-IBGZPJMESA-N 0 3 390.325 3.132 10 0 GGAEHN O[C@H](COc1cccc(Br)c1)CN1CCN(C2CCCCC2)CC1 ZINC000178446455 565919854 /nfs/dbraw/zinc/91/98/54/565919854.db2.gz LTQNNFXEOPRQSA-SFHVURJKSA-N 0 3 397.357 3.139 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)c2ccc(I)c(Cl)c2)C1 ZINC000226789990 565921059 /nfs/dbraw/zinc/92/10/59/565921059.db2.gz GAPXHYODYOZYPS-LLVKDONJSA-N 0 3 392.668 3.159 10 0 GGAEHN Cc1nc2n(n1)C[C@H](N[C@H]1CCCOc3ccc(Br)cc31)CC2 ZINC000178506367 565923670 /nfs/dbraw/zinc/92/36/70/565923670.db2.gz ZDYSJIWSTQOAAB-HIFRSBDPSA-N 0 3 377.286 3.167 10 0 GGAEHN C[C@H]1CCCN(C(=O)CNC2(c3ccc(Br)cc3)CCOCC2)C1 ZINC000178513300 565923715 /nfs/dbraw/zinc/92/37/15/565923715.db2.gz DMAUDUHQRMNCGR-HNNXBMFYSA-N 0 3 395.341 3.303 10 0 GGAEHN CN(C)Cc1cccc(NC(=O)N[C@H](CO)c2cccc(Br)c2)c1 ZINC000178620627 565929810 /nfs/dbraw/zinc/92/98/10/565929810.db2.gz QOCQHBNRSHVFAD-QGZVFWFLSA-N 0 3 392.297 3.366 10 0 GGAEHN Cc1ccc(F)c(CS(=O)(=O)C(C)C(=O)NCc2ccc(Cl)cc2)c1 ZINC000414427137 565929950 /nfs/dbraw/zinc/92/99/50/565929950.db2.gz QUBNQTQSOAHSIA-CYBMUJFWSA-N 0 3 383.872 3.407 10 0 GGAEHN Cc1ccc(F)c(CS(=O)(=O)C(C)C(=O)NCc2ccccc2Cl)c1 ZINC000414430095 565931224 /nfs/dbraw/zinc/93/12/24/565931224.db2.gz WGTIDXBGOLOUPR-CYBMUJFWSA-N 0 3 383.872 3.407 10 0 GGAEHN CC(C)(CNC(=O)N1CCN2CCC[C@@H]2C1)c1ccccc1Br ZINC000178739189 565934981 /nfs/dbraw/zinc/93/49/81/565934981.db2.gz NKEFGGLAQCKMSB-CQSZACIVSA-N 0 3 380.330 3.216 10 0 GGAEHN COC[C@@H](O)CN[C@H](c1ccccc1)c1ccc(OC)c(Br)c1 ZINC000178830210 565940246 /nfs/dbraw/zinc/94/02/46/565940246.db2.gz OIDLAWSUDZARCS-MAUKXSAKSA-N 0 3 380.282 3.144 10 0 GGAEHN CCOc1cc(C[N@H+](C[C@@H]2CCC(=O)N2)C(C)C)cc(Br)c1[O-] ZINC000414577664 565949857 /nfs/dbraw/zinc/94/98/57/565949857.db2.gz OWZHCGPMUJHJAP-ZDUSSCGKSA-N 0 3 385.302 3.042 10 0 GGAEHN CCOc1cc(C[N@@H+](C[C@@H]2CCC(=O)N2)C(C)C)cc(Br)c1[O-] ZINC000414577664 565949863 /nfs/dbraw/zinc/94/98/63/565949863.db2.gz OWZHCGPMUJHJAP-ZDUSSCGKSA-N 0 3 385.302 3.042 10 0 GGAEHN COCCN1CCC[C@@H]1CNCc1cc(Br)ccc1OC(F)F ZINC000237087266 565950609 /nfs/dbraw/zinc/95/06/09/565950609.db2.gz SCWZGPLSUZFRNV-CQSZACIVSA-N 0 3 393.272 3.251 10 0 GGAEHN COCCN1CCC[C@H]1CNCc1cc(Br)ccc1OC(F)F ZINC000237093549 565950682 /nfs/dbraw/zinc/95/06/82/565950682.db2.gz SCWZGPLSUZFRNV-AWEZNQCLSA-N 0 3 393.272 3.251 10 0 GGAEHN O=C(NCCCNCc1cccnc1)Nc1ccc(Br)cc1F ZINC000414699564 565956369 /nfs/dbraw/zinc/95/63/69/565956369.db2.gz IUIFPDWKZGLWAF-UHFFFAOYSA-N 0 3 381.249 3.285 10 0 GGAEHN COc1cc(C[NH2+]C2CCN(c3ccccn3)CC2)cc(Br)c1[O-] ZINC000237363743 565957980 /nfs/dbraw/zinc/95/79/80/565957980.db2.gz BTMCJMDECOLLFJ-UHFFFAOYSA-N 0 3 392.297 3.317 10 0 GGAEHN CCCN(C[C@@H]1CCCN(C(=O)CN)C1)[C@@H](C)c1ccccc1Br ZINC000414733375 565957934 /nfs/dbraw/zinc/95/79/34/565957934.db2.gz ATKJOJSSRJSULE-HOTGVXAUSA-N 0 3 396.373 3.419 10 0 GGAEHN CCOc1c(Br)cc(Cl)cc1NC(=O)N1CCCNCC1 ZINC000414782610 565959988 /nfs/dbraw/zinc/95/99/88/565959988.db2.gz XWRNLEPYHCMYKY-UHFFFAOYSA-N 0 3 376.682 3.328 10 0 GGAEHN Cc1noc(CCN[C@H]2CCCOc3ccc(I)cc32)n1 ZINC000360811251 565961861 /nfs/dbraw/zinc/96/18/61/565961861.db2.gz RHFHDDWPNGGLOF-ZDUSSCGKSA-N 0 3 399.232 3.029 10 0 GGAEHN CC(C(=O)N(C)[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1)S(C)(=O)=O ZINC000360790255 565961871 /nfs/dbraw/zinc/96/18/71/565961871.db2.gz CWNONTMGDFRCPK-BYCMXARLSA-N 0 3 377.428 3.233 10 0 GGAEHN C[C@H](C(=O)N1CCN(Cc2ccc(Cl)s2)CC1)[C@H](N)c1ccccc1 ZINC000237558736 565963903 /nfs/dbraw/zinc/96/39/03/565963903.db2.gz ZCBGIWPAKDRPPG-KSSFIOAISA-N 0 3 377.941 3.382 10 0 GGAEHN C[C@@H](C(=O)N1CCN(Cc2ccc(Cl)s2)CC1)[C@@H](N)c1ccccc1 ZINC000237592762 565965589 /nfs/dbraw/zinc/96/55/89/565965589.db2.gz ZCBGIWPAKDRPPG-RDTXWAMCSA-N 0 3 377.941 3.382 10 0 GGAEHN CN(C)C[C@H]1CN(Cc2csc(-c3cccc(Br)c3)n2)CCO1 ZINC000179217940 565966880 /nfs/dbraw/zinc/96/68/80/565966880.db2.gz GTUXMLFVKABVFA-INIZCTEOSA-N 0 3 396.354 3.335 10 0 GGAEHN FC1(F)CCNC[C@H]1NC1CCN(Cc2ccccc2Br)CC1 ZINC000414992786 565968335 /nfs/dbraw/zinc/96/83/35/565968335.db2.gz BSVPWXAHQOEYBZ-MRXNPFEDSA-N 0 3 388.300 3.000 10 0 GGAEHN Cc1cc(CNC[C@@H](O)COc2ccc3c(c2)OCO3)ccc1Br ZINC000237743144 565970377 /nfs/dbraw/zinc/97/03/77/565970377.db2.gz QGTBIAZRAIOXFC-CQSZACIVSA-N 0 3 394.265 3.016 10 0 GGAEHN COc1ccc(Br)cc1C1(C(=O)N(C)[C@H]2CCN(C3CC3)C2)CC1 ZINC000415159402 565977387 /nfs/dbraw/zinc/97/73/87/565977387.db2.gz JAHDXBIDMWJSMT-HNNXBMFYSA-N 0 3 393.325 3.184 10 0 GGAEHN COc1ccc(Br)cc1C1(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)CC1 ZINC000415206106 565978371 /nfs/dbraw/zinc/97/83/71/565978371.db2.gz AWXCFOKEGSAQCP-ZFWWWQNUSA-N 0 3 395.341 3.430 10 0 GGAEHN C[C@@H]1C[C@H](N[C@H]2CCN(C3CCOCC3)C2=O)c2cccc(Br)c21 ZINC000362303197 565978688 /nfs/dbraw/zinc/97/86/88/565978688.db2.gz JPJCYXZDTUKMRZ-DQYPLSBCSA-N 0 3 393.325 3.367 10 0 GGAEHN CNCc1cccc(NC(=O)C(=O)N[C@H]2CCCc3sc(Cl)cc32)c1 ZINC000415261288 565981852 /nfs/dbraw/zinc/98/18/52/565981852.db2.gz GNONWPWJJZNDMH-AWEZNQCLSA-N 0 3 377.897 3.253 10 0 GGAEHN CNCc1cccc(NC(=O)C(=O)N[C@@H]2CCCc3sc(Cl)cc32)c1 ZINC000415261289 565982805 /nfs/dbraw/zinc/98/28/05/565982805.db2.gz GNONWPWJJZNDMH-CQSZACIVSA-N 0 3 377.897 3.253 10 0 GGAEHN COc1cc(C(=O)NC[C@H]2CCCN2CC(C)C)sc1Br ZINC000179526781 565986796 /nfs/dbraw/zinc/98/67/96/565986796.db2.gz SIDDDJCBSSTNBF-LLVKDONJSA-N 0 3 375.332 3.369 10 0 GGAEHN CCC[C@H](C(=O)N[C@H](C)c1cc2c(cc1Br)OCCO2)N(C)C ZINC000179562520 565988492 /nfs/dbraw/zinc/98/84/92/565988492.db2.gz QFINEZTVXIPOJP-BXUZGUMPSA-N 0 3 385.302 3.128 10 0 GGAEHN CC[C@H]1CN2CCC[C@H]2CN1C(=O)CSCC(=O)c1ccc(Cl)cc1 ZINC000245422318 565988892 /nfs/dbraw/zinc/98/88/92/565988892.db2.gz PIOGZNGZDSCQQV-IRXDYDNUSA-N 0 3 380.941 3.341 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2C)[C@@H](C)C1 ZINC000245413775 565989364 /nfs/dbraw/zinc/98/93/64/565989364.db2.gz CCKGUALUAAGPSW-DZGCQCFKSA-N 0 3 378.460 3.365 10 0 GGAEHN CCC[C@H](C(=O)NC[C@H]1CCN(c2ccc(Br)cc2)C1)N(C)C ZINC000179575793 565990079 /nfs/dbraw/zinc/99/00/79/565990079.db2.gz RECOOJRQBKJNQX-RHSMWYFYSA-N 0 3 382.346 3.122 10 0 GGAEHN CCC[C@@H](C(=O)NC[C@@H]1CCN(c2ccc(Br)cc2)C1)N(C)C ZINC000179575753 565990439 /nfs/dbraw/zinc/99/04/39/565990439.db2.gz RECOOJRQBKJNQX-YOEHRIQHSA-N 0 3 382.346 3.122 10 0 GGAEHN CN(CCc1nccs1)C(=O)NC[C@@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000245544523 565994764 /nfs/dbraw/zinc/99/47/64/565994764.db2.gz MGLZXULPPIHMSM-YOEHRIQHSA-N 0 3 378.567 3.472 10 0 GGAEHN CC(C)N1CC[C@H](N[C@@H]2CCCS(=O)(=O)C2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245564879 565996306 /nfs/dbraw/zinc/99/63/06/565996306.db2.gz OMBGDBYPASADQM-FHLIZLRMSA-N 0 3 388.936 3.170 10 0 GGAEHN COCc1nc(C)c(C(=O)NC[C@H]2CCCN(C)[C@H]2c2cccs2)s1 ZINC000245612374 565998406 /nfs/dbraw/zinc/99/84/06/565998406.db2.gz BYJFDHCDJNTEFS-CZUORRHYSA-N 0 3 379.551 3.472 10 0 GGAEHN CC(C)N1CC[C@H](N[C@H](C)CS(C)(=O)=O)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000245608788 565998634 /nfs/dbraw/zinc/99/86/34/565998634.db2.gz UDTDSJIDGMRIGM-DQYPLSBCSA-N 0 3 376.925 3.026 10 0 GGAEHN CCS(=O)(=O)C[C@H](C)N[C@H]1CCN(C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245613985 565998682 /nfs/dbraw/zinc/99/86/82/565998682.db2.gz XACHKBMQPXZJEN-KKXDTOCCSA-N 0 3 390.952 3.416 10 0 GGAEHN CCS(=O)(=O)C[C@H](C)N[C@@H]1CCN(C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245613992 565999075 /nfs/dbraw/zinc/99/90/75/565999075.db2.gz XACHKBMQPXZJEN-VHSSKADRSA-N 0 3 390.952 3.416 10 0 GGAEHN CN1CCC(C(=O)N2CCC[C@@H]2c2ccccc2I)CC1 ZINC000363301654 565999120 /nfs/dbraw/zinc/99/91/20/565999120.db2.gz BDCFKGFVFVCXOE-MRXNPFEDSA-N 0 3 398.288 3.297 10 0 GGAEHN Cc1cccc(NC(=O)NCCCNCc2cccnc2)c1Br ZINC000415493140 566000195 /nfs/dbraw/zinc/00/01/95/566000195.db2.gz CSXXOQWNVHQBAI-UHFFFAOYSA-N 0 3 377.286 3.454 10 0 GGAEHN CN1CC[C@H](NC(=O)COc2ccccc2Br)[C@H]1c1ccccc1 ZINC000245678419 566001596 /nfs/dbraw/zinc/00/15/96/566001596.db2.gz LVJSTNOBKNTOTQ-QFBILLFUSA-N 0 3 389.293 3.390 10 0 GGAEHN CN1CC[C@H](NC(=O)COc2ccccc2Br)[C@@H]1c1ccccc1 ZINC000179706218 566001766 /nfs/dbraw/zinc/00/17/66/566001766.db2.gz LVJSTNOBKNTOTQ-LPHOPBHVSA-N 0 3 389.293 3.390 10 0 GGAEHN O[C@@H](CN1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1)c1cccc(Br)c1 ZINC000245717490 566003679 /nfs/dbraw/zinc/00/36/79/566003679.db2.gz GWSAQKOWNZXYIJ-ZBFHGGJFSA-N 0 3 391.313 3.358 10 0 GGAEHN O[C@@H](CN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1cccc(Br)c1 ZINC000245717490 566003685 /nfs/dbraw/zinc/00/36/85/566003685.db2.gz GWSAQKOWNZXYIJ-ZBFHGGJFSA-N 0 3 391.313 3.358 10 0 GGAEHN CC(C(=O)N[C@H]1CCCC[C@H]1C)S(=O)(=O)Cc1nc(C(C)(C)C)cs1 ZINC000245859310 566007799 /nfs/dbraw/zinc/00/77/99/566007799.db2.gz HJUJOFWJKCLMNR-RDBSUJKOSA-N 0 3 386.583 3.439 10 0 GGAEHN CC(C(=O)N1C[C@H](C)C[C@H](C)C1)S(=O)(=O)Cc1nc(C(C)(C)C)cs1 ZINC000245888764 566009394 /nfs/dbraw/zinc/00/93/94/566009394.db2.gz YXNPWONZJUQMHD-MJBXVCDLSA-N 0 3 386.583 3.248 10 0 GGAEHN Cn1cc([C@H]2CCN(Cc3cnn(-c4ccc(Br)cc4)c3)C2)cn1 ZINC000179807440 566009704 /nfs/dbraw/zinc/00/97/04/566009704.db2.gz SSJBGRSJRNNDIE-HNNXBMFYSA-N 0 3 386.297 3.358 10 0 GGAEHN COc1ccc(CNC(=O)N2CCC[C@H]3CN(C)CC[C@H]32)cc1Br ZINC000245918326 566010613 /nfs/dbraw/zinc/01/06/13/566010613.db2.gz GRPCXYAEFFUVBA-GOEBONIOSA-N 0 3 396.329 3.083 10 0 GGAEHN Cc1ccc(I)cc1C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000245965988 566011816 /nfs/dbraw/zinc/01/18/16/566011816.db2.gz DRDSIWUDAYPYTL-GXTWGEPZSA-N 0 3 386.277 3.154 10 0 GGAEHN O=C(Nc1cc(F)c(Br)c(Cl)c1)N[C@H]1CNCCC1(F)F ZINC000415706638 566014203 /nfs/dbraw/zinc/01/42/03/566014203.db2.gz LLQKDJVJLOVXAL-VIFPVBQESA-N 0 3 386.599 3.360 10 0 GGAEHN O=C(Nc1cc(F)c(Br)c(Cl)c1)N[C@@H]1CNCCC1(F)F ZINC000415706637 566014234 /nfs/dbraw/zinc/01/42/34/566014234.db2.gz LLQKDJVJLOVXAL-SECBINFHSA-N 0 3 386.599 3.360 10 0 GGAEHN Cc1c(I)cccc1C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000246071736 566015045 /nfs/dbraw/zinc/01/50/45/566015045.db2.gz YCIYQKUIGUQZRD-AAEUAGOBSA-N 0 3 386.277 3.154 10 0 GGAEHN O=C(Nc1cccc2cc(Br)cnc21)N[C@H]1CNCCC1(F)F ZINC000415721160 566015438 /nfs/dbraw/zinc/01/54/38/566015438.db2.gz JKTCXPLXIGSPMC-LBPRGKRZSA-N 0 3 385.212 3.116 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(C)c(Br)c2)[C@@H](C)C1 ZINC000246118997 566017059 /nfs/dbraw/zinc/01/70/59/566017059.db2.gz IYCMZUBYFKUCMG-XJKSGUPXSA-N 0 3 389.359 3.108 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)Nc2cc(OC)c(Br)c(OC)c2)C1 ZINC000179907066 566018712 /nfs/dbraw/zinc/01/87/12/566018712.db2.gz XFARFTYETLPGCH-LLVKDONJSA-N 0 3 386.290 3.072 10 0 GGAEHN CN(C[C@@H](O)COc1c(Cl)cccc1Cl)[C@@H]1CCCc2c1cnn2C ZINC000246195950 566021781 /nfs/dbraw/zinc/02/17/81/566021781.db2.gz ABNBLMGETLKHJH-MLGOLLRUSA-N 0 3 384.307 3.476 10 0 GGAEHN Brc1ccc([C@@H](NC[C@@H]2COC3(CCOCC3)O2)C2CC2)cc1 ZINC000179984401 566023030 /nfs/dbraw/zinc/02/30/30/566023030.db2.gz AEWVKGZKPIMPFG-SJORKVTESA-N 0 3 382.298 3.412 10 0 GGAEHN O=C(Nc1ccc2c(c1)CNC2)N[C@H](CCO)c1ccccc1Br ZINC000415984996 566023947 /nfs/dbraw/zinc/02/39/47/566023947.db2.gz ADJXCRXAKHYKNZ-QGZVFWFLSA-N 0 3 390.281 3.298 10 0 GGAEHN CC(C)N1C[C@H](C)[C@H](NC(=O)Nc2ccccc2I)C1 ZINC000246285986 566024186 /nfs/dbraw/zinc/02/41/86/566024186.db2.gz BXGKTKXJUKKMFF-SMDDNHRTSA-N 0 3 387.265 3.141 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2F)[C@@H](C)C1 ZINC000246274711 566024480 /nfs/dbraw/zinc/02/44/80/566024480.db2.gz VEJKOOVXBPVYLT-SMDDNHRTSA-N 0 3 382.423 3.195 10 0 GGAEHN C[C@@H]1CN2CCC[C@H]2CN1Cc1nc(-c2ccc(Br)s2)no1 ZINC000246303626 566025650 /nfs/dbraw/zinc/02/56/50/566025650.db2.gz CKEGYXGSNHRKAD-MNOVXSKESA-N 0 3 383.315 3.229 10 0 GGAEHN O=S(=O)(c1ccc(Cl)nc1Cl)N1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 ZINC000246380264 566026973 /nfs/dbraw/zinc/02/69/73/566026973.db2.gz OPIFLVJMMVPIQK-WCQYABFASA-N 0 3 390.336 3.026 10 0 GGAEHN COc1c(Br)cccc1CN(C)C1CCN(c2cnccn2)CC1 ZINC000364006682 566029454 /nfs/dbraw/zinc/02/94/54/566029454.db2.gz DLHDYNGEYKQYOA-UHFFFAOYSA-N 0 3 391.313 3.349 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(C)c(Br)s2)[C@@H](C)C1 ZINC000246504780 566031080 /nfs/dbraw/zinc/03/10/80/566031080.db2.gz NKHPCYNRNYXZFV-RYUDHWBXSA-N 0 3 395.388 3.170 10 0 GGAEHN CC[C@@H]1CN(Cc2ccc(Br)c3cccnc23)CCN1C[C@@H](C)O ZINC000180099473 566032989 /nfs/dbraw/zinc/03/29/89/566032989.db2.gz LFWPUHKTRAUEIH-GDBMZVCRSA-N 0 3 392.341 3.274 10 0 GGAEHN C[C@H](NC[C@@H](O)c1cc(Cl)cc(Cl)c1)c1ccc(S(N)(=O)=O)cc1 ZINC000180123254 566034413 /nfs/dbraw/zinc/03/44/13/566034413.db2.gz JDRGJUNHDVRVFI-MGPLVRAMSA-N 0 3 389.304 3.025 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1Cc1cc(Br)c2c(c1)OCCO2 ZINC000180124605 566035086 /nfs/dbraw/zinc/03/50/86/566035086.db2.gz ZDZRXOPCHSKHTI-HNNXBMFYSA-N 0 3 392.297 3.390 10 0 GGAEHN CN(Cc1cc(Br)ccc1F)C(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C ZINC000364123110 566036268 /nfs/dbraw/zinc/03/62/68/566036268.db2.gz VRIKEWORJQFTOT-QIIPPGSGSA-N 0 3 399.304 3.079 10 0 GGAEHN CC[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc(C)cc1Br ZINC000246693249 566037264 /nfs/dbraw/zinc/03/72/64/566037264.db2.gz YYJSWMSYIRKFAL-KBPBESRZSA-N 0 3 387.343 3.005 10 0 GGAEHN COc1c(Br)c(C)sc1C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000246708341 566037347 /nfs/dbraw/zinc/03/73/47/566037347.db2.gz CMXNKEMBSTWZDB-ONGXEEELSA-N 0 3 375.332 3.382 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N(C)[C@@H]1CCN(C)C[C@@H]1C ZINC000246753302 566039679 /nfs/dbraw/zinc/03/96/79/566039679.db2.gz ZOFCRKUNBCOGQP-JJRVBVJISA-N 0 3 382.346 3.362 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N(C)[C@@H]1CCN(C)C[C@H]1C ZINC000246753281 566039764 /nfs/dbraw/zinc/03/97/64/566039764.db2.gz ZOFCRKUNBCOGQP-CKEIUWERSA-N 0 3 382.346 3.362 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)N1CCc2cc(Cl)cc(Cl)c2C1 ZINC000364221980 566039808 /nfs/dbraw/zinc/03/98/08/566039808.db2.gz QKVRVQFGSBIDKD-GMBSWORKSA-N 0 3 383.319 3.411 10 0 GGAEHN Cc1cc(Br)ccc1CN[C@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000180171689 566040114 /nfs/dbraw/zinc/04/01/14/566040114.db2.gz XDWGHMUQDDSKFI-GFCCVEGCSA-N 0 3 383.311 3.256 10 0 GGAEHN Cc1cc(Br)ccc1CN[C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000180171673 566040378 /nfs/dbraw/zinc/04/03/78/566040378.db2.gz XDWGHMUQDDSKFI-LBPRGKRZSA-N 0 3 383.311 3.256 10 0 GGAEHN C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cc2c(cc(Br)cc2F)[nH]1 ZINC000246770721 566041106 /nfs/dbraw/zinc/04/11/06/566041106.db2.gz AWKRYEABENXYLG-JQWIXIFHSA-N 0 3 380.261 3.378 10 0 GGAEHN C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1 ZINC000246801228 566041260 /nfs/dbraw/zinc/04/12/60/566041260.db2.gz BUNHZJYYFADIEM-WFASDCNBSA-N 0 3 379.291 3.488 10 0 GGAEHN CO[C@H](c1ccc(Cl)cc1)[C@H](C)N[C@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000180179632 566041346 /nfs/dbraw/zinc/04/13/46/566041346.db2.gz FIPQALNQDXVLRB-VBHSOAQHSA-N 0 3 382.913 3.414 10 0 GGAEHN C[C@@H](NC[C@@H](O)c1c(Cl)cccc1Cl)c1ccc(S(N)(=O)=O)cc1 ZINC000180182957 566041655 /nfs/dbraw/zinc/04/16/55/566041655.db2.gz VQBVUJAFMNXRJV-MEBBXXQBSA-N 0 3 389.304 3.025 10 0 GGAEHN CN(C)[C@@H](CC(=O)N[C@@H](CO)c1cccc(Br)c1)c1ccccc1 ZINC000416189552 566042535 /nfs/dbraw/zinc/04/25/35/566042535.db2.gz KWBVGDQGUBNZBB-ROUUACIJSA-N 0 3 391.309 3.292 10 0 GGAEHN CC(C)(C)OC(=O)[C@H]1CCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000246810915 566042513 /nfs/dbraw/zinc/04/25/13/566042513.db2.gz AAVAYYITOYWBRJ-QWHCGFSZSA-N 0 3 390.307 3.397 10 0 GGAEHN COc1ccc(CCC(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)cc1Br ZINC000246854139 566044340 /nfs/dbraw/zinc/04/43/40/566044340.db2.gz UCDRJCZDYBRWQI-RDJZCZTQSA-N 0 3 395.341 3.333 10 0 GGAEHN C[C@@H]1CN(CC2=Cc3cc(Cl)cc(Cl)c3OC2)C[C@@H]1N1CCOCC1 ZINC000180226421 566045053 /nfs/dbraw/zinc/04/50/53/566045053.db2.gz JDWNKPHQDZBLHM-ACJLOTCBSA-N 0 3 383.319 3.422 10 0 GGAEHN C[C@H]1CN2CCC[C@H]2CN1Cc1nc(-c2cc(Br)cs2)no1 ZINC000246982395 566048741 /nfs/dbraw/zinc/04/87/41/566048741.db2.gz DYHFLPLHINMCNH-JQWIXIFHSA-N 0 3 383.315 3.229 10 0 GGAEHN C[C@H](Oc1ccc(F)cc1Br)C(=O)N1C[C@H]2CCCN2C[C@@H]1C ZINC000246961027 566048808 /nfs/dbraw/zinc/04/88/08/566048808.db2.gz DJPQJTLXCLUYNQ-SGMGOOAPSA-N 0 3 385.277 3.051 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)N[C@H](c2cncc(Br)c2)C2CC2)CCN1C ZINC000287955456 566050004 /nfs/dbraw/zinc/05/00/04/566050004.db2.gz VLFGSRJPKFMDGK-JLZZUVOBSA-N 0 3 395.345 3.419 10 0 GGAEHN C[C@H](Cc1ccc(F)c(Br)c1)C(=O)N1C[C@@H]2CCCN2C[C@@H]1C ZINC000247076045 566052081 /nfs/dbraw/zinc/05/20/81/566052081.db2.gz QNFXSBSCRADISP-IPYPFGDCSA-N 0 3 383.305 3.462 10 0 GGAEHN Cc1nn(CC(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)c(C)c1Cl ZINC000247181545 566054460 /nfs/dbraw/zinc/05/44/60/566054460.db2.gz BCFJNIFSBBJZHE-KBXCAEBGSA-N 0 3 380.945 3.414 10 0 GGAEHN Cc1ccc(I)c(C(=O)N(C)[C@H]2CCN(C)C[C@H]2C)c1 ZINC000247361441 566058866 /nfs/dbraw/zinc/05/88/66/566058866.db2.gz KDWYQASBGFCEIE-DOMZBBRYSA-N 0 3 386.277 3.012 10 0 GGAEHN C[C@H](Oc1ccc(F)cc1Br)C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000247342219 566058982 /nfs/dbraw/zinc/05/89/82/566058982.db2.gz JFNAYDGQBIJKOU-SGMGOOAPSA-N 0 3 387.293 3.297 10 0 GGAEHN C[C@H](Oc1ccc(F)cc1Br)C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000247342210 566059395 /nfs/dbraw/zinc/05/93/95/566059395.db2.gz JFNAYDGQBIJKOU-OBJOEFQTSA-N 0 3 387.293 3.297 10 0 GGAEHN Cc1sc2ncnc(SCC(=O)N[C@@H]3CN(C(C)C)C[C@H]3C)c2c1C ZINC000247438649 566060704 /nfs/dbraw/zinc/06/07/04/566060704.db2.gz RVJFBDKGOSWQJS-BXUZGUMPSA-N 0 3 378.567 3.245 10 0 GGAEHN C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1 ZINC000247470934 566061347 /nfs/dbraw/zinc/06/13/47/566061347.db2.gz RQQXLRUDVINRML-JSGCOSHPSA-N 0 3 379.291 3.488 10 0 GGAEHN C[C@H]1CN2CCC[C@H]2CN1Cc1nnc(-c2ccccc2Br)o1 ZINC000247478038 566061618 /nfs/dbraw/zinc/06/16/18/566061618.db2.gz SJUMBQHLCUTQCA-STQMWFEESA-N 0 3 377.286 3.168 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)cc1OC ZINC000247482922 566061823 /nfs/dbraw/zinc/06/18/23/566061823.db2.gz WHGIKQSJRLJAPK-IUODEOHRSA-N 0 3 399.329 3.315 10 0 GGAEHN Cc1cccc(C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c1I ZINC000247477586 566061953 /nfs/dbraw/zinc/06/19/53/566061953.db2.gz VVHUTANILOAXBV-TZMCWYRMSA-N 0 3 386.277 3.058 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)Cc2cc(Cl)cc(Cl)c2)[C@@H](C)C1 ZINC000247668862 566063699 /nfs/dbraw/zinc/06/36/99/566063699.db2.gz ZCRJDZAVPAJDJI-LRDDRELGSA-N 0 3 379.353 3.485 10 0 GGAEHN C[C@H](NC(=O)C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1)c1cccc(Cl)c1Cl ZINC000288241892 566064348 /nfs/dbraw/zinc/06/43/48/566064348.db2.gz QPODXMYGBMSLCL-RWMBFGLXSA-N 0 3 386.323 3.112 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)N[C@H]1CCSc2ccc(Cl)cc21 ZINC000247650685 566064390 /nfs/dbraw/zinc/06/43/90/566064390.db2.gz WNDWMYRMVWVLGN-HOCLYGCPSA-N 0 3 383.945 3.287 10 0 GGAEHN CS(=O)(=O)N1CCC[C@H](CN[C@@H](CC(F)(F)F)c2ccc(F)cc2)C1 ZINC000180566143 566073365 /nfs/dbraw/zinc/07/33/65/566073365.db2.gz HZCDPCHVWXIDIP-DOMZBBRYSA-N 0 3 382.423 3.080 10 0 GGAEHN CCc1nc2n(n1)C[C@H](N[C@@H](C)c1ccc(OC)c(Br)c1)CC2 ZINC000180612599 566076905 /nfs/dbraw/zinc/07/69/05/566076905.db2.gz PEUQEPOJMIVLEU-WCQYABFASA-N 0 3 379.302 3.277 10 0 GGAEHN CCc1nc2n(n1)C[C@@H](N[C@@H](C)c1ccc(I)cc1)CC2 ZINC000180625815 566078062 /nfs/dbraw/zinc/07/80/62/566078062.db2.gz WDQRFKNXFXRUII-FZMZJTMJSA-N 0 3 396.276 3.111 10 0 GGAEHN CCc1nc2n(n1)C[C@H](N[C@H](C)c1ccc(I)cc1)CC2 ZINC000180625833 566078490 /nfs/dbraw/zinc/07/84/90/566078490.db2.gz WDQRFKNXFXRUII-BXUZGUMPSA-N 0 3 396.276 3.111 10 0 GGAEHN O[C@@H]1CCCC[C@@H]1CN[C@@H](c1ccc(Br)cc1)c1cncnc1 ZINC000248552335 566081174 /nfs/dbraw/zinc/08/11/74/566081174.db2.gz JCIKTBVVQMRYLY-OLMNPRSZSA-N 0 3 376.298 3.469 10 0 GGAEHN O[C@@H]1CCCC[C@H]1CN[C@@H](c1ccc(Br)cc1)c1cncnc1 ZINC000248552579 566081289 /nfs/dbraw/zinc/08/12/89/566081289.db2.gz JCIKTBVVQMRYLY-QGTPRVQTSA-N 0 3 376.298 3.469 10 0 GGAEHN CCS(=O)(=O)NCCCN1CCC(c2ccc(C(F)(F)F)cc2)CC1 ZINC000180693331 566081892 /nfs/dbraw/zinc/08/18/92/566081892.db2.gz BXRDKXAFECOCGJ-UHFFFAOYSA-N 0 3 378.460 3.214 10 0 GGAEHN C[C@H](CC(=O)Nc1cccc(Br)c1)NCC(=O)NC1CCCCC1 ZINC000180732322 566084458 /nfs/dbraw/zinc/08/44/58/566084458.db2.gz FYWUEWMVZMYXGT-CYBMUJFWSA-N 0 3 396.329 3.205 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(Br)cc2C)[C@@H](C)C1 ZINC000248697160 566086834 /nfs/dbraw/zinc/08/68/34/566086834.db2.gz JXSKASXYGMKWJC-ZFWWWQNUSA-N 0 3 389.359 3.108 10 0 GGAEHN O[C@H](CN1CCCN(c2nnc(C(F)(F)F)s2)CC1)C1CCCCC1 ZINC000365274711 566092683 /nfs/dbraw/zinc/09/26/83/566092683.db2.gz BXMFXCLPBSAOJM-CYBMUJFWSA-N 0 3 378.464 3.010 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(Cl)c(F)c2Cl)[C@@H](C)C1 ZINC000249038582 566095874 /nfs/dbraw/zinc/09/58/74/566095874.db2.gz GLLMSOFTQPKPBM-JQWIXIFHSA-N 0 3 383.316 3.483 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(Cl)c(F)c2Cl)[C@@H](C)C1 ZINC000249038579 566095950 /nfs/dbraw/zinc/09/59/50/566095950.db2.gz GLLMSOFTQPKPBM-CMPLNLGQSA-N 0 3 383.316 3.483 10 0 GGAEHN CN1CCCN(c2ccc(NC(=O)c3ncsc3Br)cc2)CC1 ZINC000288931168 566097947 /nfs/dbraw/zinc/09/79/47/566097947.db2.gz TYAIKVZGXBAEBT-UHFFFAOYSA-N 0 3 395.326 3.300 10 0 GGAEHN CN(Cc1cc(F)cc(Br)c1)C1CCN(c2cnccn2)CC1 ZINC000365519314 566106267 /nfs/dbraw/zinc/10/62/67/566106267.db2.gz XVOZNQIVHFMYHY-UHFFFAOYSA-N 0 3 379.277 3.479 10 0 GGAEHN C[C@H]1SCCN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)[C@H]1C ZINC000365547434 566107526 /nfs/dbraw/zinc/10/75/26/566107526.db2.gz OKLCNFXOCOGBDH-CZWNDGCPSA-N 0 3 379.492 3.327 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)NC[C@@]2(C)CCCS2)C1 ZINC000251716807 566111918 /nfs/dbraw/zinc/11/19/18/566111918.db2.gz LCAKCMNAPNYERY-CRAIPNDOSA-N 0 3 382.599 3.201 10 0 GGAEHN CC(C)N1CC[C@@H](NCCCS(C)(=O)=O)[C@H]1c1ccc(Cl)c(F)c1 ZINC000252515227 566115380 /nfs/dbraw/zinc/11/53/80/566115380.db2.gz HXJFIINVPIYTIM-IAGOWNOFSA-N 0 3 376.925 3.027 10 0 GGAEHN O[C@@H](CSc1ncccc1Br)CN1CCc2ccccc2C1 ZINC000181153121 566120217 /nfs/dbraw/zinc/12/02/17/566120217.db2.gz KBVPMKGLCWEJPN-OAHLLOKOSA-N 0 3 379.323 3.355 10 0 GGAEHN Cc1nc2ccccn2c(=O)c1CCN[C@@H](C)c1ccc(Br)cn1 ZINC000289406446 566121152 /nfs/dbraw/zinc/12/11/52/566121152.db2.gz OTSJDPWLQGGCDW-ZDUSSCGKSA-N 0 3 387.281 3.054 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)c2coc(-c3ccc(Br)cc3F)n2)C1 ZINC000181200313 566123745 /nfs/dbraw/zinc/12/37/45/566123745.db2.gz PLCFCSGQWIKOHH-LLVKDONJSA-N 0 3 382.233 3.019 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)NC[C@H](N)c1ccccc1 ZINC000417097004 566124682 /nfs/dbraw/zinc/12/46/82/566124682.db2.gz DDZKLBABJQFQRI-GUYCJALGSA-N 0 3 376.298 3.379 10 0 GGAEHN CS(=O)(=O)CC1(CN[C@H]2CCCOc3ccc(Br)cc32)CC1 ZINC000181224270 566126296 /nfs/dbraw/zinc/12/62/96/566126296.db2.gz FTGDMAHTBOWZHF-AWEZNQCLSA-N 0 3 388.327 3.077 10 0 GGAEHN CC(C)C[C@](C)(C[NH3+])[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000261715060 566130001 /nfs/dbraw/zinc/13/00/01/566130001.db2.gz JUNCESMOELTRCF-CYBMUJFWSA-N 0 3 383.739 3.144 10 0 GGAEHN O=C(CCN1CCNC[C@H]1c1cccnc1)Nc1c(Cl)cccc1Cl ZINC000261732014 566131829 /nfs/dbraw/zinc/13/18/29/566131829.db2.gz LXZFFWYZSGGEKE-INIZCTEOSA-N 0 3 379.291 3.364 10 0 GGAEHN Cc1nc(NC(=O)[C@@H](N)C2CCOCC2)sc1Cc1cccc(Cl)c1 ZINC000261760243 566133568 /nfs/dbraw/zinc/13/35/68/566133568.db2.gz LSVJBZWMFQWZDN-INIZCTEOSA-N 0 3 379.913 3.388 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C ZINC000261786749 566134630 /nfs/dbraw/zinc/13/46/30/566134630.db2.gz YLMJXUOGQWKQMO-XXHPDZBISA-N 0 3 395.341 3.029 10 0 GGAEHN CC(C)(C(=O)NC1CCN([C@@H]2CCOC2)CC1)c1cccc(Br)c1 ZINC000366191547 566140185 /nfs/dbraw/zinc/14/01/85/566140185.db2.gz KXHVAUONRKYNDC-QGZVFWFLSA-N 0 3 395.341 3.096 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NC1CCN([C@H]2CCOC2)CC1 ZINC000366197338 566140406 /nfs/dbraw/zinc/14/04/06/566140406.db2.gz ATTPESKGIHXBLS-WFASDCNBSA-N 0 3 387.307 3.130 10 0 GGAEHN COCCOc1c(Cl)cc(NC(=O)N2CC[C@H](N(C)C)C2)cc1Cl ZINC000181459456 566142360 /nfs/dbraw/zinc/14/23/60/566142360.db2.gz UCJAAPFLRCSSQA-LBPRGKRZSA-N 0 3 376.284 3.186 10 0 GGAEHN CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(Cc1cnc(N)s1)CC2 ZINC000262023716 566143896 /nfs/dbraw/zinc/14/38/96/566143896.db2.gz NKCNALAYWYOCFM-INIZCTEOSA-N 0 3 376.551 3.190 10 0 GGAEHN C[C@H](NC(=O)NCCCNCc1cccnc1)c1ccc(Br)cc1 ZINC000417310731 566146138 /nfs/dbraw/zinc/14/61/38/566146138.db2.gz KPMGXRIJKDFEPN-AWEZNQCLSA-N 0 3 391.313 3.384 10 0 GGAEHN CCN1CCN(c2cccc(NC(=O)c3ncsc3Br)c2)CC1 ZINC000289905887 566146494 /nfs/dbraw/zinc/14/64/94/566146494.db2.gz NFGJPZJQVCLARN-UHFFFAOYSA-N 0 3 395.326 3.300 10 0 GGAEHN Cc1csc(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)n1 ZINC000366321854 566146816 /nfs/dbraw/zinc/14/68/16/566146816.db2.gz WOGPICGGKGTFGU-UHFFFAOYSA-N 0 3 376.448 3.056 10 0 GGAEHN O=C(NCCCNCc1cccnc1)NCCc1cc(Cl)cc(Cl)c1 ZINC000417302438 566147099 /nfs/dbraw/zinc/14/70/99/566147099.db2.gz BJOZSDKDOAZWQK-UHFFFAOYSA-N 0 3 381.307 3.410 10 0 GGAEHN Cc1c(Br)cccc1CN[C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000181563636 566149687 /nfs/dbraw/zinc/14/96/87/566149687.db2.gz LXXLGVSEYSOPLM-LBPRGKRZSA-N 0 3 383.311 3.256 10 0 GGAEHN C[C@H](NCCOc1cc(Cl)ccc1Cl)c1ccc(S(N)(=O)=O)cc1 ZINC000181563919 566149692 /nfs/dbraw/zinc/14/96/92/566149692.db2.gz BZGVJDXNCFSQQE-NSHDSACASA-N 0 3 389.304 3.370 10 0 GGAEHN O=S(=O)(Cc1ccc(Cl)cc1Cl)N1CC[C@H](CN2CCCC2)C1 ZINC000181658244 566155733 /nfs/dbraw/zinc/15/57/33/566155733.db2.gz XFNNMHUCCOPHIW-CYBMUJFWSA-N 0 3 377.337 3.241 10 0 GGAEHN COC[C@@H](NC[C@@H](O)COc1cccc(Br)c1)c1ccccc1 ZINC000181645520 566156316 /nfs/dbraw/zinc/15/63/16/566156316.db2.gz RGDLPWWNOZQPJQ-SJLPKXTDSA-N 0 3 380.282 3.166 10 0 GGAEHN O=C(NCCOCc1ccc(Cl)cc1Cl)N1CC[C@H](N2CC=CC2)C1 ZINC000181711583 566160778 /nfs/dbraw/zinc/16/07/78/566160778.db2.gz ORMOLWSCWPXLOB-INIZCTEOSA-N 0 3 384.307 3.166 10 0 GGAEHN CN1CCC[C@@H]2CN(S(=O)(=O)Cc3ccc(Cl)cc3Cl)CC[C@@H]21 ZINC000181707439 566160817 /nfs/dbraw/zinc/16/08/17/566160817.db2.gz YZXLVNSGTVNFNL-WBMJQRKESA-N 0 3 377.337 3.239 10 0 GGAEHN O=C(NCCCN1CCC(O)CC1)c1sc2ccccc2c1Br ZINC000290292274 566165612 /nfs/dbraw/zinc/16/56/12/566165612.db2.gz DFPZTKHYDRQBPB-UHFFFAOYSA-N 0 3 397.338 3.240 10 0 GGAEHN O=C(Nc1n[nH]c2c1cccc2Cl)C(C[C@H]1COCCO1)C(F)(F)F ZINC000612703847 566170538 /nfs/dbraw/zinc/17/05/38/566170538.db2.gz CZYZWMUYYBMIPB-WPRPVWTQSA-N 0 3 377.750 3.139 10 0 GGAEHN O=C(Nc1n[nH]c2c1cccc2Cl)C(C[C@H]1COCCO1)C(F)(F)F ZINC000612703846 566170730 /nfs/dbraw/zinc/17/07/30/566170730.db2.gz CZYZWMUYYBMIPB-WCBMZHEXSA-N 0 3 377.750 3.139 10 0 GGAEHN O=C(Nc1n[nH]c2c1cccc2Cl)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000612703844 566170762 /nfs/dbraw/zinc/17/07/62/566170762.db2.gz CZYZWMUYYBMIPB-PSASIEDQSA-N 0 3 377.750 3.139 10 0 GGAEHN CCN(CC)CCN(CC(C)C)S(=O)(=O)c1ccc(C(F)(F)F)nc1 ZINC000181915554 566173302 /nfs/dbraw/zinc/17/33/02/566173302.db2.gz SBNWLPLELYGYAQ-UHFFFAOYSA-N 0 3 381.464 3.089 10 0 GGAEHN C[C@H](CNC(=O)NC[C@@H](N)c1ccccc1)Oc1ccc(Br)cc1 ZINC000417774020 566173901 /nfs/dbraw/zinc/17/39/01/566173901.db2.gz KHAXEMYLVMJMQO-CXAGYDPISA-N 0 3 392.297 3.216 10 0 GGAEHN Cc1cn[nH]c1CN1CCC(C(=O)Nc2ccccc2Br)CC1 ZINC000290581714 566179562 /nfs/dbraw/zinc/17/95/62/566179562.db2.gz ZMZPDMKEBFPHQY-UHFFFAOYSA-N 0 3 377.286 3.331 10 0 GGAEHN C[C@@H](Cc1ccccc1Br)NC(=O)NC[C@@H](N)c1ccccc1 ZINC000417895853 566179754 /nfs/dbraw/zinc/17/97/54/566179754.db2.gz QHFBSTQYLBQCGB-SUMWQHHRSA-N 0 3 376.298 3.379 10 0 GGAEHN COc1cc(Br)ccc1CN1CCC(CN2CCOCC2)CC1 ZINC000182080974 566181755 /nfs/dbraw/zinc/18/17/55/566181755.db2.gz MJBMFTHEGZVZIA-UHFFFAOYSA-N 0 3 383.330 3.002 10 0 GGAEHN Cc1cc(N2CCC[C@H](N[C@@H](C)c3ccc(Br)nc3)C2)n(C)n1 ZINC000290628380 566182001 /nfs/dbraw/zinc/18/20/01/566182001.db2.gz IWPGVNBPPMCCRD-ZFWWWQNUSA-N 0 3 378.318 3.206 10 0 GGAEHN Cc1cc(N2CCC[C@@H](N[C@H](C)c3ccc(Br)nc3)C2)n(C)n1 ZINC000290628373 566182075 /nfs/dbraw/zinc/18/20/75/566182075.db2.gz IWPGVNBPPMCCRD-UKRRQHHQSA-N 0 3 378.318 3.206 10 0 GGAEHN COc1cc(Br)ccc1CN(C)[C@@H]1CCCN(c2cccnn2)C1 ZINC000182170319 566186525 /nfs/dbraw/zinc/18/65/25/566186525.db2.gz RHECNNQNPJMGLN-MRXNPFEDSA-N 0 3 391.313 3.349 10 0 GGAEHN COc1cc(Br)ccc1CN1CCN(CC2CCOCC2)CC1 ZINC000182190990 566187763 /nfs/dbraw/zinc/18/77/63/566187763.db2.gz CUFVWAUWFAONNP-UHFFFAOYSA-N 0 3 383.330 3.002 10 0 GGAEHN C[C@H](CS(C)(=O)=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)N2C ZINC000367163564 566188151 /nfs/dbraw/zinc/18/81/51/566188151.db2.gz KOZGWQZBXDWCIQ-QNBCLJFBSA-N 0 3 384.973 3.277 10 0 GGAEHN C[C@@H](CS(C)(=O)=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)N2C ZINC000367163563 566188547 /nfs/dbraw/zinc/18/85/47/566188547.db2.gz KOZGWQZBXDWCIQ-QKHUXGNCSA-N 0 3 384.973 3.277 10 0 GGAEHN CCn1nncc1CN[C@@H]1CCCN(c2c(C)cc(Br)cc2C)C1 ZINC000418053104 566193366 /nfs/dbraw/zinc/19/33/66/566193366.db2.gz BGKCWMQMGLQKRV-MRXNPFEDSA-N 0 3 392.345 3.436 10 0 GGAEHN N[C@H](CNC(=O)N[C@H]1CCOc2c(Br)cccc21)c1ccccc1 ZINC000418146776 566199707 /nfs/dbraw/zinc/19/97/07/566199707.db2.gz AMZJTCMASMFYPU-CVEARBPZSA-N 0 3 390.281 3.272 10 0 GGAEHN N[C@@H](CNC(=O)N[C@@H]1CCOc2c(Br)cccc21)c1ccccc1 ZINC000418146779 566200232 /nfs/dbraw/zinc/20/02/32/566200232.db2.gz AMZJTCMASMFYPU-JKSUJKDBSA-N 0 3 390.281 3.272 10 0 GGAEHN CC[C@H](NC(=O)N[C@H]1CNCCC1(F)F)c1cc(F)cc(Br)c1 ZINC000418145574 566200324 /nfs/dbraw/zinc/20/03/24/566200324.db2.gz OKMKEFKFORTFIW-STQMWFEESA-N 0 3 394.235 3.336 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)COc1ccc(C2SCCCS2)cc1 ZINC000263913555 566200373 /nfs/dbraw/zinc/20/03/73/566200373.db2.gz NFSRKQKBGMKVPM-MRXNPFEDSA-N 0 3 380.579 3.487 10 0 GGAEHN O=C(NCc1cnc(-c2ccc(Cl)cc2)s1)N[C@@H]1CNCCC1(F)F ZINC000418177532 566202264 /nfs/dbraw/zinc/20/22/64/566202264.db2.gz HTFKICRPGFHRHA-CYBMUJFWSA-N 0 3 386.855 3.260 10 0 GGAEHN CN(Cc1ccc(Br)cc1)C(=O)NCCCNCc1cccnc1 ZINC000418322317 566208872 /nfs/dbraw/zinc/20/88/72/566208872.db2.gz COCYGTDGXQYGDO-UHFFFAOYSA-N 0 3 391.313 3.165 10 0 GGAEHN N[C@@H](CNC(=O)N1CCOc2ccc(Br)cc2C1)c1ccccc1 ZINC000418420191 566212009 /nfs/dbraw/zinc/21/20/09/566212009.db2.gz AOHMOODHFVAXQA-INIZCTEOSA-N 0 3 390.281 3.053 10 0 GGAEHN CN(CCc1ccc(Br)cc1)C(=O)NC[C@H](N)c1ccccc1 ZINC000418406119 566212383 /nfs/dbraw/zinc/21/23/83/566212383.db2.gz BSKYEQTVKZCBCU-KRWDZBQOSA-N 0 3 376.298 3.333 10 0 GGAEHN N[C@H](CNC(=O)N1CCOc2ccc(Br)cc2C1)c1ccccc1 ZINC000418420292 566212427 /nfs/dbraw/zinc/21/24/27/566212427.db2.gz AOHMOODHFVAXQA-MRXNPFEDSA-N 0 3 390.281 3.053 10 0 GGAEHN N[C@@H](CNC(=O)N1CCc2c(F)ccc(Br)c2C1)c1ccccc1 ZINC000418453816 566213331 /nfs/dbraw/zinc/21/33/31/566213331.db2.gz PQGMAOCQKACWEL-KRWDZBQOSA-N 0 3 392.272 3.356 10 0 GGAEHN COC(=O)c1cc(NC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)ccc1Br ZINC000182626782 566215871 /nfs/dbraw/zinc/21/58/71/566215871.db2.gz WWHIVYRJQZQCGW-AAEUAGOBSA-N 0 3 398.301 3.182 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)N1CCC[C@H]1c1cccc(Br)c1 ZINC000418741404 566222156 /nfs/dbraw/zinc/22/21/56/566222156.db2.gz ATPLGCZOSAUPIN-UONOGXRCSA-N 0 3 388.256 3.293 10 0 GGAEHN CCN(Cc1cc(Br)ccc1F)C(=O)N[C@@H]1CNCCC1(F)F ZINC000418747001 566222243 /nfs/dbraw/zinc/22/22/43/566222243.db2.gz IVEAMFNUIOVRHC-CYBMUJFWSA-N 0 3 394.235 3.117 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)N1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000418751418 566222339 /nfs/dbraw/zinc/22/23/39/566222339.db2.gz RALATCBACCUUEU-KGLIPLIRSA-N 0 3 375.872 3.213 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)N1CC[C@H](Sc2cccc(Cl)c2)C1 ZINC000418751416 566222373 /nfs/dbraw/zinc/22/23/73/566222373.db2.gz RALATCBACCUUEU-KBPBESRZSA-N 0 3 375.872 3.213 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)N1CCC[C@@H]1c1cccc(Br)c1 ZINC000418741405 566222419 /nfs/dbraw/zinc/22/24/19/566222419.db2.gz ATPLGCZOSAUPIN-ZIAGYGMSSA-N 0 3 388.256 3.293 10 0 GGAEHN CC(C)N(Cc1ccc(Br)cc1)C(=O)N[C@@H]1CNCCC1(F)F ZINC000418751041 566222474 /nfs/dbraw/zinc/22/24/74/566222474.db2.gz QCMOHEOIYLCSPQ-CQSZACIVSA-N 0 3 390.272 3.366 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)N1CCC(F)(c2ccc(Cl)cc2)CC1 ZINC000418764150 566223468 /nfs/dbraw/zinc/22/34/68/566223468.db2.gz NXMFHGAEUFVJQZ-AWEZNQCLSA-N 0 3 375.822 3.307 10 0 GGAEHN CN1CCC(CC(=O)NC[C@@H]2CCN(c3ccc(Br)cc3)C2)CC1 ZINC000291541776 566224950 /nfs/dbraw/zinc/22/49/50/566224950.db2.gz VHCBXUCYBYOVMJ-INIZCTEOSA-N 0 3 394.357 3.124 10 0 GGAEHN C[C@@H](NCCOc1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(Cl)s1 ZINC000182968642 566232529 /nfs/dbraw/zinc/23/25/29/566232529.db2.gz WMAZNXVDTFCCTE-GFCCVEGCSA-N 0 3 388.942 3.381 10 0 GGAEHN C[C@H](NCCOc1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(Cl)s1 ZINC000182968623 566232612 /nfs/dbraw/zinc/23/26/12/566232612.db2.gz WMAZNXVDTFCCTE-LBPRGKRZSA-N 0 3 388.942 3.381 10 0 GGAEHN O=C1C[C@H]([C@H]2CCCCN2Cc2nc3cc(Br)ccc3o2)CN1 ZINC000368505076 566240614 /nfs/dbraw/zinc/24/06/14/566240614.db2.gz UHHRCSIOCVUENL-SMDDNHRTSA-N 0 3 378.270 3.081 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NCc1cn(Cc2cccnc2)nn1 ZINC000183464935 566247289 /nfs/dbraw/zinc/24/72/89/566247289.db2.gz QZGGWLUGSDLWFY-CQSZACIVSA-N 0 3 386.297 3.205 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NCc1cn(Cc2cccnc2)nn1 ZINC000183464916 566247467 /nfs/dbraw/zinc/24/74/67/566247467.db2.gz QZGGWLUGSDLWFY-AWEZNQCLSA-N 0 3 386.297 3.205 10 0 GGAEHN CCC[C@@H](O)[C@@H](CO)NCc1cnc(-c2ccc(Br)cc2)s1 ZINC000419820965 566250648 /nfs/dbraw/zinc/25/06/48/566250648.db2.gz MZQCGQUHZLRYQN-HUUCEWRRSA-N 0 3 385.327 3.184 10 0 GGAEHN Cn1c(-c2ccc(Br)cc2)nnc1N1CC[C@@H](N2CCCCC2)C1 ZINC000508960989 566252440 /nfs/dbraw/zinc/25/24/40/566252440.db2.gz LSLHEKLJSHFMJK-MRXNPFEDSA-N 0 3 390.329 3.309 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)Nc2cccc(OCC(F)(F)F)c2)CCSC1 ZINC000481777371 566252992 /nfs/dbraw/zinc/25/29/92/566252992.db2.gz JLZZVCDXFMKOSN-OAHLLOKOSA-N 0 3 377.432 3.187 10 0 GGAEHN CN(C)[C@@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)c1ccccc1 ZINC000599347359 566254929 /nfs/dbraw/zinc/25/49/29/566254929.db2.gz NUEPMXZIVVDXGR-INIZCTEOSA-N 0 3 387.281 3.358 10 0 GGAEHN CC(C)(CNC(=O)c1[nH]nc2ccc(Br)cc21)N1CCCCC1 ZINC000599346772 566255007 /nfs/dbraw/zinc/25/50/07/566255007.db2.gz AADAZLNGMNTHAP-UHFFFAOYSA-N 0 3 379.302 3.320 10 0 GGAEHN OCC1(CO)CCN(Cc2ccc(-c3ccccc3Br)s2)C1 ZINC000668665593 566255099 /nfs/dbraw/zinc/25/50/99/566255099.db2.gz ABDUXDLVLWQPAC-UHFFFAOYSA-N 0 3 382.323 3.354 10 0 GGAEHN CN(C)S(=O)(=O)CCN(C)[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000509028328 566255470 /nfs/dbraw/zinc/25/54/70/566255470.db2.gz GCQNPUCKAFDPNP-HZPDHXFCSA-N 0 3 378.460 3.165 10 0 GGAEHN CN(C)S(=O)(=O)CCN(C)[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000509028330 566256406 /nfs/dbraw/zinc/25/64/06/566256406.db2.gz GCQNPUCKAFDPNP-JKSUJKDBSA-N 0 3 378.460 3.165 10 0 GGAEHN CC(C)CN1CCN(c2ncnc3cccc(I)c32)CC1 ZINC000575172671 566256543 /nfs/dbraw/zinc/25/65/43/566256543.db2.gz WMHLYSJCOLTENL-UHFFFAOYSA-N 0 3 396.276 3.012 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1CC[C@H]2COC[C@@H]2C1 ZINC000668706575 566257511 /nfs/dbraw/zinc/25/75/11/566257511.db2.gz UZZQKBRALSNIPD-HOCLYGCPSA-N 0 3 376.298 3.412 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CC[C@@H]2COC[C@@H]2C1 ZINC000668704058 566258289 /nfs/dbraw/zinc/25/82/89/566258289.db2.gz BORNWUMBMIPFPQ-ZBFHGGJFSA-N 0 3 376.298 3.412 10 0 GGAEHN C[C@H]1CN(C)CC[C@H]1N(C)C(=O)c1cc2c(cncc2Br)s1 ZINC000648299220 566258793 /nfs/dbraw/zinc/25/87/93/566258793.db2.gz HWNPAQOZNQLULZ-GXFFZTMASA-N 0 3 382.327 3.471 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1CC[C@@H]2COC[C@@H]2C1 ZINC000668705044 566258979 /nfs/dbraw/zinc/25/89/79/566258979.db2.gz FPJTTWSISWHAKR-ZBFHGGJFSA-N 0 3 376.298 3.412 10 0 GGAEHN CC(C)NC(=O)[C@@H]1CCCN(CC2=Cc3cc(Br)ccc3OC2)C1 ZINC000668732093 566259955 /nfs/dbraw/zinc/25/99/55/566259955.db2.gz FMIJYQQGTHHYGK-OAHLLOKOSA-N 0 3 393.325 3.462 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N[C@H]1CSCc2ccc(Br)cc21 ZINC000624939275 566260796 /nfs/dbraw/zinc/26/07/96/566260796.db2.gz IOPMUEZFLYYWBY-ZFWWWQNUSA-N 0 3 384.343 3.130 10 0 GGAEHN CCO[C@@H]1C[C@@H](N[C@@H]2CCc3cc(Br)ccc3NC2=O)[C@@H]1SC ZINC000599451993 566266656 /nfs/dbraw/zinc/26/66/56/566266656.db2.gz LBOHPJIDLKFQSW-FPCVCCKLSA-N 0 3 399.354 3.201 10 0 GGAEHN O[C@H](CN[C@@H](c1cccnc1)C1CC1)COc1cccc(Br)c1 ZINC000556019374 566267266 /nfs/dbraw/zinc/26/72/66/566267266.db2.gz JLYWCXVPYBEKSS-SJLPKXTDSA-N 0 3 377.282 3.325 10 0 GGAEHN C[NH+](C)[C@@H]1CCC[C@@H]([N-]S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000509168787 566269994 /nfs/dbraw/zinc/26/99/94/566269994.db2.gz WLMKBDXWMWGVIF-GHMZBOCLSA-N 0 3 395.750 3.254 10 0 GGAEHN CCC[NH+]1CCC(C[N-]S(=O)(=O)c2sc(C)cc2Br)CC1 ZINC000462263923 566270809 /nfs/dbraw/zinc/27/08/09/566270809.db2.gz ROCUWVOTQSYENB-UHFFFAOYSA-N 0 3 395.388 3.219 10 0 GGAEHN CSCCCNC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1nccs1 ZINC000599533137 566272612 /nfs/dbraw/zinc/27/26/12/566272612.db2.gz HKBIWAAJZHHAGN-IAGOWNOFSA-N 0 3 375.563 3.228 10 0 GGAEHN CCC(F)(F)C(C)(C)CS(=O)(=O)N1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 ZINC000625082059 566274262 /nfs/dbraw/zinc/27/42/62/566274262.db2.gz YMYKAEZDGQRVBK-GOEBONIOSA-N 0 3 378.529 3.336 10 0 GGAEHN CCC(F)(F)C(C)(C)CS(=O)(=O)N1CC[C@@H]2[C@H](CCCN2C2CC2)C1 ZINC000625082058 566274272 /nfs/dbraw/zinc/27/42/72/566274272.db2.gz YMYKAEZDGQRVBK-GDBMZVCRSA-N 0 3 378.529 3.336 10 0 GGAEHN CN(Cc1ncc(Br)cc1Br)[C@H]1CCN(C2CC2)C1 ZINC000481999941 566276286 /nfs/dbraw/zinc/27/62/86/566276286.db2.gz IOKRQZJCFHZJLB-LBPRGKRZSA-N 0 3 389.135 3.275 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NCc1ccc2c(n1)CCCC2 ZINC000556243637 566278557 /nfs/dbraw/zinc/27/85/57/566278557.db2.gz HBXQBFFYBBPBOR-CYBMUJFWSA-N 0 3 376.298 3.063 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2csc(-c3ccccc3)n2)[C@H](C)C1 ZINC000462300256 566278705 /nfs/dbraw/zinc/27/87/05/566278705.db2.gz ILVVVAUGTKHZPE-ZBFHGGJFSA-N 0 3 379.551 3.161 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2csc(-c3ccccc3)n2)[C@@H](C)C1 ZINC000462300252 566278781 /nfs/dbraw/zinc/27/87/81/566278781.db2.gz ILVVVAUGTKHZPE-GOEBONIOSA-N 0 3 379.551 3.161 10 0 GGAEHN CN(Cc1c(Br)cncc1Br)[C@H]1CCN(C2CC2)C1 ZINC000575632270 566279151 /nfs/dbraw/zinc/27/91/51/566279151.db2.gz TXOJFSMBEQATLX-NSHDSACASA-N 0 3 389.135 3.275 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(OC)c(Cl)c2Cl)[C@@H](C)C1 ZINC000462310473 566279497 /nfs/dbraw/zinc/27/94/97/566279497.db2.gz CSMBGMZHOJSUCK-RYUDHWBXSA-N 0 3 395.352 3.353 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2sc(C)cc2Br)[C@@H](C)C1 ZINC000462317638 566281711 /nfs/dbraw/zinc/28/17/11/566281711.db2.gz VRLWXPWMVRRNQH-GXFFZTMASA-N 0 3 395.388 3.170 10 0 GGAEHN Cc1cc(S(=O)(=O)N2C[C@@H](c3ccccc3F)[C@H](N)C2)c(Cl)cc1F ZINC000420473415 566282010 /nfs/dbraw/zinc/28/20/10/566282010.db2.gz VRKPFQZEOAIUOY-BLLLJJGKSA-N 0 3 386.851 3.042 10 0 GGAEHN COC(=O)c1cnc(CN2C[C@@H](c3ccc(Br)cc3)C[C@@H]2C)cn1 ZINC000599651920 566282482 /nfs/dbraw/zinc/28/24/82/566282482.db2.gz IIGDQJCSVXXJGZ-JSGCOSHPSA-N 0 3 390.281 3.404 10 0 GGAEHN C[C@H]1C[C@@H](c2nc(CC(=O)Nc3ccccc3Br)no2)CCN1C ZINC000420493295 566284055 /nfs/dbraw/zinc/28/40/55/566284055.db2.gz NOZWRUBYFUYKKW-RYUDHWBXSA-N 0 3 393.285 3.211 10 0 GGAEHN C[C@H]1CN(C)CC[C@H]1N(C)C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000669118317 566286815 /nfs/dbraw/zinc/28/68/15/566286815.db2.gz LJVAQTOUEAOZAM-KBXCAEBGSA-N 0 3 394.357 3.462 10 0 GGAEHN O[C@H](CNC[C@@H](O)Cc1cccc(F)c1)COc1c(Cl)cccc1Cl ZINC000575803352 566287403 /nfs/dbraw/zinc/28/74/03/566287403.db2.gz KHPQLAFSWHVCOO-LSDHHAIUSA-N 0 3 388.266 3.065 10 0 GGAEHN COC(=O)C1C[C@H](C)N(C[C@H](O)COc2ccc(Cl)c(Cl)c2)[C@@H](C)C1 ZINC000599703534 566287919 /nfs/dbraw/zinc/28/79/19/566287919.db2.gz CLVZCSZLLZXWMA-OBJOEFQTSA-N 0 3 390.307 3.395 10 0 GGAEHN C[C@H](Cc1ccc(F)c(Br)c1)C(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000482173246 566289018 /nfs/dbraw/zinc/28/90/18/566289018.db2.gz DTFUOOZIKGFQHM-DOMZBBRYSA-N 0 3 383.305 3.462 10 0 GGAEHN COc1ccc(-c2nnc(N3C[C@@H](SC)[C@@H](N4CCCC4)C3)s2)cc1 ZINC000420609081 566289072 /nfs/dbraw/zinc/28/90/72/566289072.db2.gz GKZAFBARKAEPKJ-JKSUJKDBSA-N 0 3 376.551 3.230 10 0 GGAEHN CC(C)N1CCCN(C(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)CC1 ZINC000625208626 566289489 /nfs/dbraw/zinc/28/94/89/566289489.db2.gz KZRCLJPNIIYAMM-BPQIPLTHSA-N 0 3 377.326 3.278 10 0 GGAEHN Cc1cc(Br)cc(C)c1S(=O)(=O)N(C)[C@@H]1CCN(C)C[C@H]1C ZINC000462354544 566289387 /nfs/dbraw/zinc/28/93/87/566289387.db2.gz DKXLWYCEHSMSJH-UKRRQHHQSA-N 0 3 389.359 3.027 10 0 GGAEHN Cc1cc(Br)cc(C)c1S(=O)(=O)N(C)[C@H]1CCN(C)C[C@@H]1C ZINC000462354545 566289590 /nfs/dbraw/zinc/28/95/90/566289590.db2.gz DKXLWYCEHSMSJH-ZFWWWQNUSA-N 0 3 389.359 3.027 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cc(C)cc(Br)c2F)C[C@@H]1N(C)C ZINC000599721696 566289624 /nfs/dbraw/zinc/28/96/24/566289624.db2.gz PXPXFSWPHQZVRJ-QWHCGFSZSA-N 0 3 375.307 3.014 10 0 GGAEHN COC(=O)[C@@H]1C[C@@H](C)N(C[C@@H](O)COc2cc(Cl)ccc2Cl)[C@@H](C)C1 ZINC000599711582 566289830 /nfs/dbraw/zinc/28/98/30/566289830.db2.gz UOJAAEGIKUJXCR-QVHKTLOISA-N 0 3 390.307 3.395 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cc(C)cc(Br)c2F)C[C@H]1N(C)C ZINC000599721694 566289854 /nfs/dbraw/zinc/28/98/54/566289854.db2.gz PXPXFSWPHQZVRJ-CHWSQXEVSA-N 0 3 375.307 3.014 10 0 GGAEHN CS[C@H]1CN(C(=O)c2csc(N(C)c3ccccc3)n2)C[C@H]1N(C)C ZINC000599721737 566290187 /nfs/dbraw/zinc/29/01/87/566290187.db2.gz QZGLKHKEDKDRFA-CVEARBPZSA-N 0 3 376.551 3.029 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2csc(N(C)c3ccccc3)n2)C[C@@H]1N(C)C ZINC000599721740 566290238 /nfs/dbraw/zinc/29/02/38/566290238.db2.gz QZGLKHKEDKDRFA-JKSUJKDBSA-N 0 3 376.551 3.029 10 0 GGAEHN Cc1cc(I)cc(C(=O)N(C)[C@H]2CCN(C3CC3)C2)c1C ZINC000482186452 566290990 /nfs/dbraw/zinc/29/09/90/566290990.db2.gz ZNPIMMKEKMCVFS-HNNXBMFYSA-N 0 3 398.288 3.217 10 0 GGAEHN Cc1cc(I)cc(C(=O)N(C)[C@@H]2CCN(C3CC3)C2)c1C ZINC000482186454 566291029 /nfs/dbraw/zinc/29/10/29/566291029.db2.gz ZNPIMMKEKMCVFS-OAHLLOKOSA-N 0 3 398.288 3.217 10 0 GGAEHN O=C(CCCCOc1ccc(Br)cc1)NCCNc1ccncc1 ZINC000535259320 566291047 /nfs/dbraw/zinc/29/10/47/566291047.db2.gz CEQWUYOGOWWEDE-UHFFFAOYSA-N 0 3 392.297 3.043 10 0 GGAEHN CCN(CC)[C@@H]1CCN(S(=O)(=O)c2cccc(Br)c2Cl)C1 ZINC000556376027 566292943 /nfs/dbraw/zinc/29/29/43/566292943.db2.gz NUKKPKKWRSEIIB-LLVKDONJSA-N 0 3 395.750 3.207 10 0 GGAEHN Cc1c(Br)cc(CN[C@@H](C)Cn2cncn2)cc1Br ZINC000556384855 566293629 /nfs/dbraw/zinc/29/36/29/566293629.db2.gz ARMYVINGTXVAQA-VIFPVBQESA-N 0 3 388.107 3.290 10 0 GGAEHN COCCN1CCC[C@@H]1CN[C@@H](C)c1ccccc1I ZINC000482241775 566296501 /nfs/dbraw/zinc/29/65/01/566296501.db2.gz JFVGFAURTGPOAA-UONOGXRCSA-N 0 3 388.293 3.053 10 0 GGAEHN NC(=O)Cc1ccc(CN[C@H]2CCc3c2ccc(F)c3Br)cc1 ZINC000648590148 566296451 /nfs/dbraw/zinc/29/64/51/566296451.db2.gz DELRWUAYPNETQV-INIZCTEOSA-N 0 3 377.257 3.393 10 0 GGAEHN COCCN1CCC[C@H]1CN[C@@H]1CCCOc2c(Br)cccc21 ZINC000482256618 566297494 /nfs/dbraw/zinc/29/74/94/566297494.db2.gz MWEWWGRMZRSODU-WMLDXEAASA-N 0 3 383.330 3.363 10 0 GGAEHN CC[NH+]1CCC(CC[N-]S(=O)(=O)c2ccc(OC)c(Cl)c2Cl)CC1 ZINC000462408814 566297721 /nfs/dbraw/zinc/29/77/21/566297721.db2.gz JGPMNOKSLHYONT-UHFFFAOYSA-N 0 3 395.352 3.402 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(Cl)ccc2OC(F)F)[C@@H](C)C1 ZINC000420678504 566298619 /nfs/dbraw/zinc/29/86/19/566298619.db2.gz SXTXMEPGFSRKMT-WCQYABFASA-N 0 3 396.887 3.292 10 0 GGAEHN CN(C(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1)[C@H]1CCN(C2CC2)C1 ZINC000599870308 566301313 /nfs/dbraw/zinc/30/13/13/566301313.db2.gz KVJUGPNJSRASTB-HNNXBMFYSA-N 0 3 379.291 3.488 10 0 GGAEHN CN(C(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1)[C@@H]1CCN(C2CC2)C1 ZINC000599870310 566301466 /nfs/dbraw/zinc/30/14/66/566301466.db2.gz KVJUGPNJSRASTB-OAHLLOKOSA-N 0 3 379.291 3.488 10 0 GGAEHN CN(C(=O)CCCOc1ccccc1Br)[C@H]1CCN(C2CC2)C1 ZINC000599868992 566301537 /nfs/dbraw/zinc/30/15/37/566301537.db2.gz CWHAEGLOYQCHRI-HNNXBMFYSA-N 0 3 381.314 3.303 10 0 GGAEHN O=C(NC1CCN(C2CC2)CC1)c1cc2c(cncc2Br)s1 ZINC000648722284 566302758 /nfs/dbraw/zinc/30/27/58/566302758.db2.gz KMBWVTYMPKCFRK-UHFFFAOYSA-N 0 3 380.311 3.415 10 0 GGAEHN O=C([C@H]1CCCN(CCOc2cc(F)cc(Br)c2)C1)N1CCCC1 ZINC000575981833 566303093 /nfs/dbraw/zinc/30/30/93/566303093.db2.gz QLDNOVYZGYMNNL-AWEZNQCLSA-N 0 3 399.304 3.301 10 0 GGAEHN CN(C)CCN(C)C(=O)Nc1cc(F)c(Cl)cc1I ZINC000599928502 566304229 /nfs/dbraw/zinc/30/42/29/566304229.db2.gz NMSNAMLWEUQNQR-UHFFFAOYSA-N 0 3 399.635 3.109 10 0 GGAEHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)[C@H]1C[C@@H]1C(F)F ZINC000509432446 566304800 /nfs/dbraw/zinc/30/48/00/566304800.db2.gz ZCOXHYYUUAVJOF-KBPBESRZSA-N 0 3 375.257 3.241 10 0 GGAEHN O=C(COc1ccccc1)N1CC[C@H](NCc2ccc(Br)s2)C1 ZINC000509432834 566304922 /nfs/dbraw/zinc/30/49/22/566304922.db2.gz VEWNJSDHABWFJD-ZDUSSCGKSA-N 0 3 395.322 3.280 10 0 GGAEHN CSC1(CNC(=O)c2cccc(F)c2OC(F)(F)F)CCN(C)CC1 ZINC000599960566 566306029 /nfs/dbraw/zinc/30/60/29/566306029.db2.gz MJGDRIHZLMQCHG-UHFFFAOYSA-N 0 3 380.407 3.282 10 0 GGAEHN Cn1cc(Br)c(CN[C@@H]2CN(Cc3ccccc3)C(C)(C)C2)n1 ZINC000648731500 566306155 /nfs/dbraw/zinc/30/61/55/566306155.db2.gz HRIZVMVMQZMAJU-HNNXBMFYSA-N 0 3 377.330 3.325 10 0 GGAEHN COc1c(Br)ccc(F)c1C(=O)N[C@@H](CC(C)C)CN(C)C ZINC000648750793 566308234 /nfs/dbraw/zinc/30/82/34/566308234.db2.gz GDNLJWUPIZISNF-NSHDSACASA-N 0 3 375.282 3.303 10 0 GGAEHN O=C(CSCc1ccc(Cl)cc1)N1CCC(N2CCCOCC2)CC1 ZINC000600007010 566308869 /nfs/dbraw/zinc/30/88/69/566308869.db2.gz KLMGUORRUCQBRU-UHFFFAOYSA-N 0 3 382.957 3.287 10 0 GGAEHN Brc1cncc([C@@H](NCCc2nnnn2-c2ccccc2)C2CC2)c1 ZINC000556522926 566310106 /nfs/dbraw/zinc/31/01/06/566310106.db2.gz QIRDGSQUGXKHJP-SFHVURJKSA-N 0 3 399.296 3.103 10 0 GGAEHN O[C@H](CN[C@H](c1cccnc1)C1CC1)COc1ccc(Br)cc1 ZINC000445766359 566311834 /nfs/dbraw/zinc/31/18/34/566311834.db2.gz IWZISIULQWVFLJ-AEFFLSMTSA-N 0 3 377.282 3.325 10 0 GGAEHN CN(C)C1(CNC(=O)N[C@H]2CCOc3ccc(Br)cc32)CCC1 ZINC000445842326 566313473 /nfs/dbraw/zinc/31/34/73/566313473.db2.gz YTNWYIFTPLHPCA-AWEZNQCLSA-N 0 3 382.302 3.056 10 0 GGAEHN O=C([C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)N1CC[C@@H](N2CCCCC2)C1 ZINC000625366078 566314738 /nfs/dbraw/zinc/31/47/38/566314738.db2.gz WKUCJLUFLSSVGV-VLDUQVBPSA-N 0 3 389.337 3.422 10 0 GGAEHN C[NH+](C)C1CCC([N-]S(=O)(=O)c2cccc(Br)c2Cl)CC1 ZINC000420748577 566315118 /nfs/dbraw/zinc/31/51/18/566315118.db2.gz QPKWPBFEEVBPPQ-UHFFFAOYSA-N 0 3 395.750 3.254 10 0 GGAEHN CSC1(CNC(=O)N2CC(Cc3ccccc3Cl)C2)CCN(C)CC1 ZINC000462509389 566316192 /nfs/dbraw/zinc/31/61/92/566316192.db2.gz YPPXBRNMAIPSFR-UHFFFAOYSA-N 0 3 381.973 3.351 10 0 GGAEHN O=C(N[C@H]1CCN(CC2CC2)C1)N[C@@H]1CCOc2c(Br)cccc21 ZINC000669649754 566317652 /nfs/dbraw/zinc/31/76/52/566317652.db2.gz YQNFQVUVESVLKN-XJKSGUPXSA-N 0 3 394.313 3.056 10 0 GGAEHN C[C@H](N[C@H](CO)C[C@H](O)C(C)(C)C)c1ccc(I)cc1 ZINC000556605553 566318480 /nfs/dbraw/zinc/31/84/80/566318480.db2.gz ARDUHERCAKOYEH-CQDKDKBSSA-N 0 3 391.293 3.100 10 0 GGAEHN CN(CCNS(=O)(=O)c1ccc(Br)c(F)c1)C1CCCCC1 ZINC000462540202 566318940 /nfs/dbraw/zinc/31/89/40/566318940.db2.gz YYNQTSGAMYLOLU-UHFFFAOYSA-N 0 3 393.322 3.131 10 0 GGAEHN C[C@@]1(CNCC(=O)Nc2ccc(I)cc2)CCCS1 ZINC000600157219 566319136 /nfs/dbraw/zinc/31/91/36/566319136.db2.gz SZAJUPUGHBNMJP-AWEZNQCLSA-N 0 3 390.290 3.105 10 0 GGAEHN O=C(NC1CCN(C2CCCC2)CC1)C(=O)c1ccc(Br)cc1 ZINC000482584748 566319553 /nfs/dbraw/zinc/31/95/53/566319553.db2.gz PVZKYUMWFKJNSM-UHFFFAOYSA-N 0 3 379.298 3.155 10 0 GGAEHN C[C@H](CC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)n1cc(Br)cn1 ZINC000648842545 566320415 /nfs/dbraw/zinc/32/04/15/566320415.db2.gz BYSIOZVSLFRDBQ-MZMPZRCHSA-N 0 3 391.313 3.158 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N(C)C[C@@H]1CCCN1C ZINC000420832335 566324019 /nfs/dbraw/zinc/32/40/19/566324019.db2.gz KKIPSQYSHBUEHP-OCCSQVGLSA-N 0 3 384.318 3.254 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N(C)C[C@H]1CCCN1C ZINC000420832336 566324424 /nfs/dbraw/zinc/32/44/24/566324424.db2.gz KKIPSQYSHBUEHP-TZMCWYRMSA-N 0 3 384.318 3.254 10 0 GGAEHN O=C(NC[C@H]1CC12CCSCC2)NCC1(N2CCSCC2)CCCC1 ZINC000420859654 566325591 /nfs/dbraw/zinc/32/55/91/566325591.db2.gz MFZQJWLORHSMTQ-MRXNPFEDSA-N 0 3 383.627 3.181 10 0 GGAEHN CN(C)CCN1CCN(C(=O)CCCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000509664609 566325804 /nfs/dbraw/zinc/32/58/04/566325804.db2.gz BMSKYQHWACCLPI-UHFFFAOYSA-N 0 3 386.367 3.412 10 0 GGAEHN CN(C(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)[C@H]1CCN(C2CC2)C1 ZINC000625487524 566327034 /nfs/dbraw/zinc/32/70/34/566327034.db2.gz XNRGSCDOACUNCG-LGRHPFTQSA-N 0 3 375.310 3.030 10 0 GGAEHN CN1CCC[C@]2(CCN(C(=O)[C@@H]3CCc4cc(Br)ccc43)C2)C1 ZINC000648914751 566328969 /nfs/dbraw/zinc/32/89/69/566328969.db2.gz UJJDDIRMIYVVQK-MJGOQNOKSA-N 0 3 377.326 3.423 10 0 GGAEHN CC[C@H](CN1CCCC1)NS(=O)(=O)c1c(Cl)cccc1Br ZINC000669838896 566329892 /nfs/dbraw/zinc/32/98/92/566329892.db2.gz CLTBDVRYVSHDCZ-LLVKDONJSA-N 0 3 395.750 3.255 10 0 GGAEHN O=C(N[C@H]1CCN(CC2CC2)C1)c1c(Cl)cc(F)cc1Br ZINC000648922080 566331014 /nfs/dbraw/zinc/33/10/14/566331014.db2.gz GSPDTDWYHJFRLY-NSHDSACASA-N 0 3 375.669 3.456 10 0 GGAEHN CC[C@@H](CN1CCCC1)NS(=O)(=O)c1c(Cl)cccc1Br ZINC000669838897 566331142 /nfs/dbraw/zinc/33/11/42/566331142.db2.gz CLTBDVRYVSHDCZ-NSHDSACASA-N 0 3 395.750 3.255 10 0 GGAEHN Cc1cc(Br)c(F)c(C(=O)N2CCC(OCCN(C)C)CC2)c1 ZINC000625539118 566334167 /nfs/dbraw/zinc/33/41/67/566334167.db2.gz WATRTBOBCYRNSK-UHFFFAOYSA-N 0 3 387.293 3.079 10 0 GGAEHN CCN(CC)[C@@H]1CCN(S(=O)(=O)c2c(C)cc(Br)cc2C)C1 ZINC000462684985 566339715 /nfs/dbraw/zinc/33/97/15/566339715.db2.gz VWGMYFQSRYDAQE-OAHLLOKOSA-N 0 3 389.359 3.171 10 0 GGAEHN COc1ccc([C@@H](CN(C)C)NC(=O)Cc2cscc2Br)cc1 ZINC000556867374 566340023 /nfs/dbraw/zinc/34/00/23/566340023.db2.gz ANOPTQFFQUWYOB-MRXNPFEDSA-N 0 3 397.338 3.481 10 0 GGAEHN CCOc1cc(C[NH2+]C[C@H](CO)Cc2ccccc2)cc(Br)c1[O-] ZINC000556892313 566341932 /nfs/dbraw/zinc/34/19/32/566341932.db2.gz JPMJIOCZMFUXIX-MRXNPFEDSA-N 0 3 394.309 3.494 10 0 GGAEHN C[C@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1cccc(OC(F)(F)F)c1 ZINC000556921573 566345291 /nfs/dbraw/zinc/34/52/91/566345291.db2.gz PSRJIFWIEHSRMU-GXTWGEPZSA-N 0 3 380.432 3.050 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)CCOc1ccc(Cl)cc1Cl)CCO2 ZINC000649134331 566347128 /nfs/dbraw/zinc/34/71/28/566347128.db2.gz WLEYZKAKHAJURO-UHFFFAOYSA-N 0 3 387.307 3.086 10 0 GGAEHN Cc1ccc(CCC(=O)N2CCOC3(CCN(C)CC3)C2)c(Br)c1 ZINC000649130722 566347143 /nfs/dbraw/zinc/34/71/43/566347143.db2.gz TZUMFSRXLYAEJV-UHFFFAOYSA-N 0 3 395.341 3.013 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)c1cc(Br)ccc1Cl)CCO2 ZINC000649136351 566347173 /nfs/dbraw/zinc/34/71/73/566347173.db2.gz HNIWARLZNKEHMJ-UHFFFAOYSA-N 0 3 387.705 3.039 10 0 GGAEHN CCCN1CCC[C@@H]1C(=O)N[C@@H]1CCN(c2ccccc2Br)C1 ZINC000600577710 566347358 /nfs/dbraw/zinc/34/73/58/566347358.db2.gz KSOFXBZLXDENJS-RHSMWYFYSA-N 0 3 380.330 3.018 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)CCOc1ccc(Cl)c(Cl)c1)CCO2 ZINC000649134788 566347528 /nfs/dbraw/zinc/34/75/28/566347528.db2.gz GTSKURRODVLGLX-UHFFFAOYSA-N 0 3 387.307 3.086 10 0 GGAEHN C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)N1CCOC2(CCN(C)CC2)C1 ZINC000649134278 566347735 /nfs/dbraw/zinc/34/77/35/566347735.db2.gz ULXUEYRZNHVPIB-ZDUSSCGKSA-N 0 3 387.307 3.084 10 0 GGAEHN CN(C(=O)c1cc(-c2ccc(Br)cc2)n[nH]1)[C@H]1CCN(C2CC2)C1 ZINC000600570332 566347946 /nfs/dbraw/zinc/34/79/46/566347946.db2.gz AMADSZDFBALHHL-HNNXBMFYSA-N 0 3 389.297 3.148 10 0 GGAEHN C[C@H](CC(=O)N1CCOC2(CCN(C)CC2)C1)c1ccc(Br)cc1 ZINC000649131313 566348143 /nfs/dbraw/zinc/34/81/43/566348143.db2.gz GVWQKAHRHVRPEE-OAHLLOKOSA-N 0 3 395.341 3.266 10 0 GGAEHN COC(=O)[C@H](NC[C@@H]1CCN1C1CCCC1)c1ccccc1Br ZINC000600614149 566350258 /nfs/dbraw/zinc/35/02/58/566350258.db2.gz MCGLDPJNJBBIQZ-WMLDXEAASA-N 0 3 381.314 3.270 10 0 GGAEHN COC(=O)[C@H](NC[C@H]1CCN1C1CCCC1)c1cccc(Br)c1 ZINC000600612976 566350728 /nfs/dbraw/zinc/35/07/28/566350728.db2.gz DGMMBWSINCVYBZ-IAGOWNOFSA-N 0 3 381.314 3.270 10 0 GGAEHN COC(=O)[C@H](NC[C@H]1CCN1C1CCCC1)c1ccccc1Br ZINC000600614148 566351130 /nfs/dbraw/zinc/35/11/30/566351130.db2.gz MCGLDPJNJBBIQZ-RHSMWYFYSA-N 0 3 381.314 3.270 10 0 GGAEHN CCCN1CCC[C@H]1C(=O)NCc1nc2cc(Br)ccc2n1CC ZINC000483046437 566353608 /nfs/dbraw/zinc/35/36/08/566353608.db2.gz JUBWAICNUUEEII-INIZCTEOSA-N 0 3 393.329 3.309 10 0 GGAEHN CCCC[C@@](C)(NC[C@H](O)CN1CCOCC1)c1cccc(Br)c1 ZINC000483064715 566356982 /nfs/dbraw/zinc/35/69/82/566356982.db2.gz YZILBTOIBIOGEP-RBUKOAKNSA-N 0 3 399.373 3.137 10 0 GGAEHN CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000510024570 566357453 /nfs/dbraw/zinc/35/74/53/566357453.db2.gz VZENNTJAZYNCAF-XJKCOSOUSA-N 0 3 385.961 3.097 10 0 GGAEHN OC[C@@]1(NCc2cnc3ccccc3n2)CCc2cc(Br)ccc2C1 ZINC000625796134 566361289 /nfs/dbraw/zinc/36/12/89/566361289.db2.gz GGDTYTQRFLZUAZ-HXUWFJFHSA-N 0 3 398.304 3.402 10 0 GGAEHN COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)CN1CC[C@@H](C)C1 ZINC000576595848 566361359 /nfs/dbraw/zinc/36/13/59/566361359.db2.gz PZSBDDYPPIBNET-CJNGLKHVSA-N 0 3 381.314 3.463 10 0 GGAEHN CC1(C)CCC[C@@](CO)(NCC(=O)Nc2ccc(Br)cc2F)C1 ZINC000625833764 566363407 /nfs/dbraw/zinc/36/34/07/566363407.db2.gz ZNOZPNDEYDWHCY-QGZVFWFLSA-N 0 3 387.293 3.448 10 0 GGAEHN C[C@H](Oc1cccc(Br)c1)C(=O)N1CCc2ccccc2[C@@H]1CN ZINC000576637992 566365510 /nfs/dbraw/zinc/36/55/10/566365510.db2.gz NDNNDERWMYSEME-UGSOOPFHSA-N 0 3 389.293 3.301 10 0 GGAEHN Cc1cc(Br)ccc1[C@@H]1CCCN1C(=O)N[C@@H](CN)C(F)(F)F ZINC000625899365 566367993 /nfs/dbraw/zinc/36/79/93/566367993.db2.gz RUPNZTJCARHVEY-STQMWFEESA-N 0 3 394.235 3.494 10 0 GGAEHN CC[C@@H]1C[C@@H](NCc2cc(Br)ccc2O[C@H](C)C(=O)NC)CCO1 ZINC000421373849 566368520 /nfs/dbraw/zinc/36/85/20/566368520.db2.gz DZNAUNIWFNLHOI-UHOFOFEASA-N 0 3 399.329 3.010 10 0 GGAEHN C[C@@H](NC(=O)c1ccc(CN2CCCC2)cc1)c1ncc(Br)cn1 ZINC000557150476 566368810 /nfs/dbraw/zinc/36/88/10/566368810.db2.gz QOPCTYYWPBXGOP-CYBMUJFWSA-N 0 3 389.297 3.326 10 0 GGAEHN CC[C@@H]1C[C@H](NCc2cc(Br)ccc2O[C@H](C)C(=O)NC)CCO1 ZINC000421373848 566368989 /nfs/dbraw/zinc/36/89/89/566368989.db2.gz DZNAUNIWFNLHOI-DAXOMENPSA-N 0 3 399.329 3.010 10 0 GGAEHN CC1(N2CCOCC2)CCN(Cc2ccc(Br)c(F)c2F)CC1 ZINC000625960708 566370252 /nfs/dbraw/zinc/37/02/52/566370252.db2.gz YVHQSLVZPSQLHB-UHFFFAOYSA-N 0 3 389.284 3.414 10 0 GGAEHN C[C@H](NCCC1CCS(=O)(=O)CC1)c1ccc(Br)cc1F ZINC000446939775 566371402 /nfs/dbraw/zinc/37/14/02/566371402.db2.gz BNHBWRCBCHRTCH-NSHDSACASA-N 0 3 378.307 3.454 10 0 GGAEHN CN(C)C[C@@H](NCC[C@@H]1CCS(=O)(=O)C1)c1ccc(Cl)c(Cl)c1 ZINC000625983600 566372333 /nfs/dbraw/zinc/37/23/33/566372333.db2.gz UWAHBHVIVOHHCT-MLGOLLRUSA-N 0 3 379.353 3.011 10 0 GGAEHN CN(C)C[C@@H](NCC1(CS(C)(=O)=O)CC1)c1ccc(Cl)c(Cl)c1 ZINC000625983017 566372493 /nfs/dbraw/zinc/37/24/93/566372493.db2.gz BNWGDIFXQZKBRL-OAHLLOKOSA-N 0 3 379.353 3.011 10 0 GGAEHN CCOc1cc(C[NH2+][C@H](C)C2(OC)CCOCC2)cc(Br)c1[O-] ZINC000421407896 566372747 /nfs/dbraw/zinc/37/27/47/566372747.db2.gz WTQGTLDTZQZZEQ-GFCCVEGCSA-N 0 3 388.302 3.227 10 0 GGAEHN CN(C)C[C@@H](NCC[C@H]1CCS(=O)(=O)C1)c1ccc(Cl)c(Cl)c1 ZINC000625983598 566372905 /nfs/dbraw/zinc/37/29/05/566372905.db2.gz UWAHBHVIVOHHCT-BLLLJJGKSA-N 0 3 379.353 3.011 10 0 GGAEHN CN1CCC[C@@H]1CN[C@@H](CO)c1ccc(Br)cc1C(F)(F)F ZINC000649595856 566377608 /nfs/dbraw/zinc/37/76/08/566377608.db2.gz BBNLZQAMALQBNA-RISCZKNCSA-N 0 3 381.236 3.185 10 0 GGAEHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000626026703 566377735 /nfs/dbraw/zinc/37/77/35/566377735.db2.gz VKVMYGWGWXVAIF-HPZZWOGRSA-N 0 3 389.337 3.420 10 0 GGAEHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000626026705 566378104 /nfs/dbraw/zinc/37/81/04/566378104.db2.gz VKVMYGWGWXVAIF-VRPWAGJOSA-N 0 3 389.337 3.420 10 0 GGAEHN C[C@@H]1C[C@@H](c2ccc(Br)cc2)CN1CC[C@@H]1CCS(=O)(=O)C1 ZINC000626041000 566378692 /nfs/dbraw/zinc/37/86/92/566378692.db2.gz PHNFSOCKEDICML-IIAWOOMASA-N 0 3 386.355 3.452 10 0 GGAEHN O=C(NC1CCN(CCc2ccccc2)CC1)c1nscc1Br ZINC000649608237 566379106 /nfs/dbraw/zinc/37/91/06/566379106.db2.gz UEXXJSCLUVYYEM-UHFFFAOYSA-N 0 3 394.338 3.343 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2F)C[C@H]1N1CCCC1 ZINC000483392372 566379350 /nfs/dbraw/zinc/37/93/50/566379350.db2.gz GBOGCLXNZOGRFW-CABCVRRESA-N 0 3 376.419 3.496 10 0 GGAEHN CNC(=O)C[C@@H](NCCOc1ccccc1Br)c1ccccc1 ZINC000483412699 566380850 /nfs/dbraw/zinc/38/08/50/566380850.db2.gz VQANUNRQPGGXKM-MRXNPFEDSA-N 0 3 377.282 3.295 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)CN1C1CC1 ZINC000626042002 566381586 /nfs/dbraw/zinc/38/15/86/566381586.db2.gz OPGGCGCGUOCGMO-MOGKDCFKSA-N 0 3 375.310 3.076 10 0 GGAEHN CCN1CCC(NC(=O)CNC2(c3ccccc3Br)CCC2)CC1 ZINC000649646213 566382542 /nfs/dbraw/zinc/38/25/42/566382542.db2.gz XBTVRCJTANGLCW-UHFFFAOYSA-N 0 3 394.357 3.018 10 0 GGAEHN O=C(CCN1CCC(C2(O)CC2)CC1)Nc1ccc(Br)cc1F ZINC000649674267 566383682 /nfs/dbraw/zinc/38/36/82/566383682.db2.gz MZSRRWSIYPDZBW-UHFFFAOYSA-N 0 3 385.277 3.154 10 0 GGAEHN C[C@]1(Cc2cccc(Cl)c2)CCCN1C[C@@H]1CCCN(S(C)(=O)=O)C1 ZINC000649684192 566385383 /nfs/dbraw/zinc/38/53/83/566385383.db2.gz IKKAZYQGAAUEOJ-PKOBYXMFSA-N 0 3 384.973 3.409 10 0 GGAEHN O=C([C@H]1CCCN(CCOc2cccc(Br)c2)C1)N1CCCC1 ZINC000601073466 566388607 /nfs/dbraw/zinc/38/86/07/566388607.db2.gz HKNRKVOIWWVNSW-HNNXBMFYSA-N 0 3 381.314 3.162 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(Cl)c(Br)c1 ZINC000447135566 566389048 /nfs/dbraw/zinc/38/90/48/566389048.db2.gz FBCSIMJKDQWFKP-GFCCVEGCSA-N 0 3 390.709 3.335 10 0 GGAEHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)c1cc[nH]c(=O)c1Br)N(C)C ZINC000510514544 566389388 /nfs/dbraw/zinc/38/93/88/566389388.db2.gz UYLRDWGCQUEZFR-MLGOLLRUSA-N 0 3 392.297 3.279 10 0 GGAEHN O=C(CCN1CCC(Cn2cnnc2)CC1)Nc1c(Cl)cccc1Cl ZINC000649786495 566393430 /nfs/dbraw/zinc/39/34/30/566393430.db2.gz OEKOOHICCLSQDT-UHFFFAOYSA-N 0 3 382.295 3.326 10 0 GGAEHN CC(C)N(C[C@@H](O)COc1ccc(Cl)cc1Br)[C@H]1CCOC1 ZINC000463228591 566394964 /nfs/dbraw/zinc/39/49/64/566394964.db2.gz CULMLHBCWRYSLM-UONOGXRCSA-N 0 3 392.721 3.342 10 0 GGAEHN CNC(=O)CCOC1CCN([C@@H]2CCCc3ccc(Br)cc32)CC1 ZINC000536731335 566397696 /nfs/dbraw/zinc/39/76/96/566397696.db2.gz JQEPFJFLYAUOPB-GOSISDBHSA-N 0 3 395.341 3.444 10 0 GGAEHN Cc1cc(Br)cc(C)c1CNC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000601290371 566398639 /nfs/dbraw/zinc/39/86/39/566398639.db2.gz JEHHQIUVRHJEOW-MRXNPFEDSA-N 0 3 380.330 3.444 10 0 GGAEHN COCCN1CCN(CCC(=O)Nc2cc(Cl)ccc2Cl)C(C)(C)C1 ZINC000649849728 566399298 /nfs/dbraw/zinc/39/92/98/566399298.db2.gz IDDBGKMFCVFNCU-UHFFFAOYSA-N 0 3 388.339 3.365 10 0 GGAEHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000649849034 566400161 /nfs/dbraw/zinc/40/01/61/566400161.db2.gz KVFHDAPJKCFRQT-YSVLISHTSA-N 0 3 393.325 3.258 10 0 GGAEHN COCCN1CCN(CCCC(=O)c2ccc(Br)cc2)C(C)(C)C1 ZINC000649851167 566400358 /nfs/dbraw/zinc/40/03/58/566400358.db2.gz NWTRHMLHBFXICC-UHFFFAOYSA-N 0 3 397.357 3.455 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)NCCOc1cccc(Cl)c1Cl ZINC000577058625 566400827 /nfs/dbraw/zinc/40/08/27/566400827.db2.gz SCYJBYJCMLPAII-BKGUAONASA-N 0 3 387.307 3.021 10 0 GGAEHN C[C@@H](N[C@@H](C)Cn1cc(Br)ccc1=O)c1ccc2c(c1)OCCO2 ZINC000671117089 566401022 /nfs/dbraw/zinc/40/10/22/566401022.db2.gz MQYCMPJHHXXINP-QWHCGFSZSA-N 0 3 393.281 3.121 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)NCCOc1cccc(Cl)c1Cl ZINC000577058626 566401272 /nfs/dbraw/zinc/40/12/72/566401272.db2.gz SCYJBYJCMLPAII-MZKGEVEHSA-N 0 3 387.307 3.021 10 0 GGAEHN CN(CCN1CCCCC1)Cc1nnc(-c2ccccc2Br)o1 ZINC000649886556 566403201 /nfs/dbraw/zinc/40/32/01/566403201.db2.gz GSFDLPRENWJCFI-UHFFFAOYSA-N 0 3 379.302 3.417 10 0 GGAEHN CS(=O)(=O)N1CC[C@H](CN2CCC(c3cccc(Cl)c3Cl)CC2)C1 ZINC000463364417 566403729 /nfs/dbraw/zinc/40/37/29/566403729.db2.gz ACFZEDNFWWYVMC-CYBMUJFWSA-N 0 3 391.364 3.454 10 0 GGAEHN C[C@@H](CCc1ccc(Cl)s1)NCCS(=O)(=O)NCc1ccccc1 ZINC000536858927 566407053 /nfs/dbraw/zinc/40/70/53/566407053.db2.gz SWJWQQCJPOCPOG-AWEZNQCLSA-N 0 3 386.970 3.432 10 0 GGAEHN CN(C)C1(CN(C)C(=O)[C@H]2CCOc3ccc(Br)cc32)CCC1 ZINC000649949271 566407701 /nfs/dbraw/zinc/40/77/01/566407701.db2.gz VDCTXSNDLCLYIH-AWEZNQCLSA-N 0 3 381.314 3.258 10 0 GGAEHN Cc1nccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)c1Br ZINC000649949053 566408221 /nfs/dbraw/zinc/40/82/21/566408221.db2.gz NGOGUNXFVHWTCJ-NXEZZACHSA-N 0 3 381.192 3.261 10 0 GGAEHN C[C@@H](NC(=O)CSCc1cc(-c2cccs2)on1)C1=CCN(C)CC1 ZINC000510742167 566410126 /nfs/dbraw/zinc/41/01/26/566410126.db2.gz XRIHKTVMRMYWMS-CYBMUJFWSA-N 0 3 377.535 3.403 10 0 GGAEHN CC[C@@H]1C[C@@H](N[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)CCO1 ZINC000421849469 566411584 /nfs/dbraw/zinc/41/15/84/566411584.db2.gz BUNLZNCDHNUQHE-OUAUKWLOSA-N 0 3 381.325 3.249 10 0 GGAEHN CCN(CC)CCN(C(=O)c1ccn(C)c1C)c1ccc(Br)cn1 ZINC000649988699 566412170 /nfs/dbraw/zinc/41/21/70/566412170.db2.gz GWKIKXJHQFMTNR-UHFFFAOYSA-N 0 3 393.329 3.480 10 0 GGAEHN CCNC(=O)C[C@H]1CCCCN1C[C@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000671248954 566413292 /nfs/dbraw/zinc/41/32/92/566413292.db2.gz SGMZDNVMEHUFOH-KGLIPLIRSA-N 0 3 389.323 3.114 10 0 GGAEHN CN1CCN([C@H]2CC[C@@H](NC(=O)c3csc(C(F)(F)F)c3)CC2)CC1 ZINC000626457975 566413481 /nfs/dbraw/zinc/41/34/81/566413481.db2.gz JYDPJYVOEYBALB-OKILXGFUSA-N 0 3 375.460 3.055 10 0 GGAEHN Cn1nnnc1CCN[C@H](c1sccc1Br)C1CCCCC1 ZINC000671296832 566414268 /nfs/dbraw/zinc/41/42/68/566414268.db2.gz FAYRQYPFZLVGOL-AWEZNQCLSA-N 0 3 384.347 3.488 10 0 GGAEHN CC(C)N1CCC[C@H](NC(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)C1 ZINC000626483340 566414774 /nfs/dbraw/zinc/41/47/74/566414774.db2.gz SPEGYKIFSUJOOL-LGRHPFTQSA-N 0 3 377.326 3.324 10 0 GGAEHN CCO[C@H]1C[C@H](NCc2ccc(S(=O)(=O)N(C)C)s2)C12CCCCC2 ZINC000557792531 566420933 /nfs/dbraw/zinc/42/09/33/566420933.db2.gz UYGUQWLUBDGFGL-HOTGVXAUSA-N 0 3 386.583 3.216 10 0 GGAEHN CC[C@@H](N[C@H](CO)CC1CCCC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000510945236 566422522 /nfs/dbraw/zinc/42/25/22/566422522.db2.gz LZZGSEVWLUTPAN-DOTOQJQBSA-N 0 3 388.961 3.230 10 0 GGAEHN Clc1ccc2c(c1)OCCC[C@H]2NC[C@@]1(N2CCOCC2)CCSC1 ZINC000537105142 566423019 /nfs/dbraw/zinc/42/30/19/566423019.db2.gz PMNLLNIJCYUHEV-MJGOQNOKSA-N 0 3 382.957 3.351 10 0 GGAEHN C[C@@H]1CN(C(=O)Cc2ccc(Br)cc2[O-])CC[N@@H+](C2CCC2)C1 ZINC000557838232 566426667 /nfs/dbraw/zinc/42/66/67/566426667.db2.gz WTZOLUMYDNCYNQ-ZDUSSCGKSA-N 0 3 381.314 3.030 10 0 GGAEHN C[C@@H]1CN(C(=O)Cc2ccc(Br)cc2[O-])CC[N@H+](C2CCC2)C1 ZINC000557838232 566426676 /nfs/dbraw/zinc/42/66/76/566426676.db2.gz WTZOLUMYDNCYNQ-ZDUSSCGKSA-N 0 3 381.314 3.030 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1C(=O)N(C)C[C@H]1CCCN1C ZINC000422033334 566428833 /nfs/dbraw/zinc/42/88/33/566428833.db2.gz HHJQKWGMDJVSLA-MRXNPFEDSA-N 0 3 391.313 3.109 10 0 GGAEHN CCC[C@@H](C)CN1CCN(CC(=O)Nc2ccc(Br)cc2)CC1 ZINC000537204646 566430271 /nfs/dbraw/zinc/43/02/71/566430271.db2.gz YEPGVFXDZXQVHF-OAHLLOKOSA-N 0 3 382.346 3.441 10 0 GGAEHN CN(C[C@@H]1CCCN1C)C(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000422163870 566436742 /nfs/dbraw/zinc/43/67/42/566436742.db2.gz UQICKODUQYYCPA-ZFWWWQNUSA-N 0 3 382.302 3.008 10 0 GGAEHN CO[C@H](CS(=O)(=O)[N-]c1ccc(SCC[NH+]2CCCC2)cc1)C1CC1 ZINC000650218159 566438695 /nfs/dbraw/zinc/43/86/95/566438695.db2.gz UGBUAXSUKXLQOR-GOSISDBHSA-N 0 3 384.567 3.041 10 0 GGAEHN CN(C)CCn1cc(NC(=O)C2(c3cc(F)cc(Br)c3)CC2)cn1 ZINC000671681779 566439049 /nfs/dbraw/zinc/43/90/49/566439049.db2.gz MOIQAULSTVHCBW-UHFFFAOYSA-N 0 3 395.276 3.017 10 0 GGAEHN C[C@H]1CN(CCCNC(=O)N2CCc3c2cccc3Br)CCCO1 ZINC000422197431 566439933 /nfs/dbraw/zinc/43/99/33/566439933.db2.gz FVUUBSVFFSHOAL-AWEZNQCLSA-N 0 3 396.329 3.022 10 0 GGAEHN CSC1(CNC(=O)N2CCc3c2cccc3Br)CCN(C)CC1 ZINC000422209729 566439982 /nfs/dbraw/zinc/43/99/82/566439982.db2.gz ULYAHQZCRJVJAO-UHFFFAOYSA-N 0 3 398.370 3.349 10 0 GGAEHN Cc1cc(Br)c(F)c(C(=O)NCCCN2CCCO[C@H](C)C2)c1 ZINC000626667003 566440825 /nfs/dbraw/zinc/44/08/25/566440825.db2.gz HUZFOLZPZSGGQF-CYBMUJFWSA-N 0 3 387.293 3.127 10 0 GGAEHN CS[C@@H]1CN([C@H](C)C(=O)Nc2ccc(F)cc2Cl)C[C@@H]1N1CCCC1 ZINC000484609906 566440764 /nfs/dbraw/zinc/44/07/64/566440764.db2.gz BAMMWMAETIDDHZ-OAUYIBNBSA-N 0 3 385.936 3.318 10 0 GGAEHN O=C(C(=O)N1CCC[C@H]1CN1CCCCC1)c1ccc(Br)cc1 ZINC000511132362 566441031 /nfs/dbraw/zinc/44/10/31/566441031.db2.gz WGTNLAGSZIFGQE-INIZCTEOSA-N 0 3 379.298 3.109 10 0 GGAEHN O=C(NC[C@@H]1CCCCN1C1CC1)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000626669991 566441116 /nfs/dbraw/zinc/44/11/16/566441116.db2.gz LDFPPABLNOIQNC-PTKHLAPESA-N 0 3 389.337 3.468 10 0 GGAEHN CN(C)C[C@@]1(O)CCCN(C(=O)c2cc3cc(Br)ccc3s2)C1 ZINC000626678612 566441769 /nfs/dbraw/zinc/44/17/69/566441769.db2.gz FZTLTQHPHKXNFR-KRWDZBQOSA-N 0 3 397.338 3.193 10 0 GGAEHN CN(C)C[C@]1(O)CCCN(C(=O)c2cc3cc(Br)ccc3s2)C1 ZINC000626678614 566441810 /nfs/dbraw/zinc/44/18/10/566441810.db2.gz FZTLTQHPHKXNFR-QGZVFWFLSA-N 0 3 397.338 3.193 10 0 GGAEHN Cc1ccc(I)c(C(=O)N[C@@H](C)CN2CCCCC2)c1 ZINC000511199152 566444229 /nfs/dbraw/zinc/44/42/29/566444229.db2.gz NUGQPRVWJZCLGV-ZDUSSCGKSA-N 0 3 386.277 3.204 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1cc(F)c(Br)c(Cl)c1 ZINC000511210153 566445095 /nfs/dbraw/zinc/44/50/95/566445095.db2.gz TVBULZNWHBGDPL-NSHDSACASA-N 0 3 393.684 3.082 10 0 GGAEHN Cc1ccc(I)c(C(=O)NCCN2CCCCCC2)c1 ZINC000511216231 566445226 /nfs/dbraw/zinc/44/52/26/566445226.db2.gz XDTXYNDYEQQFAV-UHFFFAOYSA-N 0 3 386.277 3.205 10 0 GGAEHN Cc1nc([C@@H](C)NC[C@H]2CCN(S(=O)(=O)c3cccs3)C2)c(C)s1 ZINC000671765130 566449536 /nfs/dbraw/zinc/44/95/36/566449536.db2.gz UPHZZPFVBQLFKW-BXUZGUMPSA-N 0 3 385.580 3.183 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)NC[C@](C)(O)C(=O)OC(C)(C)C ZINC000484733946 566450419 /nfs/dbraw/zinc/45/04/19/566450419.db2.gz CCZYOSMGLBXNPG-DIFFPNOSSA-N 0 3 390.293 3.202 10 0 GGAEHN Cc1nc([C@H]2CCCN(C[C@@H](O)COc3c(Cl)cccc3Cl)C2)n[nH]1 ZINC000537562219 566452615 /nfs/dbraw/zinc/45/26/15/566452615.db2.gz MARYLLDHMGKWCZ-QWHCGFSZSA-N 0 3 385.295 3.039 10 0 GGAEHN Cc1n[nH]c([C@H]2CCCN(C[C@@H](O)COc3c(Cl)cccc3Cl)C2)n1 ZINC000537562219 566452619 /nfs/dbraw/zinc/45/26/19/566452619.db2.gz MARYLLDHMGKWCZ-QWHCGFSZSA-N 0 3 385.295 3.039 10 0 GGAEHN Cc1nnc([C@H]2CCCN(C[C@@H](O)COc3c(Cl)cccc3Cl)C2)[nH]1 ZINC000537562219 566452621 /nfs/dbraw/zinc/45/26/21/566452621.db2.gz MARYLLDHMGKWCZ-QWHCGFSZSA-N 0 3 385.295 3.039 10 0 GGAEHN NC(=O)c1c(F)cc(Br)cc1N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000537641018 566459216 /nfs/dbraw/zinc/45/92/16/566459216.db2.gz HUPZDBATRABDEQ-CQSZACIVSA-N 0 3 392.272 3.374 10 0 GGAEHN C[C@H](NC(=O)C(=O)c1ccc(Br)cc1)[C@H]1CCCN(C2CCC2)C1 ZINC000511381443 566460164 /nfs/dbraw/zinc/46/01/64/566460164.db2.gz RKLSMXHCXZBITR-ZFWWWQNUSA-N 0 3 393.325 3.401 10 0 GGAEHN C[C@@H](NC[C@@H]1CCN(c2cccc(Br)c2)C1)c1cnccc1N ZINC000422902198 566464802 /nfs/dbraw/zinc/46/48/02/566464802.db2.gz UADYYMBPFWEIBF-KGLIPLIRSA-N 0 3 375.314 3.434 10 0 GGAEHN Cc1cc(Br)c(C(=O)Nc2cnn(CCN(C)C)c2)cc1Cl ZINC000672144432 566467133 /nfs/dbraw/zinc/46/71/33/566467133.db2.gz KAJBQGZEESLXHQ-UHFFFAOYSA-N 0 3 385.693 3.421 10 0 GGAEHN COc1cc(CN[C@@H](C)c2ccc(CN)nc2C)cc(Br)c1OC ZINC000422935347 566467251 /nfs/dbraw/zinc/46/72/51/566467251.db2.gz ADLSOMVRHQLGRK-NSHDSACASA-N 0 3 394.313 3.479 10 0 GGAEHN CN(C(=O)N[C@@H]1C[C@@H]1c1cccc(Br)c1)[C@@H]1CCN(C2CC2)C1 ZINC000558389382 566469742 /nfs/dbraw/zinc/46/97/42/566469742.db2.gz QHKIOIFYPWWMMY-BRWVUGGUSA-N 0 3 378.314 3.183 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)N2CC[C@H](C(F)(F)F)C3(CCC3)C2)CCSC1 ZINC000511534363 566470157 /nfs/dbraw/zinc/47/01/57/566470157.db2.gz YKWGDCKHYKLSPI-XJKSGUPXSA-N 0 3 379.492 3.188 10 0 GGAEHN C[C@@H]1CC[C@H](C)N1[C@H]1CCCN(C(=O)C(=O)c2ccc(Br)cc2)C1 ZINC000511543625 566470319 /nfs/dbraw/zinc/47/03/19/566470319.db2.gz YBWZDLAFCKRRTI-VBQJREDUSA-N 0 3 393.325 3.496 10 0 GGAEHN O=C(N[C@@H]1CCCSc2ccc(Br)cc21)N1CCCNCC1 ZINC000627180039 566471306 /nfs/dbraw/zinc/47/13/06/566471306.db2.gz VDTCWGMPHHNGAI-CQSZACIVSA-N 0 3 384.343 3.381 10 0 GGAEHN CCCCN1CCCC[C@H]1CNC(=O)C(=O)c1ccc(Br)cc1 ZINC000511552711 566471551 /nfs/dbraw/zinc/47/15/51/566471551.db2.gz OYDNQEQHLKYFEG-INIZCTEOSA-N 0 3 381.314 3.403 10 0 GGAEHN COc1ccc(OCCN[C@@](C)(CO)c2ccc(Br)cc2)cc1 ZINC000511551708 566471687 /nfs/dbraw/zinc/47/16/87/566471687.db2.gz DWSRZYKGTCVGEQ-SFHVURJKSA-N 0 3 380.282 3.334 10 0 GGAEHN C[C@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)C(=O)c1ccc(Br)cc1 ZINC000511554925 566471988 /nfs/dbraw/zinc/47/19/88/566471988.db2.gz ASWKALLKGXNEHN-HZSPNIEDSA-N 0 3 381.314 3.114 10 0 GGAEHN CN(Cc1nc(-c2ccc(Br)s2)no1)[C@H]1CCN(C2CC2)C1 ZINC000511569899 566473144 /nfs/dbraw/zinc/47/31/44/566473144.db2.gz GNTFBZRCMOOVGB-NSHDSACASA-N 0 3 383.315 3.229 10 0 GGAEHN C[C@H](NC(=O)[C@H]1CCCCN1C1CCCC1)c1ncc(Br)cn1 ZINC000558457836 566474228 /nfs/dbraw/zinc/47/42/28/566474228.db2.gz CFNOBIOTUAPSAU-SWLSCSKDSA-N 0 3 381.318 3.213 10 0 GGAEHN C[C@@H](NC(=O)[C@@H]1CCCCN1C1CCCC1)c1ncc(Br)cn1 ZINC000558457834 566475153 /nfs/dbraw/zinc/47/51/53/566475153.db2.gz CFNOBIOTUAPSAU-DOMZBBRYSA-N 0 3 381.318 3.213 10 0 GGAEHN Cn1cnnc1Sc1ccc(NC(=O)[C@H]2NCCCC2(C)C)cc1Cl ZINC000423111513 566476689 /nfs/dbraw/zinc/47/66/89/566476689.db2.gz WCXJFYNIKUXRGU-CQSZACIVSA-N 0 3 379.917 3.336 10 0 GGAEHN C[C@@](CO)(NCC[S@](=O)c1ccccc1)c1ccc(Br)cc1 ZINC000511612791 566477371 /nfs/dbraw/zinc/47/73/71/566477371.db2.gz VQQOVTWDFXJBGB-JTSKRJEESA-N 0 3 382.323 3.054 10 0 GGAEHN CC1(C)CCCN[C@H]1C(=O)N1CCO[C@H](c2cccc(Br)c2)C1 ZINC000423112970 566477533 /nfs/dbraw/zinc/47/75/33/566477533.db2.gz XUSSHGRUOPFVEU-HOTGVXAUSA-N 0 3 381.314 3.127 10 0 GGAEHN CN(CCC(=O)N1CCc2c(F)ccc(Br)c2C1)c1ccncc1 ZINC000577934457 566477864 /nfs/dbraw/zinc/47/78/64/566477864.db2.gz MEKOPCFEOWWSSE-UHFFFAOYSA-N 0 3 392.272 3.394 10 0 GGAEHN OC[C@@H]1CN(CCCc2nc(-c3cccs3)no2)CC[C@@H]1C(F)(F)F ZINC000511681172 566481539 /nfs/dbraw/zinc/48/15/39/566481539.db2.gz KZAWNLVZBSKTEM-RYUDHWBXSA-N 0 3 375.416 3.223 10 0 GGAEHN Fc1cc(Br)cc2c1CC[C@@H]2Nc1ccc(N2CCNCC2)cn1 ZINC000423235711 566482312 /nfs/dbraw/zinc/48/23/12/566482312.db2.gz RHWQKIIIIFSVDB-KRWDZBQOSA-N 0 3 391.288 3.492 10 0 GGAEHN COc1ccc([C@@H](C)Nc2ccc(N3CCNCC3)cn2)cc1Br ZINC000423231073 566482939 /nfs/dbraw/zinc/48/29/39/566482939.db2.gz KQKSQJYLBYELPY-CYBMUJFWSA-N 0 3 391.313 3.435 10 0 GGAEHN Cc1cc(N2CCC[C@H](N[C@@H](C)c3cncc(Br)c3)C2)n(C)n1 ZINC000578027420 566483822 /nfs/dbraw/zinc/48/38/22/566483822.db2.gz ZQOMLVJDJSTPSX-BBRMVZONSA-N 0 3 378.318 3.206 10 0 GGAEHN CCN(CC)CCN(CC(C)C)S(=O)(=O)c1cccnc1C(F)(F)F ZINC000672377676 566483958 /nfs/dbraw/zinc/48/39/58/566483958.db2.gz LGHUWENIWYPANI-UHFFFAOYSA-N 0 3 381.464 3.089 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)c1cc(C(F)(F)F)ccc1Cl ZINC000627518633 566485344 /nfs/dbraw/zinc/48/53/44/566485344.db2.gz PCGREDFNVVEMSD-HUUCEWRRSA-N 0 3 376.806 3.294 10 0 GGAEHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000558570394 566486780 /nfs/dbraw/zinc/48/67/80/566486780.db2.gz XYSFZHPSKBQCHJ-XFBWCDHKSA-N 0 3 394.313 3.055 10 0 GGAEHN CN1CCC[C@]2(CCN(C(=O)[C@H]3[C@@H]4c5cccc(Br)c5C[C@H]34)C2)C1 ZINC000627534326 566487239 /nfs/dbraw/zinc/48/72/39/566487239.db2.gz VUHMYTZKJRJSRQ-MMTROXRISA-N 0 3 389.337 3.279 10 0 GGAEHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000558570388 566487289 /nfs/dbraw/zinc/48/72/89/566487289.db2.gz XYSFZHPSKBQCHJ-LYRGGWFBSA-N 0 3 394.313 3.055 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)Cc1cccc(Br)c1 ZINC000511769232 566488718 /nfs/dbraw/zinc/48/87/18/566488718.db2.gz ITZXBKBJCWHQBU-SFHVURJKSA-N 0 3 375.310 3.281 10 0 GGAEHN C[C@H](N[C@@H]1CNCCC1(F)F)c1ccc(F)c(I)c1 ZINC000423472777 566490788 /nfs/dbraw/zinc/49/07/88/566490788.db2.gz GDIWZVCVJLUROU-QPUJVOFHSA-N 0 3 384.183 3.078 10 0 GGAEHN C[C@H](N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1nccs1 ZINC000578101725 566491240 /nfs/dbraw/zinc/49/12/40/566491240.db2.gz WEMVIRVTJZSYQX-VQISRLSMSA-N 0 3 382.892 3.298 10 0 GGAEHN CN1CCC[C@H](NC(=O)NCC2(c3ccc(Br)s3)CCC2)C1 ZINC000672454389 566491524 /nfs/dbraw/zinc/49/15/24/566491524.db2.gz JRUCXRUZBWRDOT-LBPRGKRZSA-N 0 3 386.359 3.326 10 0 GGAEHN CCN(C(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)C1CCN(C)CC1 ZINC000627615316 566491624 /nfs/dbraw/zinc/49/16/24/566491624.db2.gz UMFQKMUKYBFSPE-BPQIPLTHSA-N 0 3 377.326 3.278 10 0 GGAEHN C[C@H](N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1nccs1 ZINC000578101722 566491901 /nfs/dbraw/zinc/49/19/01/566491901.db2.gz WEMVIRVTJZSYQX-COLVAYQJSA-N 0 3 382.892 3.298 10 0 GGAEHN CCN(C(=O)c1cc(=O)[nH]c2ccc(Br)cc21)C1CCN(C)CC1 ZINC000627619239 566492363 /nfs/dbraw/zinc/49/23/63/566492363.db2.gz YQBMXMDTFIOUNS-UHFFFAOYSA-N 0 3 392.297 3.259 10 0 GGAEHN Cc1cc([C@H](NC[C@H](O)CS(=O)(=O)c2cccs2)C2CC2)ccc1F ZINC000538116640 566493280 /nfs/dbraw/zinc/49/32/80/566493280.db2.gz LQVWHWIFMWVCCC-MAUKXSAKSA-N 0 3 383.510 3.071 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)N[C@@H]1C[C@@H](C)N(C3CC3)C1)CC2 ZINC000538126630 566493657 /nfs/dbraw/zinc/49/36/57/566493657.db2.gz NEYQJCQQRFNXNP-CZUORRHYSA-N 0 3 392.341 3.450 10 0 GGAEHN CN1CC[C@@H]2CN(C(=O)c3c(F)ccc(C(F)(F)F)c3Br)C[C@@H]21 ZINC000627632565 566493686 /nfs/dbraw/zinc/49/36/86/566493686.db2.gz NAIJVVXYCMINRP-KCJUWKMLSA-N 0 3 395.194 3.383 10 0 GGAEHN Cc1cc([C@@H](NC[C@@H](O)CS(=O)(=O)c2cccs2)C2CC2)ccc1F ZINC000538116641 566493751 /nfs/dbraw/zinc/49/37/51/566493751.db2.gz LQVWHWIFMWVCCC-QAPCUYQASA-N 0 3 383.510 3.071 10 0 GGAEHN C[C@H](CN1CCCCC1)NC(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651096315 566496522 /nfs/dbraw/zinc/49/65/22/566496522.db2.gz BLOWWUYROIQHLH-UKRRQHHQSA-N 0 3 381.314 3.306 10 0 GGAEHN COc1ccc(CNC[C@H](Cc2ccc(F)cc2)C(N)=O)c(Br)c1 ZINC000511955214 566500072 /nfs/dbraw/zinc/50/00/72/566500072.db2.gz DZQHQTANSBCIPU-AWEZNQCLSA-N 0 3 395.272 3.031 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651180179 566500933 /nfs/dbraw/zinc/50/09/33/566500933.db2.gz IEFRBLRWGVXCBZ-LSDHHAIUSA-N 0 3 383.330 3.408 10 0 GGAEHN CN(C)CCOc1ccccc1CNC(=O)Cc1sccc1Br ZINC000448826746 566501451 /nfs/dbraw/zinc/50/14/51/566501451.db2.gz ZKIBBBLGQLMOBI-UHFFFAOYSA-N 0 3 397.338 3.310 10 0 GGAEHN N[C@@H]1CN(C(=O)COc2ccc(Cl)c(Cl)c2)C[C@H]1c1cccc(F)c1 ZINC000424007940 566502024 /nfs/dbraw/zinc/50/20/24/566502024.db2.gz HARLKHHHILQTSK-WMLDXEAASA-N 0 3 383.250 3.465 10 0 GGAEHN Cc1ccc(C(=O)N2CCC(N3CCCOCC3)CC2)c(C)c1Br ZINC000627741764 566502418 /nfs/dbraw/zinc/50/24/18/566502418.db2.gz UTOGXOXDYSMZDB-UHFFFAOYSA-N 0 3 395.341 3.393 10 0 GGAEHN Cn1cc([C@@H](NC[C@@H](O)COc2ccc(Br)cc2)C(C)(C)C)cn1 ZINC000538277033 566502740 /nfs/dbraw/zinc/50/27/40/566502740.db2.gz MEZJIBXNXGHZRJ-NVXWUHKLSA-N 0 3 396.329 3.299 10 0 GGAEHN O=C(CCc1cccc(Br)c1)N1CCC(N2CCCOCC2)CC1 ZINC000627737846 566503160 /nfs/dbraw/zinc/50/31/60/566503160.db2.gz SRCBFEYSJUXGBG-UHFFFAOYSA-N 0 3 395.341 3.095 10 0 GGAEHN Cc1cccc(Br)c1C(=O)N1CCC(N2CCCOCC2)CC1 ZINC000627742318 566503425 /nfs/dbraw/zinc/50/34/25/566503425.db2.gz QTDTXZGARORDDC-UHFFFAOYSA-N 0 3 381.314 3.084 10 0 GGAEHN COc1ccc(F)cc1[C@H](C)N[C@H](C)Cn1cc(Br)ccc1=O ZINC000578227492 566503875 /nfs/dbraw/zinc/50/38/75/566503875.db2.gz MSHXVQWFBCMQHD-NEPJUHHUSA-N 0 3 383.261 3.498 10 0 GGAEHN N[C@@H]1CN(C(=O)COc2ccc(Cl)c(Cl)c2)C[C@H]1c1ccccc1F ZINC000424035892 566505005 /nfs/dbraw/zinc/50/50/05/566505005.db2.gz GOSVYDRRKWXZIH-SUMWQHHRSA-N 0 3 383.250 3.465 10 0 GGAEHN N[C@@H]1CN(S(=O)(=O)c2cccc(Cl)c2F)CC[C@H]1c1ccc(F)cc1 ZINC000578248722 566505366 /nfs/dbraw/zinc/50/53/66/566505366.db2.gz QCTIMDOXHYJQCW-DZGCQCFKSA-N 0 3 386.851 3.124 10 0 GGAEHN CN(C)C[C@@H]1CCCCN1C(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000651256979 566505420 /nfs/dbraw/zinc/50/54/20/566505420.db2.gz STZHFXIWQHDXNY-GJZGRUSLSA-N 0 3 381.314 3.258 10 0 GGAEHN CN(C)C[C@H]1CCCCN1C(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000651256978 566505880 /nfs/dbraw/zinc/50/58/80/566505880.db2.gz STZHFXIWQHDXNY-CABCVRRESA-N 0 3 381.314 3.258 10 0 GGAEHN C[C@@H]1CC[C@@H](C)N(CC(=O)N2CCN(c3ncc(Cl)cc3Cl)CC2)C1 ZINC000464825414 566506561 /nfs/dbraw/zinc/50/65/61/566506561.db2.gz WZYHHWPLESMKQI-ZIAGYGMSSA-N 0 3 385.339 3.157 10 0 GGAEHN C[C@H](NC(=O)CN1CCC[C@H]2COCC[C@@H]21)c1ccc(Br)cc1 ZINC000464848546 566506687 /nfs/dbraw/zinc/50/66/87/566506687.db2.gz GKUWHJKLLSZKBZ-QRTARXTBSA-N 0 3 381.314 3.127 10 0 GGAEHN O[C@H]1CCC[C@H]1N1CCN(c2ncc(Br)c3ccc(F)cc32)CC1 ZINC000651306148 566508528 /nfs/dbraw/zinc/50/85/28/566508528.db2.gz UFIJMRFAGXSVAL-SJORKVTESA-N 0 3 394.288 3.172 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)c1ccc(I)cc1Cl ZINC000464922661 566509921 /nfs/dbraw/zinc/50/99/21/566509921.db2.gz SFYIVPHNUHQJKS-LLVKDONJSA-N 0 3 392.668 3.111 10 0 GGAEHN CC(C)Oc1cc(C(=O)N(C)[C@H]2CN3CCC2CC3)ccc1Br ZINC000651307416 566509997 /nfs/dbraw/zinc/50/99/97/566509997.db2.gz AIDOHJVHDSRWOF-INIZCTEOSA-N 0 3 381.314 3.403 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)CSCc1ccc(Br)cc1F ZINC000464925457 566510240 /nfs/dbraw/zinc/51/02/40/566510240.db2.gz DMGCXMNNRQTPOU-AWEZNQCLSA-N 0 3 389.334 3.374 10 0 GGAEHN COCCN(CCN(C)C)C(=O)c1ccc2scc(Br)c2c1 ZINC000448908221 566510553 /nfs/dbraw/zinc/51/05/53/566510553.db2.gz FULIFCNHNGFELR-UHFFFAOYSA-N 0 3 385.327 3.314 10 0 GGAEHN CC1(C)NC(=O)CC[C@H]1NCc1ccc(I)c(Cl)c1 ZINC000558860178 566512212 /nfs/dbraw/zinc/51/22/12/566512212.db2.gz OCXMCRWDSGVSJL-GFCCVEGCSA-N 0 3 392.668 3.091 10 0 GGAEHN COc1cc(Br)c(C(=O)NCCN2[C@H](C)CCC[C@H]2C)cc1OC ZINC000448934293 566513747 /nfs/dbraw/zinc/51/37/47/566513747.db2.gz UWEXUZJRZMYGPY-CHWSQXEVSA-N 0 3 399.329 3.459 10 0 GGAEHN COC1CCN(C(C)(C)CNC(=O)Cc2sccc2Br)CC1 ZINC000448933477 566513772 /nfs/dbraw/zinc/51/37/72/566513772.db2.gz AKRXXEPSDURMFQ-UHFFFAOYSA-N 0 3 389.359 3.059 10 0 GGAEHN CN(C[C@H]1CCCN(C)C1)C(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000651347176 566514871 /nfs/dbraw/zinc/51/48/71/566514871.db2.gz ZYADSNWTGRDTIK-ZFWWWQNUSA-N 0 3 381.314 3.115 10 0 GGAEHN COc1ccc(C[C@@H](CO)CNCc2cncn2C(C)C)cc1Br ZINC000424166048 566516055 /nfs/dbraw/zinc/51/60/55/566516055.db2.gz CARPZSHYHRTZBH-OAHLLOKOSA-N 0 3 396.329 3.176 10 0 GGAEHN CC(C)n1cncc1CNCCCNC(=O)c1ccc(Br)cc1 ZINC000424161911 566516284 /nfs/dbraw/zinc/51/62/84/566516284.db2.gz WJQVJFIDROSGTN-UHFFFAOYSA-N 0 3 379.302 3.136 10 0 GGAEHN CCN1CCN(CCNC(=O)c2ccc3scc(Br)c3c2)CC1 ZINC000448977662 566516754 /nfs/dbraw/zinc/51/67/54/566516754.db2.gz ZGRNJKNWBADFPR-UHFFFAOYSA-N 0 3 396.354 3.031 10 0 GGAEHN CC[C@@H](CN1CCCC1)NC(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000651349201 566516706 /nfs/dbraw/zinc/51/67/06/566516706.db2.gz WNIMWIPKRDDZIR-GJZGRUSLSA-N 0 3 381.314 3.306 10 0 GGAEHN CC[C@H](CN1CCCC1)NC(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000651349200 566516921 /nfs/dbraw/zinc/51/69/21/566516921.db2.gz WNIMWIPKRDDZIR-CABCVRRESA-N 0 3 381.314 3.306 10 0 GGAEHN CC(C)C[C@H](CNCc1ccc(S(C)(=O)=O)s1)C(=O)OC(C)(C)C ZINC000424191477 566518115 /nfs/dbraw/zinc/51/81/15/566518115.db2.gz RCSGOPAKPZUWJF-CYBMUJFWSA-N 0 3 375.556 3.245 10 0 GGAEHN Cc1cc(Br)cc(CNC[C@@H]2CCN(C)C(=O)C2)c1OC(F)F ZINC000424191770 566518301 /nfs/dbraw/zinc/51/83/01/566518301.db2.gz RQZWBLZWGIPDBG-LLVKDONJSA-N 0 3 391.256 3.317 10 0 GGAEHN CC(C)n1cncc1CNC[C@@H](CO)Cc1ccc(F)c(Br)c1 ZINC000424180438 566518318 /nfs/dbraw/zinc/51/83/18/566518318.db2.gz OILAWZKUWQCQEV-AWEZNQCLSA-N 0 3 384.293 3.306 10 0 GGAEHN CN1CC[C@H](CNCc2cc(C(F)(F)F)ccc2Br)CC1=O ZINC000424192713 566518660 /nfs/dbraw/zinc/51/86/60/566518660.db2.gz UKGMKNFVHJZYHN-JTQLQIEISA-N 0 3 379.220 3.426 10 0 GGAEHN C[C@@H]1CN(CCO)[C@@H](C)CN1c1ncc(Br)c2ccc(F)cc21 ZINC000651357807 566518659 /nfs/dbraw/zinc/51/86/59/566518659.db2.gz HVNWAOWBTNUMAY-NWDGAFQWSA-N 0 3 382.277 3.028 10 0 GGAEHN CCCN(C(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)[C@H]1CCN(C)C1 ZINC000627914516 566518627 /nfs/dbraw/zinc/51/86/27/566518627.db2.gz YIBVSIHEWIUAPO-LGRHPFTQSA-N 0 3 377.326 3.278 10 0 GGAEHN CN1CC[C@H](CNCc2cc(Br)ccc2OC(F)F)CC1=O ZINC000424196132 566518710 /nfs/dbraw/zinc/51/87/10/566518710.db2.gz ZDWIPNYVPKSFSD-JTQLQIEISA-N 0 3 377.229 3.009 10 0 GGAEHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000628026134 566524245 /nfs/dbraw/zinc/52/42/45/566524245.db2.gz KIUXNPYXSPQXBQ-AIHBUXEESA-N 0 3 389.337 3.468 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N1CC[C@H]2CC[C@@H](C1)N2C ZINC000465236614 566524566 /nfs/dbraw/zinc/52/45/66/566524566.db2.gz QBBMAMKNNAJUOE-CABCVRRESA-N 0 3 390.325 3.407 10 0 GGAEHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000628026135 566524854 /nfs/dbraw/zinc/52/48/54/566524854.db2.gz KIUXNPYXSPQXBQ-RXABAKJHSA-N 0 3 389.337 3.468 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000628037280 566525643 /nfs/dbraw/zinc/52/56/43/566525643.db2.gz VSQVGVCTPXSSAS-QQDQCYIDSA-N 0 3 377.326 3.324 10 0 GGAEHN O=C1C[C@H]([C@H]2CCCCN2Cc2ccnc3c(Br)cccc23)CN1 ZINC000449040155 566526001 /nfs/dbraw/zinc/52/60/01/566526001.db2.gz GUXFJAKZXOEZGP-WMLDXEAASA-N 0 3 388.309 3.488 10 0 GGAEHN O=S(=O)(Cc1cc(Cl)sc1Cl)N1CCN(c2ccncc2)CC1 ZINC000651503746 566526477 /nfs/dbraw/zinc/52/64/77/566526477.db2.gz MZFDAXNYPJYVFP-UHFFFAOYSA-N 0 3 392.333 3.102 10 0 GGAEHN O=S(=O)(NCc1ccccc1CN1CCCCC1)c1cncc(Cl)c1 ZINC000559139912 566528404 /nfs/dbraw/zinc/52/84/04/566528404.db2.gz SKDWGZBXXKQKPJ-UHFFFAOYSA-N 0 3 379.913 3.199 10 0 GGAEHN COC(=O)CC1CC(NCc2ccc(I)cc2Cl)C1 ZINC000424346828 566528978 /nfs/dbraw/zinc/52/89/78/566528978.db2.gz JYTOEIPADLCBED-UHFFFAOYSA-N 0 3 393.652 3.376 10 0 GGAEHN CC[C@@H](CO)N1CCN(Cc2cc(Br)cc(C(F)(F)F)c2)CC1 ZINC000538721453 566530106 /nfs/dbraw/zinc/53/01/06/566530106.db2.gz LYPNTYLEFLNRIE-HNNXBMFYSA-N 0 3 395.263 3.356 10 0 GGAEHN C[C@H](NCc1ccc(S(=O)(=O)N2CCOCC2)s1)[C@H]1CCCC[C@H]1C ZINC000449128783 566531515 /nfs/dbraw/zinc/53/15/15/566531515.db2.gz ARCXFIWBBKNDCI-VYDXJSESSA-N 0 3 386.583 3.073 10 0 GGAEHN CNC(=O)[C@H](C)Oc1ccc(Br)cc1CNCCCCSC ZINC000449157803 566533105 /nfs/dbraw/zinc/53/31/05/566533105.db2.gz RIHOCRZNCHWDLX-LBPRGKRZSA-N 0 3 389.359 3.195 10 0 GGAEHN C[C@@H](COc1ccc(Cl)c(Cl)c1)N[C@@H]1CCN(C2CCOCC2)C1=O ZINC000449178344 566533361 /nfs/dbraw/zinc/53/33/61/566533361.db2.gz SISUJZZAXZFYEN-YVEFUNNKSA-N 0 3 387.307 3.130 10 0 GGAEHN C[C@H](COc1ccc(Cl)c(Cl)c1)N[C@@H]1CCN(C2CCOCC2)C1=O ZINC000449178343 566533559 /nfs/dbraw/zinc/53/35/59/566533559.db2.gz SISUJZZAXZFYEN-SJKOYZFVSA-N 0 3 387.307 3.130 10 0 GGAEHN Cc1cc(CN)cc(NC(=O)C(=O)N[C@H]2CCCc3sc(Cl)cc32)c1 ZINC000424473969 566535408 /nfs/dbraw/zinc/53/54/08/566535408.db2.gz XFTXPJJJUCDJQJ-AWEZNQCLSA-N 0 3 377.897 3.301 10 0 GGAEHN CN1CCC[C@H](CNC(=O)NCCOCC(F)(F)F)[C@H]1c1cccs1 ZINC000465551978 566536033 /nfs/dbraw/zinc/53/60/33/566536033.db2.gz TZOSTEQTBHWTPS-OCCSQVGLSA-N 0 3 379.448 3.009 10 0 GGAEHN NC(=O)N[C@@H]1CCN(Cc2ccc(-c3ccccc3Br)s2)C1 ZINC000538795779 566536408 /nfs/dbraw/zinc/53/64/08/566536408.db2.gz VYDRYFHYROGSGL-LLVKDONJSA-N 0 3 380.311 3.420 10 0 GGAEHN CN1CCC[C@@H](CNC(=O)NCCOCC(F)(F)F)[C@@H]1c1cccs1 ZINC000465551976 566536636 /nfs/dbraw/zinc/53/66/36/566536636.db2.gz TZOSTEQTBHWTPS-GXTWGEPZSA-N 0 3 379.448 3.009 10 0 GGAEHN C[C@@H]1C[C@@H](NC(=O)C(=O)Nc2cc(Cl)c(Cl)c(Cl)c2)CCN1C ZINC000651588167 566539065 /nfs/dbraw/zinc/53/90/65/566539065.db2.gz JUEUJZQBJQKVOS-BDAKNGLRSA-N 0 3 378.687 3.184 10 0 GGAEHN COc1ccc(Br)c(CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1 ZINC000465657383 566539786 /nfs/dbraw/zinc/53/97/86/566539786.db2.gz IUDMUQZOYATRIW-JSGCOSHPSA-N 0 3 384.318 3.082 10 0 GGAEHN CN1CC[C@H]2[C@H](CCCN2S(=O)(=O)Cc2cc(Cl)sc2Cl)C1 ZINC000651607163 566540260 /nfs/dbraw/zinc/54/02/60/566540260.db2.gz FUHGVAXREVVCFW-PWSUYJOCSA-N 0 3 383.366 3.301 10 0 GGAEHN CN1CCC[C@@H]2CN(S(=O)(=O)Cc3cc(Cl)sc3Cl)CC[C@@H]21 ZINC000651604234 566540503 /nfs/dbraw/zinc/54/05/03/566540503.db2.gz UVACKHIAFXLSCK-PWSUYJOCSA-N 0 3 383.366 3.301 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)Cc1noc2ccc(Br)cc21 ZINC000424586061 566543564 /nfs/dbraw/zinc/54/35/64/566543564.db2.gz DUTRFMKGRCUJMY-GFCCVEGCSA-N 0 3 380.286 3.123 10 0 GGAEHN C[C@H](CNC(=O)Cc1noc2ccc(Br)cc21)N1CCC[C@@H](C)C1 ZINC000424585815 566543801 /nfs/dbraw/zinc/54/38/01/566543801.db2.gz QUYJWSSNWBHLCB-CHWSQXEVSA-N 0 3 394.313 3.369 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)Cc1noc2ccc(Br)cc21 ZINC000424586064 566543815 /nfs/dbraw/zinc/54/38/15/566543815.db2.gz DUTRFMKGRCUJMY-LBPRGKRZSA-N 0 3 380.286 3.123 10 0 GGAEHN C[C@@H](CNC(=O)Cc1noc2ccc(Br)cc21)N1CCC[C@@H](C)C1 ZINC000424585817 566544255 /nfs/dbraw/zinc/54/42/55/566544255.db2.gz QUYJWSSNWBHLCB-OLZOCXBDSA-N 0 3 394.313 3.369 10 0 GGAEHN Cc1cc(N2CCC[C@@H](NCc3cccc(F)c3Br)C2)n(C)n1 ZINC000449288211 566544812 /nfs/dbraw/zinc/54/48/12/566544812.db2.gz YFTAHUQSLCRLRG-CQSZACIVSA-N 0 3 381.293 3.389 10 0 GGAEHN Cc1cc(N2CCC[C@H](NCc3cc(F)cc(Br)c3)C2)n(C)n1 ZINC000449285804 566544909 /nfs/dbraw/zinc/54/49/09/566544909.db2.gz SSRDSQPGKSIMBJ-INIZCTEOSA-N 0 3 381.293 3.389 10 0 GGAEHN OC[C@@H](CNCc1cc(Br)ccc1OC(F)F)c1cccnc1 ZINC000673616360 566546423 /nfs/dbraw/zinc/54/64/23/566546423.db2.gz SDHSGQZDBBHQAU-CYBMUJFWSA-N 0 3 387.224 3.311 10 0 GGAEHN C[C@H](NCc1ccnc2c(Br)cccc12)C1(S(C)(=O)=O)CC1 ZINC000449319327 566547978 /nfs/dbraw/zinc/54/79/78/566547978.db2.gz GHAADQMDTQQBHV-NSHDSACASA-N 0 3 383.311 3.053 10 0 GGAEHN Brc1ccc(-c2n[nH]cc2CN2CC[C@@H](Cn3ccnn3)C2)s1 ZINC000628336607 566548889 /nfs/dbraw/zinc/54/88/89/566548889.db2.gz LAHYKAIBCSKDEF-LLVKDONJSA-N 0 3 393.314 3.014 10 0 GGAEHN CN(CCC1CCN(c2ccncc2)CC1)c1ncncc1Br ZINC000538928735 566549542 /nfs/dbraw/zinc/54/95/42/566549542.db2.gz XOGJYNOPCPDMSV-UHFFFAOYSA-N 0 3 376.302 3.377 10 0 GGAEHN O[C@H](CCNCc1cnn(-c2ccc(Br)cc2)c1)C(F)(F)F ZINC000578735334 566550661 /nfs/dbraw/zinc/55/06/61/566550661.db2.gz GVFJWKSCWCIKSS-CYBMUJFWSA-N 0 3 378.192 3.038 10 0 GGAEHN CCN1CC[C@H]2OCCN(Cc3ccnc4c(Br)cccc34)[C@H]2C1 ZINC000449337485 566551107 /nfs/dbraw/zinc/55/11/07/566551107.db2.gz BNBQKPXSAYESJL-ZWKOTPCHSA-N 0 3 390.325 3.292 10 0 GGAEHN O=S1(=O)C[C@@H](CNCc2cc(F)cc(Br)c2)c2ccccc21 ZINC000449361759 566553073 /nfs/dbraw/zinc/55/30/73/566553073.db2.gz YNDYFXIFSOQLOR-GFCCVEGCSA-N 0 3 384.270 3.249 10 0 GGAEHN O=C(Cc1noc2ccc(Br)cc21)N1CC[C@H](N2CCCCC2)C1 ZINC000424666391 566554802 /nfs/dbraw/zinc/55/48/02/566554802.db2.gz SLGMBYXTHDCNLX-AWEZNQCLSA-N 0 3 392.297 3.220 10 0 GGAEHN CN1CCC[C@@]2(CCN(S(=O)(=O)Cc3cc(Cl)sc3Cl)C2)C1 ZINC000651717777 566555117 /nfs/dbraw/zinc/55/51/17/566555117.db2.gz RVTDXNBICRYQSK-CQSZACIVSA-N 0 3 383.366 3.302 10 0 GGAEHN C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000486084603 566555825 /nfs/dbraw/zinc/55/58/25/566555825.db2.gz CTRGODSAHVTGFN-WFASDCNBSA-N 0 3 398.320 3.397 10 0 GGAEHN Cn1nccc1CN1CC[C@@H](Cc2cccc(I)c2)C1 ZINC000449392087 566556190 /nfs/dbraw/zinc/55/61/90/566556190.db2.gz IUWLQXXCSUCSBP-AWEZNQCLSA-N 0 3 381.261 3.089 10 0 GGAEHN COC[C@@](C)(O)CCNCc1cnc(-c2ccc(Br)cc2)s1 ZINC000449384060 566556491 /nfs/dbraw/zinc/55/64/91/566556491.db2.gz MADHONBOVHDBMN-INIZCTEOSA-N 0 3 385.327 3.450 10 0 GGAEHN CCC1(N2CCOCC2)CCN(Cc2cncc(Br)c2C)CC1 ZINC000628476515 566557231 /nfs/dbraw/zinc/55/72/31/566557231.db2.gz SNBNQYBJZYFLFQ-UHFFFAOYSA-N 0 3 382.346 3.229 10 0 GGAEHN Nc1c(Br)cc(Br)cc1CN[C@@H]1CO[C@H](C2CC2)C1 ZINC000628463063 566557520 /nfs/dbraw/zinc/55/75/20/566557520.db2.gz RHTXZSDSAJMXKV-AAEUAGOBSA-N 0 3 390.119 3.451 10 0 GGAEHN COc1cc(C(=O)NCCN2[C@H](C)CCC[C@H]2C)cc(Br)c1OC ZINC000559569890 566559565 /nfs/dbraw/zinc/55/95/65/566559565.db2.gz LHOKZOFHPZPBFY-CHWSQXEVSA-N 0 3 399.329 3.459 10 0 GGAEHN O[C@@H](CNC[C@@H]1COc2ccccc2O1)COc1ccc(Cl)cc1Cl ZINC000559581213 566559638 /nfs/dbraw/zinc/55/96/38/566559638.db2.gz FVMKQVZYDVCMMQ-UONOGXRCSA-N 0 3 384.259 3.163 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C ZINC000466221624 566560148 /nfs/dbraw/zinc/56/01/48/566560148.db2.gz VMVWDLCNSSNJAI-OGHNNQOOSA-N 0 3 380.330 3.162 10 0 GGAEHN COc1ncc(C(=O)Nc2cc(CN(C)C)ccc2C)cc1Br ZINC000424707854 566562232 /nfs/dbraw/zinc/56/22/32/566562232.db2.gz QOLCZKJNVFWTNK-UHFFFAOYSA-N 0 3 378.270 3.475 10 0 GGAEHN O[C@@H]1C[C@@H]([C@H]2CCCOC2)N(Cc2ccc(Br)c3cccnc23)C1 ZINC000449431187 566562644 /nfs/dbraw/zinc/56/26/44/566562644.db2.gz CYQPZTSXDSIKCJ-DAYGRLMNSA-N 0 3 391.309 3.359 10 0 GGAEHN O[C@@H]1C[C@@H]([C@@H]2CCCOC2)N(CC2=Cc3cc(Br)ccc3OC2)C1 ZINC000449434737 566562726 /nfs/dbraw/zinc/56/27/26/566562726.db2.gz SHVFQELOUORYGK-OLMNPRSZSA-N 0 3 394.309 3.087 10 0 GGAEHN O[C@@H]1C[C@@H]([C@@H]2CCCOC2)N(Cc2ccnc3c(Br)cccc23)C1 ZINC000449433578 566562881 /nfs/dbraw/zinc/56/28/81/566562881.db2.gz MXJSXROGGVIUKO-RKVPGOIHSA-N 0 3 391.309 3.359 10 0 GGAEHN CN(C)CCn1cc(NC(=O)NC2(c3ccc(Br)cc3)CC2)cn1 ZINC000673872134 566563667 /nfs/dbraw/zinc/56/36/67/566563667.db2.gz SYJWJYDVVUWIFG-UHFFFAOYSA-N 0 3 392.301 3.018 10 0 GGAEHN C[C@@H](c1ccccc1Br)N(C)C(=O)Nc1cnn(CCN(C)C)c1 ZINC000673870834 566563975 /nfs/dbraw/zinc/56/39/75/566563975.db2.gz RWSYWYMAKUUBPC-ZDUSSCGKSA-N 0 3 394.317 3.432 10 0 GGAEHN CC1(C)COC[C@H]1NCc1cc(Br)cc(Br)c1N ZINC000449627143 566585066 /nfs/dbraw/zinc/58/50/66/566585066.db2.gz YWGGVGSFEMGISQ-LLVKDONJSA-N 0 3 378.108 3.308 10 0 GGAEHN CN(C)CCn1cc(NC(=O)N[C@H]2CCc3c2cccc3Br)cn1 ZINC000673871191 566564175 /nfs/dbraw/zinc/56/41/75/566564175.db2.gz YITIKCDXRGQDQT-INIZCTEOSA-N 0 3 392.301 3.016 10 0 GGAEHN C[C@H](CNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1)Oc1cccc(Br)c1 ZINC000466300081 566564655 /nfs/dbraw/zinc/56/46/55/566564655.db2.gz VWFFFAQXZRSMDQ-SQWLQELKSA-N 0 3 398.345 3.341 10 0 GGAEHN C[C@H](CNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1)Oc1cccc(Br)c1 ZINC000466300080 566564951 /nfs/dbraw/zinc/56/49/51/566564951.db2.gz VWFFFAQXZRSMDQ-LZWOXQAQSA-N 0 3 398.345 3.341 10 0 GGAEHN C[C@H](CNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1)Oc1cccc(Br)c1 ZINC000466300079 566565061 /nfs/dbraw/zinc/56/50/61/566565061.db2.gz VWFFFAQXZRSMDQ-IIAWOOMASA-N 0 3 398.345 3.341 10 0 GGAEHN CN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2noc3ccc(Br)cc32)C1 ZINC000424737958 566565060 /nfs/dbraw/zinc/56/50/60/566565060.db2.gz LZBFAIZVVNINIP-LRDDRELGSA-N 0 3 392.297 3.076 10 0 GGAEHN C[C@H](CC(=O)NC[C@@H]1CCN1C1CCCCC1)n1cc(Br)cn1 ZINC000628543914 566565430 /nfs/dbraw/zinc/56/54/30/566565430.db2.gz VYZLQCPZOTUAQV-CJNGLKHVSA-N 0 3 383.334 3.120 10 0 GGAEHN CCN(CC)CCN(C(=O)CC1CCOCC1)c1ccc(Br)cn1 ZINC000559696876 566566812 /nfs/dbraw/zinc/56/68/12/566566812.db2.gz YMDDWEWETZPAKR-UHFFFAOYSA-N 0 3 398.345 3.336 10 0 GGAEHN CS(=O)(=O)N[C@H]1CCCC[C@H]1CNCc1csc(-c2ccccc2)n1 ZINC000512904669 566567388 /nfs/dbraw/zinc/56/73/88/566567388.db2.gz ZXPPHKCPKKDGOY-RDJZCZTQSA-N 0 3 379.551 3.008 10 0 GGAEHN Cn1cc(Br)c(CNC2CCN(CCc3ccc(F)cc3)CC2)n1 ZINC000449487028 566569122 /nfs/dbraw/zinc/56/91/22/566569122.db2.gz WIHBSGOARUCDJT-UHFFFAOYSA-N 0 3 395.320 3.118 10 0 GGAEHN C[C@H]1C[C@@H](NCc2nn(C)cc2Br)CN(Cc2ccccc2)C1 ZINC000449483038 566570036 /nfs/dbraw/zinc/57/00/36/566570036.db2.gz FWEDJJRSWXJKJN-GOEBONIOSA-N 0 3 377.330 3.183 10 0 GGAEHN C[C@H]1C[C@H](NCc2nn(C)cc2Br)CN(Cc2ccccc2)C1 ZINC000449483039 566570101 /nfs/dbraw/zinc/57/01/01/566570101.db2.gz FWEDJJRSWXJKJN-HOCLYGCPSA-N 0 3 377.330 3.183 10 0 GGAEHN C[C@@H](CNC(=O)N(C)[C@H]1CCN(C2CC2)C1)Oc1ccc(Br)cc1 ZINC000466376880 566570151 /nfs/dbraw/zinc/57/01/51/566570151.db2.gz PGDRROAGCKWEGH-BBRMVZONSA-N 0 3 396.329 3.095 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@@H]1CNCc1ccc(F)c(-c2cccs2)c1 ZINC000513002164 566572326 /nfs/dbraw/zinc/57/23/26/566572326.db2.gz UPBGALOWBGSODU-OAHLLOKOSA-N 0 3 382.526 3.458 10 0 GGAEHN COc1ncc(C(=O)Nc2ccccc2CCN(C)C)cc1Br ZINC000424796045 566572824 /nfs/dbraw/zinc/57/28/24/566572824.db2.gz GVBTUFADPUYZFA-UHFFFAOYSA-N 0 3 378.270 3.209 10 0 GGAEHN OC[C@@]1(CNCc2cnc3ccc(Br)cn23)CCc2ccccc21 ZINC000651884530 566573000 /nfs/dbraw/zinc/57/30/00/566573000.db2.gz KKMXFSNSRWFULA-IBGZPJMESA-N 0 3 386.293 3.063 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@H]1CNCc1ccc(F)c(-c2cccs2)c1 ZINC000513002163 566573065 /nfs/dbraw/zinc/57/30/65/566573065.db2.gz UPBGALOWBGSODU-HNNXBMFYSA-N 0 3 382.526 3.458 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@H]1CNCc1ccc(Cl)c(C(F)(F)F)c1 ZINC000513026628 566573763 /nfs/dbraw/zinc/57/37/63/566573763.db2.gz DQNGMWFKDBBAIC-LBPRGKRZSA-N 0 3 384.851 3.263 10 0 GGAEHN Cc1cc([C@@H](C)NC[C@H]2CCCCN2S(C)(=O)=O)sc1Br ZINC000513012645 566573940 /nfs/dbraw/zinc/57/39/40/566573940.db2.gz RJXIDKXQHOBJLQ-VXGBXAGGSA-N 0 3 395.388 3.284 10 0 GGAEHN C[C@H](COc1cccc(F)c1)N[C@H](C)Cn1cc(Br)ccc1=O ZINC000559892848 566575332 /nfs/dbraw/zinc/57/53/32/566575332.db2.gz ARLQFMXNHDQKDX-CHWSQXEVSA-N 0 3 383.261 3.196 10 0 GGAEHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)Cc1noc2ccc(Br)cc21 ZINC000424828184 566576324 /nfs/dbraw/zinc/57/63/24/566576324.db2.gz FYVIALRCKNQICS-GXTWGEPZSA-N 0 3 392.297 3.218 10 0 GGAEHN COc1cc(Br)ccc1[C@H]1CCCN1C(=O)CN1CC[C@@H](C)C1 ZINC000628679239 566577435 /nfs/dbraw/zinc/57/74/35/566577435.db2.gz FEQOQWCKOUTVAN-CZUORRHYSA-N 0 3 381.314 3.463 10 0 GGAEHN CN1CCC[C@@]2(CCN(C(=O)Cc3noc4ccc(Br)cc43)C2)C1 ZINC000424846547 566577866 /nfs/dbraw/zinc/57/78/66/566577866.db2.gz MPPMENYVTLGCJN-GOSISDBHSA-N 0 3 392.297 3.077 10 0 GGAEHN CN1CCC[C@]2(CCN(C(=O)Cc3noc4ccc(Br)cc43)C2)C1 ZINC000424846548 566578340 /nfs/dbraw/zinc/57/83/40/566578340.db2.gz MPPMENYVTLGCJN-SFHVURJKSA-N 0 3 392.297 3.077 10 0 GGAEHN COc1ccc(C[C@H](CO)CNCc2cnccc2C)cc1Br ZINC000449597518 566579044 /nfs/dbraw/zinc/57/90/44/566579044.db2.gz FIUUQSQDOYLAMM-HNNXBMFYSA-N 0 3 379.298 3.102 10 0 GGAEHN CCCn1cc(CNC[C@@H](CO)Cc2cc(Br)ccc2F)cn1 ZINC000449600752 566580128 /nfs/dbraw/zinc/58/01/28/566580128.db2.gz PKDRBNOKGWEOGG-ZDUSSCGKSA-N 0 3 384.293 3.136 10 0 GGAEHN CN(CCC(=O)N1CCN(C)c2cc(Br)ccc21)c1ccncc1 ZINC000579094442 566580474 /nfs/dbraw/zinc/58/04/74/566580474.db2.gz VIRGUYPHCNHMRZ-UHFFFAOYSA-N 0 3 389.297 3.153 10 0 GGAEHN COc1ncc(C(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1Br ZINC000424852226 566580571 /nfs/dbraw/zinc/58/05/71/566580571.db2.gz PIKWMNVEPMYXCZ-OAHLLOKOSA-N 0 3 396.260 3.025 10 0 GGAEHN CCn1nccc1CCN[C@@](C)(CC(=O)OC)c1ccc(Br)cc1 ZINC000513121698 566580853 /nfs/dbraw/zinc/58/08/53/566580853.db2.gz HTHSJASTKLSQMY-SFHVURJKSA-N 0 3 394.313 3.276 10 0 GGAEHN CC[C@@H](OCCNCc1ccc(S(N)(=O)=O)c(Cl)c1)c1ccccc1 ZINC000651978536 566581591 /nfs/dbraw/zinc/58/15/91/566581591.db2.gz QLKNNDVFXNTAEH-QGZVFWFLSA-N 0 3 382.913 3.245 10 0 GGAEHN COc1cc(C)nc(CNC[C@@H](CO)Cc2ccc(C)c(Br)c2)c1 ZINC000449601392 566581982 /nfs/dbraw/zinc/58/19/82/566581982.db2.gz RKGFOAGIOALPOE-INIZCTEOSA-N 0 3 393.325 3.410 10 0 GGAEHN CN(C)CCn1cc(NC(=O)CCc2cc(Cl)ccc2Br)cn1 ZINC000674306159 566583645 /nfs/dbraw/zinc/58/36/45/566583645.db2.gz KHPQWAUMRSXRFT-UHFFFAOYSA-N 0 3 399.720 3.432 10 0 GGAEHN COC(=O)C[C@](C)(NCCCn1ccnc1C)c1ccc(Br)cc1 ZINC000513133283 566584023 /nfs/dbraw/zinc/58/40/23/566584023.db2.gz GCSVLJGVQZNJCV-SFHVURJKSA-N 0 3 394.313 3.412 10 0 GGAEHN COC(=O)C[C@@](C)(NCCCc1nc(C)no1)c1ccc(Br)cc1 ZINC000513133624 566584058 /nfs/dbraw/zinc/58/40/58/566584058.db2.gz LUEBVWSUGJXBRP-QGZVFWFLSA-N 0 3 396.285 3.141 10 0 GGAEHN COc1ncc(Br)cc1CNC(=O)C[C@H](c1ccccc1)N(C)C ZINC000628793420 566585174 /nfs/dbraw/zinc/58/51/74/566585174.db2.gz GKCIDCXQAOGAAW-MRXNPFEDSA-N 0 3 392.297 3.162 10 0 GGAEHN COc1ccc(Br)cc1CN[C@@H]1CCCc2c1ccc(=O)n2C ZINC000652044930 566586191 /nfs/dbraw/zinc/58/61/91/566586191.db2.gz WPXAEVLCWBTYNR-OAHLLOKOSA-N 0 3 377.282 3.324 10 0 GGAEHN COc1cc(C[NH2+][C@H]2CCCc3c2ccc(=O)n3C)cc(Br)c1[O-] ZINC000652044042 566586297 /nfs/dbraw/zinc/58/62/97/566586297.db2.gz FOUUXTVRNRXFPQ-AWEZNQCLSA-N 0 3 393.281 3.029 10 0 GGAEHN CN(C)CCOc1ccccc1C(=O)NCCc1ccc(Br)cc1 ZINC000604978426 566588193 /nfs/dbraw/zinc/58/81/93/566588193.db2.gz FAENJKZEHNOPBU-UHFFFAOYSA-N 0 3 391.309 3.362 10 0 GGAEHN COc1ccc(Br)cc1C[C@@H](CO)CNCc1cnccc1C ZINC000449678643 566588729 /nfs/dbraw/zinc/58/87/29/566588729.db2.gz FYKUJONOJAECCN-CQSZACIVSA-N 0 3 379.298 3.102 10 0 GGAEHN C[C@H]1OCC[C@@H]1N(CCO)Cc1cc(Br)cc(Br)c1 ZINC000449677126 566589508 /nfs/dbraw/zinc/58/95/08/566589508.db2.gz LQHJFYAHYDBHBU-YGRLFVJLSA-N 0 3 393.119 3.183 10 0 GGAEHN CN(CCC(=O)Nc1ccc(I)cc1)c1ccncc1 ZINC000579216229 566589620 /nfs/dbraw/zinc/58/96/20/566589620.db2.gz WUTJFPRSBUXGML-UHFFFAOYSA-N 0 3 381.217 3.151 10 0 GGAEHN Cc1cc(Br)cn2c(CN(CCO)C3CCSCC3)cnc12 ZINC000449680896 566591078 /nfs/dbraw/zinc/59/10/78/566591078.db2.gz CSLDLTRIAXEWNV-UHFFFAOYSA-N 0 3 384.343 3.095 10 0 GGAEHN O[C@@H](CNCCOc1ncccc1Cl)COc1c(Cl)cccc1Cl ZINC000579222868 566591223 /nfs/dbraw/zinc/59/12/23/566591223.db2.gz GYFORWICZFRLKI-NSHDSACASA-N 0 3 391.682 3.450 10 0 GGAEHN COc1cc(C)nc(CNC[C@@H](CO)Cc2cccc(Br)c2C)c1 ZINC000449680168 566591526 /nfs/dbraw/zinc/59/15/26/566591526.db2.gz GHDANZTZCYABMY-HNNXBMFYSA-N 0 3 393.325 3.410 10 0 GGAEHN C[C@H]1OCC[C@@H]1N(CCO)Cc1cc(Br)cc(C(F)(F)F)c1 ZINC000449680972 566591574 /nfs/dbraw/zinc/59/15/74/566591574.db2.gz UZLBTCVRVLETFR-YGRLFVJLSA-N 0 3 382.220 3.440 10 0 GGAEHN COc1cc(C)nc(CNC[C@@H](CO)Cc2ccc(F)c(Br)c2)c1 ZINC000449685274 566592612 /nfs/dbraw/zinc/59/26/12/566592612.db2.gz RWDPWOCHKCNZDZ-AWEZNQCLSA-N 0 3 397.288 3.241 10 0 GGAEHN CCCn1cc(CNC[C@@H](CO)Cc2cc(Br)ccc2OC)cn1 ZINC000449685716 566592651 /nfs/dbraw/zinc/59/26/51/566592651.db2.gz VOLZJUIJLQBKCN-AWEZNQCLSA-N 0 3 396.329 3.005 10 0 GGAEHN CCCn1cc(CNC[C@H](CO)Cc2cccc(Br)c2C)cn1 ZINC000449686965 566592834 /nfs/dbraw/zinc/59/28/34/566592834.db2.gz ZIRALEQESZHQQT-OAHLLOKOSA-N 0 3 380.330 3.305 10 0 GGAEHN O=C1CC[C@H](N2CCN(CCCc3c(Cl)cccc3Cl)CC2)CCN1 ZINC000449702571 566594258 /nfs/dbraw/zinc/59/42/58/566594258.db2.gz SKYYFYBEOBEJBR-HNNXBMFYSA-N 0 3 384.351 3.212 10 0 GGAEHN COC[C@]1(CO)CCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000449695925 566594266 /nfs/dbraw/zinc/59/42/66/566594266.db2.gz JLSYFHCYHIZGHG-QGZVFWFLSA-N 0 3 397.338 3.403 10 0 GGAEHN COC[C@@]1(CO)CCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000449695924 566594888 /nfs/dbraw/zinc/59/48/88/566594888.db2.gz JLSYFHCYHIZGHG-KRWDZBQOSA-N 0 3 397.338 3.403 10 0 GGAEHN CN(CCC(=O)NCc1ccc(Br)c(F)c1F)c1ccncc1 ZINC000628893786 566595867 /nfs/dbraw/zinc/59/58/67/566595867.db2.gz GYLGOFYTGCVUCP-UHFFFAOYSA-N 0 3 384.224 3.265 10 0 GGAEHN C[C@@H](CCc1ccc(Br)cc1)NC(=O)N1CCN2CCC1CC2 ZINC000560098271 566597091 /nfs/dbraw/zinc/59/70/91/566597091.db2.gz YQLOSPUFPHNGFK-AWEZNQCLSA-N 0 3 380.330 3.260 10 0 GGAEHN CO[C@@H](c1ccc(Br)cc1)[C@H](C)NC(=O)N1CCN2CCC1CC2 ZINC000560105414 566597817 /nfs/dbraw/zinc/59/78/17/566597817.db2.gz OSWBFCOVQWBNJW-SUMWQHHRSA-N 0 3 396.329 3.015 10 0 GGAEHN COc1cc(CNC[C@@H]2CCC[C@H]2O)cc(Br)c1OC(F)F ZINC000449737777 566597720 /nfs/dbraw/zinc/59/77/20/566597720.db2.gz UIXKPDVBKUIDSU-CMPLNLGQSA-N 0 3 380.229 3.310 10 0 GGAEHN COc1ncc(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)cc1Cl ZINC000560103329 566598645 /nfs/dbraw/zinc/59/86/45/566598645.db2.gz QKKYCEGBIKWDOI-CYBMUJFWSA-N 0 3 379.913 3.447 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCC1)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000628964324 566598796 /nfs/dbraw/zinc/59/87/96/566598796.db2.gz BNZPWPIFAHRUOC-KRDRHDLTSA-N 0 3 389.337 3.468 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCC1)c1cnc2ncc(Br)cc2c1 ZINC000628965038 566598954 /nfs/dbraw/zinc/59/89/54/566598954.db2.gz TYAPDWNINGMZIW-MRXNPFEDSA-N 0 3 389.297 3.139 10 0 GGAEHN Cn1nc2cc(Br)ccc2c1C(=O)NC[C@H]1CCN1C1CCCC1 ZINC000628966384 566599111 /nfs/dbraw/zinc/59/91/11/566599111.db2.gz RRAUHDZJPJZZCW-CQSZACIVSA-N 0 3 391.313 3.083 10 0 GGAEHN CN(C)C[C@@H](NC(=O)CCCCc1c[nH]nn1)c1ccc(Cl)c(Cl)c1 ZINC000628968092 566600377 /nfs/dbraw/zinc/60/03/77/566600377.db2.gz AONBFBLUIYBBFY-MRXNPFEDSA-N 0 3 384.311 3.243 10 0 GGAEHN CN(C)C[C@@H](NC(=O)CCCCc1cn[nH]n1)c1ccc(Cl)c(Cl)c1 ZINC000628968092 566600383 /nfs/dbraw/zinc/60/03/83/566600383.db2.gz AONBFBLUIYBBFY-MRXNPFEDSA-N 0 3 384.311 3.243 10 0 GGAEHN NC[C@@H](C(=O)N1CCc2c(Br)ccc(F)c2C1)c1ccc(F)cc1 ZINC000579351356 566600880 /nfs/dbraw/zinc/60/08/80/566600880.db2.gz KQGHIHUDQWGFOI-CQSZACIVSA-N 0 3 395.247 3.355 10 0 GGAEHN CN(C)C[C@H](NC(=O)CCCCc1c[nH]nn1)c1ccc(Cl)c(Cl)c1 ZINC000628968084 566601006 /nfs/dbraw/zinc/60/10/06/566601006.db2.gz AONBFBLUIYBBFY-INIZCTEOSA-N 0 3 384.311 3.243 10 0 GGAEHN CN(C)C[C@H](NC(=O)CCCCc1cn[nH]n1)c1ccc(Cl)c(Cl)c1 ZINC000628968084 566601010 /nfs/dbraw/zinc/60/10/10/566601010.db2.gz AONBFBLUIYBBFY-INIZCTEOSA-N 0 3 384.311 3.243 10 0 GGAEHN CN1C[C@@H]2CCCN(C(=O)c3cc(F)c(Br)cc3Cl)[C@@H]2C1 ZINC000425066251 566601661 /nfs/dbraw/zinc/60/16/61/566601661.db2.gz OFIGORSGPWSQOK-LKFCYVNXSA-N 0 3 375.669 3.408 10 0 GGAEHN CN(C)CCN(C)c1ccc(Br)cc1NC(=O)CCOCC1CC1 ZINC000425098904 566604591 /nfs/dbraw/zinc/60/45/91/566604591.db2.gz MYZJFWADSNROAZ-UHFFFAOYSA-N 0 3 398.345 3.202 10 0 GGAEHN CN1CCC[C@@]2(CCN(C(=O)[C@H]3CCOc4ccc(Br)cc43)C2)C1 ZINC000652362144 566604655 /nfs/dbraw/zinc/60/46/55/566604655.db2.gz ZBGJHAYOICLENF-HNAYVOBHSA-N 0 3 393.325 3.260 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1c(Cl)cc(F)cc1Br ZINC000449839719 566607571 /nfs/dbraw/zinc/60/75/71/566607571.db2.gz DCOGOHAYCVVEPO-NSHDSACASA-N 0 3 393.684 3.082 10 0 GGAEHN C[C@H]1CN(C(=O)[C@H]2CCOc3ccc(Br)cc32)CCN(C2CC2)C1 ZINC000652372756 566607582 /nfs/dbraw/zinc/60/75/82/566607582.db2.gz LAEKXYJNEHVAKA-CJNGLKHVSA-N 0 3 393.325 3.258 10 0 GGAEHN COC1CCN(C(C)(C)CNC(=O)c2ccsc2Br)CC1 ZINC000449847156 566608738 /nfs/dbraw/zinc/60/87/38/566608738.db2.gz DQNPZONOEWGAGG-UHFFFAOYSA-N 0 3 375.332 3.130 10 0 GGAEHN NC(=O)N[C@H]1CCN(Cc2ccc(-c3ccc(Br)cc3)s2)C1 ZINC000539894783 566611533 /nfs/dbraw/zinc/61/15/33/566611533.db2.gz NBYBTYIQOVUTES-ZDUSSCGKSA-N 0 3 380.311 3.420 10 0 GGAEHN COC(=O)c1ccc(CN2CCC[C@@H]([C@H]3CCOC3)C2)c(Br)c1 ZINC000560261169 566611764 /nfs/dbraw/zinc/61/17/64/566611764.db2.gz PXLHRQDRYZBOJE-ZBFHGGJFSA-N 0 3 382.298 3.484 10 0 GGAEHN CCC[C@@H](C)[C@H](CO)NCC(=O)Nc1c(Cl)cc(Cl)cc1C(=O)OC ZINC000579480399 566612606 /nfs/dbraw/zinc/61/26/06/566612606.db2.gz RZYFXERPNWXCPF-YGRLFVJLSA-N 0 3 391.295 3.105 10 0 GGAEHN CCC[C@H](C)[C@H](CO)NCC(=O)Nc1c(Cl)cc(Cl)cc1C(=O)OC ZINC000579480396 566612902 /nfs/dbraw/zinc/61/29/02/566612902.db2.gz RZYFXERPNWXCPF-HZMBPMFUSA-N 0 3 391.295 3.105 10 0 GGAEHN CCCN(C(=O)[C@@H]1CCOc2ccc(Br)cc21)[C@H]1CCN(C)C1 ZINC000652489965 566614328 /nfs/dbraw/zinc/61/43/28/566614328.db2.gz QADYXKNYXFOBER-LSDHHAIUSA-N 0 3 381.314 3.258 10 0 GGAEHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)CSCc1cc(-c2cccs2)on1 ZINC000467037745 566619767 /nfs/dbraw/zinc/61/97/67/566619767.db2.gz ZDVYALOPDGQNJL-IUODEOHRSA-N 0 3 377.535 3.235 10 0 GGAEHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)CSCc1cc(-c2cccs2)on1 ZINC000467037744 566620008 /nfs/dbraw/zinc/62/00/08/566620008.db2.gz ZDVYALOPDGQNJL-DOMZBBRYSA-N 0 3 377.535 3.235 10 0 GGAEHN CC(C(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1)S(C)(=O)=O ZINC000629182764 566622044 /nfs/dbraw/zinc/62/20/44/566622044.db2.gz BNPHFFDRHBDFAW-ABAIWWIYSA-N 0 3 380.853 3.044 10 0 GGAEHN CC(C(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1)S(C)(=O)=O ZINC000629182767 566622078 /nfs/dbraw/zinc/62/20/78/566622078.db2.gz BNPHFFDRHBDFAW-XHDPSFHLSA-N 0 3 380.853 3.044 10 0 GGAEHN O=C(NCc1ccc(Cl)cc1Cl)N1CCN(CC2CCOCC2)CC1 ZINC000605944562 566622391 /nfs/dbraw/zinc/62/23/91/566622391.db2.gz RQCKNHWOVPIYGF-UHFFFAOYSA-N 0 3 386.323 3.247 10 0 GGAEHN CCCOc1c(Br)cc(CN[C@H](C(=O)NC)C(C)C)cc1OC ZINC000486807035 566623439 /nfs/dbraw/zinc/62/34/39/566623439.db2.gz CJFWWVUPJBGLQB-HNNXBMFYSA-N 0 3 387.318 3.107 10 0 GGAEHN CC(C)N1CCCN(C(=O)c2cc(=O)[nH]c3ccc(Br)cc32)CC1 ZINC000606365106 566626851 /nfs/dbraw/zinc/62/68/51/566626851.db2.gz MTAAWWWKGAZJOZ-UHFFFAOYSA-N 0 3 392.297 3.259 10 0 GGAEHN O=C(C(=O)N1CCCN(C2CCCC2)CC1)c1ccc(Br)cc1 ZINC000606411157 566628631 /nfs/dbraw/zinc/62/86/31/566628631.db2.gz LDJRBZBDAHXOIV-UHFFFAOYSA-N 0 3 379.298 3.109 10 0 GGAEHN CC[C@@H](C)N[C@@H](CNC(=O)c1cnc(OC)c(Br)c1)c1ccco1 ZINC000425300269 566628783 /nfs/dbraw/zinc/62/87/83/566628783.db2.gz HASYAAXNWHDEFQ-RISCZKNCSA-N 0 3 396.285 3.305 10 0 GGAEHN C[C@@H](N[C@H](CO)c1ccc(Br)cc1)c1ccc(-n2cncn2)cc1 ZINC000540140926 566630953 /nfs/dbraw/zinc/63/09/53/566630953.db2.gz AXSIUDGISSZXRM-FZKQIMNGSA-N 0 3 387.281 3.414 10 0 GGAEHN C[C@@H](C(=O)Nc1ccc(Cl)cc1C(F)(F)F)N1CCNC[C@@](C)(F)C1 ZINC000579713032 566632139 /nfs/dbraw/zinc/63/21/39/566632139.db2.gz YGPJWOQZCWYJIT-ZUZCIYMTSA-N 0 3 381.801 3.319 10 0 GGAEHN CS[C@H]1CC[C@H]1NCc1ccccc1CS(=O)(=O)N1CCC(C)CC1 ZINC000425344081 566632350 /nfs/dbraw/zinc/63/23/50/566632350.db2.gz ISVNPWBILLSJAF-MOPGFXCFSA-N 0 3 382.595 3.232 10 0 GGAEHN CS[C@@H]1CC[C@@H]1NCC(C)(C)S(=O)(=O)c1ccc(Br)cc1 ZINC000425339585 566632869 /nfs/dbraw/zinc/63/28/69/566632869.db2.gz CSCBVMUKBOQVIR-UONOGXRCSA-N 0 3 392.384 3.485 10 0 GGAEHN CS[C@@H]1CC[C@H]1NCc1ccccc1CS(=O)(=O)N1CCC(C)CC1 ZINC000425344088 566633009 /nfs/dbraw/zinc/63/30/09/566633009.db2.gz ISVNPWBILLSJAF-RTBURBONSA-N 0 3 382.595 3.232 10 0 GGAEHN CS[C@H]1CC[C@@H]1NCC(C)(C)S(=O)(=O)c1ccc(Br)cc1 ZINC000425339583 566633944 /nfs/dbraw/zinc/63/39/44/566633944.db2.gz CSCBVMUKBOQVIR-KBPBESRZSA-N 0 3 392.384 3.485 10 0 GGAEHN CS[C@@H]1CC[C@@H]1NCc1ccccc1CS(=O)(=O)N1CCC(C)CC1 ZINC000425344086 566634040 /nfs/dbraw/zinc/63/40/40/566634040.db2.gz ISVNPWBILLSJAF-RBUKOAKNSA-N 0 3 382.595 3.232 10 0 GGAEHN O=C(NCCNc1ccncc1)Nc1cccc2cc(Br)cnc21 ZINC000486891418 566634311 /nfs/dbraw/zinc/63/43/11/566634311.db2.gz CVRMCPQAWNOCMB-UHFFFAOYSA-N 0 3 386.253 3.048 10 0 GGAEHN CCNC(=O)N1CC[C@H](N[C@@H]2CCc3c2cc(Cl)cc3Br)C1 ZINC000540165034 566634289 /nfs/dbraw/zinc/63/42/89/566634289.db2.gz WKRKCRGSEXTFIB-XHDPSFHLSA-N 0 3 386.721 3.483 10 0 GGAEHN Cc1ccc(CC(=O)NCCCCN2C[C@@H](C)O[C@@H](C)C2)c(Br)c1 ZINC000450121095 566635274 /nfs/dbraw/zinc/63/52/74/566635274.db2.gz HVWFKRCWAHQYBA-IYBDPMFKSA-N 0 3 397.357 3.306 10 0 GGAEHN O=[S@](CCNC1(CO)Cc2ccccc2C1)c1cc(Cl)ccc1Cl ZINC000579758605 566636769 /nfs/dbraw/zinc/63/67/69/566636769.db2.gz KCGBAKOHAGIOEP-XMMPIXPASA-N 0 3 384.328 3.221 10 0 GGAEHN C[C@H]1CN(CCCCNC(=O)Cc2sccc2Br)C[C@H](C)O1 ZINC000450121980 566636998 /nfs/dbraw/zinc/63/69/98/566636998.db2.gz LXUMWJXOWHJWRF-STQMWFEESA-N 0 3 389.359 3.059 10 0 GGAEHN CCN(CCCOc1cccc(I)c1)Cc1cnn(C)c1 ZINC000514001350 566638101 /nfs/dbraw/zinc/63/81/01/566638101.db2.gz JDNRZDKHBJOCOA-UHFFFAOYSA-N 0 3 399.276 3.316 10 0 GGAEHN CCOc1ccc(CCNCc2c(Br)cnn2C)cc1OCC ZINC000486953616 566638158 /nfs/dbraw/zinc/63/81/58/566638158.db2.gz GOIHNWOQZKKXKL-UHFFFAOYSA-N 0 3 382.302 3.312 10 0 GGAEHN Cn1ncc(Br)c1CNCC(C)(C)N1CCc2ccccc2C1 ZINC000486962487 566640135 /nfs/dbraw/zinc/64/01/35/566640135.db2.gz CTDTYWQIIFESMG-UHFFFAOYSA-N 0 3 377.330 3.109 10 0 GGAEHN Cc1cc(C)n(-c2ccc(CCNCc3c(Br)cnn3C)cc2)n1 ZINC000486981745 566640267 /nfs/dbraw/zinc/64/02/67/566640267.db2.gz SHMGCYSIUVLYLV-UHFFFAOYSA-N 0 3 388.313 3.317 10 0 GGAEHN CC[C@@H]1C[C@@H](CN2CCCN(c3nnc(C(F)(F)F)s3)CC2)CCO1 ZINC000467365366 566641583 /nfs/dbraw/zinc/64/15/83/566641583.db2.gz PLEUVTBIYIKBMD-QWHCGFSZSA-N 0 3 378.464 3.274 10 0 GGAEHN CCCN(Cc1ccc(S(=O)(=O)N(C)C)s1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000425418369 566642257 /nfs/dbraw/zinc/64/22/57/566642257.db2.gz LOULXYDAYVOHLZ-UAGQMJEPSA-N 0 3 386.583 3.024 10 0 GGAEHN CN(C)C[C@@H]1CN(C(=O)Cc2ccc(Br)s2)c2ccccc2O1 ZINC000675489695 566649014 /nfs/dbraw/zinc/64/90/14/566649014.db2.gz GSNIZJBKWCGUFQ-GFCCVEGCSA-N 0 3 395.322 3.409 10 0 GGAEHN CS[C@H]1CN(C(=O)Cc2ccc(Br)s2)C[C@@H]1N1CCCC1 ZINC000487113621 566648996 /nfs/dbraw/zinc/64/89/96/566648996.db2.gz PFIOOOOFWRFEQD-STQMWFEESA-N 0 3 389.384 3.091 10 0 GGAEHN CCc1ccc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)s1 ZINC000487126324 566650450 /nfs/dbraw/zinc/65/04/50/566650450.db2.gz BFZVJEPPSXQTFY-CRAIPNDOSA-N 0 3 378.563 3.499 10 0 GGAEHN COC(=O)c1ccc(Br)cc1CN(C)C1CCC(NC(C)=O)CC1 ZINC000514248760 566650605 /nfs/dbraw/zinc/65/06/05/566650605.db2.gz VMBZHRQLOXTTFK-UHFFFAOYSA-N 0 3 397.313 3.115 10 0 GGAEHN CS[C@@H]1CN(C(=O)CCc2cccc(F)c2Br)C[C@@H]1N(C)C ZINC000450267753 566650925 /nfs/dbraw/zinc/65/09/25/566650925.db2.gz XYXDHIADKSLPLX-UONOGXRCSA-N 0 3 389.334 3.025 10 0 GGAEHN CS[C@@H]1CN(C(=O)CCc2cccc(F)c2Br)C[C@H]1N(C)C ZINC000450267755 566651130 /nfs/dbraw/zinc/65/11/30/566651130.db2.gz XYXDHIADKSLPLX-ZIAGYGMSSA-N 0 3 389.334 3.025 10 0 GGAEHN Cn1ncc(Br)c1CNC[C@]1(Cc2ccc(F)cc2)CCC[C@H]1O ZINC000487162273 566652758 /nfs/dbraw/zinc/65/27/58/566652758.db2.gz SEURCHBYNNYJPT-QZTJIDSGSA-N 0 3 396.304 3.185 10 0 GGAEHN COc1c(Br)ccc(C)c1C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21 ZINC000425552799 566654230 /nfs/dbraw/zinc/65/42/30/566654230.db2.gz RATLXQJFFQRYOL-UKRRQHHQSA-N 0 3 381.314 3.322 10 0 GGAEHN COc1c(Br)ccc(C)c1C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21 ZINC000425552797 566654497 /nfs/dbraw/zinc/65/44/97/566654497.db2.gz RATLXQJFFQRYOL-HIFRSBDPSA-N 0 3 381.314 3.322 10 0 GGAEHN Clc1cc(CN2CC[C@H](c3nc[nH]n3)C2)ccc1I ZINC000425551666 566654658 /nfs/dbraw/zinc/65/46/58/566654658.db2.gz QPYYEVMOEZXVIT-JTQLQIEISA-N 0 3 388.640 3.052 10 0 GGAEHN CCC1(N2CCOCC2)CCN(C(=O)[C@H]2SCCc3sccc32)CC1 ZINC000629417998 566654781 /nfs/dbraw/zinc/65/47/81/566654781.db2.gz LRYHCRNFYBVKNY-KRWDZBQOSA-N 0 3 380.579 3.182 10 0 GGAEHN CCN1CC[C@@H](N(C)C(=O)c2n[nH]c3ccc(Br)cc32)C[C@@H]1C ZINC000607128300 566658109 /nfs/dbraw/zinc/65/81/09/566658109.db2.gz YXPXXAKBSZRNEF-WCQYABFASA-N 0 3 379.302 3.270 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C ZINC000467716917 566659076 /nfs/dbraw/zinc/65/90/76/566659076.db2.gz ZVTOGLCZTRQATA-BLLLJJGKSA-N 0 3 390.325 3.311 10 0 GGAEHN CCCN1CCC[C@@H]1C(=O)N[C@H]1CCN(c2ccc(Br)cc2)C1 ZINC000487261461 566659704 /nfs/dbraw/zinc/65/97/04/566659704.db2.gz MKEJZZIQRGBUNE-DOTOQJQBSA-N 0 3 380.330 3.018 10 0 GGAEHN CCc1cc(Br)ccc1NC(=O)Nc1cnn(CCN(C)C)c1 ZINC000675696358 566659833 /nfs/dbraw/zinc/65/98/33/566659833.db2.gz QRSXIRQUMDZDEJ-UHFFFAOYSA-N 0 3 380.290 3.414 10 0 GGAEHN CN(C)C[C@H](c1ccc(Cl)c(Cl)c1)N1C(=O)N[C@](C)(CCF)C1=O ZINC000629487223 566662432 /nfs/dbraw/zinc/66/24/32/566662432.db2.gz KEVMJMMOZMQZEJ-CZUORRHYSA-N 0 3 376.259 3.266 10 0 GGAEHN CN(CCCCOc1ccccc1C(F)(F)F)C[C@@H]1CCS(=O)(=O)C1 ZINC000607193462 566663314 /nfs/dbraw/zinc/66/33/14/566663314.db2.gz NTWYIOZMSLZPJI-AWEZNQCLSA-N 0 3 379.444 3.231 10 0 GGAEHN Cc1ccc(-c2nsc(NC(=O)[C@]3(N)[C@@H]4CCCO[C@H]4C3(C)C)n2)s1 ZINC000580071535 566663299 /nfs/dbraw/zinc/66/32/99/566663299.db2.gz WDJUSUHSIRUEMS-ILMHXZGMSA-N 0 3 378.523 3.046 10 0 GGAEHN Cc1c([C@@H](C)N[C@H]2CCCN(C)C2)nnn1-c1cccc(Br)c1 ZINC000675767747 566663469 /nfs/dbraw/zinc/66/34/69/566663469.db2.gz UMNIGTNJQZJLQY-DOMZBBRYSA-N 0 3 378.318 3.083 10 0 GGAEHN Cc1ccc(-c2nsc(NC(=O)[C@]3(N)[C@H]4CCCO[C@H]4C3(C)C)n2)s1 ZINC000580071534 566663474 /nfs/dbraw/zinc/66/34/74/566663474.db2.gz WDJUSUHSIRUEMS-GSDQYQHOSA-N 0 3 378.523 3.046 10 0 GGAEHN Brc1ccc2c(c1)[C@@H](NC1CCN(c3cnccn3)CC1)CCO2 ZINC000675779411 566663766 /nfs/dbraw/zinc/66/37/66/566663766.db2.gz VMEQWBWPFPVJIP-INIZCTEOSA-N 0 3 389.297 3.321 10 0 GGAEHN CCCN(CC(F)(F)F)C(=O)CN1CCNC[C@@H]1c1ccccc1Cl ZINC000629530018 566664235 /nfs/dbraw/zinc/66/42/35/566664235.db2.gz SUNGFOLGARFVJG-OAHLLOKOSA-N 0 3 377.838 3.087 10 0 GGAEHN CN(C)C[C@@H]1CCCN1c1nc(C(F)(F)F)ccc1I ZINC000450380049 566665022 /nfs/dbraw/zinc/66/50/22/566665022.db2.gz PVBOGYOZZJSDDF-VIFPVBQESA-N 0 3 399.198 3.235 10 0 GGAEHN CN(C)C[C@H]1CCCN1c1nc(C(F)(F)F)ccc1I ZINC000450380048 566665203 /nfs/dbraw/zinc/66/52/03/566665203.db2.gz PVBOGYOZZJSDDF-SECBINFHSA-N 0 3 399.198 3.235 10 0 GGAEHN CC(C)CN(CCN(C)C)C(=O)Nc1cnc2c(Br)cccn12 ZINC000425675726 566666902 /nfs/dbraw/zinc/66/69/02/566666902.db2.gz RHXVMINJWWCCLM-UHFFFAOYSA-N 0 3 382.306 3.148 10 0 GGAEHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1)C(F)(F)F ZINC000425679434 566667266 /nfs/dbraw/zinc/66/72/66/566667266.db2.gz LTZICDOSIBUWGQ-LLVKDONJSA-N 0 3 396.251 3.473 10 0 GGAEHN CCN(C[C@@H]1CCCN1CC)C(=O)c1cc(OC)c(Br)s1 ZINC000580144382 566668327 /nfs/dbraw/zinc/66/83/27/566668327.db2.gz AKWMREXGIDVICF-NSHDSACASA-N 0 3 375.332 3.466 10 0 GGAEHN O=C1CC[C@@H](CN2CCC[C@@H]2c2ccccc2I)CCN1 ZINC000450403848 566668500 /nfs/dbraw/zinc/66/85/00/566668500.db2.gz MYUAOUZQNUGERD-CZUORRHYSA-N 0 3 398.288 3.344 10 0 GGAEHN COc1ccc(Cl)cc1C(C)(C)NC(=O)NC[C@@]1(N(C)C)CCSC1 ZINC000425688222 566668816 /nfs/dbraw/zinc/66/88/16/566668816.db2.gz AUCFQACVQITWEO-SFHVURJKSA-N 0 3 385.961 3.320 10 0 GGAEHN O[C@@H](CNC[C@@H]1Cc2ccccc2CO1)COc1cc(Cl)ccc1Cl ZINC000629587373 566669139 /nfs/dbraw/zinc/66/91/39/566669139.db2.gz JAQJRWMWUKXBSB-IRXDYDNUSA-N 0 3 382.287 3.464 10 0 GGAEHN CC(C)C[C@H](N[C@H](C)c1sccc1Br)C(=O)NCCN(C)C ZINC000540746645 566669751 /nfs/dbraw/zinc/66/97/51/566669751.db2.gz WTLCXROHCACHNM-OCCSQVGLSA-N 0 3 390.391 3.254 10 0 GGAEHN O[C@@H](CN[C@@H]1CCCSc2ccc(Br)cc21)Cn1cccn1 ZINC000629593081 566670534 /nfs/dbraw/zinc/67/05/34/566670534.db2.gz DLEZOVZEXJTBNX-DZGCQCFKSA-N 0 3 382.327 3.223 10 0 GGAEHN COc1ncc(Br)cc1CNC[C@@H](O)Cc1cccc(Cl)c1 ZINC000629592930 566670803 /nfs/dbraw/zinc/67/08/03/566670803.db2.gz HDPVPUMXXWQVPE-HNNXBMFYSA-N 0 3 385.689 3.199 10 0 GGAEHN O[C@H](CN[C@H]1CCCSc2ccc(Br)cc21)Cn1cccn1 ZINC000629593082 566670951 /nfs/dbraw/zinc/67/09/51/566670951.db2.gz DLEZOVZEXJTBNX-HIFRSBDPSA-N 0 3 382.327 3.223 10 0 GGAEHN C[C@H](NC(=O)C(=O)Nc1cc(Cl)c(Cl)c(Cl)c1)C1=CCN(C)CC1 ZINC000580204086 566672986 /nfs/dbraw/zinc/67/29/86/566672986.db2.gz SLNBBEHSDJFCIR-VIFPVBQESA-N 0 3 390.698 3.352 10 0 GGAEHN CN1C[C@@H]2CCCN(C(=O)N[C@@H]3CCOc4c(Br)cccc43)[C@@H]2C1 ZINC000425757063 566674159 /nfs/dbraw/zinc/67/41/59/566674159.db2.gz OKMXIOMCWLEHAZ-APHBMKBZSA-N 0 3 394.313 3.008 10 0 GGAEHN CN1C[C@@H]2CCCN(C(=O)N[C@@H]3C[C@H]3c3ccccc3Br)[C@@H]2C1 ZINC000425764079 566676082 /nfs/dbraw/zinc/67/60/82/566676082.db2.gz GLZNEODGXPKTBQ-GUDXXQAFSA-N 0 3 378.314 3.041 10 0 GGAEHN Cc1cc(C)c(NC(=O)Nc2cnn(CCN(C)C)c2)c(Br)c1 ZINC000676272599 566683707 /nfs/dbraw/zinc/68/37/07/566683707.db2.gz WBRDTSPVAVEAMR-UHFFFAOYSA-N 0 3 380.290 3.468 10 0 GGAEHN C[C@@H]1CC[C@@H](C)N1CC(=O)NC1(c2ccc(Br)cc2)CCOCC1 ZINC000468110634 566683758 /nfs/dbraw/zinc/68/37/58/566683758.db2.gz WADUJGSVBCXHAF-HUUCEWRRSA-N 0 3 395.341 3.444 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)Cc1csc(Cc2cccc(Cl)c2)n1 ZINC000425979681 566683843 /nfs/dbraw/zinc/68/38/43/566683843.db2.gz LMBBIQADXAIKAV-KRWDZBQOSA-N 0 3 377.941 3.482 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1CC[C@@H](CO)[C@@H]1C ZINC000425975928 566683894 /nfs/dbraw/zinc/68/38/94/566683894.db2.gz DHXAVRHTSMTKDT-ZFWWWQNUSA-N 0 3 378.314 3.454 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)N(C)Cc1cc(Br)cn1C ZINC000468160681 566686316 /nfs/dbraw/zinc/68/63/16/566686316.db2.gz REQDFIIOVNOXBO-OKILXGFUSA-N 0 3 385.350 3.192 10 0 GGAEHN NC(=O)[C@H](N[C@@H]1CCOC2(CCSCC2)C1)c1ccc(Br)cc1 ZINC000676349013 566686997 /nfs/dbraw/zinc/68/69/97/566686997.db2.gz NRNYJULCGFLOGG-HUUCEWRRSA-N 0 3 399.354 3.010 10 0 GGAEHN COCCN(Cc1sccc1Br)C(=O)CC1CCN(C)CC1 ZINC000487713199 566687582 /nfs/dbraw/zinc/68/75/82/566687582.db2.gz ZNYSBFNBENMTBA-UHFFFAOYSA-N 0 3 389.359 3.218 10 0 GGAEHN O[C@@H](COc1ccc(F)c(Br)c1)CN1CCc2ccccc2C1 ZINC000561263422 566690292 /nfs/dbraw/zinc/69/02/92/566690292.db2.gz VEPMEUAVPPCNOG-OAHLLOKOSA-N 0 3 380.257 3.386 10 0 GGAEHN O=c1[nH]c2ccccc2n1CCCN[C@H](CO)c1cccc(Br)c1 ZINC000541052359 566690760 /nfs/dbraw/zinc/69/07/60/566690760.db2.gz YHGFZVZVHMLJJX-MRXNPFEDSA-N 0 3 390.281 3.218 10 0 GGAEHN CN(C)[C@@]1(CNc2ccc(Br)c(C(F)(F)F)n2)CCSC1 ZINC000561263096 566691248 /nfs/dbraw/zinc/69/12/48/566691248.db2.gz PJNUTUFSCDXTKJ-GFCCVEGCSA-N 0 3 384.265 3.134 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)Cc2ccccc2C(F)(F)F)[C@@H](C)C1 ZINC000608027604 566692589 /nfs/dbraw/zinc/69/25/89/566692589.db2.gz NLMHJWDAGSVQII-XJKSGUPXSA-N 0 3 378.460 3.197 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)Cc2ccccc2C(F)(F)F)[C@H](C)C1 ZINC000608027603 566692835 /nfs/dbraw/zinc/69/28/35/566692835.db2.gz NLMHJWDAGSVQII-CZUORRHYSA-N 0 3 378.460 3.197 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@@H]1O[C@H](C)C[C@@H]1C)c1ccc(Br)cn1 ZINC000580436477 566693369 /nfs/dbraw/zinc/69/33/69/566693369.db2.gz YKNDXCDWAJHNOR-JJRVBVJISA-N 0 3 398.345 3.332 10 0 GGAEHN CC(C)(C)OC(=O)[C@@H]1CCN(CCC(=O)Nc2cccc(Br)c2)C1 ZINC000426180617 566697940 /nfs/dbraw/zinc/69/79/40/566697940.db2.gz PQZPKFFMTCRJQT-CYBMUJFWSA-N 0 3 397.313 3.441 10 0 GGAEHN COc1cc(Br)ccc1CCC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000541151298 566699014 /nfs/dbraw/zinc/69/90/14/566699014.db2.gz VVMAHAKUISQDDP-MRXNPFEDSA-N 0 3 381.314 3.085 10 0 GGAEHN C[C@@H](NCc1ccc(S(=O)(=O)N2CCCC2)o1)C1CCC(F)(F)CC1 ZINC000653868640 566699492 /nfs/dbraw/zinc/69/94/92/566699492.db2.gz DWIVQAGKOOIVAB-CYBMUJFWSA-N 0 3 376.469 3.368 10 0 GGAEHN C[C@@H](NCC(=O)Nc1ccc(Br)c(C(F)(F)F)c1)[C@H](C)CO ZINC000450725103 566700864 /nfs/dbraw/zinc/70/08/64/566700864.db2.gz BRSHNARLEKQCPT-RKDXNWHRSA-N 0 3 383.208 3.013 10 0 GGAEHN CC[C@@H](NCCS(=O)(=O)c1cccc(Br)c1)[C@H]1CCCCO1 ZINC000653877337 566701066 /nfs/dbraw/zinc/70/10/66/566701066.db2.gz NJQJNARPFABINE-HZPDHXFCSA-N 0 3 390.343 3.160 10 0 GGAEHN Cc1cc(Br)cc(C)c1N1CCC[C@H](N[C@@H](C)[C@@H](C)CO)C1=O ZINC000450737397 566701812 /nfs/dbraw/zinc/70/18/12/566701812.db2.gz JAEKHPIGBMOFQC-DZKIICNBSA-N 0 3 383.330 3.168 10 0 GGAEHN CO[C@H](CCNC(=O)NC[C@H](c1cccs1)N1CCCC1)C(F)(F)F ZINC000468428209 566701808 /nfs/dbraw/zinc/70/18/08/566701808.db2.gz PJVZTCZSFRBLHN-TZMCWYRMSA-N 0 3 379.448 3.152 10 0 GGAEHN CN1CC[C@]2(CCN(C(=O)N[C@@H]3CCc4cc(Br)ccc43)C2)C1 ZINC000488018795 566703995 /nfs/dbraw/zinc/70/39/95/566703995.db2.gz UVZVDPIGPJPHRF-AEFFLSMTSA-N 0 3 378.314 3.174 10 0 GGAEHN COCCOc1ccc(Br)cc1NC(=O)[C@@H](CN)c1ccccc1 ZINC000580555683 566704614 /nfs/dbraw/zinc/70/46/14/566704614.db2.gz VIZCRKOSESSEHI-HNNXBMFYSA-N 0 3 393.281 3.155 10 0 GGAEHN C[C@@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1cccc(Br)c1 ZINC000541229074 566705146 /nfs/dbraw/zinc/70/51/46/566705146.db2.gz KIVNUBZSFDZXQQ-CJNGLKHVSA-N 0 3 391.313 3.024 10 0 GGAEHN C[C@@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Br)cc1 ZINC000541230526 566706274 /nfs/dbraw/zinc/70/62/74/566706274.db2.gz XBJYZRYSBYADAG-CZUORRHYSA-N 0 3 391.313 3.024 10 0 GGAEHN Cc1cc(S(=O)(=O)NCCN[C@@H]2C[C@@H](c3ccccc3)[C@@H]2C)c(C)s1 ZINC000541239705 566706570 /nfs/dbraw/zinc/70/65/70/566706570.db2.gz NWFNDTMLFLVFAI-BMGDILEWSA-N 0 3 378.563 3.425 10 0 GGAEHN C[C@@H]1[C@H]([NH2+]CC[N-]S(=O)(=O)c2ccc(Cl)s2)C[C@@H]1c1ccccc1 ZINC000541239293 566706667 /nfs/dbraw/zinc/70/66/67/566706667.db2.gz CTAOJSLZHZTMPG-AEGPPILISA-N 0 3 384.954 3.462 10 0 GGAEHN CCN(CCNC(=O)N[C@H](C)c1ccc(Br)cc1OC)C1CC1 ZINC000468516499 566706762 /nfs/dbraw/zinc/70/67/62/566706762.db2.gz PGNDPEBMFRBWRH-GFCCVEGCSA-N 0 3 384.318 3.302 10 0 GGAEHN CCN(CC)CCN(C(=O)c1c(C)noc1C)c1ccc(Br)cn1 ZINC000561472761 566707604 /nfs/dbraw/zinc/70/76/04/566707604.db2.gz DFVVHSVKXDIKBV-UHFFFAOYSA-N 0 3 395.301 3.438 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNS(=O)(=O)Cc1ccccc1Br ZINC000561505452 566710042 /nfs/dbraw/zinc/71/00/42/566710042.db2.gz VZJHXPOXJNIVQY-KBPBESRZSA-N 0 3 389.359 3.131 10 0 GGAEHN C[C@@H](c1ccccc1)[C@H](O)CN(CCO)Cc1cc(Br)cs1 ZINC000450846418 566712096 /nfs/dbraw/zinc/71/20/96/566712096.db2.gz MPTOPNSCAALBFK-SUMWQHHRSA-N 0 3 384.339 3.470 10 0 GGAEHN O=C(NCCc1cc(Cl)ccc1Br)N1CCN2CCC1CC2 ZINC000580654599 566712035 /nfs/dbraw/zinc/71/20/35/566712035.db2.gz VCDDQLGOPKMNKK-UHFFFAOYSA-N 0 3 386.721 3.135 10 0 GGAEHN O=C(NCCCc1nccs1)NCC1(N2CCSCC2)CCCCC1 ZINC000515566884 566720903 /nfs/dbraw/zinc/72/09/03/566720903.db2.gz OLQCXDOCJLLCHZ-UHFFFAOYSA-N 0 3 382.599 3.127 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@@H]1CN(C2CC2)C[C@H]1C ZINC000468694349 566721848 /nfs/dbraw/zinc/72/18/48/566721848.db2.gz OXTHEMHNOSVLCV-BFQNTYOBSA-N 0 3 396.329 3.301 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000468745914 566725438 /nfs/dbraw/zinc/72/54/38/566725438.db2.gz WNUOSGDGTZRIQT-STQMWFEESA-N 0 3 396.329 3.468 10 0 GGAEHN CCOC(=O)CC(C(F)(F)F)S(=O)(=O)N(Cc1ccccc1)C(C)C ZINC000450964862 566725599 /nfs/dbraw/zinc/72/55/99/566725599.db2.gz CSSUCQJAZIXIHU-CQSZACIVSA-N 0 3 381.416 3.111 10 0 GGAEHN O=C(N[C@@H]1CCCN2CCCC[C@@H]12)[C@@H]1CCOc2ccc(Br)cc21 ZINC000654314673 566726908 /nfs/dbraw/zinc/72/69/08/566726908.db2.gz OLZMMRZGMXRTBP-OIISXLGYSA-N 0 3 393.325 3.448 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N[C@@H](CC(C)C)CN(C)C ZINC000488545707 566733079 /nfs/dbraw/zinc/73/30/79/566733079.db2.gz OTGLYVIZLITJAZ-HNNXBMFYSA-N 0 3 386.334 3.233 10 0 GGAEHN Cc1c([C@@H](C)NCC[C@@H]2CCOC2)nnn1-c1cccc(Br)c1 ZINC000541559161 566733316 /nfs/dbraw/zinc/73/33/16/566733316.db2.gz WGRPFNHTVFLLEM-TZMCWYRMSA-N 0 3 379.302 3.415 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000488522920 566733451 /nfs/dbraw/zinc/73/34/51/566733451.db2.gz VACRBOSOKPUWFW-MRXNPFEDSA-N 0 3 396.329 3.228 10 0 GGAEHN O=C(N[C@H]1CSc2ccc(Br)cc21)N1CC[C@@H](N2CC=CC2)C1 ZINC000426842650 566734064 /nfs/dbraw/zinc/73/40/64/566734064.db2.gz ICDUCYWOWJYSBU-HIFRSBDPSA-N 0 3 394.338 3.252 10 0 GGAEHN C[C@@H]1CCN(CC(=O)N2CCc3[nH]c4ccc(Br)cc4c3C2)C1 ZINC000654467908 566735158 /nfs/dbraw/zinc/73/51/58/566735158.db2.gz IMKPKMLSQMNYMW-GFCCVEGCSA-N 0 3 376.298 3.157 10 0 GGAEHN O[C@H](CNCc1ccsc1Br)CN1CCc2ccccc2C1 ZINC000515834146 566735466 /nfs/dbraw/zinc/73/54/66/566735466.db2.gz TWGJSQIOUOCJBC-MRXNPFEDSA-N 0 3 381.339 3.019 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CC[C@H](N3CCCC3)[C@H]2C)c1 ZINC000561755821 566735472 /nfs/dbraw/zinc/73/54/72/566735472.db2.gz VOOOOLZPBFVRKV-CJNGLKHVSA-N 0 3 398.288 3.298 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CCCC[C@H]2CN(C)C)c1 ZINC000608783893 566735945 /nfs/dbraw/zinc/73/59/45/566735945.db2.gz WIELNVGAOIVGBO-ZDUSSCGKSA-N 0 3 386.277 3.156 10 0 GGAEHN O[C@@H](CNCc1cnn(CC(F)(F)F)c1)COc1c(Cl)cccc1Cl ZINC000580947785 566737642 /nfs/dbraw/zinc/73/76/42/566737642.db2.gz NJBCTYIOKRRKEA-NSHDSACASA-N 0 3 398.212 3.282 10 0 GGAEHN CC(C)(C)[C@@H]1CCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C[C@@H]1O ZINC000541618366 566737795 /nfs/dbraw/zinc/73/77/95/566737795.db2.gz MQOAQACFCBAGBI-IOASZLSFSA-N 0 3 376.324 3.462 10 0 GGAEHN CN1CC[C@]2(CCN(C(=O)CSCc3cc(-c4cccs4)on3)C2)C1 ZINC000561774411 566738887 /nfs/dbraw/zinc/73/88/87/566738887.db2.gz YXRFSLRBOATYLJ-SFHVURJKSA-N 0 3 377.535 3.191 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000654536458 566739067 /nfs/dbraw/zinc/73/90/67/566739067.db2.gz SQDMMJSIBXBGAH-HOTGVXAUSA-N 0 3 396.329 3.274 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N[C@H]1CCCN2CCCC[C@H]12 ZINC000654536460 566739675 /nfs/dbraw/zinc/73/96/75/566739675.db2.gz SQDMMJSIBXBGAH-JKSUJKDBSA-N 0 3 396.329 3.274 10 0 GGAEHN CN1CCN(CC2(C)CCN(Cc3ccc(Br)c(F)c3)CC2)CC1 ZINC000541663908 566741657 /nfs/dbraw/zinc/74/16/57/566741657.db2.gz HTQZYAJQCNNFJY-UHFFFAOYSA-N 0 3 398.364 3.438 10 0 GGAEHN CCOc1cc(C[NH2+][C@H]2CCN(CC(F)(F)F)C2)cc(Br)c1[O-] ZINC000516006121 566742559 /nfs/dbraw/zinc/74/25/59/566742559.db2.gz WISQZDNTXQHVDA-NSHDSACASA-N 0 3 397.235 3.280 10 0 GGAEHN C[C@]1(c2cccc(Br)c2)C[C@@H]1C(=O)NC1CCN(C2CC2)CC1 ZINC000630626403 566744235 /nfs/dbraw/zinc/74/42/35/566744235.db2.gz GAPCLWIHMMZPQP-IEBWSBKVSA-N 0 3 377.326 3.470 10 0 GGAEHN C[C@@]1(c2cccc(Br)c2)C[C@@H]1C(=O)NC1CCN(C2CC2)CC1 ZINC000630626406 566744551 /nfs/dbraw/zinc/74/45/51/566744551.db2.gz GAPCLWIHMMZPQP-MJGOQNOKSA-N 0 3 377.326 3.470 10 0 GGAEHN NC(=O)[C@H](Cc1ccc(Cl)cc1)NCCc1ccccc1Br ZINC000581043667 566746436 /nfs/dbraw/zinc/74/64/36/566746436.db2.gz VROKGDXSPWVMFH-INIZCTEOSA-N 0 3 381.701 3.331 10 0 GGAEHN COCCN(C)CCNC(=O)c1oc2c(cc(Br)cc2C)c1C ZINC000427115326 566748211 /nfs/dbraw/zinc/74/82/11/566748211.db2.gz UKMMPOPIAPJBJL-UHFFFAOYSA-N 0 3 383.286 3.120 10 0 GGAEHN Cc1ccc(C(=O)N2CCCN(C(C)C)CC2)cc1I ZINC000609072061 566748734 /nfs/dbraw/zinc/74/87/34/566748734.db2.gz FCCPAKOZWQBCJN-UHFFFAOYSA-N 0 3 386.277 3.156 10 0 GGAEHN Cc1ccc(C(=O)N2CCC[C@H]2CN2CCCC2)cc1I ZINC000609072009 566748830 /nfs/dbraw/zinc/74/88/30/566748830.db2.gz BODHDPXCRGTQTN-HNNXBMFYSA-N 0 3 398.288 3.300 10 0 GGAEHN CN(C)CCn1cc(NC(=O)NC(C)(C)c2ccccc2Br)cn1 ZINC000677489192 566748984 /nfs/dbraw/zinc/74/89/84/566748984.db2.gz MIOLSFHXILWHMO-UHFFFAOYSA-N 0 3 394.317 3.264 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N[C@H]1CCN(C2CC2)C1 ZINC000468967610 566749079 /nfs/dbraw/zinc/74/90/79/566749079.db2.gz KALAZKLSUZHUOZ-YPMHNXCESA-N 0 3 382.302 3.055 10 0 GGAEHN O=C(NCC1(C(F)(F)F)CC1)NCC1(N2CCSCC2)CCCCC1 ZINC000561920417 566749123 /nfs/dbraw/zinc/74/91/23/566749123.db2.gz NGWNFVASBKWUJO-UHFFFAOYSA-N 0 3 379.492 3.380 10 0 GGAEHN Cc1ccc(C(=O)NCCN2CCC[C@H](C)C2)cc1I ZINC000609070565 566749268 /nfs/dbraw/zinc/74/92/68/566749268.db2.gz CFFIESYXKHCMFC-LBPRGKRZSA-N 0 3 386.277 3.061 10 0 GGAEHN C[C@H](CNC(=O)Cc1csc(CCC(F)(F)F)n1)N1CCC[C@@H](C)C1 ZINC000630741411 566750005 /nfs/dbraw/zinc/75/00/05/566750005.db2.gz WXNHSHJCLIAHSI-CHWSQXEVSA-N 0 3 377.476 3.417 10 0 GGAEHN O=C(Cc1cccc(Br)c1)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000427142962 566750599 /nfs/dbraw/zinc/75/05/99/566750599.db2.gz LDABRQUPXURCIA-GOSISDBHSA-N 0 3 395.341 3.095 10 0 GGAEHN Cc1ccc(Br)cc1C(=O)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000427149423 566751624 /nfs/dbraw/zinc/75/16/24/566751624.db2.gz GMZNSCLITGXEHT-QGZVFWFLSA-N 0 3 395.341 3.475 10 0 GGAEHN O=C(c1cc(Br)cs1)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000427160379 566751730 /nfs/dbraw/zinc/75/17/30/566751730.db2.gz AVRCQUHRZLHGSF-AWEZNQCLSA-N 0 3 387.343 3.228 10 0 GGAEHN O=C(c1ccc(F)c(Br)c1)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000427149848 566752035 /nfs/dbraw/zinc/75/20/35/566752035.db2.gz KHNQDCRNFKPXHZ-HNNXBMFYSA-N 0 3 399.304 3.305 10 0 GGAEHN CN1CCC[C@@H](NC(=O)NCCc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000677562658 566753242 /nfs/dbraw/zinc/75/32/42/566753242.db2.gz IWVZXUKEMYZHOZ-OAHLLOKOSA-N 0 3 378.929 3.399 10 0 GGAEHN O=S(=O)(C[C@H]1CCCC1(F)F)N1CCCN(CC2CCCCC2)CC1 ZINC000451092785 566753702 /nfs/dbraw/zinc/75/37/02/566753702.db2.gz UONGJUIPWYHJRO-QGZVFWFLSA-N 0 3 378.529 3.340 10 0 GGAEHN COc1ccc(Br)c(C(=O)N2C[C@@H](N3CCCC3)[C@@H](SC)C2)c1 ZINC000541840106 566753784 /nfs/dbraw/zinc/75/37/84/566753784.db2.gz CGYWWXQHUXXENY-CVEARBPZSA-N 0 3 399.354 3.110 10 0 GGAEHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)Cc1csc(CCC(F)(F)F)n1 ZINC000630811196 566754292 /nfs/dbraw/zinc/75/42/92/566754292.db2.gz MHVWUYLTVLWCMG-OLZOCXBDSA-N 0 3 377.476 3.417 10 0 GGAEHN C[C@@H](CNC(=O)CCN(C)c1ccncc1)Oc1cccc(Br)c1 ZINC000541855291 566755662 /nfs/dbraw/zinc/75/56/62/566755662.db2.gz SMBWTJLTKMNGEW-AWEZNQCLSA-N 0 3 392.297 3.254 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000469047381 566756227 /nfs/dbraw/zinc/75/62/27/566756227.db2.gz RENISFGLGJQLQB-IUODEOHRSA-N 0 3 396.329 3.397 10 0 GGAEHN CN(CCC(=O)Nc1ccc2cccc(Br)c2n1)c1ccncc1 ZINC000541855301 566756538 /nfs/dbraw/zinc/75/65/38/566756538.db2.gz VMBWJHQLGBPLJD-UHFFFAOYSA-N 0 3 385.265 3.279 10 0 GGAEHN COCCN1CCC(NC(=O)c2oc3ccccc3c2Br)CC1 ZINC000630833187 566756719 /nfs/dbraw/zinc/75/67/19/566756719.db2.gz ONKGTVNZORBQPC-UHFFFAOYSA-N 0 3 381.270 3.036 10 0 GGAEHN CN(C)CCn1cc(NC(=O)c2oc3ccccc3c2Br)cn1 ZINC000630876077 566760053 /nfs/dbraw/zinc/76/00/53/566760053.db2.gz ZSTTZXZVJULGMX-UHFFFAOYSA-N 0 3 377.242 3.206 10 0 GGAEHN O[C@H](COc1ccc(Cl)cc1Br)CN1CC[C@H](C(F)F)C1 ZINC000677732251 566761608 /nfs/dbraw/zinc/76/16/08/566761608.db2.gz MRQGXGSSIBQQLW-ONGXEEELSA-N 0 3 384.648 3.429 10 0 GGAEHN C[C@@H]1CC[C@@]2(CCN(Cc3cc(=O)n4cc(Br)ccc4n3)C2)C1 ZINC000541953842 566762359 /nfs/dbraw/zinc/76/23/59/566762359.db2.gz SUQNBJBSAQMASQ-FZKQIMNGSA-N 0 3 376.298 3.469 10 0 GGAEHN O=C(CCCSc1ccc(Br)cc1)N[C@@H]1CNCCC1(F)F ZINC000516465829 566762534 /nfs/dbraw/zinc/76/25/34/566762534.db2.gz WNCDCTUOOLZWBE-CYBMUJFWSA-N 0 3 393.297 3.435 10 0 GGAEHN Cc1[nH]c(=O)c(Br)cc1C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000581266684 566762796 /nfs/dbraw/zinc/76/27/96/566762796.db2.gz GKMWNJGVEUKHRA-CVEARBPZSA-N 0 3 390.281 3.033 10 0 GGAEHN O=C([C@@H]1[C@@H]2Cc3cc(Br)ccc3[C@@H]21)N1CC[C@H](N2CCCC2)C1 ZINC000630900075 566763146 /nfs/dbraw/zinc/76/31/46/566763146.db2.gz SKRPXBYAIXFNHD-XOYOTBSWSA-N 0 3 375.310 3.032 10 0 GGAEHN O=S(=O)(C[C@H]1CCCC1(F)F)NCC1CCN(Cc2cccs2)CC1 ZINC000451135140 566764586 /nfs/dbraw/zinc/76/45/86/566764586.db2.gz KSUQDSCYISHYAA-OAHLLOKOSA-N 0 3 392.537 3.315 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N(C)CCN(C)C1CC1 ZINC000469152157 566765514 /nfs/dbraw/zinc/76/55/14/566765514.db2.gz ZGXLRONSYVMHHM-GFCCVEGCSA-N 0 3 384.318 3.254 10 0 GGAEHN Cc1cc(C)cc(OC[C@H](O)CN[C@@H](CO)c2cccc(Br)c2)c1 ZINC000541981260 566765668 /nfs/dbraw/zinc/76/56/68/566765668.db2.gz OVDRHSXFGXGCBO-MJGOQNOKSA-N 0 3 394.309 3.129 10 0 GGAEHN CN1CCC[C@@H](NC(=O)NCc2ccc(Br)cc2C(F)(F)F)C1 ZINC000677859185 566768116 /nfs/dbraw/zinc/76/81/16/566768116.db2.gz SARISNVLVDMNOS-GFCCVEGCSA-N 0 3 394.235 3.361 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)c1ccc(Sc2ccccc2Cl)nn1 ZINC000516569558 566769251 /nfs/dbraw/zinc/76/92/51/566769251.db2.gz SXRVPDPPOKZLAG-CYBMUJFWSA-N 0 3 384.839 3.008 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@@H]1CCN(C)[C@H](C)C1 ZINC000469189258 566769400 /nfs/dbraw/zinc/76/94/00/566769400.db2.gz ZQNVNRARPZVDGN-MBNYWOFBSA-N 0 3 384.318 3.301 10 0 GGAEHN Cc1cc(CN2CC[C@@H](Cc3cccc(I)c3)C2)ncn1 ZINC000451187657 566774225 /nfs/dbraw/zinc/77/42/25/566774225.db2.gz GMROEIAZBAVFMU-HNNXBMFYSA-N 0 3 393.272 3.454 10 0 GGAEHN C[C@H](CCc1ccc(Br)cc1)NCc1cn(C[C@H]2CCOC2)nn1 ZINC000631049554 566774797 /nfs/dbraw/zinc/77/47/97/566774797.db2.gz JKGMOSTUJWWZCZ-GDBMZVCRSA-N 0 3 393.329 3.188 10 0 GGAEHN CC(C)(CNCc1cn(C[C@@H]2CCOC2)nn1)c1cccc(Br)c1 ZINC000631060361 566775778 /nfs/dbraw/zinc/77/57/78/566775778.db2.gz XGWJPMAQLZGAHP-AWEZNQCLSA-N 0 3 393.329 3.145 10 0 GGAEHN CC[C@@H](Cc1ccccc1Br)NCc1cn(C[C@@H]2CCOC2)nn1 ZINC000631091564 566777670 /nfs/dbraw/zinc/77/76/70/566777670.db2.gz RWBBAFQWWWAINI-HOCLYGCPSA-N 0 3 393.329 3.188 10 0 GGAEHN CC[C@@H](Cc1ccccc1Br)NCc1cn(C[C@H]2CCOC2)nn1 ZINC000631091565 566777757 /nfs/dbraw/zinc/77/77/57/566777757.db2.gz RWBBAFQWWWAINI-ZBFHGGJFSA-N 0 3 393.329 3.188 10 0 GGAEHN CN(C)Cc1cccc(C(=O)N(CCO)Cc2cc(Br)cs2)c1 ZINC000427547931 566778734 /nfs/dbraw/zinc/77/87/34/566778734.db2.gz BCVMHTMPCJPKKL-UHFFFAOYSA-N 0 3 397.338 3.207 10 0 GGAEHN C[C@H](C(=O)N(CCO)Cc1cc(Br)cs1)N1[C@H](C)CC[C@H]1C ZINC000427555806 566778917 /nfs/dbraw/zinc/77/89/17/566778917.db2.gz LZNYFRRZDHZVNL-JHJVBQTASA-N 0 3 389.359 3.093 10 0 GGAEHN CS[C@@H]1CN(C(=O)Nc2cc(F)cc(Br)c2F)C[C@H]1N(C)C ZINC000562359075 566783237 /nfs/dbraw/zinc/78/32/37/566783237.db2.gz WEZYWCFBIYAJAV-VXGBXAGGSA-N 0 3 394.285 3.237 10 0 GGAEHN CS[C@H]1CN(C(=O)Nc2cc(F)cc(Br)c2F)C[C@@H]1N(C)C ZINC000562359073 566783532 /nfs/dbraw/zinc/78/35/32/566783532.db2.gz WEZYWCFBIYAJAV-RYUDHWBXSA-N 0 3 394.285 3.237 10 0 GGAEHN CN1CCC[C@@H](CNc2c(F)cccc2S(N)(=O)=O)[C@H]1c1cccs1 ZINC000631128467 566784150 /nfs/dbraw/zinc/78/41/50/566784150.db2.gz MSTSBIISFGDVEY-SJCJKPOMSA-N 0 3 383.514 3.030 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N(C)CCN1CCCC1 ZINC000469357032 566784256 /nfs/dbraw/zinc/78/42/56/566784256.db2.gz SHLOJYXYGIESRQ-CYBMUJFWSA-N 0 3 384.318 3.256 10 0 GGAEHN Cn1ccnc1[C@H]1C[C@H](NCc2ncc(Br)cc2Cl)CCO1 ZINC000631154137 566785842 /nfs/dbraw/zinc/78/58/42/566785842.db2.gz FHZVCQDEUAYZHL-BXUZGUMPSA-N 0 3 385.693 3.241 10 0 GGAEHN COc1cc(CN[C@H](CO)[C@H]2CCC[C@H](OC)C2)c(F)cc1Br ZINC000631171847 566787185 /nfs/dbraw/zinc/78/71/85/566787185.db2.gz IQUKPAASJNFWGY-DETPVDSQSA-N 0 3 390.293 3.253 10 0 GGAEHN COc1cc(CN[C@H](CO)[C@@H]2CCC[C@H](OC)C2)c(F)cc1Br ZINC000631171853 566787359 /nfs/dbraw/zinc/78/73/59/566787359.db2.gz IQUKPAASJNFWGY-PVXIVEMSSA-N 0 3 390.293 3.253 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)C(=O)Nc1cc(Cl)c(Cl)c(Cl)c1 ZINC000581552845 566787769 /nfs/dbraw/zinc/78/77/69/566787769.db2.gz QRJMTNAPKJLWSW-RNCFNFMXSA-N 0 3 392.714 3.384 10 0 GGAEHN CC[C@H](N[C@@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)C(=O)NC ZINC000451281517 566788069 /nfs/dbraw/zinc/78/80/69/566788069.db2.gz JSFICCCBNQDSKS-CABZTGNLSA-N 0 3 379.810 3.190 10 0 GGAEHN COCCCn1nccc1CN[C@@H]1[C@H]2Cc3c(cccc3Br)[C@@H]12 ZINC000631195187 566788658 /nfs/dbraw/zinc/78/86/58/566788658.db2.gz ZPHPZQQGJDZPOH-CGTJXYLNSA-N 0 3 376.298 3.110 10 0 GGAEHN C[C@H]1CN(C)CC[C@H]1N(C)C(=O)C(=O)Nc1cc(Cl)c(Cl)c(Cl)c1 ZINC000581552846 566788904 /nfs/dbraw/zinc/78/89/04/566788904.db2.gz QRJMTNAPKJLWSW-TVQRCGJNSA-N 0 3 392.714 3.384 10 0 GGAEHN Brc1cccc2c1C[C@@H]1[C@H](NCc3cnc(N4CCCC4)nc3)[C@H]21 ZINC000631194982 566789258 /nfs/dbraw/zinc/78/92/58/566789258.db2.gz YHIKEYVBCKENGX-JQHSSLGASA-N 0 3 385.309 3.267 10 0 GGAEHN O[C@@H]1C[C@@H]([C@@H]2CCCOC2)N(Cc2cc(Br)cc3cccnc32)C1 ZINC000451295089 566791790 /nfs/dbraw/zinc/79/17/90/566791790.db2.gz CWBURJFIOGMQKN-OLMNPRSZSA-N 0 3 391.309 3.359 10 0 GGAEHN Brc1ccc2c(c1)C[C@@H]1[C@H]2[C@H]1NCc1cnc(N2CCCC2)nc1 ZINC000631223229 566793653 /nfs/dbraw/zinc/79/36/53/566793653.db2.gz ZEJBRKPTXVTBSW-SQNIBIBYSA-N 0 3 385.309 3.267 10 0 GGAEHN CN(C(=O)CNC[C@@H](O)COc1c(Cl)cccc1Cl)C1CCCCC1 ZINC000581662416 566796136 /nfs/dbraw/zinc/79/61/36/566796136.db2.gz JFMLDHDTPIHSII-CQSZACIVSA-N 0 3 389.323 3.114 10 0 GGAEHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@H]1CC12CCSCC2 ZINC000451327075 566797704 /nfs/dbraw/zinc/79/77/04/566797704.db2.gz FUKSGRDQURJIIM-YMAMQOFZSA-N 0 3 376.488 3.441 10 0 GGAEHN CCC(CC)(CNC(=O)[C@@H](N)CCC(=O)OC)c1ccc(Cl)c(Cl)c1 ZINC000581724393 566802059 /nfs/dbraw/zinc/80/20/59/566802059.db2.gz ZYUCGWUPQVZGRD-HNNXBMFYSA-N 0 3 389.323 3.448 10 0 GGAEHN Cc1ccc(S(=O)(=O)N2CCc3ccccc3[C@H]2CN)c(Br)c1 ZINC000581726055 566802719 /nfs/dbraw/zinc/80/27/19/566802719.db2.gz XHEVIUKCEMDISF-MRXNPFEDSA-N 0 3 395.322 3.004 10 0 GGAEHN CO[C@H](C(=O)N1CCc2ccccc2[C@@H]1CN)c1ccccc1Br ZINC000655483762 566803291 /nfs/dbraw/zinc/80/32/91/566803291.db2.gz LLKOFJDKIWYVJD-ROUUACIJSA-N 0 3 389.293 3.221 10 0 GGAEHN O=S1(=O)CCCN1CCCN[C@H]1CCCc2c(Cl)sc(Cl)c21 ZINC000678580079 566805210 /nfs/dbraw/zinc/80/52/10/566805210.db2.gz BFBMCVUZXUVIJJ-NSHDSACASA-N 0 3 383.366 3.448 10 0 GGAEHN CN(C)C[C@@]1(O)CCCN(C(=O)Nc2ccc(Br)cc2Cl)C1 ZINC000631471018 566805437 /nfs/dbraw/zinc/80/54/37/566805437.db2.gz AOQLKCVVYNYDAG-HNNXBMFYSA-N 0 3 390.709 3.023 10 0 GGAEHN NC[C@H](NC(=O)C1(c2cccc(Br)c2)CCCC1)C(F)(F)F ZINC000655509086 566806681 /nfs/dbraw/zinc/80/66/81/566806681.db2.gz JQLIVKRAUJNHBZ-LBPRGKRZSA-N 0 3 379.220 3.267 10 0 GGAEHN NC[C@H](NC(=O)C1(c2ccc(Br)cc2)CCCC1)C(F)(F)F ZINC000655509390 566806826 /nfs/dbraw/zinc/80/68/26/566806826.db2.gz LTPQBISRAXZYSU-LBPRGKRZSA-N 0 3 379.220 3.267 10 0 GGAEHN OCCC1(CN[C@H]2CCCOc3ccc(I)cc32)CC1 ZINC000427973746 566807628 /nfs/dbraw/zinc/80/76/28/566807628.db2.gz ABNFEMCRPKYIMK-AWEZNQCLSA-N 0 3 387.261 3.257 10 0 GGAEHN CC[C@@H](NC[C@@H](O)COc1ccc(Br)cc1)c1c(C)nn(C)c1C ZINC000542522142 566808471 /nfs/dbraw/zinc/80/84/71/566808471.db2.gz KJHARDXPEHYTNX-NVXWUHKLSA-N 0 3 396.329 3.280 10 0 GGAEHN CC(C)(C)[C@@H]1CCN(C[C@@H](O)COc2cc(Cl)ccc2Cl)C[C@@H]1O ZINC000542547032 566810542 /nfs/dbraw/zinc/81/05/42/566810542.db2.gz SYOVKYNZYMLWPH-FMKPAKJESA-N 0 3 376.324 3.462 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)c2oc3ccccc3c2Br)CCSC1 ZINC000631617717 566813262 /nfs/dbraw/zinc/81/32/62/566813262.db2.gz VXIUKZLZCOJIMZ-MRXNPFEDSA-N 0 3 383.311 3.362 10 0 GGAEHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1[C@@H]2Cc3cc(Br)ccc3[C@@H]21 ZINC000631676572 566814569 /nfs/dbraw/zinc/81/45/69/566814569.db2.gz AEKZKKNPKWZFRJ-XWCCPHMRSA-N 0 3 389.337 3.420 10 0 GGAEHN CN(C)Cc1ccc(NC(=O)[C@H](CN)c2ccccc2)cc1Br ZINC000581942230 566817411 /nfs/dbraw/zinc/81/74/11/566817411.db2.gz FPDYLJHRQQUJEA-MRXNPFEDSA-N 0 3 376.298 3.192 10 0 GGAEHN Cc1ccsc1[C@H](CO)NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000489917552 566817862 /nfs/dbraw/zinc/81/78/62/566817862.db2.gz XNVAOLOYJISPNM-LSDHHAIUSA-N 0 3 379.551 3.288 10 0 GGAEHN CS(=O)(=O)[C@@H]1CCCC[C@H]1N[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]12 ZINC000631702461 566818055 /nfs/dbraw/zinc/81/80/55/566818055.db2.gz OPPUEFHNVDKMCN-MZBWOGCUSA-N 0 3 384.339 3.033 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@@H](C)c1ccc2[nH]c(=O)oc2c1 ZINC000631736961 566821903 /nfs/dbraw/zinc/82/19/03/566821903.db2.gz CNKPVDCKPQJGMR-QWRGUYRKSA-N 0 3 392.253 3.197 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)COc1ccc(Br)cc1F ZINC000517397391 566824157 /nfs/dbraw/zinc/82/41/57/566824157.db2.gz BQPQASNHHABALK-CHWSQXEVSA-N 0 3 387.293 3.346 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cccc(Br)c2C)C[C@@H]1N1CCCC1 ZINC000542772668 566825075 /nfs/dbraw/zinc/82/50/75/566825075.db2.gz AGVLZSCACAHPPJ-HOTGVXAUSA-N 0 3 383.355 3.409 10 0 GGAEHN O=S1(=O)CCCN1CCCNCc1cc(Cl)ccc1OC1CCCC1 ZINC000678932189 566825424 /nfs/dbraw/zinc/82/54/24/566825424.db2.gz RYADMUDPUXRZIR-UHFFFAOYSA-N 0 3 386.945 3.177 10 0 GGAEHN C[C@@H]1CC[C@@H](C)N1[C@@H]1CCCN(S(=O)(=O)c2onc(C3CC3)c2Cl)C1 ZINC000631785165 566825908 /nfs/dbraw/zinc/82/59/08/566825908.db2.gz MFAPHMIUXZLUJK-YRGRVCCFSA-N 0 3 387.933 3.231 10 0 GGAEHN O=C(c1ccc(Br)cc1F)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000469917203 566826574 /nfs/dbraw/zinc/82/65/74/566826574.db2.gz PSEQZRWTVJYPAY-HNNXBMFYSA-N 0 3 399.304 3.305 10 0 GGAEHN O=C(c1ccc(Br)cc1F)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000469917205 566826675 /nfs/dbraw/zinc/82/66/75/566826675.db2.gz PSEQZRWTVJYPAY-OAHLLOKOSA-N 0 3 399.304 3.305 10 0 GGAEHN O=C(c1cccc(Br)c1)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000469927348 566827668 /nfs/dbraw/zinc/82/76/68/566827668.db2.gz XXOWSHANTWJVSN-KRWDZBQOSA-N 0 3 381.314 3.166 10 0 GGAEHN O=C(c1ccc(F)cc1Br)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000469921990 566827833 /nfs/dbraw/zinc/82/78/33/566827833.db2.gz ZIWSAHHOPOMONW-OAHLLOKOSA-N 0 3 399.304 3.305 10 0 GGAEHN O=C(c1cc(F)ccc1Br)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000469932291 566828005 /nfs/dbraw/zinc/82/80/05/566828005.db2.gz GZBQTPZFTQBVHG-HNNXBMFYSA-N 0 3 399.304 3.305 10 0 GGAEHN COCCN(CCOc1ccc(Cl)cc1Br)[C@H]1CCOC1 ZINC000490059024 566827995 /nfs/dbraw/zinc/82/79/95/566827995.db2.gz VNMZBRPUDGNRRH-ZDUSSCGKSA-N 0 3 378.694 3.219 10 0 GGAEHN O=C(c1csc(Br)c1)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000469920671 566828086 /nfs/dbraw/zinc/82/80/86/566828086.db2.gz VOPWBXHOMBSWIS-AWEZNQCLSA-N 0 3 387.343 3.228 10 0 GGAEHN O=C(c1cc(F)cc(Br)c1)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000469932559 566829391 /nfs/dbraw/zinc/82/93/91/566829391.db2.gz KPJPTLVAWWSTBV-KRWDZBQOSA-N 0 3 399.304 3.305 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)NC1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000542841989 566831301 /nfs/dbraw/zinc/83/13/01/566831301.db2.gz PIYWYEYNJSFABE-CQSZACIVSA-N 0 3 386.323 3.393 10 0 GGAEHN C[C@H](Cc1ccc(F)cc1Br)N[C@@H](C)C1(S(C)(=O)=O)CC1 ZINC000582144553 566835059 /nfs/dbraw/zinc/83/50/59/566835059.db2.gz QDNHDQBTNMOFGF-MNOVXSKESA-N 0 3 378.307 3.075 10 0 GGAEHN CN(CC(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1)[C@@H]1CCSC1 ZINC000490182810 566835458 /nfs/dbraw/zinc/83/54/58/566835458.db2.gz RKKSQORXZSHEKP-CZUORRHYSA-N 0 3 378.929 3.317 10 0 GGAEHN Brc1ccc2c(c1)[C@@H](NC1CCN([C@H]3CCOC3)CC1)CCO2 ZINC000655701572 566836594 /nfs/dbraw/zinc/83/65/94/566836594.db2.gz TVUAKVLIXLNQMX-RDJZCZTQSA-N 0 3 381.314 3.116 10 0 GGAEHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2csc(CCC(F)(F)F)n2)C1 ZINC000631951219 566837440 /nfs/dbraw/zinc/83/74/40/566837440.db2.gz ZOFVLYPPPKJCCL-GXTWGEPZSA-N 0 3 375.460 3.123 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CC[C@@]2(CCN(C)C2)C1 ZINC000490223495 566837593 /nfs/dbraw/zinc/83/75/93/566837593.db2.gz OJNQNQBSAJNUQY-SCLBCKFNSA-N 0 3 396.329 3.256 10 0 GGAEHN CN(C(=O)COc1ccc(Br)cc1Cl)[C@@H]1CCN(C2CC2)C1 ZINC000517647984 566837522 /nfs/dbraw/zinc/83/75/22/566837522.db2.gz VNOGNQFCUPRNCB-CYBMUJFWSA-N 0 3 387.705 3.176 10 0 GGAEHN Brc1cccc([C@H]2CCN(CCc3nnnn3-c3ccccc3)C2)c1 ZINC000451576362 566843718 /nfs/dbraw/zinc/84/37/18/566843718.db2.gz ZQGVRIONIIRDRP-INIZCTEOSA-N 0 3 398.308 3.457 10 0 GGAEHN COC(=O)[C@@H]1CCCC[C@@H]1N[C@H](C)C(=O)Nc1ccc(C)cc1Br ZINC000451585497 566844566 /nfs/dbraw/zinc/84/45/66/566844566.db2.gz BWZOWMAUFMHMCP-NFAWXSAZSA-N 0 3 397.313 3.406 10 0 GGAEHN COC(=O)[C@@H]1CCCC[C@@H]1NCC[S@@](=O)c1cc(Cl)ccc1Cl ZINC000451587603 566844841 /nfs/dbraw/zinc/84/48/41/566844841.db2.gz MPDJIUVSPUBOGU-VFDKELDYSA-N 0 3 378.321 3.422 10 0 GGAEHN Brc1cccc2c1OCC[C@H]2NC1CCN([C@@H]2CCOC2)CC1 ZINC000655763543 566845651 /nfs/dbraw/zinc/84/56/51/566845651.db2.gz PRSILKIXACWSJJ-RHSMWYFYSA-N 0 3 381.314 3.116 10 0 GGAEHN Cc1cc(Br)cn2cc(CCNCc3cc4n(n3)CCCC4)nc12 ZINC000655760651 566846034 /nfs/dbraw/zinc/84/60/34/566846034.db2.gz WHNGPGJHNBESLI-UHFFFAOYSA-N 0 3 388.313 3.270 10 0 GGAEHN CC[C@H](NCc1cn(-c2ccccc2Br)nc1C)[C@H](O)C(F)F ZINC000655778408 566848999 /nfs/dbraw/zinc/84/89/99/566848999.db2.gz KHRXQCRZJVDFGV-ZFWWWQNUSA-N 0 3 388.256 3.437 10 0 GGAEHN O=C1CCCN1CCCN[C@@H](c1ccc(Br)cc1)[C@@H]1CCCO1 ZINC000679330096 566849697 /nfs/dbraw/zinc/84/96/97/566849697.db2.gz YDHFSGGQSXBARV-WMZOPIPTSA-N 0 3 381.314 3.271 10 0 GGAEHN COCCN1CCC[C@@H]1CN[C@@H](c1ccc(Br)cc1)[C@H]1CCCO1 ZINC000679336585 566850094 /nfs/dbraw/zinc/85/00/94/566850094.db2.gz AJVGPDLZGZBUMA-QRVBRYPASA-N 0 3 397.357 3.370 10 0 GGAEHN CN(C)CCOc1ccc(CCNC(=O)c2csc(Br)c2)cc1 ZINC000517860100 566850829 /nfs/dbraw/zinc/85/08/29/566850829.db2.gz LMQGLIXLJMYSEM-UHFFFAOYSA-N 0 3 397.338 3.424 10 0 GGAEHN CCNC(=O)N1CC[C@H](N[C@@H](c2ccc(Br)cc2)[C@@H]2CCCO2)C1 ZINC000679353518 566850848 /nfs/dbraw/zinc/85/08/48/566850848.db2.gz DUCCEASSZIDLSS-ULQDDVLXSA-N 0 3 396.329 3.063 10 0 GGAEHN O=S1(=O)CCCN1CCCN[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000679354365 566850893 /nfs/dbraw/zinc/85/08/93/566850893.db2.gz ZHOBQGBJZYROAV-LJQANCHMSA-N 0 3 378.925 3.445 10 0 GGAEHN CCS(=O)(=O)C[C@H](C)NCC1(c2cccc(OC(F)(F)F)c2)CCC1 ZINC000655821383 566851179 /nfs/dbraw/zinc/85/11/79/566851179.db2.gz XRCHNFLBWNUNGH-ZDUSSCGKSA-N 0 3 379.444 3.420 10 0 GGAEHN OCC[C@]1(CN[C@@H](c2ccc(Br)cc2)[C@H]2CCCO2)CCOC1 ZINC000679349023 566851519 /nfs/dbraw/zinc/85/15/19/566851519.db2.gz JAWWAAMGKYJWIF-FGTMMUONSA-N 0 3 384.314 3.048 10 0 GGAEHN Cc1ccc(I)c(C(=O)NC[C@@H]2CCCCN2C2CC2)c1 ZINC000470157376 566851865 /nfs/dbraw/zinc/85/18/65/566851865.db2.gz LWRBKIBETWGSDT-AWEZNQCLSA-N 0 3 398.288 3.346 10 0 GGAEHN COc1cc(C)nc(CNC[C@@H](CO)Cc2ccc(Br)cc2)c1 ZINC000428535525 566852698 /nfs/dbraw/zinc/85/26/98/566852698.db2.gz LDRJVHWAHDYTDX-HNNXBMFYSA-N 0 3 379.298 3.102 10 0 GGAEHN COc1cc(Br)c(CN2CCc3ccccc3[C@@H]2CN)cc1O ZINC000563135539 566858617 /nfs/dbraw/zinc/85/86/17/566858617.db2.gz PPEMQQKQBXCHPQ-INIZCTEOSA-N 0 3 377.282 3.221 10 0 GGAEHN NC[C@@H](NC(=O)N1CCC[C@@H]1c1ccccc1Br)C(F)(F)F ZINC000655921711 566858583 /nfs/dbraw/zinc/85/85/83/566858583.db2.gz PBMFJTRQHCWOEC-VXGBXAGGSA-N 0 3 380.208 3.185 10 0 GGAEHN CC(C)N(Cc1ccc(Br)cc1)C(=O)N[C@@H](CN)C(F)(F)F ZINC000655916252 566859069 /nfs/dbraw/zinc/85/90/69/566859069.db2.gz UHYLLYDKFSQTKA-LBPRGKRZSA-N 0 3 382.224 3.259 10 0 GGAEHN NC[C@H](NC(=O)N1CCC[C@H]1c1ccc(Br)cc1)C(F)(F)F ZINC000655910957 566859178 /nfs/dbraw/zinc/85/91/78/566859178.db2.gz FPWUSTPMTCLONA-RYUDHWBXSA-N 0 3 380.208 3.185 10 0 GGAEHN Cc1nc(-c2cc3c(s2)CCN(C(=O)N[C@H](CN)C(F)(F)F)C3)cs1 ZINC000655919468 566859256 /nfs/dbraw/zinc/85/92/56/566859256.db2.gz BPANSYODEPTSBT-CYBMUJFWSA-N 0 3 390.456 3.137 10 0 GGAEHN NC[C@H](NC(=O)N1CCC(Sc2ccc(Cl)cc2)CC1)C(F)(F)F ZINC000655919787 566859527 /nfs/dbraw/zinc/85/95/27/566859527.db2.gz FKFSUMRGPNSQLM-ZDUSSCGKSA-N 0 3 381.851 3.496 10 0 GGAEHN NC[C@@H](NC(=O)NCC1(c2ccc(Br)cc2)CCC1)C(F)(F)F ZINC000655910833 566859728 /nfs/dbraw/zinc/85/97/28/566859728.db2.gz CTQCLONMNZITQV-GFCCVEGCSA-N 0 3 394.235 3.060 10 0 GGAEHN CC[C@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)C(F)(F)F ZINC000470255484 566859949 /nfs/dbraw/zinc/85/99/49/566859949.db2.gz PQHMOSGRGBPEAQ-MCIGGMRASA-N 0 3 375.357 3.432 10 0 GGAEHN COCCC[C@H](CNC(=O)N[C@@H](CN)C(F)(F)F)c1ccc(Cl)cc1 ZINC000655927777 566860852 /nfs/dbraw/zinc/86/08/52/566860852.db2.gz INTQBUSCSHBLQL-OCCSQVGLSA-N 0 3 381.826 3.039 10 0 GGAEHN NC[C@@H](NC(=O)N1CCC(c2ccccc2Br)CC1)C(F)(F)F ZINC000655929312 566861080 /nfs/dbraw/zinc/86/10/80/566861080.db2.gz SBBCJELUWXOLGG-CYBMUJFWSA-N 0 3 394.235 3.228 10 0 GGAEHN COCC[C@H](NC(=O)N[C@H](CN)C(F)(F)F)c1ccc(Cl)c(Cl)c1 ZINC000655930310 566861887 /nfs/dbraw/zinc/86/18/87/566861887.db2.gz MTJYNOJDFWCMLO-NWDGAFQWSA-N 0 3 388.217 3.260 10 0 GGAEHN Cc1cc(C(C)(C)NC(=O)N[C@@H](CN)C(F)(F)F)ccc1Br ZINC000655928067 566861920 /nfs/dbraw/zinc/86/19/20/566861920.db2.gz PSMUTVRQXWREHZ-NSHDSACASA-N 0 3 382.224 3.181 10 0 GGAEHN O=S(=O)(CCNCc1cc(-n2ccnc2)cs1)c1ccc(Cl)cc1 ZINC000543178454 566862243 /nfs/dbraw/zinc/86/22/43/566862243.db2.gz OJGFKGVTNKMFBM-UHFFFAOYSA-N 0 3 381.910 3.151 10 0 GGAEHN COc1cc(Br)ccc1CCCN(C)Cc1cnc(N(C)C)nc1 ZINC000543182859 566862333 /nfs/dbraw/zinc/86/23/33/566862333.db2.gz CGLHYLVKUGJWHH-UHFFFAOYSA-N 0 3 393.329 3.378 10 0 GGAEHN CN1CCC[C@H](N[C@@H]2CCCOc3ccc(I)cc32)C1 ZINC000610804146 566864744 /nfs/dbraw/zinc/86/47/44/566864744.db2.gz BGADAFGGPXHOEV-DZGCQCFKSA-N 0 3 386.277 3.189 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)c1ccc(I)cc1 ZINC000518085039 566865397 /nfs/dbraw/zinc/86/53/97/566865397.db2.gz JTETVWRLLQKJQH-STQMWFEESA-N 0 3 386.277 3.284 10 0 GGAEHN Cc1nc(CSc2ccccc2C(=O)N[C@@H]2CNCCC2(F)F)cs1 ZINC000563205946 566865933 /nfs/dbraw/zinc/86/59/33/566865933.db2.gz DTHXNMDXAHZOOK-OAHLLOKOSA-N 0 3 383.489 3.471 10 0 GGAEHN O=S(=O)([N-]CCCCC[NH+]1CCCCC1)c1cccnc1C(F)(F)F ZINC000582503545 566868361 /nfs/dbraw/zinc/86/83/61/566868361.db2.gz PDASOCPOIHHBIE-UHFFFAOYSA-N 0 3 379.448 3.035 10 0 GGAEHN COC[C@H](CN[C@@H](Cc1ccccn1)c1ccc(Br)cc1)OC ZINC000679722619 566869592 /nfs/dbraw/zinc/86/95/92/566869592.db2.gz GZSGATBYHPNLJL-ROUUACIJSA-N 0 3 379.298 3.379 10 0 GGAEHN COC[C@@H](CN[C@@H](Cc1ccccn1)c1ccc(Br)cc1)OC ZINC000679722616 566869640 /nfs/dbraw/zinc/86/96/40/566869640.db2.gz GZSGATBYHPNLJL-MSOLQXFVSA-N 0 3 379.298 3.379 10 0 GGAEHN CCCN1CCC[C@H]1C(=O)NCCCc1ccc(Br)cc1OC ZINC000543348483 566871717 /nfs/dbraw/zinc/87/17/17/566871717.db2.gz DFFKIFMSCFSOHM-INIZCTEOSA-N 0 3 383.330 3.381 10 0 GGAEHN CCCOc1ccc(Br)cc1CNC[C@@H]1CCCN1CCOC ZINC000518279314 566873157 /nfs/dbraw/zinc/87/31/57/566873157.db2.gz NPESXUZUCDQJAI-KRWDZBQOSA-N 0 3 385.346 3.438 10 0 GGAEHN CCCN1CCC[C@@H]1C(=O)N[C@@H]1CCN(c2cccc(Br)c2)C1 ZINC000470443522 566874365 /nfs/dbraw/zinc/87/43/65/566874365.db2.gz IHPAYFHLVVYOEQ-NVXWUHKLSA-N 0 3 380.330 3.018 10 0 GGAEHN Cc1cccc(C)c1OC[C@H](O)CN[C@@H](CO)c1cccc(Br)c1 ZINC000679831106 566876435 /nfs/dbraw/zinc/87/64/35/566876435.db2.gz HHTDURIWHSSESR-MSOLQXFVSA-N 0 3 394.309 3.129 10 0 GGAEHN COc1ccc([C@H](CN(C)C)NC(=O)Cc2sccc2Br)cc1 ZINC000451767346 566877006 /nfs/dbraw/zinc/87/70/06/566877006.db2.gz DOECUNMQCCNHKI-HNNXBMFYSA-N 0 3 397.338 3.481 10 0 GGAEHN Brc1ccc(CCNCc2cnnn2Cc2ccccc2)s1 ZINC000490752144 566877103 /nfs/dbraw/zinc/87/71/03/566877103.db2.gz AXMJGUOXGWYDPM-UHFFFAOYSA-N 0 3 377.311 3.483 10 0 GGAEHN Cc1nccc(NC(=O)N(CCN(C)C)Cc2ccsc2)c1Br ZINC000518331992 566877307 /nfs/dbraw/zinc/87/73/07/566877307.db2.gz LXTGEGOUBZUWKU-UHFFFAOYSA-N 0 3 397.342 3.232 10 0 GGAEHN COCCN1CC[C@@H](Nc2ccc(CCn3cc(Br)cn3)cc2)C1 ZINC000543396694 566877651 /nfs/dbraw/zinc/87/76/51/566877651.db2.gz VZNVCMHLCVJKQQ-GOSISDBHSA-N 0 3 393.329 3.021 10 0 GGAEHN C[C@H](NCc1ccc(S(=O)(=O)N2CCOCC2)s1)C1CCCCCC1 ZINC000543411585 566878437 /nfs/dbraw/zinc/87/84/37/566878437.db2.gz KVKWMNWXXWPODF-HNNXBMFYSA-N 0 3 386.583 3.218 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)c1cccc(F)c1I ZINC000611001979 566881241 /nfs/dbraw/zinc/88/12/41/566881241.db2.gz RRXFBJQVYGOSNU-NSHDSACASA-N 0 3 392.256 3.136 10 0 GGAEHN Cc1ccnc([C@H]2CCN(C[C@H](O)COc3ccc(Br)cc3)C2)c1 ZINC000563365920 566879913 /nfs/dbraw/zinc/87/99/13/566879913.db2.gz FMPFARQUZHDUPX-RDJZCZTQSA-N 0 3 391.309 3.382 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1F)NC[C@H]1CCCCS1(=O)=O ZINC000543427323 566880071 /nfs/dbraw/zinc/88/00/71/566880071.db2.gz YGCBSRDRNWXMGE-SMDDNHRTSA-N 0 3 378.307 3.076 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)NC[C@@H]1CCCCS1(=O)=O ZINC000543427322 566880436 /nfs/dbraw/zinc/88/04/36/566880436.db2.gz YGCBSRDRNWXMGE-RISCZKNCSA-N 0 3 378.307 3.076 10 0 GGAEHN CS(=O)(=O)N[C@H]1CCCC[C@H]1CNCc1ncc(-c2ccccc2)s1 ZINC000518411701 566882505 /nfs/dbraw/zinc/88/25/05/566882505.db2.gz WGKVBUHYNALRIZ-HOTGVXAUSA-N 0 3 379.551 3.008 10 0 GGAEHN CN(C(=O)c1[nH]nc(-c2ccccc2)c1Br)[C@@H]1CCN(C2CC2)C1 ZINC000518431463 566882689 /nfs/dbraw/zinc/88/26/89/566882689.db2.gz BUXILNVLAIKBIK-CQSZACIVSA-N 0 3 389.297 3.148 10 0 GGAEHN COc1cc(C[NH2+][C@@H]2COc3cc(F)ccc3C2)cc(Br)c1[O-] ZINC000563442183 566883390 /nfs/dbraw/zinc/88/33/90/566883390.db2.gz GSIBKNAQYGOEJS-ZDUSSCGKSA-N 0 3 382.229 3.396 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)c2c[nH]c3cccc(Br)c23)CCSC1 ZINC000490899565 566883904 /nfs/dbraw/zinc/88/39/04/566883904.db2.gz CXKBMZYTEZLVCC-MRXNPFEDSA-N 0 3 382.327 3.098 10 0 GGAEHN Cc1nc2ccc(Br)cc2c(N2CCN3CCOC[C@@H]3C2)c1C ZINC000543451819 566884222 /nfs/dbraw/zinc/88/42/22/566884222.db2.gz KFXGYDYOWCBPRB-HNNXBMFYSA-N 0 3 376.298 3.135 10 0 GGAEHN CN(C)[C@]1(CNC(=O)c2c[nH]c3cccc(Br)c23)CCSC1 ZINC000490899564 566884718 /nfs/dbraw/zinc/88/47/18/566884718.db2.gz CXKBMZYTEZLVCC-INIZCTEOSA-N 0 3 382.327 3.098 10 0 GGAEHN O=C1[C@@H](N[C@@H]2CCCc3c(Br)cccc32)CCN1C1CCOCC1 ZINC000679991594 566885147 /nfs/dbraw/zinc/88/51/47/566885147.db2.gz AXSKJUUZMGPNAE-MSOLQXFVSA-N 0 3 393.325 3.196 10 0 GGAEHN C[C@@H](NC(=O)N1CCc2ccccc2[C@@H]1CN)c1ccc(Br)cn1 ZINC000582723929 566887064 /nfs/dbraw/zinc/88/70/64/566887064.db2.gz XBQHNVBYAZRPMR-PXAZEXFGSA-N 0 3 389.297 3.173 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3c(C)ccc(Br)c3C)[C@H]2C1 ZINC000563469275 566887118 /nfs/dbraw/zinc/88/71/18/566887118.db2.gz LVTBPAHZYQTJIA-JKSUJKDBSA-N 0 3 381.314 3.001 10 0 GGAEHN C[C@H](NCC(=O)Nc1ccc(Br)cn1)[C@H]1Oc2ccccc2[C@H]1C ZINC000543547501 566889026 /nfs/dbraw/zinc/88/90/26/566889026.db2.gz QJKSMBRZWDFPMG-SOZUMNATSA-N 0 3 390.281 3.325 10 0 GGAEHN Cc1nc(CNC(=O)Nc2ccc3c(c2)CNCCO3)sc1Br ZINC000563506630 566888983 /nfs/dbraw/zinc/88/89/83/566888983.db2.gz TVIFPBKHPDNFIH-UHFFFAOYSA-N 0 3 397.298 3.018 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)NCc1cc(Br)cs1 ZINC000518529770 566889925 /nfs/dbraw/zinc/88/99/25/566889925.db2.gz VPDNWVJVZAGYLC-OAHLLOKOSA-N 0 3 380.311 3.278 10 0 GGAEHN C[C@H](NC(=O)c1c(F)cncc1Br)[C@@H](c1ccccc1)N(C)C ZINC000632517331 566891217 /nfs/dbraw/zinc/89/12/17/566891217.db2.gz IDWRIAFNMKPTPP-ZBEGNZNMSA-N 0 3 380.261 3.404 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)c1cc2c(c(Br)c1)OCO2 ZINC000518597862 566893062 /nfs/dbraw/zinc/89/30/62/566893062.db2.gz URDKKEUGIYZRJG-RYUDHWBXSA-N 0 3 383.286 3.171 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)c1cccc(I)c1 ZINC000518600882 566893098 /nfs/dbraw/zinc/89/30/98/566893098.db2.gz ZVQKJHZCEKIXRJ-CHWSQXEVSA-N 0 3 386.277 3.284 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)COc1ccc(F)cc1Br ZINC000518596672 566893731 /nfs/dbraw/zinc/89/37/31/566893731.db2.gz JAWHOTCWSVRJOY-CHWSQXEVSA-N 0 3 387.293 3.346 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1CC[C@H]2CN(C)C[C@H]21 ZINC000656260052 566893872 /nfs/dbraw/zinc/89/38/72/566893872.db2.gz IHLWLLPJHPTWLX-KBXCAEBGSA-N 0 3 375.314 3.079 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)c1cc2c(c(Br)c1)OCO2 ZINC000518597863 566894035 /nfs/dbraw/zinc/89/40/35/566894035.db2.gz URDKKEUGIYZRJG-TXEJJXNPSA-N 0 3 383.286 3.171 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CNCC[C@H](O)C(F)(F)F ZINC000656261191 566894739 /nfs/dbraw/zinc/89/47/39/566894739.db2.gz FBTJENGAKACKPI-AWEZNQCLSA-N 0 3 392.219 3.346 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CC[C@@H](N3CCCCC3)C2)c1 ZINC000518618385 566894995 /nfs/dbraw/zinc/89/49/95/566894995.db2.gz NXEDQIYFZJMGKQ-CQSZACIVSA-N 0 3 398.288 3.300 10 0 GGAEHN CC(C)[NH+]1CCC(C(=O)Nc2cc(I)ccc2[O-])CC1 ZINC000611156699 566895153 /nfs/dbraw/zinc/89/51/53/566895153.db2.gz OVVSKOBFRXLYFZ-UHFFFAOYSA-N 0 3 388.249 3.056 10 0 GGAEHN CCN(CC)CCN(C(=O)c1ccncc1)c1ccc(Br)cn1 ZINC000582848817 566900394 /nfs/dbraw/zinc/90/03/94/566900394.db2.gz OYXIAUMRJXNZFP-UHFFFAOYSA-N 0 3 377.286 3.228 10 0 GGAEHN O=C(CCN1CC[C@H]([C@H](O)C(F)(F)F)C1)Nc1ccccc1Br ZINC000451881485 566900886 /nfs/dbraw/zinc/90/08/86/566900886.db2.gz BKJHHQSPCLWIHH-HZMBPMFUSA-N 0 3 395.219 3.023 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)NC[C@H](C)N1CCCC1 ZINC000518765763 566901913 /nfs/dbraw/zinc/90/19/13/566901913.db2.gz GCMFGKHQGKYTNX-ZDUSSCGKSA-N 0 3 378.314 3.313 10 0 GGAEHN O=C(CCOC1CNC1)N[C@H](c1ccccc1)c1ccc(Br)cc1 ZINC000518755578 566902432 /nfs/dbraw/zinc/90/24/32/566902432.db2.gz JHIJOUNXTRDLBY-LJQANCHMSA-N 0 3 389.293 3.033 10 0 GGAEHN O=C(CCOc1ccc(Cl)cc1Br)N1CCN2CCC1CC2 ZINC000470772238 566903199 /nfs/dbraw/zinc/90/31/99/566903199.db2.gz JGSOBWKWOXNZHZ-UHFFFAOYSA-N 0 3 387.705 3.178 10 0 GGAEHN O=C(CCN1CC[C@@H]([C@H](O)C(F)(F)F)C1)Nc1cccc(Br)c1 ZINC000451891955 566903283 /nfs/dbraw/zinc/90/32/83/566903283.db2.gz OXLKSBCLAIZGAR-YGRLFVJLSA-N 0 3 395.219 3.023 10 0 GGAEHN Cc1cccc2c1CC[C@H]2NCc1ccc(S(N)(=O)=O)c(Br)c1 ZINC000582892379 566903387 /nfs/dbraw/zinc/90/33/87/566903387.db2.gz RXMBSZFNEJOUKH-MRXNPFEDSA-N 0 3 395.322 3.182 10 0 GGAEHN CCOc1cc(C[NH2+]C2CCN(CC(F)F)CC2)cc(Br)c1[O-] ZINC000656493859 566904555 /nfs/dbraw/zinc/90/45/55/566904555.db2.gz ITJMDDRIWZAHBI-UHFFFAOYSA-N 0 3 393.272 3.373 10 0 GGAEHN O=C(CCN1CC[C@@H]([C@@H](O)C(F)(F)F)C1)Nc1ccc(Br)cc1 ZINC000451915412 566905832 /nfs/dbraw/zinc/90/58/32/566905832.db2.gz VKYDOGOXCXUDGH-QMTHXVAHSA-N 0 3 395.219 3.023 10 0 GGAEHN C[C@@H](Cc1ccccc1Br)NC(=O)CCN(C)c1ccncc1 ZINC000543713991 566905855 /nfs/dbraw/zinc/90/58/55/566905855.db2.gz ACSBLAJRCZBJBB-AWEZNQCLSA-N 0 3 376.298 3.418 10 0 GGAEHN CN(CCC(=O)Nc1cccc(I)c1)c1ccncc1 ZINC000543715386 566906357 /nfs/dbraw/zinc/90/63/57/566906357.db2.gz IMLUUEHPXVZCSB-UHFFFAOYSA-N 0 3 381.217 3.151 10 0 GGAEHN O=C(CCN1CC[C@H]([C@@H](O)C(F)(F)F)C1)Nc1ccc(Br)cc1 ZINC000451915411 566906515 /nfs/dbraw/zinc/90/65/15/566906515.db2.gz VKYDOGOXCXUDGH-IINYFYTJSA-N 0 3 395.219 3.023 10 0 GGAEHN O=C(NCCc1ccccc1Br)NC[C@@H]1CCCCN1C1CC1 ZINC000429101905 566907989 /nfs/dbraw/zinc/90/79/89/566907989.db2.gz KCHTWGMOLLPLGJ-INIZCTEOSA-N 0 3 380.330 3.308 10 0 GGAEHN O=C(NCCc1ccccc1Br)NC[C@H]1CCCCN1C1CC1 ZINC000429101906 566908473 /nfs/dbraw/zinc/90/84/73/566908473.db2.gz KCHTWGMOLLPLGJ-MRXNPFEDSA-N 0 3 380.330 3.308 10 0 GGAEHN Cc1sc2ncnc(SCCC(=O)N3CCN4CCC3CC4)c2c1C ZINC000470851686 566909507 /nfs/dbraw/zinc/90/95/07/566909507.db2.gz PCSBGGVFLMCLKG-UHFFFAOYSA-N 0 3 376.551 3.097 10 0 GGAEHN CC(C(=O)NCCc1ccc(F)cc1)S(=O)(=O)Cc1ccsc1Cl ZINC000656533824 566912623 /nfs/dbraw/zinc/91/26/23/566912623.db2.gz BVZJOBRJIGDXGJ-LLVKDONJSA-N 0 3 389.901 3.203 10 0 GGAEHN C[C@@H]1CN(CCCNC(=O)c2oc3ccccc3c2Br)CCCO1 ZINC000632764937 566912802 /nfs/dbraw/zinc/91/28/02/566912802.db2.gz XZEAIZWTGKTXCF-CYBMUJFWSA-N 0 3 395.297 3.426 10 0 GGAEHN CC(C(=O)NCCc1cccs1)S(=O)(=O)Cc1ccsc1Cl ZINC000656534461 566913803 /nfs/dbraw/zinc/91/38/03/566913803.db2.gz RLDWFWNFMFREKL-SNVBAGLBSA-N 0 3 377.940 3.125 10 0 GGAEHN C[C@H]1[C@H](C(F)(F)F)CCN1CCC(=O)Nc1ccc(C(N)=O)c(Cl)c1 ZINC000470938929 566915915 /nfs/dbraw/zinc/91/59/15/566915915.db2.gz AORMPROHTSRQKR-JOYOIKCWSA-N 0 3 377.794 3.040 10 0 GGAEHN O=C(NC[C@H]1CCN(Cc2ccccc2)C1)c1c(F)cncc1Br ZINC000632813159 566916308 /nfs/dbraw/zinc/91/63/08/566916308.db2.gz CZOLZNMOLACECF-CQSZACIVSA-N 0 3 392.272 3.235 10 0 GGAEHN O=S(=O)(CCNC1CC(OCc2ccccc2)C1)c1ccc(Cl)cc1 ZINC000491927875 566919071 /nfs/dbraw/zinc/91/90/71/566919071.db2.gz DKCXFTHMDJBZJQ-UHFFFAOYSA-N 0 3 379.909 3.451 10 0 GGAEHN O=C(N[C@@H]1[C@H]2Cc3c(cccc3Br)[C@@H]12)NC1CCN(C2CC2)CC1 ZINC000632843204 566919159 /nfs/dbraw/zinc/91/91/59/566919159.db2.gz JGBYCBUZBHYAPZ-CGTJXYLNSA-N 0 3 390.325 3.013 10 0 GGAEHN COCc1cc(Cl)cc(S(=O)(=O)N2CCCC[C@H](N3CCCC3)C2)c1 ZINC000583113180 566921478 /nfs/dbraw/zinc/92/14/78/566921478.db2.gz ZVTAKOVECNMHKO-KRWDZBQOSA-N 0 3 386.945 3.125 10 0 GGAEHN CC[C@@H](Cc1ccccc1Br)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000471077426 566925594 /nfs/dbraw/zinc/92/55/94/566925594.db2.gz DRJZGVDQSSJFKX-DLBZAZTESA-N 0 3 392.341 3.426 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NCc1cn2ccc(Br)cc2n1 ZINC000519235834 566927784 /nfs/dbraw/zinc/92/77/84/566927784.db2.gz DSFIUDQNZGKCFN-KRWDZBQOSA-N 0 3 387.325 3.359 10 0 GGAEHN CC1CCN(S(=O)(=O)Cc2ccccc2CN[C@@H]2CCCSC2)CC1 ZINC000544002175 566927942 /nfs/dbraw/zinc/92/79/42/566927942.db2.gz HBYVUVINSWCQKM-LJQANCHMSA-N 0 3 382.595 3.234 10 0 GGAEHN CC(C)n1ccc(C[C@@H](C)NCC(=O)Nc2ccc(Br)cc2)n1 ZINC000544007517 566928545 /nfs/dbraw/zinc/92/85/45/566928545.db2.gz GOCWIKIEJUNGCJ-CYBMUJFWSA-N 0 3 379.302 3.386 10 0 GGAEHN CNC(=O)[C@@H](C)Oc1ccc(Br)cc1CN[C@H]1CC12CCCC2 ZINC000583184701 566929005 /nfs/dbraw/zinc/92/90/05/566929005.db2.gz MXHKXJJMCBSBTL-WBMJQRKESA-N 0 3 381.314 3.385 10 0 GGAEHN COC[C@H](N[C@@H](C)C(=O)Nc1cc(Cl)ccc1Cl)C1CCOCC1 ZINC000656679445 566931932 /nfs/dbraw/zinc/93/19/32/566931932.db2.gz IKYKVHAJPBSYFV-ZBEGNZNMSA-N 0 3 375.296 3.352 10 0 GGAEHN COC[C@H](N[C@@H](C)C(=O)Nc1ccc(C)cc1Br)C1CCOCC1 ZINC000656676710 566932361 /nfs/dbraw/zinc/93/23/61/566932361.db2.gz CPOMVJIUZKNXME-GUYCJALGSA-N 0 3 399.329 3.116 10 0 GGAEHN COC[C@@H]1CCCN(CC(=O)N[C@@H](C)c2ccc(Br)cc2)CC1 ZINC000452088712 566933023 /nfs/dbraw/zinc/93/30/23/566933023.db2.gz OZKFQRDAJRELSH-LSDHHAIUSA-N 0 3 383.330 3.375 10 0 GGAEHN COC[C@H](N[C@H](C)C(=O)Nc1ccc(Cl)c(Cl)c1)C1CCOCC1 ZINC000656679848 566934087 /nfs/dbraw/zinc/93/40/87/566934087.db2.gz RMKDZSVRQMHPIO-BZNIZROVSA-N 0 3 375.296 3.352 10 0 GGAEHN COC[C@@H](N[C@@H](C)C(=O)Nc1ccc(Cl)cc1Cl)C1CCOCC1 ZINC000656680903 566934170 /nfs/dbraw/zinc/93/41/70/566934170.db2.gz XEKMGUXXIDXLJE-MEDUHNTESA-N 0 3 375.296 3.352 10 0 GGAEHN COC[C@@H](N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)C1CCOCC1 ZINC000656680030 566934334 /nfs/dbraw/zinc/93/43/34/566934334.db2.gz SZVNKAJLUOIHSZ-DLBZAZTESA-N 0 3 387.307 3.130 10 0 GGAEHN COC[C@H](N[C@@H](C)C(=O)Nc1ccc(Cl)c(Cl)c1)C1CCOCC1 ZINC000656679850 566934537 /nfs/dbraw/zinc/93/45/37/566934537.db2.gz RMKDZSVRQMHPIO-ZBEGNZNMSA-N 0 3 375.296 3.352 10 0 GGAEHN CN(C)CCn1cc(Nc2ncnc3cc(F)c(Br)cc32)cn1 ZINC000680828477 566934911 /nfs/dbraw/zinc/93/49/11/566934911.db2.gz COIIMJGYCQXBIX-UHFFFAOYSA-N 0 3 379.237 3.033 10 0 GGAEHN C[C@@]1(CCNCCS(=O)(=O)c2cccc(Br)c2)CC1(F)F ZINC000656714986 566935518 /nfs/dbraw/zinc/93/55/18/566935518.db2.gz POEGZGQWDDTMOV-CYBMUJFWSA-N 0 3 382.270 3.248 10 0 GGAEHN C[C@H]1CCN(CCNC(=O)c2cc(Br)cc(N3CCCC3)c2)C1 ZINC000611749130 566935825 /nfs/dbraw/zinc/93/58/25/566935825.db2.gz IWPYCXDTRCKCMH-AWEZNQCLSA-N 0 3 380.330 3.121 10 0 GGAEHN O=S(=O)(c1ccc(C(F)(F)F)cc1)N1CCCC[C@@H](N2CCCC2)C1 ZINC000519376351 566936122 /nfs/dbraw/zinc/93/61/22/566936122.db2.gz MNDPKKVMFQDZBO-OAHLLOKOSA-N 0 3 376.444 3.344 10 0 GGAEHN NC[C@@H](C(=O)N1CCc2cc(Br)ccc2C1)c1ccc(F)cc1 ZINC000519396985 566937479 /nfs/dbraw/zinc/93/74/79/566937479.db2.gz KWHBMLDHWWUGMS-QGZVFWFLSA-N 0 3 377.257 3.215 10 0 GGAEHN Cc1nc(-c2ccc(C(=O)N3CCOC[C@H]3[C@@H]3CCCN3C)s2)cs1 ZINC000633195443 566941822 /nfs/dbraw/zinc/94/18/22/566941822.db2.gz GJFSHPRAXXDZQZ-GJZGRUSLSA-N 0 3 377.535 3.115 10 0 GGAEHN CN1CCC[C@@]2(CCN(C(=O)Cc3csc(CCC(F)(F)F)n3)C2)C1 ZINC000633207680 566943968 /nfs/dbraw/zinc/94/39/68/566943968.db2.gz UTISTLHZBSHBRZ-MRXNPFEDSA-N 0 3 375.460 3.125 10 0 GGAEHN CN1CCC[C@]2(CCN(C(=O)CCc3cccc(F)c3Br)C2)C1 ZINC000452151792 566944365 /nfs/dbraw/zinc/94/43/65/566944365.db2.gz NZVFRXHKCOTRCL-SFHVURJKSA-N 0 3 383.305 3.465 10 0 GGAEHN Cc1cc(Br)cn2c(CNCC3(O)Cc4ccccc4C3)cnc12 ZINC000544171448 566945207 /nfs/dbraw/zinc/94/52/07/566945207.db2.gz NSXIWUZAFJFKEM-UHFFFAOYSA-N 0 3 386.293 3.025 10 0 GGAEHN Cc1nn(-c2ccncc2)cc1CN[C@H](CO)c1ccc(Br)cc1 ZINC000544175750 566945517 /nfs/dbraw/zinc/94/55/17/566945517.db2.gz DUDOXUDAFZGKOB-GOSISDBHSA-N 0 3 387.281 3.161 10 0 GGAEHN C[C@H](NC(=O)CN1CCCC[C@H]1C1(O)CC1)c1ccc(Br)cc1 ZINC000519525140 566945529 /nfs/dbraw/zinc/94/55/29/566945529.db2.gz JPZLEAFHTFITER-BBRMVZONSA-N 0 3 381.314 3.006 10 0 GGAEHN C[C@@H]1CN(C(=O)[C@@H]2[C@@H]3Cc4cc(Br)ccc4[C@@H]32)CCN(C2CC2)C1 ZINC000633254560 566946829 /nfs/dbraw/zinc/94/68/29/566946829.db2.gz BWRQNFBVAZLIEG-JHQYFNNDSA-N 0 3 389.337 3.278 10 0 GGAEHN COc1ccc(CN[C@@H]2C[NH2+]CC[C@@H]2c2ccccc2)c(Br)c1[O-] ZINC000656788957 566950103 /nfs/dbraw/zinc/95/01/03/566950103.db2.gz KLSXIRAYTGPWRP-HZPDHXFCSA-N 0 3 391.309 3.399 10 0 GGAEHN CCN(C(=O)[C@H]1[C@@H]2c3ccc(Br)cc3C[C@H]12)C1CCN(C)CC1 ZINC000633305514 566950069 /nfs/dbraw/zinc/95/00/69/566950069.db2.gz PWPUQMCLZWYYHO-RCCFBDPRSA-N 0 3 377.326 3.278 10 0 GGAEHN O=C(Cc1sccc1Br)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000452193358 566950696 /nfs/dbraw/zinc/95/06/96/566950696.db2.gz NLUKYQULIBINAE-AWEZNQCLSA-N 0 3 395.322 3.258 10 0 GGAEHN CCCN1CCC[C@H]1C(=O)NCCc1c[nH]c2ccc(Br)cc12 ZINC000544305391 566952428 /nfs/dbraw/zinc/95/24/28/566952428.db2.gz ICQSKYLMGOIKAV-KRWDZBQOSA-N 0 3 378.314 3.464 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N(CCN(C)C)Cc1cccs1 ZINC000612085307 566953043 /nfs/dbraw/zinc/95/30/43/566953043.db2.gz WLGGLCYUWRNYLF-UHFFFAOYSA-N 0 3 382.327 3.418 10 0 GGAEHN COc1ccc(CCC(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)c(Br)c1 ZINC000612102602 566953442 /nfs/dbraw/zinc/95/34/42/566953442.db2.gz CCZLKBQEGHRNIR-GXTWGEPZSA-N 0 3 381.314 3.132 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CN1C(=O)N[C@H](Cc2cc(Cl)cc(Cl)c2)C1=O ZINC000656820181 566954043 /nfs/dbraw/zinc/95/40/43/566954043.db2.gz BJORCPLZDOWSFY-HUUCEWRRSA-N 0 3 384.307 3.329 10 0 GGAEHN COc1cc(CN(C)C)ccc1NC(=O)c1cnc(OC)c(Br)c1 ZINC000633379351 566954269 /nfs/dbraw/zinc/95/42/69/566954269.db2.gz SYMYMMQERQQEJK-UHFFFAOYSA-N 0 3 394.269 3.175 10 0 GGAEHN O=C(c1cc(Cl)cc(Cl)c1F)N1CCC(N2CCCOCC2)CC1 ZINC000633410518 566959090 /nfs/dbraw/zinc/95/90/90/566959090.db2.gz PPFAPRUPZHOSAY-UHFFFAOYSA-N 0 3 375.271 3.459 10 0 GGAEHN CC[C@H](NC[C@@H](O)COc1cccc(Br)c1)c1c(C)nn(C)c1C ZINC000564297979 566962059 /nfs/dbraw/zinc/96/20/59/566962059.db2.gz LXNBHFHAXKFTDN-WBVHZDCISA-N 0 3 396.329 3.280 10 0 GGAEHN CN1C(=O)C[C@@H](NCCCOCC(F)(F)F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000493936851 566962300 /nfs/dbraw/zinc/96/23/00/566962300.db2.gz LUWRNGNUXIKKSB-HIFRSBDPSA-N 0 3 382.785 3.310 10 0 GGAEHN O=C(CN[C@@H]1CC[C@H]1C1CCC1)Nc1ccc(I)cc1 ZINC000583571278 566963486 /nfs/dbraw/zinc/96/34/86/566963486.db2.gz NBQIASCCYFJHCO-LSDHHAIUSA-N 0 3 384.261 3.398 10 0 GGAEHN CN(C)c1cc(Cl)cc(Cl)c1CNCCC1CCS(=O)(=O)CC1 ZINC000519756337 566965428 /nfs/dbraw/zinc/96/54/28/566965428.db2.gz XDQVRXUDSRVESM-UHFFFAOYSA-N 0 3 379.353 3.364 10 0 GGAEHN CNS(=O)(=O)CCCN[C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 ZINC000544469349 566966203 /nfs/dbraw/zinc/96/62/03/566966203.db2.gz MYMHBUITQOKHPO-LLVKDONJSA-N 0 3 387.958 3.362 10 0 GGAEHN COC(=O)CCN(CCn1cc(C)cn1)Cc1cccc(Br)c1 ZINC000519765308 566967348 /nfs/dbraw/zinc/96/73/48/566967348.db2.gz DEIUIMZQAFMISO-UHFFFAOYSA-N 0 3 380.286 3.019 10 0 GGAEHN CCO[C@H](CN[C@@H](C)Cn1cc(Br)ccc1=O)c1ccccc1 ZINC000519775094 566967407 /nfs/dbraw/zinc/96/74/07/566967407.db2.gz PQKGFXCTPHITMU-WMLDXEAASA-N 0 3 379.298 3.367 10 0 GGAEHN CCO[C@@H](CN[C@H](C)Cn1cc(Br)ccc1=O)c1ccccc1 ZINC000519775054 566967752 /nfs/dbraw/zinc/96/77/52/566967752.db2.gz PQKGFXCTPHITMU-PBHICJAKSA-N 0 3 379.298 3.367 10 0 GGAEHN CN(CC1CCN(C)CC1)S(=O)(=O)c1cc(Cl)cc(Br)c1 ZINC000656897456 566968800 /nfs/dbraw/zinc/96/88/00/566968800.db2.gz MARVOFZVNHTRDE-UHFFFAOYSA-N 0 3 395.750 3.065 10 0 GGAEHN CN1CCC[C@H](NC(=O)N[C@@H](c2cc(F)cc(Br)c2)C2CC2)C1 ZINC000681317128 566968982 /nfs/dbraw/zinc/96/89/82/566968982.db2.gz JGSPMVQTLDNERN-JKSUJKDBSA-N 0 3 384.293 3.433 10 0 GGAEHN CN1CCC[C@@H](NC(=O)N[C@H](c2cc(F)cc(Br)c2)C2CC2)C1 ZINC000681317121 566969213 /nfs/dbraw/zinc/96/92/13/566969213.db2.gz JGSPMVQTLDNERN-CVEARBPZSA-N 0 3 384.293 3.433 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)NCc1c(Cl)cccc1OC(F)F ZINC000633551145 566969616 /nfs/dbraw/zinc/96/96/16/566969616.db2.gz QSCYLMJJMVGHQL-UHFFFAOYSA-N 0 3 375.847 3.425 10 0 GGAEHN Cc1nc2ccc(CNCCOc3ccc(S(C)(=O)=O)cc3)cc2s1 ZINC000494068481 566969674 /nfs/dbraw/zinc/96/96/74/566969674.db2.gz HUUFIPJHVHBCRP-UHFFFAOYSA-N 0 3 376.503 3.177 10 0 GGAEHN C[C@H]1[C@H](C(F)(F)F)CCN1C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000471676845 566970443 /nfs/dbraw/zinc/97/04/43/566970443.db2.gz NCLRAUUJBPCUIE-UONOGXRCSA-N 0 3 379.492 3.330 10 0 GGAEHN O=C(N[C@@H]1CCCN(CCCO)C1)c1cc(Br)cc2ccccc21 ZINC000452379312 566971669 /nfs/dbraw/zinc/97/16/69/566971669.db2.gz ZVSNXCLCCXEFML-MRXNPFEDSA-N 0 3 391.309 3.179 10 0 GGAEHN Cc1cc(Br)cc2c(C(=O)N[C@@H]3CCCN(CCCO)C3)coc21 ZINC000452387282 566973094 /nfs/dbraw/zinc/97/30/94/566973094.db2.gz ZVCLXPHGAGTRKQ-CQSZACIVSA-N 0 3 395.297 3.080 10 0 GGAEHN O=C(CCCOc1cccc(Cl)c1Cl)NC[C@@H]1CCCCN1CCO ZINC000452387949 566973355 /nfs/dbraw/zinc/97/33/55/566973355.db2.gz INHLNTWFWJBGFL-AWEZNQCLSA-N 0 3 389.323 3.115 10 0 GGAEHN O=C(CCCc1cc(Cl)sc1Cl)NC[C@H]1CCCCN1CCO ZINC000452395684 566975007 /nfs/dbraw/zinc/97/50/07/566975007.db2.gz WZWCVHBYTHYBRM-CYBMUJFWSA-N 0 3 379.353 3.341 10 0 GGAEHN O=C(CCCc1cc(Cl)sc1Cl)NC[C@@H]1CCCCN1CCO ZINC000452395685 566975033 /nfs/dbraw/zinc/97/50/33/566975033.db2.gz WZWCVHBYTHYBRM-ZDUSSCGKSA-N 0 3 379.353 3.341 10 0 GGAEHN CCN(CC(=O)NC1CCN(C2CC2)CC1)Cc1cccc(Br)c1 ZINC000519918135 566979691 /nfs/dbraw/zinc/97/96/91/566979691.db2.gz CYFMMMQEDRPFOT-UHFFFAOYSA-N 0 3 394.357 3.014 10 0 GGAEHN CN1C(=O)C[C@H](NCC[S@@](=O)c2ccccc2)[C@H]1c1ccc(Cl)cc1 ZINC000494271619 566981469 /nfs/dbraw/zinc/98/14/69/566981469.db2.gz RODVAFVKYJFDCO-SXMMONRFSA-N 0 3 376.909 3.009 10 0 GGAEHN CN(C)CCOc1ccccc1C(=O)NCc1cccc(Br)c1 ZINC000519936775 566981378 /nfs/dbraw/zinc/98/13/78/566981378.db2.gz JMGANQFXOZQHED-UHFFFAOYSA-N 0 3 377.282 3.320 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2ccc(F)cc2Br)C[C@@H]1N1CCCC1 ZINC000544689562 566982258 /nfs/dbraw/zinc/98/22/58/566982258.db2.gz BUVSHVWNCPUHKU-LSDHHAIUSA-N 0 3 387.318 3.240 10 0 GGAEHN COC(=O)c1ccccc1CCN(CCO)Cc1cc(Br)cs1 ZINC000494286058 566983116 /nfs/dbraw/zinc/98/31/16/566983116.db2.gz WBRNPQUMYCTWHR-UHFFFAOYSA-N 0 3 398.322 3.334 10 0 GGAEHN O=C(NC[C@H]1CCCCN1CCO)c1ccc2scc(Br)c2c1 ZINC000583794211 566983985 /nfs/dbraw/zinc/98/39/85/566983985.db2.gz QWUCXNRWXNJWPF-CYBMUJFWSA-N 0 3 397.338 3.240 10 0 GGAEHN CN(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)C1CCCCC1 ZINC000520125128 566986181 /nfs/dbraw/zinc/98/61/81/566986181.db2.gz FYBHREJJZJAVAS-UHFFFAOYSA-N 0 3 380.432 3.128 10 0 GGAEHN COc1ccc(CCC(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c(Br)c1 ZINC000612648803 566986174 /nfs/dbraw/zinc/98/61/74/566986174.db2.gz IWWUERDRDNEEML-YJBOKZPZSA-N 0 3 395.341 3.333 10 0 GGAEHN CC(C)Cc1ncc(CN[C@H](C)CCNS(=O)(=O)c2ccccc2)s1 ZINC000583818723 566986817 /nfs/dbraw/zinc/98/68/17/566986817.db2.gz RWSFPYLIVMRRNK-OAHLLOKOSA-N 0 3 381.567 3.188 10 0 GGAEHN C[C@@H](CC(F)(F)F)CS(=O)(=O)NC[C@H]1CCN(Cc2ccccc2)C1 ZINC000656976214 566988003 /nfs/dbraw/zinc/98/80/03/566988003.db2.gz IBPZZGKHDFPXBY-GOEBONIOSA-N 0 3 378.460 3.016 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)c1nc(C2CC2)ncc1Br ZINC000494323155 566988250 /nfs/dbraw/zinc/98/82/50/566988250.db2.gz PJWAYZAUIDVYKJ-VXGBXAGGSA-N 0 3 381.318 3.109 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)c1nc(C2CC2)ncc1Br ZINC000494323153 566989087 /nfs/dbraw/zinc/98/90/87/566989087.db2.gz PJWAYZAUIDVYKJ-RYUDHWBXSA-N 0 3 381.318 3.109 10 0 GGAEHN Cc1nnc([C@H](C)NC(=O)NC[C@H]2CCCN(C)[C@@H]2c2cccs2)s1 ZINC000544761621 566990317 /nfs/dbraw/zinc/99/03/17/566990317.db2.gz BJAUAWRDHSGXJZ-LNSITVRQSA-N 0 3 379.555 3.351 10 0 GGAEHN C[C@H](C(=O)N[C@@H](C)c1ccc(Cl)cc1Cl)N1CCNC[C@@](C)(F)C1 ZINC000583872619 566991512 /nfs/dbraw/zinc/99/15/12/566991512.db2.gz VZKAOLOCJHPVOB-XWCIJXRUSA-N 0 3 376.303 3.193 10 0 GGAEHN CC(C)N(CCN(C)C)C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000612774685 566997320 /nfs/dbraw/zinc/99/73/20/566997320.db2.gz RLJOCTRIUHPJNR-UHFFFAOYSA-N 0 3 382.346 3.462 10 0 GGAEHN Cn1ncc(Br)c1CN1CCCN(CCCc2ccccc2)CC1 ZINC000494430888 567000164 /nfs/dbraw/zinc/00/01/64/567000164.db2.gz BXFBHJBISIBXRW-UHFFFAOYSA-N 0 3 391.357 3.323 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N1CCCC12CCN(C)CC2 ZINC000430275254 567003530 /nfs/dbraw/zinc/00/35/30/567003530.db2.gz AKLNJZRQBLVISD-UHFFFAOYSA-N 0 3 396.329 3.228 10 0 GGAEHN C[C@@H]1CCN(CC(=O)NC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)C1 ZINC000520424717 567004859 /nfs/dbraw/zinc/00/48/59/567004859.db2.gz BIBPTQVAVMRYAS-CQSZACIVSA-N 0 3 384.351 3.416 10 0 GGAEHN CCOC(=O)C1(O)CCN(CC/C=C/c2ccc(Br)cc2)CC1 ZINC000494548181 567007979 /nfs/dbraw/zinc/00/79/79/567007979.db2.gz MONKWSFNXVLNPP-HWKANZROSA-N 0 3 382.298 3.242 10 0 GGAEHN CC[C@@H](Cc1cccc(Br)c1)C(=O)N[C@H]1CNCCC1(F)F ZINC000564798247 567009809 /nfs/dbraw/zinc/00/98/09/567009809.db2.gz QSZUEYCNCUDIQG-JSGCOSHPSA-N 0 3 375.257 3.131 10 0 GGAEHN C[C@@](O)(CN[C@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1)C(F)(F)F ZINC000564850112 567013305 /nfs/dbraw/zinc/01/33/05/567013305.db2.gz QDNJSECIMRXMDR-JOYOIKCWSA-N 0 3 391.743 3.235 10 0 GGAEHN CC(C)Oc1cc(NC(=O)c2ccn(CCN(C)C)n2)ccc1Br ZINC000634057279 567013959 /nfs/dbraw/zinc/01/39/59/567013959.db2.gz IFUJIGNSMSSHFC-UHFFFAOYSA-N 0 3 395.301 3.247 10 0 GGAEHN Cc1sc(C(C)(C)NC(=O)C(C)S(C)(=O)=O)nc1-c1ccccc1F ZINC000452758912 567015174 /nfs/dbraw/zinc/01/51/74/567015174.db2.gz SMFSLHIDZGTQEP-NSHDSACASA-N 0 3 384.498 3.042 10 0 GGAEHN Ic1cnc(CN2CCCC[C@@H](N3CCCC3)C2)s1 ZINC000584140038 567015256 /nfs/dbraw/zinc/01/52/56/567015256.db2.gz OFCOVJPZLLABOS-GFCCVEGCSA-N 0 3 391.322 3.198 10 0 GGAEHN COc1ccc(Br)c(C(=O)Nc2cnn(C3CCN(C)CC3)c2)c1 ZINC000634084444 567016517 /nfs/dbraw/zinc/01/65/17/567016517.db2.gz ROAXTMHJIZEUQL-UHFFFAOYSA-N 0 3 393.285 3.173 10 0 GGAEHN CN1CCC(n2cc(NC(=O)c3ccc(Br)c(F)c3F)cn2)CC1 ZINC000634097722 567016715 /nfs/dbraw/zinc/01/67/15/567016715.db2.gz FXWYVWUMVCYXGM-UHFFFAOYSA-N 0 3 399.239 3.443 10 0 GGAEHN CN1CCC(n2cc(NC(=O)Cc3cccc(Br)c3)cn2)CC1 ZINC000634089955 567016767 /nfs/dbraw/zinc/01/67/67/567016767.db2.gz QAQOGLPIPPPUDN-UHFFFAOYSA-N 0 3 377.286 3.094 10 0 GGAEHN Cc1ccsc1[C@@H](CO)NC[C@H](O)COc1ccccc1C(F)(F)F ZINC000494672992 567016823 /nfs/dbraw/zinc/01/68/23/567016823.db2.gz OMLSKAASMDKYAG-GXTWGEPZSA-N 0 3 375.412 3.138 10 0 GGAEHN CN1CCC(n2cc(NC(=O)c3cc(Br)c(F)cc3F)cn2)CC1 ZINC000634095149 567016929 /nfs/dbraw/zinc/01/69/29/567016929.db2.gz JGRRRJGHZWLWHE-UHFFFAOYSA-N 0 3 399.239 3.443 10 0 GGAEHN O=C(NCC1(c2ccccc2Br)CCC1)N1CCN2CCC1CC2 ZINC000494757043 567020612 /nfs/dbraw/zinc/02/06/12/567020612.db2.gz RUUZNTXQBBSTMU-UHFFFAOYSA-N 0 3 392.341 3.360 10 0 GGAEHN Cc1cc2c(o1)c(C(=O)NC[C@@H]1CCCCN1CCO)ccc2Br ZINC000584213900 567022224 /nfs/dbraw/zinc/02/22/24/567022224.db2.gz SFDPJYNXBRHNFB-ZDUSSCGKSA-N 0 3 395.297 3.080 10 0 GGAEHN Cc1cc(C(=O)N[C@@H]2CNCCC2(F)F)nn1-c1ccc(Cl)cc1Cl ZINC000564953889 567024432 /nfs/dbraw/zinc/02/44/32/567024432.db2.gz HPLQEGIDJHTNFH-CQSZACIVSA-N 0 3 389.233 3.215 10 0 GGAEHN C[C@@H]1CN(C2CC2)C[C@@H]1Nc1ncnc2cccc(I)c21 ZINC000545164836 567024381 /nfs/dbraw/zinc/02/43/81/567024381.db2.gz YSIGKAIFLOHPOP-YGRLFVJLSA-N 0 3 394.260 3.129 10 0 GGAEHN C[C@H]1C[C@@H](Nc2ncnc3cccc(I)c32)CN1C1CC1 ZINC000545163194 567024437 /nfs/dbraw/zinc/02/44/37/567024437.db2.gz AWMRTOJVSVECBC-WDEREUQCSA-N 0 3 394.260 3.272 10 0 GGAEHN Cc1cc(C(=O)N[C@H]2CNCCC2(F)F)nn1-c1ccc(Cl)cc1Cl ZINC000564953884 567024648 /nfs/dbraw/zinc/02/46/48/567024648.db2.gz HPLQEGIDJHTNFH-AWEZNQCLSA-N 0 3 389.233 3.215 10 0 GGAEHN C[C@@H]1C[C@H](N(C)c2ncnc3cccc(I)c32)CCN1C ZINC000545166435 567025776 /nfs/dbraw/zinc/02/57/76/567025776.db2.gz XRDOJBDZYAPUFA-VXGBXAGGSA-N 0 3 396.276 3.153 10 0 GGAEHN CSc1ccccc1C[C@@H](C)NC[C@@H]1CS(=O)(=O)c2ccccc2O1 ZINC000564964517 567026293 /nfs/dbraw/zinc/02/62/93/567026293.db2.gz OFTSTVADWPTCJH-GDBMZVCRSA-N 0 3 377.531 3.164 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000613273975 567026400 /nfs/dbraw/zinc/02/64/00/567026400.db2.gz ZOUDYDYOHMSJLS-CYBMUJFWSA-N 0 3 376.298 3.403 10 0 GGAEHN CSc1ccccc1C[C@H](C)NC[C@@H]1CS(=O)(=O)c2ccccc2O1 ZINC000564964523 567026524 /nfs/dbraw/zinc/02/65/24/567026524.db2.gz OFTSTVADWPTCJH-GOEBONIOSA-N 0 3 377.531 3.164 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1ccc(Br)cc1OC(C)C ZINC000520836938 567026798 /nfs/dbraw/zinc/02/67/98/567026798.db2.gz DSMGPOBWVPSXEK-OAHLLOKOSA-N 0 3 399.329 3.077 10 0 GGAEHN CN(Cc1nccs1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472450984 567027200 /nfs/dbraw/zinc/02/72/00/567027200.db2.gz VBPWTCPNOGBDCV-UHFFFAOYSA-N 0 3 376.448 3.090 10 0 GGAEHN O=C(NC[C@H]1NCCc2ccccc21)[C@@H]1CCc2cc(Br)ccc21 ZINC000564994165 567028293 /nfs/dbraw/zinc/02/82/93/567028293.db2.gz OHNQCEHVGPQTKS-RTBURBONSA-N 0 3 385.305 3.482 10 0 GGAEHN C[C@H](c1ccccc1)N1CC[C@H](Nc2ncc(I)cn2)C1 ZINC000545208467 567029096 /nfs/dbraw/zinc/02/90/96/567029096.db2.gz VNHHGBRZEAUIHT-DOMZBBRYSA-N 0 3 394.260 3.329 10 0 GGAEHN C[C@H](N[C@@H]1CCCC(F)(F)C1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430695308 567029150 /nfs/dbraw/zinc/02/91/50/567029150.db2.gz MTYZOTSJLKRKDO-GXSJLCMTSA-N 0 3 397.285 3.325 10 0 GGAEHN CN1CC[C@@H]2[C@H](CCCN2C(=O)[C@H]2CCc3cc(Br)ccc32)C1 ZINC000564998477 567029479 /nfs/dbraw/zinc/02/94/79/567029479.db2.gz NOOYHUYRCCJGJQ-FHLIZLRMSA-N 0 3 377.326 3.422 10 0 GGAEHN CCO[C@@H]1C[C@](N)(C(=O)NCc2c(Cl)cccc2OC(F)F)C1(C)C ZINC000634298989 567029635 /nfs/dbraw/zinc/02/96/35/567029635.db2.gz DPAKKFNNJSXKCG-DYVFJYSZSA-N 0 3 376.831 3.090 10 0 GGAEHN CCN(CC)[C@H](CNc1cc(Br)cnc1C(N)=O)c1ccco1 ZINC000472491267 567029924 /nfs/dbraw/zinc/02/99/24/567029924.db2.gz ANAWYXPXBCAOSN-CYBMUJFWSA-N 0 3 381.274 3.031 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N1CCc2ccccc2[C@@H]1CN ZINC000565001070 567029998 /nfs/dbraw/zinc/02/99/98/567029998.db2.gz KUPZOGASRLTUIT-KRWDZBQOSA-N 0 3 389.293 3.085 10 0 GGAEHN CCN(CC)[C@@H](CNc1cc(Br)cnc1C(N)=O)c1ccco1 ZINC000472491278 567030025 /nfs/dbraw/zinc/03/00/25/567030025.db2.gz ANAWYXPXBCAOSN-ZDUSSCGKSA-N 0 3 381.274 3.031 10 0 GGAEHN CCN(CC)[C@H](CNc1cc(Br)cnc1C(N)=O)c1ccsc1 ZINC000472494250 567030163 /nfs/dbraw/zinc/03/01/63/567030163.db2.gz FHJNANMLUJZLHX-CQSZACIVSA-N 0 3 397.342 3.500 10 0 GGAEHN C[C@H]1CN(CCCNC(=O)[C@H]2CCc3cc(Br)ccc32)CCCO1 ZINC000565022553 567030802 /nfs/dbraw/zinc/03/08/02/567030802.db2.gz GHFRYJIINJEKAE-KSSFIOAISA-N 0 3 395.341 3.096 10 0 GGAEHN C[C@@H]1CN(CCCNC(=O)[C@H]2CCc3cc(Br)ccc32)CCCO1 ZINC000565022552 567030876 /nfs/dbraw/zinc/03/08/76/567030876.db2.gz GHFRYJIINJEKAE-KDOFPFPSSA-N 0 3 395.341 3.096 10 0 GGAEHN CN(C(=O)NCc1cc2cc(Br)ccc2[nH]1)[C@H]1CCN(C2CC2)C1 ZINC000545242082 567032715 /nfs/dbraw/zinc/03/27/15/567032715.db2.gz TZZHOQCVQFCZGU-INIZCTEOSA-N 0 3 391.313 3.309 10 0 GGAEHN C[NH+](C)C1(CNC(=O)Cc2ccc(Br)cc2[O-])CCCCCC1 ZINC000430877631 567037423 /nfs/dbraw/zinc/03/74/23/567037423.db2.gz ZWEAPYTUQYGGKA-UHFFFAOYSA-N 0 3 383.330 3.468 10 0 GGAEHN C[C@]1(F)CNCCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000521045584 567037467 /nfs/dbraw/zinc/03/74/67/567037467.db2.gz XJBCXYGIVARNRK-KRWDZBQOSA-N 0 3 379.277 3.040 10 0 GGAEHN Cc1ccc(CN2CC[C@H](CN(C)C(=O)c3nc(C)ncc3Cl)C2)s1 ZINC000565091678 567037763 /nfs/dbraw/zinc/03/77/63/567037763.db2.gz BUYJHTMTBHYWDP-CQSZACIVSA-N 0 3 378.929 3.402 10 0 GGAEHN CCCN1CCC(CNS(=O)(=O)c2ccc(Br)cc2C)CC1 ZINC000472584862 567038977 /nfs/dbraw/zinc/03/89/77/567038977.db2.gz XWLVPXVZLRRDBU-UHFFFAOYSA-N 0 3 389.359 3.158 10 0 GGAEHN O=C1N[C@]2(CCN(Cc3ccccc3)C2)C(=O)N1Cc1ccsc1Cl ZINC000657256525 567041258 /nfs/dbraw/zinc/04/12/58/567041258.db2.gz FTBHSQGATNAMBG-SFHVURJKSA-N 0 3 375.881 3.098 10 0 GGAEHN CC(C)(C)OC(=O)[C@@H]1CCN(C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000495056775 567041969 /nfs/dbraw/zinc/04/19/69/567041969.db2.gz DRCYRKRMRQIQMD-TZMCWYRMSA-N 0 3 390.307 3.397 10 0 GGAEHN CC(C)(C)N1CCCN(C(=O)c2n[nH]c3ccc(Br)cc32)CC1 ZINC000521115729 567042344 /nfs/dbraw/zinc/04/23/44/567042344.db2.gz BNBOFUYVDAHVTP-UHFFFAOYSA-N 0 3 379.302 3.272 10 0 GGAEHN CC(C)(C)OC(=O)[C@H]1CCN(C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000495056773 567042722 /nfs/dbraw/zinc/04/27/22/567042722.db2.gz DRCYRKRMRQIQMD-JSGCOSHPSA-N 0 3 390.307 3.397 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000682458438 567045717 /nfs/dbraw/zinc/04/57/17/567045717.db2.gz XGBLWTUOMUCOAL-SWLSCSKDSA-N 0 3 396.329 3.302 10 0 GGAEHN Cc1cc(C(=O)NC[C@H](C)N(C)C2CC2)nn1-c1ccc(Br)cc1 ZINC000431026741 567047467 /nfs/dbraw/zinc/04/74/67/567047467.db2.gz XUZILVUWUPUNHN-ZDUSSCGKSA-N 0 3 391.313 3.156 10 0 GGAEHN O=S1(=O)CC(CCNCc2ccc(-c3ccc(Br)cc3)o2)C1 ZINC000682475027 567048006 /nfs/dbraw/zinc/04/80/06/567048006.db2.gz WPHFTWZMRXPZJW-UHFFFAOYSA-N 0 3 384.295 3.233 10 0 GGAEHN CN(CCN(C)C1CC1)C(=O)c1c(F)c(F)c(Br)c(F)c1F ZINC000613601591 567048717 /nfs/dbraw/zinc/04/87/17/567048717.db2.gz RSVNLWHCOFVFKB-UHFFFAOYSA-N 0 3 383.183 3.172 10 0 GGAEHN CN(C)CCOc1ccc(CCNCc2c(F)cncc2Br)cc1 ZINC000657351221 567050140 /nfs/dbraw/zinc/05/01/40/567050140.db2.gz MQRZMUJPAGTBDE-UHFFFAOYSA-N 0 3 396.304 3.256 10 0 GGAEHN CC[C@@H](c1ccc(Br)cc1)N1CCC[C@@H](C(=O)N2CCOCC2)C1 ZINC000472774959 567051426 /nfs/dbraw/zinc/05/14/26/567051426.db2.gz UUAXJJKZNYPUJG-AEFFLSMTSA-N 0 3 395.341 3.471 10 0 GGAEHN CN(CCNC(=O)c1[nH]nc2ccc(Br)cc21)Cc1ccccc1 ZINC000521358004 567055796 /nfs/dbraw/zinc/05/57/96/567055796.db2.gz HYLIQYXJZGNPJS-UHFFFAOYSA-N 0 3 387.281 3.187 10 0 GGAEHN Cn1ncc(C2CCC2)c1CNC[C@@H](CO)Cc1cccc(Br)c1 ZINC000657447499 567056984 /nfs/dbraw/zinc/05/69/84/567056984.db2.gz CRFZISPFBKYDAG-HNNXBMFYSA-N 0 3 392.341 3.391 10 0 GGAEHN O=C(Nc1cc(Cl)ccc1N1CCSCC1)N[C@H]1CNCCC1(F)F ZINC000521406172 567057597 /nfs/dbraw/zinc/05/75/97/567057597.db2.gz PJWRZRMSCIHEEB-AWEZNQCLSA-N 0 3 390.887 3.012 10 0 GGAEHN CN(C)CCOc1ccc(NC(=O)c2cccc([S@](C)=O)c2)cc1Cl ZINC000613775653 567060153 /nfs/dbraw/zinc/06/01/53/567060153.db2.gz CHWHTWRQPOHIME-VWLOTQADSA-N 0 3 380.897 3.270 10 0 GGAEHN COc1ccc(CCNCc2c(C(F)(F)F)cnn2C)c(Cl)c1OC ZINC000657473521 567060474 /nfs/dbraw/zinc/06/04/74/567060474.db2.gz MBAPXJSQYROLFQ-UHFFFAOYSA-N 0 3 377.794 3.442 10 0 GGAEHN CS[C@H]1CN(C(=O)CSc2cccc(C(F)(F)F)c2)C[C@H]1N(C)C ZINC000495566651 567062942 /nfs/dbraw/zinc/06/29/42/567062942.db2.gz XUVDJYIGRHIVRS-KGLIPLIRSA-N 0 3 378.485 3.302 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNCc1ccc(Br)cc1N1CCOCC1 ZINC000657527641 567065618 /nfs/dbraw/zinc/06/56/18/567065618.db2.gz WYQNAEMLVDBUJO-QGZVFWFLSA-N 0 3 396.373 3.248 10 0 GGAEHN COc1ccc(CNCc2ccc(CNC(C)=O)cc2)cc1Br ZINC000657541675 567066883 /nfs/dbraw/zinc/06/68/83/567066883.db2.gz RHVJIQYKBUTZOV-UHFFFAOYSA-N 0 3 377.282 3.384 10 0 GGAEHN CCSCC[NH2+]Cc1cccc([N-]S(=O)(=O)c2ccc(OC)cc2)c1 ZINC000545623451 567066936 /nfs/dbraw/zinc/06/69/36/567066936.db2.gz BFUHFTVEBVKMSR-UHFFFAOYSA-N 0 3 380.535 3.339 10 0 GGAEHN C[C@@H](NCCCC1CCOCC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000453241180 567067100 /nfs/dbraw/zinc/06/71/00/567067100.db2.gz VQYJKWXILWCSRM-LLVKDONJSA-N 0 3 395.352 3.498 10 0 GGAEHN CO[C@@H](CNCc1cc(Br)cc(Br)c1)[C@H]1CCOC1 ZINC000657542206 567067284 /nfs/dbraw/zinc/06/72/84/567067284.db2.gz OVJGUBWLUZXKRX-FZMZJTMJSA-N 0 3 393.119 3.353 10 0 GGAEHN CO[C@H](CNCc1cn(-c2ccccc2Br)nc1C)[C@H]1CCOC1 ZINC000657542319 567067335 /nfs/dbraw/zinc/06/73/35/567067335.db2.gz XFDRZYICLAIPTM-KBXCAEBGSA-N 0 3 394.313 3.084 10 0 GGAEHN C[C@H]1CCN(CC(=O)N2CCO[C@@H](c3cc(F)c(Cl)cc3Cl)C2)C1 ZINC000565439113 567067516 /nfs/dbraw/zinc/06/75/16/567067516.db2.gz CYZNRDJHJVNSIN-MEDUHNTESA-N 0 3 375.271 3.374 10 0 GGAEHN OCCCN1CCC[C@@H](N[C@H]2CCCOc3ccc(Br)cc32)C1 ZINC000453253253 567067441 /nfs/dbraw/zinc/06/74/41/567067441.db2.gz CTILENJEASAARE-WBVHZDCISA-N 0 3 383.330 3.099 10 0 GGAEHN CO[C@H](CNCc1ccc(Br)c(Br)c1)[C@H]1CCOC1 ZINC000657546020 567068589 /nfs/dbraw/zinc/06/85/89/567068589.db2.gz VBSIHMXIIPLQJA-SMDDNHRTSA-N 0 3 393.119 3.353 10 0 GGAEHN COC[C@H](CCNCc1cn(-c2ccc(Br)cc2)nc1C)OC ZINC000657555398 567068613 /nfs/dbraw/zinc/06/86/13/567068613.db2.gz UTJUONHNXCCMDQ-KRWDZBQOSA-N 0 3 382.302 3.084 10 0 GGAEHN COCC[C@@H](COC)N[C@@H](C)c1ccc(F)c(I)c1 ZINC000453257601 567069539 /nfs/dbraw/zinc/06/95/39/567069539.db2.gz SHYWVKQWTWWCMO-JQWIXIFHSA-N 0 3 381.229 3.132 10 0 GGAEHN COC[C@H](NCc1nc(-c2ccc(Br)cc2)c[nH]1)C1CCOCC1 ZINC000657565125 567070455 /nfs/dbraw/zinc/07/04/55/567070455.db2.gz HDQCFRYBJKVZOY-KRWDZBQOSA-N 0 3 394.313 3.370 10 0 GGAEHN COC[C@H](NCC1=Cc2cc(Br)ccc2OC1)C1CCOCC1 ZINC000657565726 567070723 /nfs/dbraw/zinc/07/07/23/567070723.db2.gz UHIHAHAEEISHKY-KRWDZBQOSA-N 0 3 382.298 3.256 10 0 GGAEHN CO[C@@H]1CCC[C@H]([C@H](CO)NCc2cnc3c(C)cc(Br)cn23)C1 ZINC000657577077 567073213 /nfs/dbraw/zinc/07/32/13/567073213.db2.gz OKXCFHTUWLRGGA-XKQJLSEDSA-N 0 3 396.329 3.061 10 0 GGAEHN O[C@@H]1CCN(Cc2ccc(CNCc3cc(Br)ccc3F)cc2)C1 ZINC000657593535 567074389 /nfs/dbraw/zinc/07/43/89/567074389.db2.gz AHRIEGAWPUCGCY-GOSISDBHSA-N 0 3 393.300 3.445 10 0 GGAEHN O[C@H]1CCN(Cc2ccc(CNCc3cc(F)ccc3Br)cc2)C1 ZINC000657598251 567074715 /nfs/dbraw/zinc/07/47/15/567074715.db2.gz ZMRZGRYSBHILON-SFHVURJKSA-N 0 3 393.300 3.445 10 0 GGAEHN C[C@@H](NCC1(CF)CCOCC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000453306868 567074911 /nfs/dbraw/zinc/07/49/11/567074911.db2.gz JSOQIMILTZPJCO-SNVBAGLBSA-N 0 3 399.315 3.058 10 0 GGAEHN O[C@H]1CCN(Cc2ccc(CNCc3cc(Br)ccc3F)cc2)C1 ZINC000657593539 567074997 /nfs/dbraw/zinc/07/49/97/567074997.db2.gz AHRIEGAWPUCGCY-SFHVURJKSA-N 0 3 393.300 3.445 10 0 GGAEHN O[C@H]1CCN(Cc2ccc(CNCc3cc(F)cc(Br)c3)cc2)C1 ZINC000657595115 567075095 /nfs/dbraw/zinc/07/50/95/567075095.db2.gz FKTXHMXZOWLXGE-IBGZPJMESA-N 0 3 393.300 3.445 10 0 GGAEHN O[C@@H]1CCN(Cc2ccc(CNCc3ccc(Br)cc3F)cc2)C1 ZINC000657593993 567075470 /nfs/dbraw/zinc/07/54/70/567075470.db2.gz GAUSMLYKXUNWBW-GOSISDBHSA-N 0 3 393.300 3.445 10 0 GGAEHN O=C(CCN[C@H]1CCOc2ccc(Br)cc21)Nc1cccnc1 ZINC000682845968 567075611 /nfs/dbraw/zinc/07/56/11/567075611.db2.gz SWXBFHSTPBCUBR-HNNXBMFYSA-N 0 3 376.254 3.286 10 0 GGAEHN O[C@@H]1CCN(Cc2ccc(CNCc3c(F)cccc3Br)cc2)C1 ZINC000657596014 567075620 /nfs/dbraw/zinc/07/56/20/567075620.db2.gz KXBBCTSBQUUZEB-MRXNPFEDSA-N 0 3 393.300 3.445 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CNCCO[C@H]1CC1(F)F ZINC000657619024 567077072 /nfs/dbraw/zinc/07/70/72/567077072.db2.gz KCIUCRSMPOIRNQ-HNNXBMFYSA-N 0 3 386.240 3.457 10 0 GGAEHN CCOc1c(Br)cc(CNCCO[C@H]2CC2(F)F)cc1OC ZINC000657618454 567077330 /nfs/dbraw/zinc/07/73/30/567077330.db2.gz UJQKHNYJQWXENU-ZDUSSCGKSA-N 0 3 380.229 3.370 10 0 GGAEHN C[C@H]1CC[C@@H](NCc2ccnc3c(Br)cccc23)CS1(=O)=O ZINC000657637459 567078760 /nfs/dbraw/zinc/07/87/60/567078760.db2.gz IVHAATIKNYVWEF-WCQYABFASA-N 0 3 383.311 3.053 10 0 GGAEHN C[C@H]1CC[C@@H](NCc2ccc(Br)c3cccnc23)CS1(=O)=O ZINC000657636146 567079248 /nfs/dbraw/zinc/07/92/48/567079248.db2.gz DPWJADAQOKFLIW-WCQYABFASA-N 0 3 383.311 3.053 10 0 GGAEHN Cc1ccc(C(=O)N(CCN(C)C)C[C@H]2CCCO2)c(C)c1Br ZINC000682893025 567079692 /nfs/dbraw/zinc/07/96/92/567079692.db2.gz XSSVBTQZBVYHMU-OAHLLOKOSA-N 0 3 383.330 3.249 10 0 GGAEHN O[C@@H]1CCC[C@H]1CN[C@@H]1CCCOc2ccc(I)cc21 ZINC000453359447 567080073 /nfs/dbraw/zinc/08/00/73/567080073.db2.gz AITOXCJFDISERM-NILFDRSVSA-N 0 3 387.261 3.256 10 0 GGAEHN CN(C)C[C@@]1(O)CCCN(C(=O)c2cc(Br)cc3ccccc32)C1 ZINC000614068442 567080307 /nfs/dbraw/zinc/08/03/07/567080307.db2.gz NFENAEZSBBWKDI-IBGZPJMESA-N 0 3 391.309 3.131 10 0 GGAEHN CS(=O)(=O)C1(CNCc2cccc(OCC(F)(F)F)c2)CCCCC1 ZINC000657652679 567080276 /nfs/dbraw/zinc/08/02/76/567080276.db2.gz DCKPKAQLWNLGEK-UHFFFAOYSA-N 0 3 379.444 3.465 10 0 GGAEHN Cc1cc2c(o1)c(C(=O)N1CCC[C@](O)(CN(C)C)C1)ccc2Br ZINC000614065124 567080859 /nfs/dbraw/zinc/08/08/59/567080859.db2.gz KYXJTEOLHNMMMW-SFHVURJKSA-N 0 3 395.297 3.032 10 0 GGAEHN CNC(=O)[C@H](C)Oc1ccc(Br)cc1CNC[C@@]1(C)CC1(F)F ZINC000657665470 567082455 /nfs/dbraw/zinc/08/24/55/567082455.db2.gz MKRVLIRUSBDALR-ZUZCIYMTSA-N 0 3 391.256 3.097 10 0 GGAEHN CNC(=O)[C@H](C)Oc1ccc(Br)cc1CNC[C@@H]1CCC[C@@H](C)O1 ZINC000657670296 567082509 /nfs/dbraw/zinc/08/25/09/567082509.db2.gz SQCUNHUPZSEYBB-WWGRRREGSA-N 0 3 399.329 3.010 10 0 GGAEHN C[C@H]1CCC[C@H](CNCc2ccc(Br)cc2N2CCOCC2)O1 ZINC000657662523 567082604 /nfs/dbraw/zinc/08/26/04/567082604.db2.gz ADKHWLABOZQNNC-WMLDXEAASA-N 0 3 383.330 3.333 10 0 GGAEHN CN(C)c1ncc(CNCC2(Cc3ccc(Br)cc3)CC2)cn1 ZINC000657660613 567082873 /nfs/dbraw/zinc/08/28/73/567082873.db2.gz PGQAYLGRTMJWEU-UHFFFAOYSA-N 0 3 375.314 3.418 10 0 GGAEHN Cn1cc(C[C@@H]2CCC[C@@H]2NCc2cn3ccc(Br)cc3n2)cn1 ZINC000657685961 567083986 /nfs/dbraw/zinc/08/39/86/567083986.db2.gz BIHURFHZSFYPSB-YOEHRIQHSA-N 0 3 388.313 3.331 10 0 GGAEHN OC(CNCc1nc(-c2ccc(Br)cc2)c[nH]1)(C1CC1)C1CC1 ZINC000657697404 567085700 /nfs/dbraw/zinc/08/57/00/567085700.db2.gz ATSQDHIOOHEPEV-UHFFFAOYSA-N 0 3 376.298 3.480 10 0 GGAEHN Cn1cc(C[C@H]2CCC[C@@H]2NCc2cc3c(cc2Br)OCO3)cn1 ZINC000657689902 567086477 /nfs/dbraw/zinc/08/64/77/567086477.db2.gz ZMURWBGBEZWDNX-CJNGLKHVSA-N 0 3 392.297 3.412 10 0 GGAEHN CCOCCOc1ccc(Br)cc1CN[C@H]1C[C@H](O)C12CCC2 ZINC000657702846 567086629 /nfs/dbraw/zinc/08/66/29/567086629.db2.gz JRSGVOPQJNKWBI-IRXDYDNUSA-N 0 3 384.314 3.258 10 0 GGAEHN CC(C)N1CCCN(c2nnc(-c3ccccc3Br)n2C)CC1 ZINC000453412684 567086739 /nfs/dbraw/zinc/08/67/39/567086739.db2.gz BQKKCLAJQJOSSP-UHFFFAOYSA-N 0 3 378.318 3.165 10 0 GGAEHN O=C1CC[C@@H](CNCc2ccc(OCc3ccccc3)c(Br)c2)N1 ZINC000657708853 567087536 /nfs/dbraw/zinc/08/75/36/567087536.db2.gz BDYOHMZRZSVNDP-INIZCTEOSA-N 0 3 389.293 3.396 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CNCCc1cncc(C)n1 ZINC000657713446 567087987 /nfs/dbraw/zinc/08/79/87/567087987.db2.gz SEVGFFSEKNWUFQ-UHFFFAOYSA-N 0 3 386.297 3.374 10 0 GGAEHN CCOCCOc1ccc(Br)cc1CNCCc1cncc(C)n1 ZINC000657712392 567088132 /nfs/dbraw/zinc/08/81/32/567088132.db2.gz RGHZLDZBNGVBSP-UHFFFAOYSA-N 0 3 394.313 3.295 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN[C@H]1C[C@@H](O)C12CCC2 ZINC000657705330 567088379 /nfs/dbraw/zinc/08/83/79/567088379.db2.gz KEIHTGUPXOJPKW-DLBZAZTESA-N 0 3 376.298 3.336 10 0 GGAEHN CCCOc1c(Br)cc(CNC[C@@H]2CCC(=O)N2)cc1OCC ZINC000657708975 567088447 /nfs/dbraw/zinc/08/84/47/567088447.db2.gz DGKFJSNACBEGJX-ZDUSSCGKSA-N 0 3 385.302 3.005 10 0 GGAEHN CCOC(=O)CCN(Cc1nc2ccc(Br)cc2[nH]1)CC1CC1 ZINC000614163342 567089423 /nfs/dbraw/zinc/08/94/23/567089423.db2.gz ZOLMYDAANSZDQO-UHFFFAOYSA-N 0 3 380.286 3.491 10 0 GGAEHN COc1cc(Br)ccc1CN[C@@H]1C[C@@H](N2CCOCC2)C12CCC2 ZINC000657746938 567091148 /nfs/dbraw/zinc/09/11/48/567091148.db2.gz JWEXVIQYLSZBRI-QZTJIDSGSA-N 0 3 395.341 3.191 10 0 GGAEHN Fc1ccc(Br)c(CN[C@@H]2C[C@@H](N3CCOCC3)C23CCC3)c1 ZINC000657748375 567092501 /nfs/dbraw/zinc/09/25/01/567092501.db2.gz YIYNMHSUYVKHSW-IAGOWNOFSA-N 0 3 383.305 3.321 10 0 GGAEHN Fc1cc(Br)ccc1CN[C@@H]1C[C@@H](N2CCOCC2)C12CCC2 ZINC000657747533 567092638 /nfs/dbraw/zinc/09/26/38/567092638.db2.gz KJWKEKGDTUWDAR-IAGOWNOFSA-N 0 3 383.305 3.321 10 0 GGAEHN Fc1ccc(CN[C@@H]2C[C@@H](N3CCOCC3)C23CCC3)cc1Br ZINC000657748896 567093443 /nfs/dbraw/zinc/09/34/43/567093443.db2.gz ZJAYJWVSNDFMKT-IAGOWNOFSA-N 0 3 383.305 3.321 10 0 GGAEHN COCCN(C)CCCNC(=O)c1coc2c1cc(Br)cc2C ZINC000473631276 567093565 /nfs/dbraw/zinc/09/35/65/567093565.db2.gz RWVMIJPYRLXDTK-UHFFFAOYSA-N 0 3 383.286 3.202 10 0 GGAEHN OC1(CNCc2cc3c(c(Br)c2)OCO3)CCC(F)(F)CC1 ZINC000657777373 567094211 /nfs/dbraw/zinc/09/42/11/567094211.db2.gz ZGEFNLLJUCZZPO-UHFFFAOYSA-N 0 3 378.213 3.208 10 0 GGAEHN CCS(=O)(=O)C1(CNCc2ccc(Br)c3cccnc23)CC1 ZINC000657759759 567094660 /nfs/dbraw/zinc/09/46/60/567094660.db2.gz WSQSYYBJNICLQL-UHFFFAOYSA-N 0 3 383.311 3.054 10 0 GGAEHN Cc1cc(Br)cn2c(CNC3(CO)Cc4ccccc4C3)cnc12 ZINC000522030619 567095540 /nfs/dbraw/zinc/09/55/40/567095540.db2.gz MJPYCCUDFUARCA-UHFFFAOYSA-N 0 3 386.293 3.025 10 0 GGAEHN NC(=O)CC1(CNCc2cn3ccc(Br)cc3n2)CCCCC1 ZINC000657797063 567096128 /nfs/dbraw/zinc/09/61/28/567096128.db2.gz CJFSNTYKSUHKTG-UHFFFAOYSA-N 0 3 379.302 3.012 10 0 GGAEHN Cc1nc2ccc(S(=O)(=O)NC3CCN(C4CCCC4)CC3)cc2s1 ZINC000565751527 567096259 /nfs/dbraw/zinc/09/62/59/567096259.db2.gz XTBFPGNYXFZZFK-UHFFFAOYSA-N 0 3 379.551 3.290 10 0 GGAEHN O=C(Cc1csc2ccc(Br)cc12)NCCNc1ccncc1 ZINC000473676682 567096596 /nfs/dbraw/zinc/09/65/96/567096596.db2.gz OYEUTQFACRCBKU-UHFFFAOYSA-N 0 3 390.306 3.252 10 0 GGAEHN C[C@@H](NC1CCN(Cc2ccccc2Br)CC1)c1nccn1C ZINC000657794746 567096790 /nfs/dbraw/zinc/09/67/90/567096790.db2.gz VSDUUGWWYZVONU-CQSZACIVSA-N 0 3 377.330 3.498 10 0 GGAEHN COc1cc(Br)c(CNCC2(CC(N)=O)CCCCC2)cc1OC ZINC000657796739 567097223 /nfs/dbraw/zinc/09/72/23/567097223.db2.gz FMWTZBFLZXLLSC-UHFFFAOYSA-N 0 3 399.329 3.382 10 0 GGAEHN O=C(Cc1ccncc1Cl)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000614249177 567098231 /nfs/dbraw/zinc/09/82/31/567098231.db2.gz ZVEZWNQTONIRQR-UHFFFAOYSA-N 0 3 375.822 3.199 10 0 GGAEHN CC[C@@H]1CN(C)CCCN1C(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000614332949 567103587 /nfs/dbraw/zinc/10/35/87/567103587.db2.gz WSRDEDRDYTZYKS-HUUCEWRRSA-N 0 3 381.314 3.258 10 0 GGAEHN OC[C@@H](CNCc1cn2cccc(F)c2n1)Cc1cccc(Br)c1 ZINC000683206445 567105446 /nfs/dbraw/zinc/10/54/46/567105446.db2.gz QXAHVAGOFNVLMT-CQSZACIVSA-N 0 3 392.272 3.177 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)C2(c3ccccc3Br)CC2)CCSC1 ZINC000473860583 567109908 /nfs/dbraw/zinc/10/99/08/567109908.db2.gz SVSCCLFGJXFEJY-MRXNPFEDSA-N 0 3 383.355 3.034 10 0 GGAEHN CN(CCN(C)C1CC1)C(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000473902920 567112342 /nfs/dbraw/zinc/11/23/42/567112342.db2.gz DNOZNCUMLRRMSR-OAHLLOKOSA-N 0 3 382.302 3.008 10 0 GGAEHN Cc1cc(Br)cc(C)c1S(=O)(=O)N(C)C[C@H]1CCCN(C)C1 ZINC000522373134 567113806 /nfs/dbraw/zinc/11/38/06/567113806.db2.gz JYPIYEDMDADBMU-AWEZNQCLSA-N 0 3 389.359 3.028 10 0 GGAEHN O=S(=O)([N-]CC[NH2+][C@@H]1CCCSCC1)c1cccc(Cl)c1Cl ZINC000658009204 567114005 /nfs/dbraw/zinc/11/40/05/567114005.db2.gz CPDMUZGCSXCNQF-LLVKDONJSA-N 0 3 383.366 3.147 10 0 GGAEHN CS[C@H]1CN(C(=O)Nc2cccc(OCC(F)(F)F)c2)C[C@H]1N(C)C ZINC000497655148 567114593 /nfs/dbraw/zinc/11/45/93/567114593.db2.gz BMSJHFRGBXKXER-KGLIPLIRSA-N 0 3 377.432 3.137 10 0 GGAEHN Cc1c(C(=O)NC[C@@H](CN(C)C)c2ccc(Cl)cc2)sc2nccn12 ZINC000565976479 567116424 /nfs/dbraw/zinc/11/64/24/567116424.db2.gz KGVODFAWQAMHPT-AWEZNQCLSA-N 0 3 376.913 3.433 10 0 GGAEHN CC[C@@H](Cc1ccc(Cl)cc1)NC[C@@H]1CS(=O)(=O)c2ccccc2O1 ZINC000658046184 567117035 /nfs/dbraw/zinc/11/70/35/567117035.db2.gz PBXQWQBXUMZCON-DLBZAZTESA-N 0 3 379.909 3.486 10 0 GGAEHN CN1CC[C@H]2[C@@H](CCCN2C(=O)NCCc2ccccc2Br)C1 ZINC000497691510 567118218 /nfs/dbraw/zinc/11/82/18/567118218.db2.gz PCXNEUXEVVACGP-RDJZCZTQSA-N 0 3 380.330 3.117 10 0 GGAEHN C[C@H](CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccccn1 ZINC000658061308 567118431 /nfs/dbraw/zinc/11/84/31/567118431.db2.gz APCAVXZAIOJOPW-WBMJQRKESA-N 0 3 395.322 3.456 10 0 GGAEHN COc1cc(OC)c([C@@H](C)NCCC2(CS(C)(=O)=O)CC2)cc1Cl ZINC000658075974 567120296 /nfs/dbraw/zinc/12/02/96/567120296.db2.gz DIQGBTSBEABSHD-GFCCVEGCSA-N 0 3 375.918 3.223 10 0 GGAEHN COc1cc([C@H](C)NCCNC(=O)c2ccc(Br)cn2)ccc1F ZINC000658091895 567120531 /nfs/dbraw/zinc/12/05/31/567120531.db2.gz IXGXBIDXRQBDBV-NSHDSACASA-N 0 3 396.260 3.072 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1ccn(-c2ccc(Br)cc2)n1 ZINC000431995730 567120869 /nfs/dbraw/zinc/12/08/69/567120869.db2.gz OKTOITOHRQYSKX-AWEZNQCLSA-N 0 3 391.313 3.239 10 0 GGAEHN Cc1cc(Br)ccc1CN(C)C(=O)Nc1cnn(CCN(C)C)c1 ZINC000683407224 567121066 /nfs/dbraw/zinc/12/10/66/567121066.db2.gz KLAQKVNDCUJRRD-UHFFFAOYSA-N 0 3 394.317 3.180 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1ccn(-c2ccc(Br)cc2)n1 ZINC000431995731 567121194 /nfs/dbraw/zinc/12/11/94/567121194.db2.gz OKTOITOHRQYSKX-CQSZACIVSA-N 0 3 391.313 3.239 10 0 GGAEHN COC(=O)CC1CCN(C[C@@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000497732814 567121099 /nfs/dbraw/zinc/12/10/99/567121099.db2.gz RFCVMMGVYJBHEN-CYBMUJFWSA-N 0 3 376.280 3.008 10 0 GGAEHN C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)Cc1ccc(Br)cc1[O-] ZINC000431992775 567121588 /nfs/dbraw/zinc/12/15/88/567121588.db2.gz GQPDDKDXUHXQHA-CQSZACIVSA-N 0 3 383.330 3.468 10 0 GGAEHN C[C@@H]1CCCC[N@H+]1CCCCNC(=O)Cc1ccc(Br)cc1[O-] ZINC000431992775 567121591 /nfs/dbraw/zinc/12/15/91/567121591.db2.gz GQPDDKDXUHXQHA-CQSZACIVSA-N 0 3 383.330 3.468 10 0 GGAEHN CC1(C)CC[C@@H](CNCc2ccc(Br)cc2N2CCOCC2)O1 ZINC000473996593 567123766 /nfs/dbraw/zinc/12/37/66/567123766.db2.gz QIKHPCHPMFCBMS-INIZCTEOSA-N 0 3 383.330 3.333 10 0 GGAEHN C[C@H](NCc1ccc(CN2CC[C@H](O)C2)cc1)c1cncc(Br)c1 ZINC000658140622 567123881 /nfs/dbraw/zinc/12/38/81/567123881.db2.gz VNODHFDKAYLBER-LIRRHRJNSA-N 0 3 390.325 3.262 10 0 GGAEHN C[C@H](NCc1ccc(CN2CC[C@H](O)C2)cc1)c1ccc(Br)cn1 ZINC000658141087 567124065 /nfs/dbraw/zinc/12/40/65/567124065.db2.gz WEWNCWNWZSWAHK-KSSFIOAISA-N 0 3 390.325 3.262 10 0 GGAEHN CN(C)CCn1cc(NC(=O)c2cc(Cl)cc(Br)c2F)cn1 ZINC000683443387 567124033 /nfs/dbraw/zinc/12/40/33/567124033.db2.gz ZICOZRACDNBTGD-UHFFFAOYSA-N 0 3 389.656 3.252 10 0 GGAEHN CC[C@@H]1C[C@@H](N[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)CCO1 ZINC000566082970 567124184 /nfs/dbraw/zinc/12/41/84/567124184.db2.gz MGSQNHGUCOHMKY-GUTXKFCHSA-N 0 3 388.327 3.215 10 0 GGAEHN C[C@H](NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1ncc(Br)s1 ZINC000658136794 567124594 /nfs/dbraw/zinc/12/45/94/567124594.db2.gz IIUNHDLYOPEBOF-SWLSCSKDSA-N 0 3 396.354 3.323 10 0 GGAEHN OCCO[C@@]1(CN[C@@H](Cc2ccccc2Cl)c2ccsc2)CCOC1 ZINC000658143755 567124988 /nfs/dbraw/zinc/12/49/88/567124988.db2.gz IOVWIYOXJVYFKL-RBUKOAKNSA-N 0 3 381.925 3.443 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)c1cccc(F)c1Br ZINC000432034362 567125784 /nfs/dbraw/zinc/12/57/84/567125784.db2.gz RLFPEOPVXDWRKY-AWEZNQCLSA-N 0 3 379.273 3.491 10 0 GGAEHN O=C(Cc1cscc1Br)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000432030864 567126196 /nfs/dbraw/zinc/12/61/96/567126196.db2.gz HAUFMCGWCFMNPV-HNNXBMFYSA-N 0 3 379.323 3.444 10 0 GGAEHN C[C@H](NC[C@@]1(OCCO)CCOC1)c1ccc(SCC(F)(F)F)cc1 ZINC000658149169 567126398 /nfs/dbraw/zinc/12/63/98/567126398.db2.gz RATKUYQDJCZECH-BBRMVZONSA-N 0 3 379.444 3.160 10 0 GGAEHN COCCOc1ccc(Br)cc1NC(=O)[C@H]1NCCCC1(C)C ZINC000566101412 567126613 /nfs/dbraw/zinc/12/66/13/567126613.db2.gz NQXWZJJZAHGWCH-OAHLLOKOSA-N 0 3 385.302 3.191 10 0 GGAEHN C[C@H](NC[C@]1(OCCO)CCOC1)c1ccc(SCC(F)(F)F)cc1 ZINC000658149172 567126817 /nfs/dbraw/zinc/12/68/17/567126817.db2.gz RATKUYQDJCZECH-XJKSGUPXSA-N 0 3 379.444 3.160 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@H]1C[C@H](Oc2ccccc2)C1 ZINC000658192003 567128153 /nfs/dbraw/zinc/12/81/53/567128153.db2.gz OKBKGLSHPWVUSN-FRFSOERESA-N 0 3 377.282 3.199 10 0 GGAEHN Cc1ccc(CCCN2CCN(c3ccc(Br)cn3)CC2)cn1 ZINC000474106178 567134191 /nfs/dbraw/zinc/13/41/91/567134191.db2.gz SSUWVKSCXMYEGE-UHFFFAOYSA-N 0 3 375.314 3.302 10 0 GGAEHN CC(C)[C@H](O)[C@@H](N[C@H](C)Cn1cc(Br)ccc1=O)c1ccccc1 ZINC000658288414 567134416 /nfs/dbraw/zinc/13/44/16/567134416.db2.gz OPQZDYNXCBRYDC-CCKFTAQKSA-N 0 3 393.325 3.347 10 0 GGAEHN CCS(=O)(=O)C1(CN[C@@H](Cc2ccccc2Br)C2CC2)CC1 ZINC000658299300 567134491 /nfs/dbraw/zinc/13/44/91/567134491.db2.gz DYFYJSREOOURDD-INIZCTEOSA-N 0 3 386.355 3.327 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)NCc1ccsc1Br ZINC000566192908 567134994 /nfs/dbraw/zinc/13/49/94/567134994.db2.gz FLBSGTYQIUHOBI-CQSZACIVSA-N 0 3 380.311 3.278 10 0 GGAEHN COc1ccc([C@H](C)NCCN2C[C@H]3CCCCN3C2=O)cc1Br ZINC000658309177 567135141 /nfs/dbraw/zinc/13/51/41/567135141.db2.gz NQSVUUUGZRMFMB-DZGCQCFKSA-N 0 3 396.329 3.398 10 0 GGAEHN O=C1N(CCN[C@@H]2CCc3c2cccc3Br)C[C@H]2CCCCN12 ZINC000658306466 567135681 /nfs/dbraw/zinc/13/56/81/567135681.db2.gz PWFUGUHNVWYBBJ-CXAGYDPISA-N 0 3 378.314 3.316 10 0 GGAEHN O=C1N(CCN[C@H]2CCc3c2ccc(F)c3Br)C[C@H]2CCCCN12 ZINC000658305696 567136456 /nfs/dbraw/zinc/13/64/56/567136456.db2.gz LRQMOZFRZIHULH-WBMJQRKESA-N 0 3 396.304 3.455 10 0 GGAEHN CC1(C)OCC[C@H]1CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000658329622 567136472 /nfs/dbraw/zinc/13/64/72/567136472.db2.gz GMEWGYBFDMQBOM-SMDDNHRTSA-N 0 3 388.327 3.072 10 0 GGAEHN CC1(C)OCC[C@H]1CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000658329615 567136502 /nfs/dbraw/zinc/13/65/02/567136502.db2.gz GMEWGYBFDMQBOM-FZMZJTMJSA-N 0 3 388.327 3.072 10 0 GGAEHN Cc1cc(Br)cc2c(C(=O)NCCCN3CCC(O)CC3)coc21 ZINC000474127416 567138970 /nfs/dbraw/zinc/13/89/70/567138970.db2.gz YGDLGSJVCPXJDY-UHFFFAOYSA-N 0 3 395.297 3.080 10 0 GGAEHN O[C@H](COC[C@H]1CCCO1)CN1CC=C(c2cccc(Br)c2)CC1 ZINC000546586395 567140736 /nfs/dbraw/zinc/14/07/36/567140736.db2.gz HWFDQCLXNNBSBM-RBUKOAKNSA-N 0 3 396.325 3.095 10 0 GGAEHN COc1ccccc1[C@H]1C[NH2+]CCN1Cc1cccc([O-])c1Br ZINC000566230307 567141084 /nfs/dbraw/zinc/14/10/84/567141084.db2.gz ADDSUQCMFRGMOY-OAHLLOKOSA-N 0 3 377.282 3.310 10 0 GGAEHN O=S(=O)([N-][C@@H]1CC[NH2+]C2(CCC2)C1)c1cccc(Br)c1Cl ZINC000658401252 567141526 /nfs/dbraw/zinc/14/15/26/567141526.db2.gz AYAPMAJTVBZFCO-SNVBAGLBSA-N 0 3 393.734 3.056 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1cc(I)ccc1F ZINC000474170860 567143242 /nfs/dbraw/zinc/14/32/42/567143242.db2.gz PQKJKIJMUAQPDS-LLVKDONJSA-N 0 3 390.240 3.035 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1cc(I)ccc1F ZINC000474170861 567143764 /nfs/dbraw/zinc/14/37/64/567143764.db2.gz PQKJKIJMUAQPDS-NSHDSACASA-N 0 3 390.240 3.035 10 0 GGAEHN Cc1cc(Br)cc2c(C(=O)NC3(CCO)CCN(C)CC3)coc21 ZINC000474197016 567146325 /nfs/dbraw/zinc/14/63/25/567146325.db2.gz KMAUZLFJAAGDJO-UHFFFAOYSA-N 0 3 395.297 3.080 10 0 GGAEHN O=C1CCCN1CCNCc1cnc(-c2ccc(Br)cc2)s1 ZINC000566343958 567150137 /nfs/dbraw/zinc/15/01/37/567150137.db2.gz HKHHFEAILWVXLI-UHFFFAOYSA-N 0 3 380.311 3.285 10 0 GGAEHN Cc1nc(N[C@@H](CO)c2ccsc2)cc(N[C@H](CO)c2ccsc2)n1 ZINC000546732520 567153344 /nfs/dbraw/zinc/15/33/44/567153344.db2.gz INBVQYIEQVLRCG-GASCZTMLSA-N 0 3 376.507 3.199 10 0 GGAEHN Cn1ncc(Br)c1CN[C@@H]1CCc2nc(-c3ccccc3)ncc2C1 ZINC000683767237 567153778 /nfs/dbraw/zinc/15/37/78/567153778.db2.gz FKKIGMUBGWFEGE-OAHLLOKOSA-N 0 3 398.308 3.287 10 0 GGAEHN Cn1ncc(Br)c1CNC[C@H]1CCN(c2ccc(F)c(F)c2)C1 ZINC000683766175 567153862 /nfs/dbraw/zinc/15/38/62/567153862.db2.gz BBLRNPVIVCHUIW-LLVKDONJSA-N 0 3 385.256 3.077 10 0 GGAEHN Cn1ncc(Br)c1CN[C@@H](CN1CCCCC1)c1ccccc1 ZINC000683769023 567153889 /nfs/dbraw/zinc/15/38/89/567153889.db2.gz CAPRIHQRTIRWRN-KRWDZBQOSA-N 0 3 377.330 3.499 10 0 GGAEHN Cn1ncc(Br)c1CNC[C@H]1CCN(c2ccc(Cl)cc2)C1 ZINC000683766184 567153942 /nfs/dbraw/zinc/15/39/42/567153942.db2.gz CEROHZAGBIUNLF-GFCCVEGCSA-N 0 3 383.721 3.452 10 0 GGAEHN C[C@@H]1CCN(Cc2ccccc2)CCN1Cc1c(Br)cnn1C ZINC000683829434 567157614 /nfs/dbraw/zinc/15/76/14/567157614.db2.gz DKEYXKYWEZEYFK-OAHLLOKOSA-N 0 3 377.330 3.279 10 0 GGAEHN CSc1cc(C(=O)N2CCC[C@@](O)(CN(C)C)C2)c(Cl)cc1Cl ZINC000683915121 567160017 /nfs/dbraw/zinc/16/00/17/567160017.db2.gz WLQLRMOJLNTXEF-MRXNPFEDSA-N 0 3 377.337 3.244 10 0 GGAEHN CN(C)C[C@@]1(O)CCCN(C(=O)CCCOc2cccc(Cl)c2Cl)C1 ZINC000683914560 567160298 /nfs/dbraw/zinc/16/02/98/567160298.db2.gz XVZDJMAOFRZMQL-SFHVURJKSA-N 0 3 389.323 3.068 10 0 GGAEHN COC(=O)C[C@@](C)(NCCOc1ccccc1Br)c1ccncc1 ZINC000589163927 567160285 /nfs/dbraw/zinc/16/02/85/567160285.db2.gz GCQIYKZUDHFYCM-GOSISDBHSA-N 0 3 393.281 3.291 10 0 GGAEHN C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)N1CCC[C@](O)(CN(C)C)C1 ZINC000683912948 567160329 /nfs/dbraw/zinc/16/03/29/567160329.db2.gz OWTHTURQCXPKRQ-PXAZEXFGSA-N 0 3 391.364 3.389 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)[C@@H](C)Oc1ccc(F)cc1Br ZINC000498331599 567167689 /nfs/dbraw/zinc/16/76/89/567167689.db2.gz FSTTURAFAOCFOY-OCCSQVGLSA-N 0 3 389.309 3.448 10 0 GGAEHN CN1CCN([C@H]2CC[C@@H](NC(=O)Cc3cccc(Cl)c3Cl)CC2)CC1 ZINC000684060708 567173431 /nfs/dbraw/zinc/17/34/31/567173431.db2.gz DCHIEBJSBWZVBO-IYBDPMFKSA-N 0 3 384.351 3.211 10 0 GGAEHN CSc1cc(Br)ccc1C(=O)N1CCOC[C@H]1[C@H]1CCCN1C ZINC000615274783 567174664 /nfs/dbraw/zinc/17/46/64/567174664.db2.gz KEHXJHFNWOCKJG-CABCVRRESA-N 0 3 399.354 3.106 10 0 GGAEHN Cc1ccc(C(=O)N2CCOC[C@@H]2[C@@H]2CCCN2C)c(C)c1Br ZINC000615270851 567175546 /nfs/dbraw/zinc/17/55/46/567175546.db2.gz SNRDJZIJAMTRBC-JKSUJKDBSA-N 0 3 381.314 3.001 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000615277545 567175585 /nfs/dbraw/zinc/17/55/85/567175585.db2.gz WLSULDHXXSAZRS-JFTQMJAMSA-N 0 3 383.319 3.419 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000615271762 567175719 /nfs/dbraw/zinc/17/57/19/567175719.db2.gz YIHSJROWKYAHKR-HUUCEWRRSA-N 0 3 376.806 3.294 10 0 GGAEHN O=C(CN1CCc2c(ccc(Cl)c2Cl)C1)NC1CCN(C2CC2)CC1 ZINC000523892892 567176952 /nfs/dbraw/zinc/17/69/52/567176952.db2.gz LQDSDJVSBAUSQO-UHFFFAOYSA-N 0 3 382.335 3.095 10 0 GGAEHN Cc1cc(NC(=O)N2CC[C@@H](F)[C@H](N)C2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000659007986 567177170 /nfs/dbraw/zinc/17/71/70/567177170.db2.gz WDTUPVQHFRFBIO-ZIAGYGMSSA-N 0 3 386.258 3.391 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)Cc1cscc1Br ZINC000432647877 567177746 /nfs/dbraw/zinc/17/77/46/567177746.db2.gz WHODFJMCYFQZMP-OAHLLOKOSA-N 0 3 381.339 3.342 10 0 GGAEHN CN(Cc1ccc(Br)o1)C(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659033695 567178989 /nfs/dbraw/zinc/17/89/89/567178989.db2.gz XBMZYRGPIUIZAB-OAHLLOKOSA-N 0 3 394.269 3.367 10 0 GGAEHN O=C(NCc1sccc1Br)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659033860 567179106 /nfs/dbraw/zinc/17/91/06/567179106.db2.gz YSOKCRJTLLKBGW-AWEZNQCLSA-N 0 3 396.310 3.493 10 0 GGAEHN CN(Cc1ccc(Br)o1)C(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659033694 567179357 /nfs/dbraw/zinc/17/93/57/567179357.db2.gz XBMZYRGPIUIZAB-HNNXBMFYSA-N 0 3 394.269 3.367 10 0 GGAEHN O=C(NCCCNCc1cccnc1)Nc1ccc(F)c(Br)c1F ZINC000659048626 567180742 /nfs/dbraw/zinc/18/07/42/567180742.db2.gz YUMJNEPMVFTWFV-UHFFFAOYSA-N 0 3 399.239 3.424 10 0 GGAEHN Cc1c(C(=O)N2CCC[C@H]2CN(C)C)cnn1-c1ccc(Br)cc1 ZINC000524103726 567181465 /nfs/dbraw/zinc/18/14/65/567181465.db2.gz WYDZRXIWYPIZFH-INIZCTEOSA-N 0 3 391.313 3.109 10 0 GGAEHN Cc1ccc(C(=O)NCCN2CCCC[C@H]2C)cc1I ZINC000524128809 567183624 /nfs/dbraw/zinc/18/36/24/567183624.db2.gz NGENJHRRDHSXGA-CYBMUJFWSA-N 0 3 386.277 3.204 10 0 GGAEHN CCN1CC[C@H]2OCCN(Cc3cc(Br)cc(F)c3F)[C@H]2C1 ZINC000566741467 567184837 /nfs/dbraw/zinc/18/48/37/567184837.db2.gz YXRWPPQXMQFSIB-LSDHHAIUSA-N 0 3 375.257 3.022 10 0 GGAEHN COc1c(Br)ccc(C)c1C(=O)N1CCC[C@@]2(CCN(C)C2)C1 ZINC000615602366 567193369 /nfs/dbraw/zinc/19/33/69/567193369.db2.gz BHTJCUFEQZAROT-SFHVURJKSA-N 0 3 381.314 3.324 10 0 GGAEHN C[C@@H](NC(=O)C1(N)CC2(CCC2)C1)c1cc2c(cc1Br)OCCO2 ZINC000659254355 567193429 /nfs/dbraw/zinc/19/34/29/567193429.db2.gz REVYRJHHZDPREL-LLVKDONJSA-N 0 3 395.297 3.059 10 0 GGAEHN O=C(C[C@H]1NCc2ccccc21)NCCOc1cccc(Br)c1 ZINC000659253987 567193515 /nfs/dbraw/zinc/19/35/15/567193515.db2.gz CKFKQHPBKHSZAW-QGZVFWFLSA-N 0 3 375.266 3.179 10 0 GGAEHN C[C@@H](CNC(=O)NCc1ccc(Br)cc1C(F)(F)F)N(C)C ZINC000454746418 567199858 /nfs/dbraw/zinc/19/98/58/567199858.db2.gz KZKJYOHGGYMLHY-VIFPVBQESA-N 0 3 382.224 3.217 10 0 GGAEHN CS[C@H]1CN(C(=O)c2ccc(Br)c(C)c2F)C[C@H]1N(C)C ZINC000566894996 567199911 /nfs/dbraw/zinc/19/99/11/567199911.db2.gz CUFONXJPRLGIOD-OLZOCXBDSA-N 0 3 375.307 3.014 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N2CCC[C@@H]2CN(C)C)cc1OC ZINC000589982211 567200475 /nfs/dbraw/zinc/20/04/75/567200475.db2.gz PVWZJNJKUXTBHP-CYBMUJFWSA-N 0 3 385.302 3.023 10 0 GGAEHN Cc1ccc([C@H](CNc2ncc(I)cn2)N2CCCC2)o1 ZINC000547329713 567201352 /nfs/dbraw/zinc/20/13/52/567201352.db2.gz KOXVIEMWPMSTTQ-ZDUSSCGKSA-N 0 3 398.248 3.232 10 0 GGAEHN O=C(NC[C@@H]1CCCCN1CCO)Nc1ccc(C(F)(F)F)cc1Cl ZINC000454775704 567201632 /nfs/dbraw/zinc/20/16/32/567201632.db2.gz QVWRNXWIEOTXKE-LBPRGKRZSA-N 0 3 379.810 3.327 10 0 GGAEHN O=C(NC[C@H]1CCCCN1CCO)Nc1ccc(C(F)(F)F)cc1Cl ZINC000454775701 567201700 /nfs/dbraw/zinc/20/17/00/567201700.db2.gz QVWRNXWIEOTXKE-GFCCVEGCSA-N 0 3 379.810 3.327 10 0 GGAEHN COC[C@@](C)(CCO)NCc1ccc(OC(F)(F)F)c(Br)c1 ZINC000474824416 567202094 /nfs/dbraw/zinc/20/20/94/567202094.db2.gz ZTHRKAONJPOSAV-CYBMUJFWSA-N 0 3 386.208 3.225 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N1CCC[C@@H]1CN(C)C ZINC000590001858 567202134 /nfs/dbraw/zinc/20/21/34/567202134.db2.gz OEIANPFZKYYFQO-CQSZACIVSA-N 0 3 378.314 3.265 10 0 GGAEHN OCC[C@@]1(CNCc2ccc(Br)cc2C(F)(F)F)CCOC1 ZINC000474820187 567202378 /nfs/dbraw/zinc/20/23/78/567202378.db2.gz ZNYTWICJRMVYGO-AWEZNQCLSA-N 0 3 382.220 3.347 10 0 GGAEHN CN1CCC(C(=O)N2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)CC1 ZINC000498798488 567202612 /nfs/dbraw/zinc/20/26/12/567202612.db2.gz KIPOISVUQYHRET-UHFFFAOYSA-N 0 3 384.351 3.022 10 0 GGAEHN O=C(Nc1cscc1Br)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000615734813 567203296 /nfs/dbraw/zinc/20/32/96/567203296.db2.gz ZCEQVQCXUDZONY-HTQZYQBOSA-N 0 3 388.205 3.433 10 0 GGAEHN O=C(Nc1cscc1Br)[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000615735166 567203340 /nfs/dbraw/zinc/20/33/40/567203340.db2.gz XCHPREDHMVOHBJ-INIZCTEOSA-N 0 3 381.295 3.086 10 0 GGAEHN O=C(Nc1cscc1Br)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000615734817 567203375 /nfs/dbraw/zinc/20/33/75/567203375.db2.gz ZCEQVQCXUDZONY-SFYZADRCSA-N 0 3 388.205 3.433 10 0 GGAEHN O=C(C[C@H]1NCc2ccccc21)N[C@H]1COc2cc(F)c(Br)cc21 ZINC000659314956 567203598 /nfs/dbraw/zinc/20/35/98/567203598.db2.gz MNUWUICBQPWOEU-CVEARBPZSA-N 0 3 391.240 3.373 10 0 GGAEHN COCCOc1ccc(Br)cc1NC(=O)C1(N)CC2(CCC2)C1 ZINC000659317785 567203737 /nfs/dbraw/zinc/20/37/37/567203737.db2.gz RKEOCWMGUARNEL-UHFFFAOYSA-N 0 3 383.286 3.074 10 0 GGAEHN CC(C)Sc1cccc(Cl)c1CNCCCN1CCCS1(=O)=O ZINC000684375678 567203971 /nfs/dbraw/zinc/20/39/71/567203971.db2.gz AIVYYSWMPISHML-UHFFFAOYSA-N 0 3 376.975 3.356 10 0 GGAEHN COc1ccc(CCC(=O)Nc2cnc3c(c2)CNCC3)c(Br)c1 ZINC000659304307 567204484 /nfs/dbraw/zinc/20/44/84/567204484.db2.gz AIONYVAQPDNWFL-UHFFFAOYSA-N 0 3 390.281 3.070 10 0 GGAEHN COc1cc(Br)ccc1CCCNC(=O)C1(N)CC2(CCC2)C1 ZINC000659317535 567204568 /nfs/dbraw/zinc/20/45/68/567204568.db2.gz MXWHQWOKORZCCW-UHFFFAOYSA-N 0 3 381.314 3.168 10 0 GGAEHN COc1ccc(CCC(=O)N2C[C@H](N)Cc3ccccc32)c(Br)c1 ZINC000659326062 567206103 /nfs/dbraw/zinc/20/61/03/567206103.db2.gz WMVHNKYWHQVLCE-OAHLLOKOSA-N 0 3 389.293 3.307 10 0 GGAEHN CCN(CC)CCN(C(=O)CC1(OC)CCC1)c1ccc(Br)cn1 ZINC000566977242 567207145 /nfs/dbraw/zinc/20/71/45/567207145.db2.gz UAIJMISISWBKQX-UHFFFAOYSA-N 0 3 398.345 3.478 10 0 GGAEHN CN(C)CCn1cc(NC(=O)c2cc(F)c(Br)cc2Cl)cn1 ZINC000684423588 567207377 /nfs/dbraw/zinc/20/73/77/567207377.db2.gz OGSNKGAUNKEAQT-UHFFFAOYSA-N 0 3 389.656 3.252 10 0 GGAEHN O=C(N[C@H]1CCN(CC2CC2)C1)c1cc(F)c(Br)cc1Cl ZINC000684436786 567207675 /nfs/dbraw/zinc/20/76/75/567207675.db2.gz KWVQGMDMNCWYJF-JTQLQIEISA-N 0 3 375.669 3.456 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)Cc1ccccc1Br ZINC000524653483 567208457 /nfs/dbraw/zinc/20/84/57/567208457.db2.gz VNDAGFXWRSNLHE-QGZVFWFLSA-N 0 3 375.310 3.281 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)CCCCc1ccc(Br)cc1 ZINC000590116860 567208888 /nfs/dbraw/zinc/20/88/88/567208888.db2.gz DMKZHKKOOOKMKZ-GOSISDBHSA-N 0 3 397.357 3.389 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)CSc1cc(Cl)ccc1Cl ZINC000590119436 567209041 /nfs/dbraw/zinc/20/90/41/567209041.db2.gz XHWHOQYLKBWQGB-ZDUSSCGKSA-N 0 3 377.337 3.313 10 0 GGAEHN Cc1c(Br)cncc1C(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659365425 567209021 /nfs/dbraw/zinc/20/90/21/567209021.db2.gz XQVJWZFCZCMZEV-MRXNPFEDSA-N 0 3 376.254 3.066 10 0 GGAEHN COc1cc(C(=O)Nc2ccc([C@@H]3CNCCO3)cc2)sc1Br ZINC000659365778 567209707 /nfs/dbraw/zinc/20/97/07/567209707.db2.gz ICANQSSRBLOMQH-ZDUSSCGKSA-N 0 3 397.294 3.432 10 0 GGAEHN O=C(CCOC1CNC1)N1CCc2sccc2[C@H]1c1ccc(Cl)cc1 ZINC000659373837 567210256 /nfs/dbraw/zinc/21/02/56/567210256.db2.gz WYWWPDWMCRBYLK-LJQANCHMSA-N 0 3 376.909 3.254 10 0 GGAEHN N[C@@H](CC(=O)N1CCOC[C@@H]1c1cccc(Br)c1)c1ccccc1 ZINC000659370440 567210397 /nfs/dbraw/zinc/21/03/97/567210397.db2.gz XXLPWHOUFKPFRW-ZWKOTPCHSA-N 0 3 389.293 3.439 10 0 GGAEHN COc1ccc(Br)c(C(=O)Nc2ccc([C@@H]3CNCCO3)cc2)c1 ZINC000659369879 567210481 /nfs/dbraw/zinc/21/04/81/567210481.db2.gz QNAVKEGDIDFHMW-KRWDZBQOSA-N 0 3 391.265 3.371 10 0 GGAEHN COc1ccc(Br)c(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)c1 ZINC000659369881 567210518 /nfs/dbraw/zinc/21/05/18/567210518.db2.gz QNAVKEGDIDFHMW-QGZVFWFLSA-N 0 3 391.265 3.371 10 0 GGAEHN N[C@@H]1CN(C(=O)c2cccnc2Oc2ccc(Br)cc2)CC[C@H]1F ZINC000659388804 567211044 /nfs/dbraw/zinc/21/10/44/567211044.db2.gz MXBLDKHGMMVMNH-HUUCEWRRSA-N 0 3 394.244 3.148 10 0 GGAEHN N[C@@H]1CN(C(=O)c2cccnc2Oc2cccc(Br)c2)CC[C@H]1F ZINC000659388783 567211092 /nfs/dbraw/zinc/21/10/92/567211092.db2.gz DVRZSKMWPHBXKG-HUUCEWRRSA-N 0 3 394.244 3.148 10 0 GGAEHN CN(Cc1ccccc1)C[C@H](O)CN1CCc2c(Br)cccc2C1 ZINC000590126537 567211370 /nfs/dbraw/zinc/21/13/70/567211370.db2.gz MRQDOCMCICWZIR-SFHVURJKSA-N 0 3 389.337 3.300 10 0 GGAEHN N[C@@H]1CN(C(=O)c2ccc(COc3cccc(Br)c3)o2)CC[C@H]1F ZINC000659389064 567211631 /nfs/dbraw/zinc/21/16/31/567211631.db2.gz IRXVVFIHVJZMKI-HUUCEWRRSA-N 0 3 397.244 3.132 10 0 GGAEHN N[C@@H]1CN(C(=O)c2ccc(Oc3cccc(Br)c3)nc2)CC[C@H]1F ZINC000659389097 567211709 /nfs/dbraw/zinc/21/17/09/567211709.db2.gz IJACKJIJTFPAIH-HUUCEWRRSA-N 0 3 394.244 3.148 10 0 GGAEHN O=C(CNC[C@@H]1CCCO1)N[C@@H]1CCCCc2cc(Br)ccc21 ZINC000659386911 567211732 /nfs/dbraw/zinc/21/17/32/567211732.db2.gz UIRJRBSLOALSAG-DOTOQJQBSA-N 0 3 381.314 3.101 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)N[C@@H]2[C@H]3Cc4cc(Br)ccc4[C@@H]23)CCN1C ZINC000637650962 567211961 /nfs/dbraw/zinc/21/19/61/567211961.db2.gz RQFFLQMQHWMGRE-NWFSRUCESA-N 0 3 392.341 3.211 10 0 GGAEHN O=C(C[C@H]1CSCCN1)N[C@H]1CCCCc2cc(Br)ccc21 ZINC000659386493 567212220 /nfs/dbraw/zinc/21/22/20/567212220.db2.gz OUSVAZNNDOVKRN-HOCLYGCPSA-N 0 3 383.355 3.428 10 0 GGAEHN Cc1ccc2c(c1Br)CN(C(=O)[C@H](CN)c1ccc(F)cc1)C2 ZINC000659387771 567212254 /nfs/dbraw/zinc/21/22/54/567212254.db2.gz OGVLXXKWVBWGSB-OAHLLOKOSA-N 0 3 377.257 3.481 10 0 GGAEHN CN(Cc1ccccc1)C[C@@H](O)CN1CCc2c(Br)cccc2C1 ZINC000590126536 567212309 /nfs/dbraw/zinc/21/23/09/567212309.db2.gz MRQDOCMCICWZIR-GOSISDBHSA-N 0 3 389.337 3.300 10 0 GGAEHN Cc1cc(SCC(=O)N2CC[C@@H](F)[C@H](N)C2)c(C)cc1Br ZINC000659391799 567213449 /nfs/dbraw/zinc/21/34/49/567213449.db2.gz HHYXEEWOIGWGRG-CHWSQXEVSA-N 0 3 375.307 3.056 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)N[C@H]2C[C@H]2c2cccc(Br)c2)CCN1C ZINC000524787404 567214498 /nfs/dbraw/zinc/21/44/98/567214498.db2.gz QKJRVULWHSNNHN-VZEFYGNVSA-N 0 3 380.330 3.429 10 0 GGAEHN N[C@@H]1CN(C(=O)N[C@H](c2ccc(Br)cc2)C2CCC2)CC[C@H]1F ZINC000659440638 567215266 /nfs/dbraw/zinc/21/52/66/567215266.db2.gz TTWYTBXOBFFDBG-OAGGEKHMSA-N 0 3 384.293 3.371 10 0 GGAEHN O=C(NC[C@@H]1CCCCN1CCO)Nc1ccc(Cl)c(Br)c1 ZINC000454941508 567215662 /nfs/dbraw/zinc/21/56/62/567215662.db2.gz KQNHJABCWKAOHS-LBPRGKRZSA-N 0 3 390.709 3.071 10 0 GGAEHN C[C@@H](CN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)c1ccncc1 ZINC000684554112 567216029 /nfs/dbraw/zinc/21/60/29/567216029.db2.gz PKWOLSPKUAUWMC-QWRGUYRKSA-N 0 3 388.320 3.490 10 0 GGAEHN N[C@@H]1CN(C(=O)NCCc2csc(-c3ccc(Cl)cc3)n2)CC[C@H]1F ZINC000659473374 567216351 /nfs/dbraw/zinc/21/63/51/567216351.db2.gz IUVFPGHHRYGSQU-HUUCEWRRSA-N 0 3 382.892 3.087 10 0 GGAEHN C[C@H](CN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)c1ccncc1 ZINC000684554110 567216587 /nfs/dbraw/zinc/21/65/87/567216587.db2.gz PKWOLSPKUAUWMC-MNOVXSKESA-N 0 3 388.320 3.490 10 0 GGAEHN O=C(NCc1ccc([O-])c(Br)c1)N1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000659470928 567216903 /nfs/dbraw/zinc/21/69/03/567216903.db2.gz JMVDSPUYKPHUOW-OAHLLOKOSA-N 0 3 396.329 3.076 10 0 GGAEHN CN(C[C@@H](O)COc1c(Cl)cccc1Cl)C[C@H](O)Cc1ccccc1 ZINC000433039168 567217220 /nfs/dbraw/zinc/21/72/20/567217220.db2.gz KOMWMTPXTGHZDO-HZPDHXFCSA-N 0 3 384.303 3.269 10 0 GGAEHN C[C@H]1CCN(CC(=O)N2CCC[C@H]2c2ccccc2I)C1 ZINC000567121729 567220006 /nfs/dbraw/zinc/22/00/06/567220006.db2.gz NRRRAQSJCAWTGT-BBRMVZONSA-N 0 3 398.288 3.297 10 0 GGAEHN C[C@H]1CCN(CC(=O)N2CCC[C@@H]2c2ccccc2I)C1 ZINC000567121732 567220628 /nfs/dbraw/zinc/22/06/28/567220628.db2.gz NRRRAQSJCAWTGT-XJKSGUPXSA-N 0 3 398.288 3.297 10 0 GGAEHN CC[C@H]1CN(C)CCCN1C(=O)c1cc(C)ccc1I ZINC000590345148 567220810 /nfs/dbraw/zinc/22/08/10/567220810.db2.gz UAZDAURNNNQODD-ZDUSSCGKSA-N 0 3 386.277 3.156 10 0 GGAEHN O=C(NC[C@@H]1CCCCN1CCO)Nc1ccc(Br)c(Cl)c1 ZINC000455015005 567223550 /nfs/dbraw/zinc/22/35/50/567223550.db2.gz ZUPSKCSTWGBJQL-LBPRGKRZSA-N 0 3 390.709 3.071 10 0 GGAEHN CN(CC[N@H+](C)C1CCCCC1)C(=O)Cc1ccc(Br)cc1[O-] ZINC000433110277 567223498 /nfs/dbraw/zinc/22/34/98/567223498.db2.gz OOBQMOQCZHMZGU-UHFFFAOYSA-N 0 3 383.330 3.420 10 0 GGAEHN CN(CC[N@@H+](C)C1CCCCC1)C(=O)Cc1ccc(Br)cc1[O-] ZINC000433110277 567223503 /nfs/dbraw/zinc/22/35/03/567223503.db2.gz OOBQMOQCZHMZGU-UHFFFAOYSA-N 0 3 383.330 3.420 10 0 GGAEHN C[C@@H]1COCC[C@@H]1NCC(=O)Nc1ccc(Br)c(C(F)(F)F)c1 ZINC000433136498 567225426 /nfs/dbraw/zinc/22/54/26/567225426.db2.gz MBYMXIHMYXQAAD-RNCFNFMXSA-N 0 3 395.219 3.421 10 0 GGAEHN CCCOc1c(Br)cc(CNC2(CC(N)=O)CCC2)cc1OC ZINC000475113783 567226323 /nfs/dbraw/zinc/22/63/23/567226323.db2.gz ZOXNOWUXBZECBE-UHFFFAOYSA-N 0 3 385.302 3.134 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N[C@H]1CCN(C)[C@@H](C)C1 ZINC000525102012 567227132 /nfs/dbraw/zinc/22/71/32/567227132.db2.gz GDHNQGDQMOKZOA-JSGCOSHPSA-N 0 3 378.314 3.311 10 0 GGAEHN C[C@@H]1OCC[C@]1(O)CNCc1cnc(-c2ccc(Br)cc2)s1 ZINC000433189842 567228975 /nfs/dbraw/zinc/22/89/75/567228975.db2.gz SSLIPPXZHPQDPM-ZBEGNZNMSA-N 0 3 383.311 3.202 10 0 GGAEHN CN1CCC[C@H](NC(=O)Nc2ccc(-c3ccc(Br)s3)nn2)C1 ZINC000684698118 567229009 /nfs/dbraw/zinc/22/90/09/567229009.db2.gz GNJXBKYGJOGAMT-JTQLQIEISA-N 0 3 396.314 3.183 10 0 GGAEHN COc1ccc(Br)c2[nH]c(C(=O)N(C)[C@H]3CCN(C)[C@H](C)C3)cc21 ZINC000525106710 567229173 /nfs/dbraw/zinc/22/91/73/567229173.db2.gz YJWFMVBQRNQUME-NEPJUHHUSA-N 0 3 394.313 3.494 10 0 GGAEHN CN(C)CC(C)(C)NC(=O)Cc1ccc(Br)c(Br)c1 ZINC000616188475 567232168 /nfs/dbraw/zinc/23/21/68/567232168.db2.gz UUNKWPNSKVSFCX-UHFFFAOYSA-N 0 3 392.135 3.211 10 0 GGAEHN CN(CCCN(C)C(=O)Cc1ccc(Br)s1)Cc1ccncc1 ZINC000567279010 567233339 /nfs/dbraw/zinc/23/33/39/567233339.db2.gz RNDSPQNCEZLPIJ-UHFFFAOYSA-N 0 3 396.354 3.429 10 0 GGAEHN COc1ccc(NC(=O)C(C[C@@H]2COCCO2)C(F)(F)F)cc1SC ZINC000616210413 567233425 /nfs/dbraw/zinc/23/34/25/567233425.db2.gz QZVPCYUKBJWYGH-NEPJUHHUSA-N 0 3 379.400 3.340 10 0 GGAEHN COc1ccc(NC(=O)C(C[C@@H]2COCCO2)C(F)(F)F)cc1SC ZINC000616210416 567233610 /nfs/dbraw/zinc/23/36/10/567233610.db2.gz QZVPCYUKBJWYGH-VXGBXAGGSA-N 0 3 379.400 3.340 10 0 GGAEHN CCC[C@H](C)[C@@H](CO)NCC(=O)Nc1ccc(Br)cc1Cl ZINC000567276893 567233807 /nfs/dbraw/zinc/23/38/07/567233807.db2.gz ZMOQSMKJTNKSPS-IINYFYTJSA-N 0 3 377.710 3.428 10 0 GGAEHN Cc1c(Br)cncc1C(=O)Nc1ccc(OCCN(C)C)c(F)c1 ZINC000616243033 567235154 /nfs/dbraw/zinc/23/51/54/567235154.db2.gz CHMUKLRQMWSEJW-UHFFFAOYSA-N 0 3 396.260 3.484 10 0 GGAEHN CN(C)CCn1cc(NC(=O)N[C@@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000684776529 567236653 /nfs/dbraw/zinc/23/66/53/567236653.db2.gz MKPCHYGELVBASF-XJKSGUPXSA-N 0 3 382.295 3.429 10 0 GGAEHN FC(F)OC1CCC(NCc2ncc(I)s2)CC1 ZINC000590662488 567237098 /nfs/dbraw/zinc/23/70/98/567237098.db2.gz WQBTWWBLWFBCLM-UHFFFAOYSA-N 0 3 388.221 3.388 10 0 GGAEHN O=C1[C@H](N2CCC[C@H]([C@@H]3CCOC3)C2)CCN1c1cccc(Br)c1 ZINC000433270225 567237973 /nfs/dbraw/zinc/23/79/73/567237973.db2.gz KAIXXXQNXRQYPH-HDMKZQKVSA-N 0 3 393.325 3.303 10 0 GGAEHN CCOCCOc1ccc(Br)cc1CNCc1ncccc1O ZINC000475342342 567242220 /nfs/dbraw/zinc/24/22/20/567242220.db2.gz JQZZMFDEYRSXSG-UHFFFAOYSA-N 0 3 381.270 3.255 10 0 GGAEHN CN1CC(=O)N(CCN2CCC(Cc3cc(Cl)ccc3Cl)CC2)C1=O ZINC000659984597 567243302 /nfs/dbraw/zinc/24/33/02/567243302.db2.gz OSPMYXFZGPNXFA-UHFFFAOYSA-N 0 3 384.307 3.142 10 0 GGAEHN OC[C@@H](CNCc1ccc(-c2cc[nH]n2)o1)Cc1ccccc1Br ZINC000433336355 567244582 /nfs/dbraw/zinc/24/45/82/567244582.db2.gz PIUHFDAKZQSMPL-CYBMUJFWSA-N 0 3 390.281 3.373 10 0 GGAEHN COC(=O)CC1(NCC(=O)NCCc2cccc(Cl)c2Cl)CCCC1 ZINC000547771618 567245753 /nfs/dbraw/zinc/24/57/53/567245753.db2.gz GXMAXMKMHHLXSG-UHFFFAOYSA-N 0 3 387.307 3.118 10 0 GGAEHN Cc1cc(Br)cc2c(C(=O)N(CCN(C)C)CCN(C)C)coc21 ZINC000547785854 567246405 /nfs/dbraw/zinc/24/64/05/567246405.db2.gz RWKLOEXUMWWLGE-UHFFFAOYSA-N 0 3 396.329 3.069 10 0 GGAEHN NC(=O)[C@H](NCCCCOc1ccccc1)c1cccc(Br)c1 ZINC000475425667 567246989 /nfs/dbraw/zinc/24/69/89/567246989.db2.gz ZWINQJXIUKIBOH-QGZVFWFLSA-N 0 3 377.282 3.424 10 0 GGAEHN CCCN(C(=O)c1cccs1)C1CCN(CC2(O)CCSCC2)CC1 ZINC000660020148 567247271 /nfs/dbraw/zinc/24/72/71/567247271.db2.gz VLNIZWOGKAQOQK-UHFFFAOYSA-N 0 3 382.595 3.323 10 0 GGAEHN COc1ccc(C[C@H](C)N[C@@H](C(N)=O)c2cccc(Br)c2)cc1 ZINC000475438206 567248210 /nfs/dbraw/zinc/24/82/10/567248210.db2.gz FPTLDYYSCRGQHH-YVEFUNNKSA-N 0 3 377.282 3.205 10 0 GGAEHN OC1(CNCc2cnc(-c3ccc(Br)cc3)s2)CCOCC1 ZINC000547820493 567249036 /nfs/dbraw/zinc/24/90/36/567249036.db2.gz FOZZUYGVXDMPDB-UHFFFAOYSA-N 0 3 383.311 3.204 10 0 GGAEHN FC1(F)C[C@@H]1OCCNC1(c2cccc(Br)c2)CCOCC1 ZINC000660037232 567250669 /nfs/dbraw/zinc/25/06/69/567250669.db2.gz WEVOEKMTHYRBLC-AWEZNQCLSA-N 0 3 376.241 3.469 10 0 GGAEHN O=S(=O)(NC[C@H]1CN(Cc2ccccc2)CC12CCC2)c1cccs1 ZINC000660057746 567253829 /nfs/dbraw/zinc/25/38/29/567253829.db2.gz QRIYWWBYBCCZRF-KRWDZBQOSA-N 0 3 376.547 3.329 10 0 GGAEHN CN1CC[C@H](NCC(=O)NC2CCCC2)C[C@H]1c1ccc(Br)cc1 ZINC000638527064 567254488 /nfs/dbraw/zinc/25/44/88/567254488.db2.gz JKFZILDDGVWEOF-ROUUACIJSA-N 0 3 394.357 3.233 10 0 GGAEHN CN1CC[C@H](NCC(=O)Nc2ccc(Br)cc2)[C@H]1c1ccccc1 ZINC000567528471 567255219 /nfs/dbraw/zinc/25/52/19/567255219.db2.gz ZYHXGZSOJFBKPY-PKOBYXMFSA-N 0 3 388.309 3.423 10 0 GGAEHN CN1CC[C@@H](NCC(=O)Nc2ccc(Br)cc2)[C@@H]1c1ccccc1 ZINC000567528470 567255456 /nfs/dbraw/zinc/25/54/56/567255456.db2.gz ZYHXGZSOJFBKPY-MJGOQNOKSA-N 0 3 388.309 3.423 10 0 GGAEHN Cc1cc(C)c(C(=O)N2CCC[C@H]2CN(C)C)cc1I ZINC000475535956 567256158 /nfs/dbraw/zinc/25/61/58/567256158.db2.gz ZGYAPVZQGDNNDE-ZDUSSCGKSA-N 0 3 386.277 3.074 10 0 GGAEHN C/C(=C\c1cccc(C(F)(F)F)c1)CN1CCC[C@@H](CS(N)(=O)=O)C1 ZINC000567546308 567256557 /nfs/dbraw/zinc/25/65/57/567256557.db2.gz IWWHCGUUWUVEHI-XETPBLJFSA-N 0 3 376.444 3.109 10 0 GGAEHN C[C@@H](C(=O)N[C@](C)(CO)c1ccc(Br)cc1)N1CCCCCC1 ZINC000616832150 567261308 /nfs/dbraw/zinc/26/13/08/567261308.db2.gz RFPAEVOBZNTRGE-KBXCAEBGSA-N 0 3 383.330 3.037 10 0 GGAEHN COc1cnccc1N1CCN(Cc2ccc(Br)cc2OC)CC1 ZINC000475622673 567263086 /nfs/dbraw/zinc/26/30/86/567263086.db2.gz JIQYZEVOFZYKGJ-UHFFFAOYSA-N 0 3 392.297 3.184 10 0 GGAEHN C[C@]1(C(N)=O)CCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000475672129 567266525 /nfs/dbraw/zinc/26/65/25/567266525.db2.gz YBWXYCCIMOYRNH-INIZCTEOSA-N 0 3 380.311 3.270 10 0 GGAEHN CC[C@H](NCCn1nc2ccccn2c1=O)c1cc(F)cc(Br)c1 ZINC000547948019 567268166 /nfs/dbraw/zinc/26/81/66/567268166.db2.gz CYTZTHFXQNRZPA-HNNXBMFYSA-N 0 3 393.260 3.139 10 0 GGAEHN Brc1ccc(CN2CCC[C@H]3COCC[C@H]32)c(N2CCOCC2)c1 ZINC000475708787 567269292 /nfs/dbraw/zinc/26/92/92/567269292.db2.gz ZRFGYDUNGMVAHN-FUHWJXTLSA-N 0 3 395.341 3.287 10 0 GGAEHN Cc1cc(CN[C@@H]2CCN(C)[C@H](c3ccc(Br)cc3)C2)ncn1 ZINC000638812062 567270756 /nfs/dbraw/zinc/27/07/56/567270756.db2.gz REWMEDRWTPZMTK-AEFFLSMTSA-N 0 3 375.314 3.473 10 0 GGAEHN CO[C@@H](CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1)[C@@H]1CCOC1 ZINC000660158406 567271743 /nfs/dbraw/zinc/27/17/43/567271743.db2.gz WVONIENQKXPCBD-APWZRJJASA-N 0 3 387.351 3.205 10 0 GGAEHN CN1CC[C@H](N[C@H](CO)CC(F)(F)F)C[C@H]1c1ccc(Br)cc1 ZINC000638833305 567274673 /nfs/dbraw/zinc/27/46/73/567274673.db2.gz VDAYVQITXKYWEU-KKUMJFAQSA-N 0 3 395.263 3.487 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)Cc1noc2ccc(Br)cc21 ZINC000617005990 567275351 /nfs/dbraw/zinc/27/53/51/567275351.db2.gz SGKLSCHGAXZPLU-LBPRGKRZSA-N 0 3 380.286 3.122 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)c1ccn(-c2ccc(Br)cc2)n1 ZINC000617007585 567275859 /nfs/dbraw/zinc/27/58/59/567275859.db2.gz WBDLUFVDLVSWMX-HNNXBMFYSA-N 0 3 391.313 3.237 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)c1cnn(-c2ccc(Br)cc2)c1 ZINC000617016052 567275970 /nfs/dbraw/zinc/27/59/70/567275970.db2.gz BPDWNGVYRVUFNA-INIZCTEOSA-N 0 3 391.313 3.237 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)c1[nH]nc(-c2ccccc2)c1Br ZINC000617015288 567276088 /nfs/dbraw/zinc/27/60/88/567276088.db2.gz ZBUGDIPBUHKNLK-ZDUSSCGKSA-N 0 3 391.313 3.442 10 0 GGAEHN COc1ccc(CCC(=O)NC[C@@H]2CCN2C(C)(C)C)c(Br)c1 ZINC000617005599 567276191 /nfs/dbraw/zinc/27/61/91/567276191.db2.gz LBWHRCMCOOPODU-AWEZNQCLSA-N 0 3 383.330 3.379 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000617006222 567276805 /nfs/dbraw/zinc/27/68/05/567276805.db2.gz YFXMNXBHCHTTIK-KGLIPLIRSA-N 0 3 381.314 3.304 10 0 GGAEHN Brc1cnc2c(CN[C@@H](c3ccccc3)[C@H]3CCOC3)cnn2c1 ZINC000638856036 567276706 /nfs/dbraw/zinc/27/67/06/567276706.db2.gz SLNXRJMUPSTRTL-YOEHRIQHSA-N 0 3 387.281 3.359 10 0 GGAEHN C[C@@H](NCC1(O)CCSCC1)c1cc2c(cc1Br)OCCO2 ZINC000660187506 567277888 /nfs/dbraw/zinc/27/78/88/567277888.db2.gz NCUUBLNTSLZVSJ-LLVKDONJSA-N 0 3 388.327 3.129 10 0 GGAEHN CCCC[N@@H+]1CCCC[C@H]1CNC(=O)Cc1ccc(Br)cc1[O-] ZINC000548074597 567278185 /nfs/dbraw/zinc/27/81/85/567278185.db2.gz YLPLADYMAVBLEK-INIZCTEOSA-N 0 3 383.330 3.468 10 0 GGAEHN CCCC[N@H+]1CCCC[C@H]1CNC(=O)Cc1ccc(Br)cc1[O-] ZINC000548074597 567278194 /nfs/dbraw/zinc/27/81/94/567278194.db2.gz YLPLADYMAVBLEK-INIZCTEOSA-N 0 3 383.330 3.468 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000548074129 567278970 /nfs/dbraw/zinc/27/89/70/567278970.db2.gz TZJJFARGIRIWMY-MRXNPFEDSA-N 0 3 381.314 3.174 10 0 GGAEHN CCN1C[C@H](C)N(c2nnc(-c3ccccc3Br)n2C)C[C@@H]1C ZINC000685509593 567279324 /nfs/dbraw/zinc/27/93/24/567279324.db2.gz YOSYAJVPWHEWLT-STQMWFEESA-N 0 3 378.318 3.164 10 0 GGAEHN C[C@H](NS(=O)(=O)c1ccc2ncsc2c1)[C@H]1CCCN(C2CCC2)C1 ZINC000548123783 567281446 /nfs/dbraw/zinc/28/14/46/567281446.db2.gz KFSXEBYFONWOJB-KBPBESRZSA-N 0 3 379.551 3.228 10 0 GGAEHN CN(C)[C@@H](CNC(=O)c1cc(Br)cc2[nH]cnc21)c1ccccc1 ZINC000499911006 567284548 /nfs/dbraw/zinc/28/45/48/567284548.db2.gz NIMHQHHSJRMCOR-INIZCTEOSA-N 0 3 387.281 3.358 10 0 GGAEHN Ic1cccc(C[C@@H]2CCN(Cc3cnccn3)C2)c1 ZINC000567855904 567285126 /nfs/dbraw/zinc/28/51/26/567285126.db2.gz GWGZQCUEVJMDGC-AWEZNQCLSA-N 0 3 379.245 3.146 10 0 GGAEHN COc1c(Br)cc(Cl)cc1NC(=O)NC[C@@H]1CCCN1C ZINC000591527542 567285091 /nfs/dbraw/zinc/28/50/91/567285091.db2.gz HGFAUAVOJZONSZ-JTQLQIEISA-N 0 3 376.682 3.327 10 0 GGAEHN COc1c(Br)cc(Cl)cc1NC(=O)N[C@@H]1CCCN(C)C1 ZINC000591528313 567285114 /nfs/dbraw/zinc/28/51/14/567285114.db2.gz XYYSUXCSORWWJN-SNVBAGLBSA-N 0 3 376.682 3.327 10 0 GGAEHN CN(C)[C@@H]1CCCN(C(=O)N[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000591573536 567287246 /nfs/dbraw/zinc/28/72/46/567287246.db2.gz WMHUJHHAALSHFP-HIFRSBDPSA-N 0 3 382.302 3.008 10 0 GGAEHN COc1ccc(C(=O)N2C[C@@H](SC)[C@H](N3CCCC3)C2)c(Br)c1 ZINC000548188281 567287210 /nfs/dbraw/zinc/28/72/10/567287210.db2.gz CGZMSRKXTWQKKU-HZPDHXFCSA-N 0 3 399.354 3.110 10 0 GGAEHN CN(C)[C@H](CNC(=O)c1cc(Br)cc2nc[nH]c21)c1cccs1 ZINC000499950620 567287798 /nfs/dbraw/zinc/28/77/98/567287798.db2.gz QZCVFMXFMPJIHT-CYBMUJFWSA-N 0 3 393.310 3.420 10 0 GGAEHN CCC(CC)(NC(=O)[C@H](N)CCC(=O)OC)c1ccc(Cl)c(Cl)c1 ZINC000567904478 567288978 /nfs/dbraw/zinc/28/89/78/567288978.db2.gz UPFRSPPTEHZUHW-CQSZACIVSA-N 0 3 375.296 3.405 10 0 GGAEHN COc1cc(C[NH2+]C[C@]2(CO)C[C@@H]2c2ccccc2)cc(Br)c1[O-] ZINC000685627260 567289368 /nfs/dbraw/zinc/28/93/68/567289368.db2.gz UVJBRVONFKAQBA-BEFAXECRSA-N 0 3 392.293 3.419 10 0 GGAEHN COc1ccc(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)cc1Br ZINC000617289897 567296487 /nfs/dbraw/zinc/29/64/87/567296487.db2.gz MOWYVWGIPMNTDY-INIZCTEOSA-N 0 3 391.309 3.360 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)c1cc(Br)ccc1F ZINC000617291008 567298192 /nfs/dbraw/zinc/29/81/92/567298192.db2.gz OXCWSDCDQMYXHI-HNNXBMFYSA-N 0 3 379.273 3.491 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)NC(C)(C)c1ccc(Br)cc1 ZINC000476172834 567301691 /nfs/dbraw/zinc/30/16/91/567301691.db2.gz YCJAVKKGBJZPFA-INIZCTEOSA-N 0 3 398.345 3.094 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)NC(C)(C)c1ccc(Br)cc1 ZINC000476174858 567301989 /nfs/dbraw/zinc/30/19/89/567301989.db2.gz YCJAVKKGBJZPFA-MRXNPFEDSA-N 0 3 398.345 3.094 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000476184712 567303440 /nfs/dbraw/zinc/30/34/40/567303440.db2.gz VGWGOXLPFJBGNM-SUMWQHHRSA-N 0 3 380.330 3.258 10 0 GGAEHN CCc1ccc([C@H](CNC(=O)c2cc[nH]c(=O)c2Br)N(C)C)cc1 ZINC000434328086 567303480 /nfs/dbraw/zinc/30/34/80/567303480.db2.gz UEJLHDSCDQRPFQ-HNNXBMFYSA-N 0 3 392.297 3.145 10 0 GGAEHN CCO[C@@H]1C[C@@H](NC(=O)NC[C@@H](c2cccs2)N2CCCC2)[C@@H]1SC ZINC000591894877 567303911 /nfs/dbraw/zinc/30/39/11/567303911.db2.gz LJYNVFYPOYHITI-DLTWYDFYSA-N 0 3 383.583 3.093 10 0 GGAEHN CS(=O)(=O)[C@@H]1CCC[C@H](N[C@@H]2CCCc3ncc(C(F)(F)F)cc32)C1 ZINC000548306284 567305783 /nfs/dbraw/zinc/30/57/83/567305783.db2.gz IOJKALJIWUQETC-WOSRLPQWSA-N 0 3 376.444 3.423 10 0 GGAEHN CS[C@H]1CN(c2nc(-c3cc(F)cc(F)c3)ns2)C[C@H]1N1CCCC1 ZINC000591931947 567305758 /nfs/dbraw/zinc/30/57/58/567305758.db2.gz ICKRXMOOSKVVPN-CABCVRRESA-N 0 3 382.505 3.499 10 0 GGAEHN CS(=O)(=O)[C@@H]1CCC[C@@H](N[C@@H]2CCCc3ncc(C(F)(F)F)cc32)C1 ZINC000548306285 567306284 /nfs/dbraw/zinc/30/62/84/567306284.db2.gz IOJKALJIWUQETC-XJKCOSOUSA-N 0 3 376.444 3.423 10 0 GGAEHN CC(=O)N1C[C@@H]2CCC[C@@H](NCc3ncc(Br)cc3Cl)[C@H]2C1 ZINC000660560959 567308431 /nfs/dbraw/zinc/30/84/31/567308431.db2.gz PMTZZWHGVGKQFP-CORIIIEPSA-N 0 3 386.721 3.234 10 0 GGAEHN Nc1n[nH]c(C2CCN([C@@H]3CCCc4ccc(Br)cc43)CC2)n1 ZINC000660566518 567309716 /nfs/dbraw/zinc/30/97/16/567309716.db2.gz FNVORQZXDRVNBM-OAHLLOKOSA-N 0 3 376.302 3.406 10 0 GGAEHN C[C@H](NCCO[C@@H]1CC1(F)F)c1ccc(Br)cc1OCCCO ZINC000660597503 567311382 /nfs/dbraw/zinc/31/13/82/567311382.db2.gz RLCKDLHICSQPQR-XHDPSFHLSA-N 0 3 394.256 3.285 10 0 GGAEHN C[C@@H](NCCO[C@H]1CC1(F)F)c1ccc(Br)cc1OCCCO ZINC000660597473 567311399 /nfs/dbraw/zinc/31/13/99/567311399.db2.gz RLCKDLHICSQPQR-ABAIWWIYSA-N 0 3 394.256 3.285 10 0 GGAEHN Brc1ccc([C@H](Cc2ccccn2)NC[C@@H]2CCc3ncnn32)cc1 ZINC000639610483 567312924 /nfs/dbraw/zinc/31/29/24/567312924.db2.gz WLMXLRAQAXTFHT-ROUUACIJSA-N 0 3 398.308 3.497 10 0 GGAEHN CCO[C@@H]1C[C@@H](NC(=O)N[C@H](CN(C)C)c2ccc(Cl)cc2)[C@@H]1SC ZINC000592085308 567313230 /nfs/dbraw/zinc/31/32/30/567313230.db2.gz BJYIASNTULKNOU-VQHPVUNQSA-N 0 3 385.961 3.151 10 0 GGAEHN COC(=O)c1cc(NC(=O)N[C@H](C)CN2CCCCC2)ccc1Br ZINC000548410396 567313261 /nfs/dbraw/zinc/31/32/61/567313261.db2.gz FKVRKHNDQIRYCY-GFCCVEGCSA-N 0 3 398.301 3.232 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CCC[C@H]1C[NH+]1CCCCC1 ZINC000548402483 567313325 /nfs/dbraw/zinc/31/33/25/567313325.db2.gz XCRYGGFTUFESRZ-INIZCTEOSA-N 0 3 381.314 3.174 10 0 GGAEHN Brc1ccc([C@H](Cc2ccccn2)NC[C@H]2CCc3ncnn32)cc1 ZINC000639610481 567313782 /nfs/dbraw/zinc/31/37/82/567313782.db2.gz WLMXLRAQAXTFHT-MSOLQXFVSA-N 0 3 398.308 3.497 10 0 GGAEHN COC(=O)CC1(NCC(=O)N[C@H](C)c2ccc(Br)cc2)CCCC1 ZINC000548426775 567314935 /nfs/dbraw/zinc/31/49/35/567314935.db2.gz GQWQNNLULGYUFE-CYBMUJFWSA-N 0 3 397.313 3.092 10 0 GGAEHN C[C@@H](NCc1cc[nH]c(=O)c1)c1ccc(Br)cc1OCCCO ZINC000639651609 567316557 /nfs/dbraw/zinc/31/65/57/567316557.db2.gz BZBDNBWDNHFKQW-GFCCVEGCSA-N 0 3 381.270 3.162 10 0 GGAEHN O=C(CSc1nc2cc(F)cc(Cl)c2o1)NC1CCN(C2CC2)CC1 ZINC000548477873 567318180 /nfs/dbraw/zinc/31/81/80/567318180.db2.gz XGCYVZBFPOUNSB-UHFFFAOYSA-N 0 3 383.876 3.455 10 0 GGAEHN CCO[C@@H]1C[C@@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)[C@@H]1SC ZINC000592169218 567319848 /nfs/dbraw/zinc/31/98/48/567319848.db2.gz MVMMQHHHGJXQKX-HLRQMNNKSA-N 0 3 380.337 3.232 10 0 GGAEHN CCO[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)[C@@H]1SC ZINC000592168163 567319987 /nfs/dbraw/zinc/31/99/87/567319987.db2.gz GFWHLKMWEGAJOA-KCXZSRPNSA-N 0 3 380.337 3.232 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)N1CC[C@@H]1c1ccc(Br)cc1 ZINC000660699784 567320916 /nfs/dbraw/zinc/32/09/16/567320916.db2.gz GGVROXFSGJQAIB-DLBZAZTESA-N 0 3 396.329 3.016 10 0 GGAEHN CCN(C(=O)c1cnn(-c2ccc(Br)cc2)c1C)[C@H]1CCN(C)C1 ZINC000617559146 567321953 /nfs/dbraw/zinc/32/19/53/567321953.db2.gz UPDCMJIBZZRYHM-INIZCTEOSA-N 0 3 391.313 3.109 10 0 GGAEHN CCN(C(=O)c1ccc(Br)cc1Br)[C@@H]1CCN(C)C1 ZINC000617552442 567322138 /nfs/dbraw/zinc/32/21/38/567322138.db2.gz OBOCWZNMANKKMT-LLVKDONJSA-N 0 3 390.119 3.378 10 0 GGAEHN CCN(C(=O)c1ccc(Br)cc1Br)[C@H]1CCN(C)C1 ZINC000617552443 567322333 /nfs/dbraw/zinc/32/23/33/567322333.db2.gz OBOCWZNMANKKMT-NSHDSACASA-N 0 3 390.119 3.378 10 0 GGAEHN CCN(C(=O)c1cc2c([nH]1)c(Br)ccc2OC)[C@H]1CCN(C)C1 ZINC000617557915 567322454 /nfs/dbraw/zinc/32/24/54/567322454.db2.gz WIGDZRWQNYWGOW-NSHDSACASA-N 0 3 380.286 3.105 10 0 GGAEHN CC(=O)c1cc(Cl)c(Cl)cc1OCC(=O)NC1CCN(C2CC2)CC1 ZINC000434738277 567323814 /nfs/dbraw/zinc/32/38/14/567323814.db2.gz QPMMZCYZPLZXEW-UHFFFAOYSA-N 0 3 385.291 3.318 10 0 GGAEHN CN(C(=O)NCCc1nc2cc(Cl)ccc2s1)[C@H]1CCN(C2CC2)C1 ZINC000476441593 567324494 /nfs/dbraw/zinc/32/44/94/567324494.db2.gz USERHUYMNYXCLJ-AWEZNQCLSA-N 0 3 378.929 3.370 10 0 GGAEHN COc1ccc(Br)c2sc(NC(=O)C3CCN(C)CC3)nc21 ZINC000617585154 567324838 /nfs/dbraw/zinc/32/48/38/567324838.db2.gz VIFIHPWWIWNOAT-UHFFFAOYSA-N 0 3 384.299 3.348 10 0 GGAEHN CN1CCC[C@@H](CNC(=O)C(=O)Nc2cc(Cl)c(Cl)c(Cl)c2)C1 ZINC000568399870 567325740 /nfs/dbraw/zinc/32/57/40/567325740.db2.gz GCCUVQYVUQTNLD-VIFPVBQESA-N 0 3 378.687 3.043 10 0 GGAEHN CCN(CC)CCN(C(=O)CC1(COC)CC1)c1ccc(Br)cn1 ZINC000568396792 567326179 /nfs/dbraw/zinc/32/61/79/567326179.db2.gz XESHNMMRHUULMW-UHFFFAOYSA-N 0 3 398.345 3.336 10 0 GGAEHN C[C@@H]1CN(CCCCNC(=O)c2csc(Br)c2)C[C@H](C)O1 ZINC000434775631 567328028 /nfs/dbraw/zinc/32/80/28/567328028.db2.gz KYKMVDQALAIFCL-TXEJJXNPSA-N 0 3 375.332 3.130 10 0 GGAEHN Brc1ccc(S[C@H]2CCN(C[C@H]3CCc4ncnn43)C2)cc1 ZINC000639889492 567328157 /nfs/dbraw/zinc/32/81/57/567328157.db2.gz FPCIGEWKKWZQKT-HIFRSBDPSA-N 0 3 379.327 3.395 10 0 GGAEHN Brc1ccc(S[C@@H]2CCN(C[C@H]3CCc4ncnn43)C2)cc1 ZINC000639889493 567328764 /nfs/dbraw/zinc/32/87/64/567328764.db2.gz FPCIGEWKKWZQKT-UKRRQHHQSA-N 0 3 379.327 3.395 10 0 GGAEHN C[C@@H]1CN(CCCCNC(=O)COc2ccc(Cl)c(Cl)c2)C[C@@H](C)O1 ZINC000434786481 567328800 /nfs/dbraw/zinc/32/88/00/567328800.db2.gz OVIITYHLRDMWDO-ZIAGYGMSSA-N 0 3 389.323 3.378 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1sccc1Br ZINC000617700009 567328910 /nfs/dbraw/zinc/32/89/10/567328910.db2.gz YLRULIYHDISPPT-CQSZACIVSA-N 0 3 395.322 3.007 10 0 GGAEHN CN1CCC[C@H](NC(=O)N[C@H]2CSCc3ccc(Br)cc32)C1 ZINC000660837886 567328914 /nfs/dbraw/zinc/32/89/14/567328914.db2.gz QGLUDXTYDRCGRD-ZFWWWQNUSA-N 0 3 384.343 3.130 10 0 GGAEHN CN1CCC[C@H](CNC(=O)NCC2(Cc3ccc(Br)cc3)CC2)C1 ZINC000660848061 567329571 /nfs/dbraw/zinc/32/95/71/567329571.db2.gz UPJPOIHCAPLCKF-MRXNPFEDSA-N 0 3 394.357 3.413 10 0 GGAEHN CN1CCC[C@@H](NC(=O)N[C@H]2CSCc3ccc(Br)cc32)C1 ZINC000660837884 567330284 /nfs/dbraw/zinc/33/02/84/567330284.db2.gz QGLUDXTYDRCGRD-HIFRSBDPSA-N 0 3 384.343 3.130 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1c(Cl)cccc1Cl ZINC000617700549 567330292 /nfs/dbraw/zinc/33/02/92/567330292.db2.gz GWADTHUVSFCMOY-OAHLLOKOSA-N 0 3 379.287 3.490 10 0 GGAEHN C[N@H+](CC[N-]S(=O)(=O)c1cc(Br)ccc1F)C1CCCCC1 ZINC000500601731 567333258 /nfs/dbraw/zinc/33/32/58/567333258.db2.gz MNLUMPFXXXMEBT-UHFFFAOYSA-N 0 3 393.322 3.131 10 0 GGAEHN C[N@@H+](CC[N-]S(=O)(=O)c1cc(Br)ccc1F)C1CCCCC1 ZINC000500601731 567333264 /nfs/dbraw/zinc/33/32/64/567333264.db2.gz MNLUMPFXXXMEBT-UHFFFAOYSA-N 0 3 393.322 3.131 10 0 GGAEHN C[C@@H](NCC(C)(C)[C@]1(O)CCOC1)c1ccccc1I ZINC000592398115 567334619 /nfs/dbraw/zinc/33/46/19/567334619.db2.gz OQJUNPYYFCKSRA-WBMJQRKESA-N 0 3 389.277 3.119 10 0 GGAEHN Cc1ccc2c(c1Br)CN(C(=O)N[C@H](C)C1=CCN(C)CC1)C2 ZINC000661009435 567339722 /nfs/dbraw/zinc/33/97/22/567339722.db2.gz JDXNSVIOSPEJHT-CYBMUJFWSA-N 0 3 378.314 3.433 10 0 GGAEHN CCN(CC)CCN(C(=O)c1cc(C)no1)c1ccc(Br)cn1 ZINC000568587062 567340455 /nfs/dbraw/zinc/34/04/55/567340455.db2.gz CXYHRYTYTYRDIC-UHFFFAOYSA-N 0 3 381.274 3.129 10 0 GGAEHN CCN(CC)CCN(C(=O)C[C@@H]1CCCCO1)c1ccc(Br)cn1 ZINC000568587309 567341007 /nfs/dbraw/zinc/34/10/07/567341007.db2.gz KSLGFAFABNJMRP-INIZCTEOSA-N 0 3 398.345 3.478 10 0 GGAEHN O=C1C[C@]2(CCN(Cc3cnc(-c4ccc(Br)cc4)s3)C2)CN1 ZINC000435061077 567341121 /nfs/dbraw/zinc/34/11/21/567341121.db2.gz XDYZYUWLARLCFB-QGZVFWFLSA-N 0 3 392.322 3.285 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N1CCO[C@H](c2cc(F)c(Cl)cc2Cl)C1 ZINC000592509896 567342621 /nfs/dbraw/zinc/34/26/21/567342621.db2.gz JPFMAMMFNJMDJH-ZBEGNZNMSA-N 0 3 390.286 3.310 10 0 GGAEHN CN1CCC[C@@H]1CNC(=O)N1CCO[C@@H](c2cc(F)c(Cl)cc2Cl)C1 ZINC000592509708 567342647 /nfs/dbraw/zinc/34/26/47/567342647.db2.gz JPFMAMMFNJMDJH-BDJLRTHQSA-N 0 3 390.286 3.310 10 0 GGAEHN CCCN1CC[C@@H](NC(=O)N[C@H](C)c2ccc(Br)cc2OC)C1 ZINC000661058698 567343787 /nfs/dbraw/zinc/34/37/87/567343787.db2.gz QOVWONRKBHZLIH-TZMCWYRMSA-N 0 3 384.318 3.302 10 0 GGAEHN CCCN1CC[C@H](NC(=O)N[C@@H](C)c2ccc(Br)cc2OC)C1 ZINC000661058696 567344271 /nfs/dbraw/zinc/34/42/71/567344271.db2.gz QOVWONRKBHZLIH-JSGCOSHPSA-N 0 3 384.318 3.302 10 0 GGAEHN CCCN1CC[C@@H](NC(=O)N[C@@H](C)c2ccc(Br)cc2OC)C1 ZINC000661058695 567344348 /nfs/dbraw/zinc/34/43/48/567344348.db2.gz QOVWONRKBHZLIH-GXTWGEPZSA-N 0 3 384.318 3.302 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000548729255 567344845 /nfs/dbraw/zinc/34/48/45/567344845.db2.gz MQHLQZVQPBCHIY-INIZCTEOSA-N 0 3 381.314 3.174 10 0 GGAEHN OCC1([C@H](NCc2ncc(Br)cc2Cl)C2CC2)CCOCC1 ZINC000661076225 567345606 /nfs/dbraw/zinc/34/56/06/567345606.db2.gz ALYZTJJLDNNXLB-OAHLLOKOSA-N 0 3 389.721 3.155 10 0 GGAEHN CCN(C(=O)c1ccn(-c2ccc(Br)cc2)n1)[C@H]1CCN(CC)C1 ZINC000617924259 567345948 /nfs/dbraw/zinc/34/59/48/567345948.db2.gz RBWFXRBHSRRMLS-INIZCTEOSA-N 0 3 391.313 3.191 10 0 GGAEHN CCN(C(=O)c1cnn(-c2ccc(Br)cc2)c1)[C@@H]1CCN(CC)C1 ZINC000617931438 567346114 /nfs/dbraw/zinc/34/61/14/567346114.db2.gz XDEXBJVQTLDFBK-QGZVFWFLSA-N 0 3 391.313 3.191 10 0 GGAEHN CCN(C(=O)Cc1c[nH]c2cccc(Br)c12)[C@@H]1CCN(CC)C1 ZINC000617927238 567346309 /nfs/dbraw/zinc/34/63/09/567346309.db2.gz SRXBBMOKISCPEX-CQSZACIVSA-N 0 3 378.314 3.416 10 0 GGAEHN CCN(C(=O)c1cc(Br)c(OC)c(OC)c1)[C@@H]1CCN(CC)C1 ZINC000617923826 567346441 /nfs/dbraw/zinc/34/64/41/567346441.db2.gz JJMFKTYSBZKCQG-CYBMUJFWSA-N 0 3 385.302 3.023 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)N2CCc3ccc(F)c(Br)c3C2)CCN1C ZINC000527594685 567346335 /nfs/dbraw/zinc/34/63/35/567346335.db2.gz QCZIGYCIUIUCOR-DGCLKSJQSA-N 0 3 384.293 3.139 10 0 GGAEHN C[C@@H](NC(=O)Cc1ccc(Br)cc1[O-])[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000548733967 567346675 /nfs/dbraw/zinc/34/66/75/567346675.db2.gz DBKPENJKGMFPQP-HIFRSBDPSA-N 0 3 395.341 3.466 10 0 GGAEHN C[C@@H](NC(=O)Cc1ccc(Br)cc1[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000548733967 567346682 /nfs/dbraw/zinc/34/66/82/567346682.db2.gz DBKPENJKGMFPQP-HIFRSBDPSA-N 0 3 395.341 3.466 10 0 GGAEHN CN(CC1=CCSC1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000661100520 567346810 /nfs/dbraw/zinc/34/68/10/567346810.db2.gz FBLXWGGRIOLUCK-UHFFFAOYSA-N 0 3 377.476 3.106 10 0 GGAEHN C[C@H](NC(=O)Cc1ccc(Br)cc1[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000548733966 567346988 /nfs/dbraw/zinc/34/69/88/567346988.db2.gz DBKPENJKGMFPQP-DZGCQCFKSA-N 0 3 395.341 3.466 10 0 GGAEHN C[C@H](NC(=O)Cc1ccc(Br)cc1[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000548733966 567346996 /nfs/dbraw/zinc/34/69/96/567346996.db2.gz DBKPENJKGMFPQP-DZGCQCFKSA-N 0 3 395.341 3.466 10 0 GGAEHN COC(=O)CC1(NCc2ccc(OC)c(OC)c2Br)CCCC1 ZINC000548755324 567347144 /nfs/dbraw/zinc/34/71/44/567347144.db2.gz YCZINCHISSQLCK-UHFFFAOYSA-N 0 3 386.286 3.432 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000661127153 567349676 /nfs/dbraw/zinc/34/96/76/567349676.db2.gz IHLNJXLJROADHE-WFASDCNBSA-N 0 3 396.329 3.445 10 0 GGAEHN O=C(CCCN1CC[C@@H](Cn2ccnn2)C1)c1ccc(Br)cc1 ZINC000661138963 567351011 /nfs/dbraw/zinc/35/10/11/567351011.db2.gz FXSGATUOWYSHMW-CQSZACIVSA-N 0 3 377.286 3.026 10 0 GGAEHN COC[C@H](NCC(=O)N[C@@H](C)c1ccc(Cl)c(Cl)c1)C1CCOCC1 ZINC000661161081 567352339 /nfs/dbraw/zinc/35/23/39/567352339.db2.gz QTFCPYKNIRSQCS-SJCJKPOMSA-N 0 3 389.323 3.202 10 0 GGAEHN Cc1sc(NC(=O)CN[C@@H](CO)C2CCC2)nc1-c1ccc(Cl)cc1 ZINC000661151133 567353378 /nfs/dbraw/zinc/35/33/78/567353378.db2.gz CQMGSZRXRLRVAI-HNNXBMFYSA-N 0 3 379.913 3.461 10 0 GGAEHN CN(CCC(=O)N[C@H]1COc2cc(F)c(Br)cc21)c1ccncc1 ZINC000548819641 567353845 /nfs/dbraw/zinc/35/38/45/567353845.db2.gz YLCCVFSHAMRWSJ-HNNXBMFYSA-N 0 3 394.244 3.059 10 0 GGAEHN O=C(CCNC[C@@H]1COc2ccccc2O1)Nc1ccc(Br)cc1 ZINC000548832133 567353993 /nfs/dbraw/zinc/35/39/93/567353993.db2.gz HWZFKBIXSZKYHN-OAHLLOKOSA-N 0 3 391.265 3.207 10 0 GGAEHN CN(C)c1ncccc1CNCCC(=O)Nc1cccc(Br)c1 ZINC000568750941 567354004 /nfs/dbraw/zinc/35/40/04/567354004.db2.gz QAPITZMXXBTAGB-UHFFFAOYSA-N 0 3 377.286 3.029 10 0 GGAEHN CC(C)Oc1cc(Cl)c(CNC2CCN(S(C)(=O)=O)CC2)cc1Cl ZINC000527636943 567354623 /nfs/dbraw/zinc/35/46/23/567354623.db2.gz ZOAIHLZLBJKXCT-UHFFFAOYSA-N 0 3 395.352 3.294 10 0 GGAEHN O=C(NCc1cc(F)c(Br)cc1F)NC1CCN(C2CC2)CC1 ZINC000527649711 567354930 /nfs/dbraw/zinc/35/49/30/567354930.db2.gz QQSNTMCPFWHYLZ-UHFFFAOYSA-N 0 3 388.256 3.153 10 0 GGAEHN CCC[C@H](C)[C@H](CO)N[C@H](CC)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000568758099 567354908 /nfs/dbraw/zinc/35/49/08/567354908.db2.gz PLZRPRFOMKZCKX-MAZHCROVSA-N 0 3 376.950 3.086 10 0 GGAEHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cc(Br)cc2[nH]cnc21 ZINC000548843747 567355594 /nfs/dbraw/zinc/35/55/94/567355594.db2.gz RTYCNHWRJWSJBG-HNNXBMFYSA-N 0 3 399.292 3.330 10 0 GGAEHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cc(Br)cc2nc[nH]c21 ZINC000548843747 567355598 /nfs/dbraw/zinc/35/55/98/567355598.db2.gz RTYCNHWRJWSJBG-HNNXBMFYSA-N 0 3 399.292 3.330 10 0 GGAEHN CO[C@@H]1CCC[C@H]([C@H](CO)NCc2cc(Br)cc(F)c2F)C1 ZINC000661219562 567357087 /nfs/dbraw/zinc/35/70/87/567357087.db2.gz USJYIPNVHKWZOY-ZBINZKHDSA-N 0 3 378.257 3.383 10 0 GGAEHN CO[C@@H]1CCC[C@@H]([C@H](CO)NCC(=O)Nc2ccc(Cl)c(Cl)c2)C1 ZINC000661218239 567357916 /nfs/dbraw/zinc/35/79/16/567357916.db2.gz KVPGTZGZJLPJBO-KFNAQCHYSA-N 0 3 375.296 3.088 10 0 GGAEHN CO[C@@H]1CCC[C@H]([C@H](CO)NCC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000661215810 567358042 /nfs/dbraw/zinc/35/80/42/567358042.db2.gz HRCLVGMSVQGQHQ-ZOWXZIJZSA-N 0 3 375.296 3.088 10 0 GGAEHN CO[C@@H]1CCC[C@@H]([C@@H](CO)NCC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000661215808 567358157 /nfs/dbraw/zinc/35/81/57/567358157.db2.gz HRCLVGMSVQGQHQ-LALPHHSUSA-N 0 3 375.296 3.088 10 0 GGAEHN CN(C)CCNC(=O)c1ccc(CNCc2ccsc2Br)cc1 ZINC000527663240 567358185 /nfs/dbraw/zinc/35/81/85/567358185.db2.gz WUIRLEHGFHRBGD-UHFFFAOYSA-N 0 3 396.354 3.092 10 0 GGAEHN OC[C@@H]1CCN(Cc2ccccc2)C[C@@H]1NCc1ccsc1Br ZINC000527667560 567358218 /nfs/dbraw/zinc/35/82/18/567358218.db2.gz XTFVINVMEVAVNL-IRXDYDNUSA-N 0 3 395.366 3.483 10 0 GGAEHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1cc[nH]c(=O)c1Br ZINC000435345462 567358378 /nfs/dbraw/zinc/35/83/78/567358378.db2.gz FWAPCRJSORCCSW-OAHLLOKOSA-N 0 3 390.281 3.117 10 0 GGAEHN O=C(NCc1cc(F)ccc1Br)NC[C@@H]1CCN1C1CCCC1 ZINC000527669377 567358976 /nfs/dbraw/zinc/35/89/76/567358976.db2.gz FZETZBXKSJDDOR-HNNXBMFYSA-N 0 3 384.293 3.404 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1cnn(-c2cccc(Br)c2)c1 ZINC000592741379 567359231 /nfs/dbraw/zinc/35/92/31/567359231.db2.gz IWPSPTDWWBEEOW-AWEZNQCLSA-N 0 3 391.313 3.239 10 0 GGAEHN CO[C@@H]1CCC[C@H]([C@H](CO)NCC(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000661221606 567359296 /nfs/dbraw/zinc/35/92/96/567359296.db2.gz WLRJPEVKUHRYAW-GHJWDPDVSA-N 0 3 375.296 3.088 10 0 GGAEHN CCCS(=O)(=O)c1ccccc1S(=O)(=O)CCN[C@H](C)C(C)(C)CC ZINC000661231377 567359320 /nfs/dbraw/zinc/35/93/20/567359320.db2.gz MDIJUFVBDMEKDJ-OAHLLOKOSA-N 0 3 389.583 3.058 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)c1cnn(-c2cccc(Br)c2)c1 ZINC000592751011 567361102 /nfs/dbraw/zinc/36/11/02/567361102.db2.gz WEBWFOOJJXMREA-INIZCTEOSA-N 0 3 393.329 3.341 10 0 GGAEHN Cc1nc(CCNCc2cc(Br)c(C)cc2Br)n[nH]1 ZINC000527689335 567362127 /nfs/dbraw/zinc/36/21/27/567362127.db2.gz ZBEBLLUHVWZTSN-UHFFFAOYSA-N 0 3 388.107 3.279 10 0 GGAEHN Cc1n[nH]c(CCNCc2cc(Br)c(C)cc2Br)n1 ZINC000527689335 567362130 /nfs/dbraw/zinc/36/21/30/567362130.db2.gz ZBEBLLUHVWZTSN-UHFFFAOYSA-N 0 3 388.107 3.279 10 0 GGAEHN Cc1cc(Br)c(CNC[C@]2(O)CCO[C@@H]2C)cc1Br ZINC000527698916 567364921 /nfs/dbraw/zinc/36/49/21/567364921.db2.gz ATECWAIBWDTDGI-QMTHXVAHSA-N 0 3 393.119 3.150 10 0 GGAEHN O=C(NCc1ccc(Br)c(F)c1)NC[C@H]1CCN1C1CCCC1 ZINC000527709673 567365973 /nfs/dbraw/zinc/36/59/73/567365973.db2.gz UXGWKFUPDSESTL-CQSZACIVSA-N 0 3 384.293 3.404 10 0 GGAEHN Cc1cc(Br)c(CN[C@@H]2CC[C@H](C(N)=O)C2)cc1Br ZINC000527715539 567367864 /nfs/dbraw/zinc/36/78/64/567367864.db2.gz DHRVSVIOWSVHBV-GXSJLCMTSA-N 0 3 390.119 3.264 10 0 GGAEHN CCOc1cc(CNCCCn2cc(Br)cn2)c(F)cc1OC ZINC000527712696 567368672 /nfs/dbraw/zinc/36/86/72/567368672.db2.gz XGXYKBDHLKDIFY-UHFFFAOYSA-N 0 3 386.265 3.372 10 0 GGAEHN CCCN(C(=O)c1ccc(C)c(I)c1)[C@@H]1CCN(C)C1 ZINC000592830122 567368612 /nfs/dbraw/zinc/36/86/12/567368612.db2.gz BQNXZWKKBIXAQC-CQSZACIVSA-N 0 3 386.277 3.156 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N[C@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000477070619 567369068 /nfs/dbraw/zinc/36/90/68/567369068.db2.gz BGMCUERSJTUADK-HOTGVXAUSA-N 0 3 384.293 3.433 10 0 GGAEHN CC(C)(C)C1=CCN(CCNC(=O)Cc2ccc(Br)cc2O)CC1 ZINC000501143636 567369503 /nfs/dbraw/zinc/36/95/03/567369503.db2.gz FSSRLFHFJWSEDT-UHFFFAOYSA-N 0 3 395.341 3.492 10 0 GGAEHN Cn1nccc1CCN1CCC[C@H]1c1ccccc1I ZINC000549041120 567371130 /nfs/dbraw/zinc/37/11/30/567371130.db2.gz XFWZMHPYJVTPLW-INIZCTEOSA-N 0 3 381.261 3.404 10 0 GGAEHN O[C@H](CNCc1cnc(-c2ccc(Br)cc2)s1)[C@@H]1CCCO1 ZINC000527757251 567371575 /nfs/dbraw/zinc/37/15/75/567371575.db2.gz IUYMRJKHGJZZOB-CABCVRRESA-N 0 3 383.311 3.202 10 0 GGAEHN CS(=O)(=O)NCCN[C@H](c1cccc(C(F)(F)F)c1)C1CCCCC1 ZINC000549077426 567372228 /nfs/dbraw/zinc/37/22/28/567372228.db2.gz JUNMEOLIKFSTOT-INIZCTEOSA-N 0 3 378.460 3.466 10 0 GGAEHN NC[C@@H](C(=O)N1CCOc2ccc(Br)cc2C1)c1ccc(F)cc1 ZINC000568999012 567372417 /nfs/dbraw/zinc/37/24/17/567372417.db2.gz QDXBOFLLOMSXHK-MRXNPFEDSA-N 0 3 393.256 3.052 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)N[C@@H](C)Cc1ccc(Cl)cc1Cl ZINC000477130961 567372477 /nfs/dbraw/zinc/37/24/77/567372477.db2.gz BNSIRBRUAJQUTO-XJKSGUPXSA-N 0 3 388.339 3.334 10 0 GGAEHN CS[C@H]1CN(c2ccc(Br)c(C(F)(F)F)n2)C[C@H]1N(C)C ZINC000569010589 567373393 /nfs/dbraw/zinc/37/33/93/567373393.db2.gz QCFHPFRRBKKHGU-ZJUUUORDSA-N 0 3 384.265 3.345 10 0 GGAEHN CN(CCC(=O)N(C)[C@H](CO)c1cccc(Cl)c1Cl)c1ccncc1 ZINC000618342025 567374725 /nfs/dbraw/zinc/37/47/25/567374725.db2.gz SACYSANTJMVAGU-MRXNPFEDSA-N 0 3 382.291 3.407 10 0 GGAEHN C[C@@H]1C[C@@H](NC(=O)NCc2cc(F)c(Br)cc2F)CCN1C ZINC000527808345 567374719 /nfs/dbraw/zinc/37/47/19/567374719.db2.gz MXQIYGJCPLNXTD-KOLCDFICSA-N 0 3 376.245 3.009 10 0 GGAEHN C[C@H](NC(=O)N[C@@H]1CCCN(C)C1)c1cc(F)c(Br)cc1F ZINC000527797905 567374746 /nfs/dbraw/zinc/37/47/46/567374746.db2.gz DNYOFYFCLVQULL-VHSXEESVSA-N 0 3 376.245 3.182 10 0 GGAEHN C[C@H](NC(=O)NC[C@@H]1CCCN1C)c1cc(F)c(Br)cc1F ZINC000527799618 567375413 /nfs/dbraw/zinc/37/54/13/567375413.db2.gz YBWQPMWNTNWWDF-UWVGGRQHSA-N 0 3 376.245 3.182 10 0 GGAEHN Cc1cc(Br)cn2c(CNC[C@H]3c4ccccc4C(=O)N3C)cnc12 ZINC000527805452 567375587 /nfs/dbraw/zinc/37/55/87/567375587.db2.gz IXGIONFNOYONIH-KRWDZBQOSA-N 0 3 399.292 3.322 10 0 GGAEHN CCN1CCC(NC(=O)NCc2ccc(Br)c(F)c2F)CC1 ZINC000527795564 567375744 /nfs/dbraw/zinc/37/57/44/567375744.db2.gz PYWHDCSOYNAMSP-UHFFFAOYSA-N 0 3 376.245 3.011 10 0 GGAEHN COc1sc(CNCC(C)(C)C(=O)N2CCCC2)cc1Br ZINC000527814050 567376242 /nfs/dbraw/zinc/37/62/42/567376242.db2.gz ZNYPWSCCOYLVGF-UHFFFAOYSA-N 0 3 375.332 3.257 10 0 GGAEHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)NCc1cc(F)c(Br)cc1F ZINC000527820518 567376342 /nfs/dbraw/zinc/37/63/42/567376342.db2.gz LXIQKSXXSPPLMW-VFZGTOFNSA-N 0 3 388.256 3.009 10 0 GGAEHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)NCc1cc(F)c(Br)cc1F ZINC000527820516 567376950 /nfs/dbraw/zinc/37/69/50/567376950.db2.gz LXIQKSXXSPPLMW-PSLIRLAXSA-N 0 3 388.256 3.009 10 0 GGAEHN C[C@H]1C[C@@H](NC(=O)NCc2cc(F)c(Br)cc2F)CCN1C ZINC000527808350 567377191 /nfs/dbraw/zinc/37/71/91/567377191.db2.gz MXQIYGJCPLNXTD-ONGXEEELSA-N 0 3 376.245 3.009 10 0 GGAEHN Cc1cc(Br)cn2c(CNCC(C)(C)C(=O)N3CCCC3)cnc12 ZINC000527813937 567377355 /nfs/dbraw/zinc/37/73/55/567377355.db2.gz WYEGWUFHCMNLGD-UHFFFAOYSA-N 0 3 393.329 3.143 10 0 GGAEHN CN(CCC(=O)N1CCOc2ccc(Br)cc2C1)c1ccncc1 ZINC000549188458 567378240 /nfs/dbraw/zinc/37/82/40/567378240.db2.gz QUNAORKJNDDQBV-UHFFFAOYSA-N 0 3 390.281 3.092 10 0 GGAEHN C[C@H]1c2ccccc2C[C@H]1NCc1nnnn1-c1ccccc1Br ZINC000661521627 567378711 /nfs/dbraw/zinc/37/87/11/567378711.db2.gz NJJGYHLDGUETOU-BLLLJJGKSA-N 0 3 384.281 3.243 10 0 GGAEHN O=C(CCNC1(c2ccccc2Cl)CCC1)NC(=O)NCC(F)(F)F ZINC000593041098 567380938 /nfs/dbraw/zinc/38/09/38/567380938.db2.gz IJGQSUPMLWQCLZ-UHFFFAOYSA-N 0 3 377.794 3.087 10 0 GGAEHN CN(C)CCn1cc(NC(=O)CCc2nc3cc(Cl)ccc3s2)cn1 ZINC000593056921 567382618 /nfs/dbraw/zinc/38/26/18/567382618.db2.gz VNILYARTKXBBRU-UHFFFAOYSA-N 0 3 377.901 3.279 10 0 GGAEHN Cc1cc(N2CCC[C@H](N3C[C@@H](C)[C@H](O)[C@@H](C)C3)C2=O)ccc1Br ZINC000661629524 567384050 /nfs/dbraw/zinc/38/40/50/567384050.db2.gz XQUKMOAIRSGGHH-IHETXDGRSA-N 0 3 395.341 3.202 10 0 GGAEHN CN1CCC2(CC1)C[C@H](NC(=O)[C@H]1C[C@]1(C)Br)c1ccccc1O2 ZINC000527928961 567384988 /nfs/dbraw/zinc/38/49/88/567384988.db2.gz FBTGWCCJQKFXNZ-VKJFTORMSA-N 0 3 393.325 3.264 10 0 GGAEHN C[C@H](NC[C@H](O)[C@H]1CCCO1)c1ccc(Br)cc1Br ZINC000527953451 567386327 /nfs/dbraw/zinc/38/63/27/567386327.db2.gz QVBGUNYGDQQOPC-QCZZGDTMSA-N 0 3 393.119 3.402 10 0 GGAEHN C[C@H](NC[C@H](O)[C@@H]1CCCO1)c1ccc(Br)cc1Br ZINC000527953450 567386400 /nfs/dbraw/zinc/38/64/00/567386400.db2.gz QVBGUNYGDQQOPC-HERUPUMHSA-N 0 3 393.119 3.402 10 0 GGAEHN C[C@@H](NC(=O)NC[C@H]1CCN1C1CCCCC1)c1ncc(Br)cn1 ZINC000527966946 567386792 /nfs/dbraw/zinc/38/67/92/567386792.db2.gz OMCLTJZIXBUPPV-IUODEOHRSA-N 0 3 396.333 3.006 10 0 GGAEHN CN(C)[C@@H](CNC(=O)Cc1ccc(Br)cc1O)c1ccccc1 ZINC000477288758 567387446 /nfs/dbraw/zinc/38/74/46/567387446.db2.gz CFTLGSDWXQCZRB-INIZCTEOSA-N 0 3 377.282 3.116 10 0 GGAEHN Fc1c(Br)ccc(CNC2CCN(c3cnccn3)CC2)c1F ZINC000527982244 567387629 /nfs/dbraw/zinc/38/76/29/567387629.db2.gz BGQAXSAXHIRWOJ-UHFFFAOYSA-N 0 3 383.240 3.276 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1ccc(F)c(I)c1 ZINC000477309243 567387843 /nfs/dbraw/zinc/38/78/43/567387843.db2.gz OZMURLBMRKWJJS-LLVKDONJSA-N 0 3 390.240 3.035 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CCC(C[NH+]2CCCC2)CC1 ZINC000477351995 567389839 /nfs/dbraw/zinc/38/98/39/567389839.db2.gz PQSVXWSAFITAPG-UHFFFAOYSA-N 0 3 381.314 3.032 10 0 GGAEHN COc1ccc([C@H](N[C@@H](C)Cn2cc(Br)ccc2=O)C2CC2)cn1 ZINC000528043707 567391624 /nfs/dbraw/zinc/39/16/24/567391624.db2.gz RKZGSVMRDBTXIE-KPZWWZAWSA-N 0 3 392.297 3.144 10 0 GGAEHN Cn1cc(C[C@H]2CCC[C@@H]2NCc2cn3cc(Br)ccc3n2)cn1 ZINC000661780278 567392523 /nfs/dbraw/zinc/39/25/23/567392523.db2.gz PTPPLSDRHONING-PBHICJAKSA-N 0 3 388.313 3.331 10 0 GGAEHN Cn1cc(C[C@H]2CCC[C@H]2NCC(=O)Nc2ccccc2Br)cn1 ZINC000661777581 567393154 /nfs/dbraw/zinc/39/31/54/567393154.db2.gz IFPOARYREGNIKF-GDBMZVCRSA-N 0 3 391.313 3.122 10 0 GGAEHN O[C@H](CN[C@H]1CCOc2c(Br)cccc21)COc1ccccc1 ZINC000501501068 567393238 /nfs/dbraw/zinc/39/32/38/567393238.db2.gz KVVCOPSDDMMCML-DYVFJYSZSA-N 0 3 378.266 3.302 10 0 GGAEHN COCCCN(C)CCNC(=O)c1c(C)cc(Br)cc1Cl ZINC000477428447 567393402 /nfs/dbraw/zinc/39/34/02/567393402.db2.gz HGHQCKDDXXNZQD-UHFFFAOYSA-N 0 3 377.710 3.109 10 0 GGAEHN COc1cc(-c2noc([C@H]3C[C@]3(C)Br)n2)ccc1OCCN(C)C ZINC000528105211 567395239 /nfs/dbraw/zinc/39/52/39/567395239.db2.gz XOKTVYCVNHQFKH-PXAZEXFGSA-N 0 3 396.285 3.327 10 0 GGAEHN O[C@H](CN[C@H]1CCOc2c(Br)cccc21)COc1ccccc1F ZINC000501544503 567395384 /nfs/dbraw/zinc/39/53/84/567395384.db2.gz DRURIRAOQUFFJA-WBMJQRKESA-N 0 3 396.256 3.441 10 0 GGAEHN C[NH+](C)C[C@H](Cc1ccccc1)NC(=O)c1cc([O-])cc(Br)c1 ZINC000528104603 567395876 /nfs/dbraw/zinc/39/58/76/567395876.db2.gz JOMKROVFCGVXJW-INIZCTEOSA-N 0 3 377.282 3.057 10 0 GGAEHN C[NH+](C)C[C@@H](Cc1ccccc1)NC(=O)c1cc([O-])cc(Br)c1 ZINC000528104605 567395893 /nfs/dbraw/zinc/39/58/93/567395893.db2.gz JOMKROVFCGVXJW-MRXNPFEDSA-N 0 3 377.282 3.057 10 0 GGAEHN CC(C)(C)O[C@@H]1C[C@@H](NCc2cc(Cl)cc(S(N)(=O)=O)c2)C12CCC2 ZINC000661846103 567396230 /nfs/dbraw/zinc/39/62/30/567396230.db2.gz YGHSHVWGSXEPJE-HZPDHXFCSA-N 0 3 386.945 3.203 10 0 GGAEHN CC(C)(C)O[C@@H]1C[C@H](NCc2cc(Cl)cc(S(N)(=O)=O)c2)C12CCC2 ZINC000661846104 567397065 /nfs/dbraw/zinc/39/70/65/567397065.db2.gz YGHSHVWGSXEPJE-JKSUJKDBSA-N 0 3 386.945 3.203 10 0 GGAEHN C[C@@H](NC(=O)N1CCN2CCC1CC2)c1cc(F)c(Br)cc1F ZINC000528160285 567397635 /nfs/dbraw/zinc/39/76/35/567397635.db2.gz ZZPQTSHGCVHRFJ-SNVBAGLBSA-N 0 3 388.256 3.278 10 0 GGAEHN C[C@@H](NC[C@H]1CSc2ccccc2O1)c1ccc(NS(C)(=O)=O)cc1 ZINC000569339487 567397957 /nfs/dbraw/zinc/39/79/57/567397957.db2.gz IBBANHUATCQUNB-CJNGLKHVSA-N 0 3 378.519 3.262 10 0 GGAEHN CO[C@H](CCNC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)C(F)(F)F ZINC000549576696 567399198 /nfs/dbraw/zinc/39/91/98/567399198.db2.gz URIGDKXBEDYMIH-UONOGXRCSA-N 0 3 381.826 3.209 10 0 GGAEHN CCCN1CC[C@@H](NC(=O)N[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000661953039 567400973 /nfs/dbraw/zinc/40/09/73/567400973.db2.gz KDXYKYXTRMNUEP-UKRRQHHQSA-N 0 3 382.302 3.056 10 0 GGAEHN CCCN1CC[C@@H](NC(=O)N[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000661953037 567401473 /nfs/dbraw/zinc/40/14/73/567401473.db2.gz KDXYKYXTRMNUEP-HIFRSBDPSA-N 0 3 382.302 3.056 10 0 GGAEHN CN(C)C[C@@H](NC(=O)c1cc[nH]c(=O)c1Br)c1ccc(Cl)cc1 ZINC000549616985 567401576 /nfs/dbraw/zinc/40/15/76/567401576.db2.gz MNMLABDLYVDOID-CYBMUJFWSA-N 0 3 398.688 3.236 10 0 GGAEHN O=C(NC1CCN([C@@H]2CCOC2)CC1)N[C@H]1CCCc2sc(Cl)cc21 ZINC000661987293 567402465 /nfs/dbraw/zinc/40/24/65/567402465.db2.gz PIOCWSUJSHJEGK-HIFRSBDPSA-N 0 3 383.945 3.331 10 0 GGAEHN OCC1(CNCc2cc(Br)c3c(c2)OCCO3)CC2(CCC2)C1 ZINC000569419991 567402464 /nfs/dbraw/zinc/40/24/64/567402464.db2.gz HEVKKEULKMGOOD-UHFFFAOYSA-N 0 3 382.298 3.253 10 0 GGAEHN C[C@@H](NCC(=O)Nc1cc(S(C)(=O)=O)ccc1Cl)C1CCC(F)CC1 ZINC000662000724 567402573 /nfs/dbraw/zinc/40/25/73/567402573.db2.gz HMTIMGWCYOPHSE-PNESKVBLSA-N 0 3 390.908 3.188 10 0 GGAEHN O=C(CNC1(c2ccc(Br)cc2)CCOCC1)NC1CCCCC1 ZINC000618614418 567402594 /nfs/dbraw/zinc/40/25/94/567402594.db2.gz KRWIDIKMLFCTEH-UHFFFAOYSA-N 0 3 395.341 3.493 10 0 GGAEHN CC[C@H](Cc1ccc(Br)cc1)NC(=O)N1CCN2CCC1CC2 ZINC000662046089 567405773 /nfs/dbraw/zinc/40/57/73/567405773.db2.gz ZUSAPHHFAPDRGJ-MRXNPFEDSA-N 0 3 380.330 3.260 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000618666311 567406499 /nfs/dbraw/zinc/40/64/99/567406499.db2.gz YROAHYLBXZASGP-HNNXBMFYSA-N 0 3 381.314 3.220 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000618666311 567406506 /nfs/dbraw/zinc/40/65/06/567406506.db2.gz YROAHYLBXZASGP-HNNXBMFYSA-N 0 3 381.314 3.220 10 0 GGAEHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)[C@H]1C[C@@]1(C)Br ZINC000528278342 567406998 /nfs/dbraw/zinc/40/69/98/567406998.db2.gz HNSRVYRIJGBGIB-CZUORRHYSA-N 0 3 375.257 3.029 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)NCc1cc(F)cc(Br)c1 ZINC000569482260 567407949 /nfs/dbraw/zinc/40/79/49/567407949.db2.gz DWWRHUDSTUHPJY-QGZVFWFLSA-N 0 3 392.272 3.356 10 0 GGAEHN CN(C(=O)N[C@@H]1CCc2c1cccc2Br)[C@H]1CCN(C2CC2)C1 ZINC000477689521 567409192 /nfs/dbraw/zinc/40/91/92/567409192.db2.gz JBZNZZQRZLARHQ-SUMWQHHRSA-N 0 3 378.314 3.315 10 0 GGAEHN CN(C(=O)N[C@@H]1CCc2c1cccc2Br)[C@@H]1CCN(C2CC2)C1 ZINC000477689518 567409238 /nfs/dbraw/zinc/40/92/38/567409238.db2.gz JBZNZZQRZLARHQ-CXAGYDPISA-N 0 3 378.314 3.315 10 0 GGAEHN CN1CC[C@H](NCC(=O)Nc2ccc(Cl)cn2)[C@H]1c1ccc(Cl)cc1 ZINC000569533451 567410678 /nfs/dbraw/zinc/41/06/78/567410678.db2.gz ITVTXHQUPSNUAU-MAUKXSAKSA-N 0 3 379.291 3.362 10 0 GGAEHN CN1CC[C@@H](NCC(=O)Nc2ccc(Cl)cn2)[C@H]1c1ccc(Cl)cc1 ZINC000569533449 567411249 /nfs/dbraw/zinc/41/12/49/567411249.db2.gz ITVTXHQUPSNUAU-CRAIPNDOSA-N 0 3 379.291 3.362 10 0 GGAEHN O=S(=O)(Cc1ccc(Cl)cc1Cl)N1CCC[C@H]1CN1CCCC1 ZINC000501891670 567412427 /nfs/dbraw/zinc/41/24/27/567412427.db2.gz PEBMTMSHKBNNMS-HNNXBMFYSA-N 0 3 377.337 3.383 10 0 GGAEHN C[C@@H]1CC[C@@H](C)N1CC(=O)N1CCOC[C@H]1c1cccc(Br)c1 ZINC000618775085 567414103 /nfs/dbraw/zinc/41/41/03/567414103.db2.gz TZKSATPHCCMFPH-CPUCHLNUSA-N 0 3 381.314 3.222 10 0 GGAEHN C[C@]1(Br)C[C@H]1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000528348330 567414247 /nfs/dbraw/zinc/41/42/47/567414247.db2.gz FXAYUMAYVATTSX-HKUYNNGSSA-N 0 3 379.342 3.327 10 0 GGAEHN COc1ccc([C@H](CNc2ncc(C(F)(F)F)s2)N(C)C)cc1OC ZINC000477743379 567414381 /nfs/dbraw/zinc/41/43/81/567414381.db2.gz NKSFNPBDPHVBAR-NSHDSACASA-N 0 3 375.416 3.316 10 0 GGAEHN CCCN(CCN1CCCC1)C(=O)NCc1ccc(Br)cc1OC ZINC000501988235 567415457 /nfs/dbraw/zinc/41/54/57/567415457.db2.gz LQODCOYLQBXCMC-UHFFFAOYSA-N 0 3 398.345 3.475 10 0 GGAEHN CC(C)N1CCN(CCCN2CCOc3cc(Br)ccc3C2)CC1 ZINC000662198354 567415913 /nfs/dbraw/zinc/41/59/13/567415913.db2.gz DZXKDWGULVROBF-UHFFFAOYSA-N 0 3 396.373 3.060 10 0 GGAEHN CN1CC[C@H](c2nc(C3(c4cccc(Br)c4)CCOCC3)no2)C1 ZINC000569648433 567419930 /nfs/dbraw/zinc/41/99/30/567419930.db2.gz BDBRYOWVPHFBOP-ZDUSSCGKSA-N 0 3 392.297 3.348 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)CCOc1ccc(Cl)cc1Br ZINC000502102477 567420059 /nfs/dbraw/zinc/42/00/59/567420059.db2.gz CRFGGJDZJARFPW-LBPRGKRZSA-N 0 3 375.694 3.082 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)c2scc(Br)c2Br)C1 ZINC000528401782 567420232 /nfs/dbraw/zinc/42/02/32/567420232.db2.gz CGJVJMRGRRWCAJ-ZETCQYMHSA-N 0 3 382.121 3.049 10 0 GGAEHN CC(C)(O)CN(Cc1ccc(Br)c(F)c1F)C1CCOCC1 ZINC000528399591 567420363 /nfs/dbraw/zinc/42/03/63/567420363.db2.gz SEYBIJZBWJSESG-UHFFFAOYSA-N 0 3 378.257 3.479 10 0 GGAEHN COc1ccc(Br)cc1[C@@H]1CCCN1C[C@@H]1CCC2(CNC2)O1 ZINC000662255204 567422812 /nfs/dbraw/zinc/42/28/12/567422812.db2.gz BCPVBNADHVJMPG-HOCLYGCPSA-N 0 3 381.314 3.116 10 0 GGAEHN O=C(NCC1(N2CCCC2)CCOCC1)c1sc2ncccc2c1Cl ZINC000528434157 567422813 /nfs/dbraw/zinc/42/28/13/567422813.db2.gz UHGVMHZUXKEGID-UHFFFAOYSA-N 0 3 379.913 3.325 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cnc(-c3c(F)cccc3F)s2)C[C@H]1N(C)C ZINC000593560754 567423433 /nfs/dbraw/zinc/42/34/33/567423433.db2.gz HIUZPBBRCXOWAT-TZMCWYRMSA-N 0 3 383.489 3.206 10 0 GGAEHN CN(C)C[C@@]1(O)CCCN(C(=O)CSCc2ccc(Cl)cc2Cl)C1 ZINC000618924511 567424831 /nfs/dbraw/zinc/42/48/31/567424831.db2.gz YRHFBPJHTMNMMY-KRWDZBQOSA-N 0 3 391.364 3.142 10 0 GGAEHN CN(C)C[C@H](CNC(=O)C(C)(C)COCC(F)F)c1ccc(Cl)cc1 ZINC000569700446 567425677 /nfs/dbraw/zinc/42/56/77/567425677.db2.gz RVLNUBADVNPNRS-AWEZNQCLSA-N 0 3 376.875 3.409 10 0 GGAEHN CCOCCOC[C@H](O)CN[C@@H](C)c1cc2cc(Br)ccc2o1 ZINC000477930356 567426019 /nfs/dbraw/zinc/42/60/19/567426019.db2.gz KKBMLJCPQKSNNY-SWLSCSKDSA-N 0 3 386.286 3.260 10 0 GGAEHN CN(CC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1)[C@H](CN)C(F)(F)F ZINC000662329437 567426867 /nfs/dbraw/zinc/42/68/67/567426867.db2.gz LRPDRJMTSAATHB-UONOGXRCSA-N 0 3 398.256 3.478 10 0 GGAEHN CS[C@@H]1CN(C(=O)[C@@H]2CSC[C@H]2c2ccccc2)C[C@H]1N1CCCC1 ZINC000593603763 567427169 /nfs/dbraw/zinc/42/71/69/567427169.db2.gz WNTUKGPBAQDGOL-WJFTUGDTSA-N 0 3 376.591 3.171 10 0 GGAEHN O=S(=O)(NC[C@@H]1CCN1C1CCCCC1)C1CCC(C(F)(F)F)CC1 ZINC000528476913 567427215 /nfs/dbraw/zinc/42/72/15/567427215.db2.gz NOFQNQDDTYHCLX-SIWZUTFBSA-N 0 3 382.492 3.434 10 0 GGAEHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1cnc2c(Br)cccn12 ZINC000436486922 567428196 /nfs/dbraw/zinc/42/81/96/567428196.db2.gz KFQISAMBLXAPPR-OLZOCXBDSA-N 0 3 392.301 3.187 10 0 GGAEHN C[C@H](CN1CCC(C)CC1)NC(=O)Cc1noc2ccc(Br)cc21 ZINC000618994949 567429635 /nfs/dbraw/zinc/42/96/35/567429635.db2.gz DUAUIHWWODDYBA-CYBMUJFWSA-N 0 3 394.313 3.369 10 0 GGAEHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)[C@@H]1C[C@@]1(C)Br ZINC000528513160 567431976 /nfs/dbraw/zinc/43/19/76/567431976.db2.gz RLLZGHHBTSHWSJ-SOLBZPMBSA-N 0 3 380.330 3.068 10 0 GGAEHN OC[C@]1([C@H](NCc2ccc(Br)c(F)c2F)C2CC2)CCCO1 ZINC000528513608 567432414 /nfs/dbraw/zinc/43/24/14/567432414.db2.gz ARDQWBHPYZXPKF-CVEARBPZSA-N 0 3 376.241 3.137 10 0 GGAEHN Ic1cnc(CN[C@H](C2CC2)C2CCOCC2)s1 ZINC000593666387 567432798 /nfs/dbraw/zinc/43/27/98/567432798.db2.gz NFAVYOUVIAXCIE-CYBMUJFWSA-N 0 3 378.279 3.043 10 0 GGAEHN Cc1cc(Br)cc(C(=O)NCCCNCc2cccnc2)c1C ZINC000662398351 567432995 /nfs/dbraw/zinc/43/29/95/567432995.db2.gz UYQJBAKRVQOLFD-UHFFFAOYSA-N 0 3 376.298 3.371 10 0 GGAEHN CCN1CC[C@H]2OCCN(CCCc3ccc(Br)cc3OC)[C@H]2C1 ZINC000550216246 567434194 /nfs/dbraw/zinc/43/41/94/567434194.db2.gz SWWIQSYUFWBGIU-ZWKOTPCHSA-N 0 3 397.357 3.185 10 0 GGAEHN O=C(c1sc2c(c1Br)CNC2)N1CCC[C@@H]1CN1CCCCC1 ZINC000662442291 567436859 /nfs/dbraw/zinc/43/68/59/567436859.db2.gz ZUGPBEGWUKXMKX-GFCCVEGCSA-N 0 3 398.370 3.204 10 0 GGAEHN CN(C)Cc1ccc(S(=O)(=O)N[C@@H]2[C@H]3Cc4c(cccc4Cl)[C@@H]23)cc1 ZINC000528550875 567437335 /nfs/dbraw/zinc/43/73/35/567437335.db2.gz FFOCUJCESBJWMJ-QXAKKESOSA-N 0 3 376.909 3.018 10 0 GGAEHN Cc1ccc(I)c(C(=O)NCCN2CCCC2(C)C)c1 ZINC000457081269 567437689 /nfs/dbraw/zinc/43/76/89/567437689.db2.gz VCWQYCPGVFYVBM-UHFFFAOYSA-N 0 3 386.277 3.204 10 0 GGAEHN Cc1cc(Br)c(C(=O)NC[C@@H]2CCCN2C)cc1Br ZINC000528562244 567438421 /nfs/dbraw/zinc/43/84/21/567438421.db2.gz NGPBXHIIFBURNI-JTQLQIEISA-N 0 3 390.119 3.344 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@H]3C[C@H]3c3cc(Cl)cc(Cl)c3)[C@H]2C1 ZINC000502516141 567439979 /nfs/dbraw/zinc/43/99/79/567439979.db2.gz JHMPMHOWRPNWOJ-XLAORIBOSA-N 0 3 383.319 3.419 10 0 GGAEHN CCO[C@@H]1C[C@H](NCc2cc(Br)c(OC)s2)[C@H]1n1cccn1 ZINC000550327225 567441176 /nfs/dbraw/zinc/44/11/76/567441176.db2.gz SHECLIHOFRQDNY-BFHYXJOUSA-N 0 3 386.315 3.224 10 0 GGAEHN CSCCC(=O)N1CCC(N2CCN(c3cccc(Cl)c3)CC2)CC1 ZINC000457114421 567441379 /nfs/dbraw/zinc/44/13/79/567441379.db2.gz KXUUGJAGZRNIOK-UHFFFAOYSA-N 0 3 381.973 3.206 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)CCCc3ccccc3Br)[C@H]2C1 ZINC000502539067 567441339 /nfs/dbraw/zinc/44/13/39/567441339.db2.gz IPBKFBGCGVKQCH-ZWKOTPCHSA-N 0 3 395.341 3.093 10 0 GGAEHN CCO[C@@H]1C[C@H](NCc2cc(Br)c(OC)s2)[C@@H]1n1cccn1 ZINC000550327228 567441333 /nfs/dbraw/zinc/44/13/33/567441333.db2.gz SHECLIHOFRQDNY-MJBXVCDLSA-N 0 3 386.315 3.224 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3cccc(Br)c3Cl)[C@H]2C1 ZINC000502558617 567442809 /nfs/dbraw/zinc/44/28/09/567442809.db2.gz CKDWSNLKLZBCCW-UONOGXRCSA-N 0 3 387.705 3.038 10 0 GGAEHN CN(C)[C@H](CNC(=O)c1sc2c(c1Br)CNC2)c1ccccc1 ZINC000662524538 567444540 /nfs/dbraw/zinc/44/45/40/567444540.db2.gz YCXUWQKTJCUGSG-CYBMUJFWSA-N 0 3 394.338 3.147 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3ccc(Cl)cc3C(F)(F)F)[C@H]2C1 ZINC000502618579 567445382 /nfs/dbraw/zinc/44/53/82/567445382.db2.gz APYDTFCEHYDPKP-LSDHHAIUSA-N 0 3 376.806 3.294 10 0 GGAEHN NC1(C(=O)N2CCO[C@@H](c3cccc(Br)c3)C2)CC2(CCC2)C1 ZINC000662541815 567446209 /nfs/dbraw/zinc/44/62/09/567446209.db2.gz UIFUBIXJEHALTL-OAHLLOKOSA-N 0 3 379.298 3.011 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3cc4c(ccc(Cl)c4Cl)[nH]3)[C@H]2C1 ZINC000502659370 567446624 /nfs/dbraw/zinc/44/66/24/567446624.db2.gz BROJYIVHNFKRRG-JKSUJKDBSA-N 0 3 382.291 3.410 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@H](C)Oc3cc(Cl)cc(Cl)c3)[C@H]2C1 ZINC000502695103 567446808 /nfs/dbraw/zinc/44/68/08/567446808.db2.gz QPFVEDBZWXTDAJ-AFAVFJNCSA-N 0 3 387.307 3.082 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3ccc(Cl)cc3Br)[C@H]2C1 ZINC000502736889 567447962 /nfs/dbraw/zinc/44/79/62/567447962.db2.gz OSAMFHQMKVUNQB-LSDHHAIUSA-N 0 3 387.705 3.038 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@@H]3C[C@@H]3c3ccc(Cl)c(Cl)c3)[C@H]2C1 ZINC000502738914 567448607 /nfs/dbraw/zinc/44/86/07/567448607.db2.gz QGOKNBPGFFYHIH-KJWYOANISA-N 0 3 383.319 3.419 10 0 GGAEHN O=C(NCc1sccc1Br)Nc1ccc2c(c1)OCCNC2 ZINC000528707833 567449455 /nfs/dbraw/zinc/44/94/55/567449455.db2.gz GJZPWFGEKXUYEM-UHFFFAOYSA-N 0 3 382.283 3.314 10 0 GGAEHN O=C(NCCc1ccccc1Br)Nc1ccc2c(c1)OCCNC2 ZINC000528710561 567449517 /nfs/dbraw/zinc/44/95/17/567449517.db2.gz SKGKQQYBBZSOQN-UHFFFAOYSA-N 0 3 390.281 3.295 10 0 GGAEHN COC(=O)c1cnc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)c(Cl)c1 ZINC000594031924 567454557 /nfs/dbraw/zinc/45/45/57/567454557.db2.gz QROBFZCTXVTBKC-NXEZZACHSA-N 0 3 380.750 3.208 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2cccc(Br)c2C)CC1 ZINC000478428189 567454589 /nfs/dbraw/zinc/45/45/89/567454589.db2.gz CYFRQYFEKCEYOF-UHFFFAOYSA-N 0 3 390.281 3.124 10 0 GGAEHN O=C(CCN1CC[C@H]2CC[C@@H](C1)[S@]2=O)Nc1cc(Cl)ccc1Cl ZINC000528781729 567455085 /nfs/dbraw/zinc/45/50/85/567455085.db2.gz CVGHJYNQRQGCRX-PSVOKBTDSA-N 0 3 375.321 3.307 10 0 GGAEHN O=C(N[C@H]1CCN(C2CCCCC2)C1)c1sc2c(c1Br)CNC2 ZINC000662668362 567455284 /nfs/dbraw/zinc/45/52/84/567455284.db2.gz LHUMUQVTOCHCLD-NSHDSACASA-N 0 3 398.370 3.251 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000478438495 567456003 /nfs/dbraw/zinc/45/60/03/567456003.db2.gz LUOVIEULHQUSDW-UHFFFAOYSA-N 0 3 380.275 3.288 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)Cc2ccc(Cl)cc2Cl)CC1 ZINC000478447569 567457486 /nfs/dbraw/zinc/45/74/86/567457486.db2.gz ROWONJSAYUXLTD-UHFFFAOYSA-N 0 3 380.275 3.288 10 0 GGAEHN O=C(CCN1CCC[C@H]1c1ccc(=O)[nH]n1)Nc1ccccc1Br ZINC000528798508 567458910 /nfs/dbraw/zinc/45/89/10/567458910.db2.gz YVBZOZNRRHZQDC-HNNXBMFYSA-N 0 3 391.269 3.110 10 0 GGAEHN O[C@H](CNC[C@@H]1COc2ccccc2O1)COc1cc(Cl)ccc1Cl ZINC000550721336 567458967 /nfs/dbraw/zinc/45/89/67/567458967.db2.gz MDZSOHRYSCGVDK-ZIAGYGMSSA-N 0 3 384.259 3.163 10 0 GGAEHN Cc1ccc2c(c1Br)CN(C(=O)[C@]1(N)[C@H]3CCCO[C@H]3C1(C)C)C2 ZINC000662740104 567459732 /nfs/dbraw/zinc/45/97/32/567459732.db2.gz WREKYNJONYDRIL-ZSZQSSIHSA-N 0 3 393.325 3.132 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)CC1 ZINC000478462720 567459778 /nfs/dbraw/zinc/45/97/78/567459778.db2.gz AGWRWJHOPXDIIL-CHWSQXEVSA-N 0 3 377.897 3.257 10 0 GGAEHN O=C(c1ccsc1C(F)(F)F)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000528825695 567459890 /nfs/dbraw/zinc/45/98/90/567459890.db2.gz MCGJJFRFASNBJK-ZDUSSCGKSA-N 0 3 376.444 3.484 10 0 GGAEHN O=C(c1ccsc1C(F)(F)F)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000528825693 567460104 /nfs/dbraw/zinc/46/01/04/567460104.db2.gz MCGJJFRFASNBJK-CYBMUJFWSA-N 0 3 376.444 3.484 10 0 GGAEHN CCN1CC[C@@H](N(C)C(=O)c2sc3c(c2Br)CNC3)C[C@H]1C ZINC000662743901 567460447 /nfs/dbraw/zinc/46/04/47/567460447.db2.gz WZXTUZKPQNZWEZ-GHMZBOCLSA-N 0 3 386.359 3.059 10 0 GGAEHN O[C@H](CNC[C@H]1COc2ccccc2O1)COc1ccc(Cl)c(Cl)c1 ZINC000641938790 567461002 /nfs/dbraw/zinc/46/10/02/567461002.db2.gz GOJKROIEBNDJTO-OCCSQVGLSA-N 0 3 384.259 3.163 10 0 GGAEHN NC[C@H](C(=O)N1CCOc2cc(Br)ccc2C1)c1ccc(F)cc1 ZINC000662740492 567461176 /nfs/dbraw/zinc/46/11/76/567461176.db2.gz GPJXEGJSNHAXHG-INIZCTEOSA-N 0 3 393.256 3.052 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCC1)Nc1ccccc1I ZINC000528856399 567462837 /nfs/dbraw/zinc/46/28/37/567462837.db2.gz YLSKLEAOUGIOHE-CYBMUJFWSA-N 0 3 399.276 3.430 10 0 GGAEHN CC(C)[C@@H](C(=O)NCc1ccc(I)cc1Cl)N(C)C ZINC000478528013 567464524 /nfs/dbraw/zinc/46/45/24/567464524.db2.gz POKKILVMFWKACJ-ZDUSSCGKSA-N 0 3 394.684 3.147 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)N[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000503026640 567464948 /nfs/dbraw/zinc/46/49/48/567464948.db2.gz NYLNMGJGCOIFJQ-WBMJQRKESA-N 0 3 386.323 3.391 10 0 GGAEHN Cc1cc(Br)c(Cl)cc1NC(=O)c1cn[n-]c1[C@@H]1CC[NH2+]C1 ZINC000662861177 567465786 /nfs/dbraw/zinc/46/57/86/567465786.db2.gz YUYUPYJBIQPELN-SECBINFHSA-N 0 3 383.677 3.463 10 0 GGAEHN CC[C@@H](Cn1cncn1)NCc1ccc(I)cc1Cl ZINC000550899880 567467460 /nfs/dbraw/zinc/46/74/60/567467460.db2.gz FILRSGJXDHNRIQ-LBPRGKRZSA-N 0 3 390.656 3.105 10 0 GGAEHN O=C(c1cccc2c1CNC2)N1CCOC[C@@H]1c1cccc(Br)c1 ZINC000662880517 567467477 /nfs/dbraw/zinc/46/74/77/567467477.db2.gz AJYSJYMCEDTAQK-GOSISDBHSA-N 0 3 387.277 3.266 10 0 GGAEHN CC[C@H](Cn1cncn1)NCc1ccc(I)cc1Cl ZINC000550899879 567468494 /nfs/dbraw/zinc/46/84/94/567468494.db2.gz FILRSGJXDHNRIQ-GFCCVEGCSA-N 0 3 390.656 3.105 10 0 GGAEHN CN1CC[C@@H](NC(=O)c2cc(O)cc(Br)c2)[C@H]1c1ccccc1 ZINC000528912357 567468706 /nfs/dbraw/zinc/46/87/06/567468706.db2.gz GCJUSKMEBSRSSN-IAGOWNOFSA-N 0 3 375.266 3.330 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)Nc1ccc(F)c(Br)c1F ZINC000662922729 567469302 /nfs/dbraw/zinc/46/93/02/567469302.db2.gz XHVZZKTUFCVBQI-NMOXSOIISA-N 0 3 389.240 3.198 10 0 GGAEHN CS[C@@H]1CN(C(=O)C[C@@H]2OCc3cc(Cl)ccc32)C[C@H]1N1CCCC1 ZINC000594339528 567469507 /nfs/dbraw/zinc/46/95/07/567469507.db2.gz QHGIFNJHHWJCRA-FGTMMUONSA-N 0 3 380.941 3.340 10 0 GGAEHN COc1ccc([C@@H](C)N[C@@H](C)Cn2cc(Br)ccc2=O)cc1F ZINC000550940154 567469778 /nfs/dbraw/zinc/46/97/78/567469778.db2.gz SNKZXCFVRNBNOQ-NWDGAFQWSA-N 0 3 383.261 3.498 10 0 GGAEHN N[C@@H]1CN(C(=O)c2ccsc2NC(=O)c2ccccc2Cl)CC[C@H]1F ZINC000662945084 567470623 /nfs/dbraw/zinc/47/06/23/567470623.db2.gz ZKLQJHIHTWBCTG-ZIAGYGMSSA-N 0 3 381.860 3.165 10 0 GGAEHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@]2(C)Br)cc1 ZINC000528946427 567471504 /nfs/dbraw/zinc/47/15/04/567471504.db2.gz UIGNTBWTHHUVAO-BQFCYCMXSA-N 0 3 381.314 3.122 10 0 GGAEHN CC(C)N1CCN(c2cccc(NC(=O)[C@@H]3C[C@@]3(C)Br)c2)CC1 ZINC000528944496 567471657 /nfs/dbraw/zinc/47/16/57/567471657.db2.gz NFSWGZPGQBYVDZ-FUHWJXTLSA-N 0 3 380.330 3.329 10 0 GGAEHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)c1cc(Br)cc2[nH]cnc21 ZINC000503183377 567472055 /nfs/dbraw/zinc/47/20/55/567472055.db2.gz UXCRHRHDEXWCKM-VXGBXAGGSA-N 0 3 379.302 3.176 10 0 GGAEHN O=C(CCN[C@@H](CO)c1cccc(Br)c1)N1CCc2ccccc21 ZINC000503200865 567473556 /nfs/dbraw/zinc/47/35/56/567473556.db2.gz WDUMKINODMCENV-KRWDZBQOSA-N 0 3 389.293 3.052 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)N[C@H](c1cncc(Br)c1)C1CC1 ZINC000551025580 567474058 /nfs/dbraw/zinc/47/40/58/567474058.db2.gz LODFUASTFJHHRW-DYVFJYSZSA-N 0 3 395.345 3.469 10 0 GGAEHN CCOc1cc(CNCc2ccc(C(=O)NC)cc2)cc(Br)c1O ZINC000642341413 567475494 /nfs/dbraw/zinc/47/54/94/567475494.db2.gz NGDAAGQTJCLVPN-UHFFFAOYSA-N 0 3 393.281 3.203 10 0 GGAEHN CSCC[C@H](N)C(=O)NCC1(c2cccc(OC(F)(F)F)c2)CCC1 ZINC000594448958 567475939 /nfs/dbraw/zinc/47/59/39/567475939.db2.gz SUPQNFHDEOXTTB-AWEZNQCLSA-N 0 3 376.444 3.204 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)c1cc(Br)cc2[nH]cnc21 ZINC000503293125 567479912 /nfs/dbraw/zinc/47/99/12/567479912.db2.gz SGWDUFSTYDBPHD-RYUDHWBXSA-N 0 3 379.302 3.318 10 0 GGAEHN CN(C)CCN(C)C(=O)c1cccnc1Oc1ccc(F)cc1Br ZINC000478733948 567481049 /nfs/dbraw/zinc/48/10/49/567481049.db2.gz SBMLFAICEUMEAY-UHFFFAOYSA-N 0 3 396.260 3.409 10 0 GGAEHN CN(C[C@H]1CCCN(C)C1)S(=O)(=O)c1cccc(Br)c1Cl ZINC000551135761 567481708 /nfs/dbraw/zinc/48/17/08/567481708.db2.gz KSIHQOBVKCVKFB-NSHDSACASA-N 0 3 395.750 3.065 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CNCC[C@@H](C)[S@@](C)=O ZINC000594497169 567481915 /nfs/dbraw/zinc/48/19/15/567481915.db2.gz DEQKSSKNLYLZFL-VERVWZFWSA-N 0 3 384.343 3.190 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CNCC[C@H](C)[S@@](C)=O ZINC000594497167 567482130 /nfs/dbraw/zinc/48/21/30/567482130.db2.gz DEQKSSKNLYLZFL-AMXDTQDGSA-N 0 3 384.343 3.190 10 0 GGAEHN CN1CCN(CCC(C)(C)NC(=O)c2sc3ncccc3c2Cl)CC1 ZINC000529054099 567482468 /nfs/dbraw/zinc/48/24/68/567482468.db2.gz KOZWTBUSEMFIKV-UHFFFAOYSA-N 0 3 380.945 3.096 10 0 GGAEHN C[C@@H]1CN(C)CC[C@H]1N(C)S(=O)(=O)c1cccc(Br)c1Cl ZINC000551168330 567483106 /nfs/dbraw/zinc/48/31/06/567483106.db2.gz XUUHFSXGGRHQER-ZYHUDNBSSA-N 0 3 395.750 3.063 10 0 GGAEHN OC[C@H](NCc1cnc(-c2ccc(Br)cc2)s1)C1CCOCC1 ZINC000570426424 567483734 /nfs/dbraw/zinc/48/37/34/567483734.db2.gz NGAUWTQBVONZDF-INIZCTEOSA-N 0 3 397.338 3.450 10 0 GGAEHN CCCC(=O)NC1CCN(C[C@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000642624245 567484082 /nfs/dbraw/zinc/48/40/82/567484082.db2.gz LZKABQDMFKZTJJ-AWEZNQCLSA-N 0 3 389.323 3.114 10 0 GGAEHN CCCN1CC[C@H](NC(=O)c2cc(Br)cc(N3CCCC3)c2)C1 ZINC000619905912 567486354 /nfs/dbraw/zinc/48/63/54/567486354.db2.gz AEPIXVRTDQJRHE-INIZCTEOSA-N 0 3 380.330 3.263 10 0 GGAEHN CSc1cc(Br)ccc1CN[C@@H](CO)C[C@H](O)C(C)(C)C ZINC000551219362 567489647 /nfs/dbraw/zinc/48/96/47/567489647.db2.gz JUIZTMDGQZTMSS-HIFRSBDPSA-N 0 3 376.360 3.419 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)Nc2cccc(Br)c2)CC1 ZINC000478904674 567489940 /nfs/dbraw/zinc/48/99/40/567489940.db2.gz ADZOJUNMHJRAMO-UHFFFAOYSA-N 0 3 391.269 3.207 10 0 GGAEHN COC(=O)c1cc(CNC[C@H](CO)Cc2ccccc2Br)c(C)o1 ZINC000594616235 567491448 /nfs/dbraw/zinc/49/14/48/567491448.db2.gz ZGFPRDHZUUWKJR-CYBMUJFWSA-N 0 3 396.281 3.078 10 0 GGAEHN O=C(N[C@H]1CSc2ccc(Br)cc21)N1CCN2CCC1CC2 ZINC000503536775 567492674 /nfs/dbraw/zinc/49/26/74/567492674.db2.gz JOUCLZNAFRKPGQ-AWEZNQCLSA-N 0 3 382.327 3.086 10 0 GGAEHN CC[C@H](Cn1cncn1)N[C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O ZINC000551279330 567493160 /nfs/dbraw/zinc/49/31/60/567493160.db2.gz FIMNQTDWULNZQG-UKRRQHHQSA-N 0 3 382.295 3.149 10 0 GGAEHN CCOC(=O)[C@@H]1CC[C@H](NCc2cnc3c(C)cc(Br)cn23)C1 ZINC000437351784 567493240 /nfs/dbraw/zinc/49/32/40/567493240.db2.gz JHJOQTYPRJOOMW-OCCSQVGLSA-N 0 3 380.286 3.227 10 0 GGAEHN CN([C@H](CN)C(F)(F)F)S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC000663310037 567494811 /nfs/dbraw/zinc/49/48/11/567494811.db2.gz GDADTISNEKLERM-MRVPVSSYSA-N 0 3 385.622 3.157 10 0 GGAEHN CN([C@@H](CN)C(F)(F)F)S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC000663310042 567495722 /nfs/dbraw/zinc/49/57/22/567495722.db2.gz GDADTISNEKLERM-QMMMGPOBSA-N 0 3 385.622 3.157 10 0 GGAEHN CN(C[C@@H]1CCCN(C)C1)C(=O)Cc1c(F)ccc(Br)c1F ZINC000503634176 567497270 /nfs/dbraw/zinc/49/72/70/567497270.db2.gz PHFDEAUTDWSDSJ-LLVKDONJSA-N 0 3 375.257 3.070 10 0 GGAEHN COC[C@@H](O)CN[C@H]1CCCc2c(Br)cc(Br)cc21 ZINC000479051702 567498511 /nfs/dbraw/zinc/49/85/11/567498511.db2.gz ARXUHDYDQFYHEX-HZMBPMFUSA-N 0 3 393.119 3.186 10 0 GGAEHN C[C@]1(Br)C[C@H]1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000529221124 567498892 /nfs/dbraw/zinc/49/88/92/567498892.db2.gz JIQQEVLKWJNOOX-BUCSNLDVSA-N 0 3 383.252 3.081 10 0 GGAEHN C[C@@]1(Br)C[C@@H]1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000529221126 567499249 /nfs/dbraw/zinc/49/92/49/567499249.db2.gz JIQQEVLKWJNOOX-UAKHECDHSA-N 0 3 383.252 3.081 10 0 GGAEHN C[C@@]1(Br)C[C@H]1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000529221125 567499573 /nfs/dbraw/zinc/49/95/73/567499573.db2.gz JIQQEVLKWJNOOX-CXHDDBMJSA-N 0 3 383.252 3.081 10 0 GGAEHN C[C@H](O)[C@@H](NCCC(=O)Nc1ccc(Br)cc1)c1ccccc1 ZINC000663374687 567502014 /nfs/dbraw/zinc/50/20/14/567502014.db2.gz DYDNMUQIPPZKPO-SCLBCKFNSA-N 0 3 377.282 3.489 10 0 GGAEHN C[C@H](c1ccccc1)[C@H](O)CNC[C@H](O)COc1c(Cl)cccc1Cl ZINC000663380771 567502366 /nfs/dbraw/zinc/50/23/66/567502366.db2.gz ZPOAEDAHPQVZLT-QIIPPGSGSA-N 0 3 384.303 3.487 10 0 GGAEHN C[C@@H](O)[C@H](NCCC(=O)Nc1ccc(Br)cc1)c1ccccc1 ZINC000663374685 567502488 /nfs/dbraw/zinc/50/24/88/567502488.db2.gz DYDNMUQIPPZKPO-ACJLOTCBSA-N 0 3 377.282 3.489 10 0 GGAEHN Cn1nc2c(c1CN[C@H]1CCN(c3cccc(Br)c3)C1)CCCC2 ZINC000643321501 567505404 /nfs/dbraw/zinc/50/54/04/567505404.db2.gz WYLJLUUTCQMLQI-HNNXBMFYSA-N 0 3 389.341 3.430 10 0 GGAEHN Cn1nc2c(c1CN[C@H]1CCN(c3ccccc3Br)C1)CCCC2 ZINC000643321406 567505690 /nfs/dbraw/zinc/50/56/90/567505690.db2.gz QATFRLJBXZFWFD-AWEZNQCLSA-N 0 3 389.341 3.430 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)N1CC2(CC2)c2ccc(Br)cc21 ZINC000529338761 567507706 /nfs/dbraw/zinc/50/77/06/567507706.db2.gz JVBVFXXPHHMPMG-ZDUSSCGKSA-N 0 3 386.240 3.008 10 0 GGAEHN CCN(C(=O)N[C@@H](C)c1ccc(OC)c(Br)c1)[C@H]1CCN(C)C1 ZINC000663516475 567513614 /nfs/dbraw/zinc/51/36/14/567513614.db2.gz QNGPSUUPRHYQOQ-JSGCOSHPSA-N 0 3 384.318 3.254 10 0 GGAEHN CCN(C(=O)NCCc1ccc(-c2csc(C)n2)s1)[C@@H]1CCN(C)C1 ZINC000663526885 567515575 /nfs/dbraw/zinc/51/55/75/567515575.db2.gz WIGDZWZSXSKWFA-CQSZACIVSA-N 0 3 378.567 3.458 10 0 GGAEHN C[C@H](CNC(=O)c1cc(Br)cc2[nH]cnc21)N1CCCC[C@@H]1C ZINC000503975637 567516576 /nfs/dbraw/zinc/51/65/76/567516576.db2.gz FXJPHXZYPLAZOX-NWDGAFQWSA-N 0 3 379.302 3.318 10 0 GGAEHN CN(C)Cc1cccc(CNC(=O)c2cc(Br)cc3[nH]cnc32)c1 ZINC000503974372 567516853 /nfs/dbraw/zinc/51/68/53/567516853.db2.gz NEEIQMYFXNFDTP-UHFFFAOYSA-N 0 3 387.281 3.317 10 0 GGAEHN COC(=O)c1ccc(CNC[C@@H](CO)c2ccccc2)c(Br)c1 ZINC000551555140 567517652 /nfs/dbraw/zinc/51/76/52/567517652.db2.gz SIRXAPCCOSJIKA-INIZCTEOSA-N 0 3 378.266 3.101 10 0 GGAEHN CC(C)(C)[C@@H](O)C[C@H](CO)NCc1ccc(OC(F)F)c(Br)c1 ZINC000551569417 567518726 /nfs/dbraw/zinc/51/87/26/567518726.db2.gz RIHMBWPYRARVJE-RISCZKNCSA-N 0 3 396.272 3.298 10 0 GGAEHN CC(C)(CNC(=O)N1CCN2CCC1CC2)c1cccc(Br)c1 ZINC000551567822 567518923 /nfs/dbraw/zinc/51/89/23/567518923.db2.gz NJLPRROUYFXYSD-UHFFFAOYSA-N 0 3 380.330 3.216 10 0 GGAEHN Cc1cccc(CC(=O)N2CCC(N3CCCOCC3)CC2)c1Br ZINC000529482346 567520720 /nfs/dbraw/zinc/52/07/20/567520720.db2.gz CSBQBMVXGWGKDI-UHFFFAOYSA-N 0 3 395.341 3.013 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CCN2CCC1CC2 ZINC000551588214 567521654 /nfs/dbraw/zinc/52/16/54/567521654.db2.gz NKMCAUYUBFUSKD-GFCCVEGCSA-N 0 3 382.302 3.008 10 0 GGAEHN O=C(c1cccc(F)c1Br)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000551593861 567522222 /nfs/dbraw/zinc/52/22/22/567522222.db2.gz UDJBRFVERFXSOP-AWEZNQCLSA-N 0 3 399.304 3.305 10 0 GGAEHN C[C@H](Cc1cc(Br)ccc1F)NC(=O)N1CCN2CCC1CC2 ZINC000551637276 567524678 /nfs/dbraw/zinc/52/46/78/567524678.db2.gz JSGXYLOEFQDWDL-GFCCVEGCSA-N 0 3 384.293 3.009 10 0 GGAEHN NC(=O)[C@@H]1CCC[C@H](NCc2cc(Cl)ccc2I)C1 ZINC000594923120 567525205 /nfs/dbraw/zinc/52/52/05/567525205.db2.gz SKLDLZMLNPMBMI-SKDRFNHKSA-N 0 3 392.668 3.078 10 0 GGAEHN Cn1cc(CCCNCc2cc(Cl)ccc2I)cn1 ZINC000594925531 567526904 /nfs/dbraw/zinc/52/69/04/567526904.db2.gz MIPSTEUWGLTKQT-UHFFFAOYSA-N 0 3 389.668 3.401 10 0 GGAEHN CC1(C)CN(CCCOc2cccc(I)c2)CC[C@@H]1O ZINC000438338972 567527654 /nfs/dbraw/zinc/52/76/54/567527654.db2.gz CCNTZZINUGAOIC-HNNXBMFYSA-N 0 3 389.277 3.153 10 0 GGAEHN CCN(C(=O)NCc1cc(OC)ccc1Br)[C@@H]1CCN(CC)C1 ZINC000663743877 567527686 /nfs/dbraw/zinc/52/76/86/567527686.db2.gz WMEAFAKIPNCSQI-CQSZACIVSA-N 0 3 384.318 3.083 10 0 GGAEHN COC1(CNCc2cc(Cl)ccc2I)CCOCC1 ZINC000594953127 567528799 /nfs/dbraw/zinc/52/87/99/567528799.db2.gz IKGHRITZZYRJBW-UHFFFAOYSA-N 0 3 395.668 3.230 10 0 GGAEHN Cc1cccc(Br)c1C(=O)N[C@H]1CC[C@@H](N2CCN(C)CC2)CC1 ZINC000644062890 567529936 /nfs/dbraw/zinc/52/99/36/567529936.db2.gz STUMKGXPTSTAEY-IYBDPMFKSA-N 0 3 394.357 3.046 10 0 GGAEHN CCNC(=O)N1CC[C@@H](N[C@@H](c2ccc(Br)cc2F)C2CC2)C1 ZINC000479382462 567530425 /nfs/dbraw/zinc/53/04/25/567530425.db2.gz AAOVLUAYEHUGPY-CZUORRHYSA-N 0 3 384.293 3.433 10 0 GGAEHN CCNC(=O)C[C@H]1CCCCN1C[C@@H](O)COc1cc(Cl)ccc1Cl ZINC000551718523 567531395 /nfs/dbraw/zinc/53/13/95/567531395.db2.gz GWAKBGNLRYTKIC-HUUCEWRRSA-N 0 3 389.323 3.114 10 0 GGAEHN CCN(CC)CCN(C(=O)c1ccccn1)c1ccc(Br)cn1 ZINC000571026146 567531434 /nfs/dbraw/zinc/53/14/34/567531434.db2.gz MJFOMNYAJHDQQZ-UHFFFAOYSA-N 0 3 377.286 3.228 10 0 GGAEHN CCNC(=O)C[C@@H]1CCCCN1C[C@H](O)COc1cc(Cl)ccc1Cl ZINC000551718522 567531414 /nfs/dbraw/zinc/53/14/14/567531414.db2.gz GWAKBGNLRYTKIC-GJZGRUSLSA-N 0 3 389.323 3.114 10 0 GGAEHN CCN(C(=O)N[C@H]1CCOc2ccc(Br)cc21)[C@@H]1CCN(C)C1 ZINC000663788245 567531830 /nfs/dbraw/zinc/53/18/30/567531830.db2.gz ZGBUVVLRFHIHJN-HIFRSBDPSA-N 0 3 382.302 3.008 10 0 GGAEHN CCN(C(=O)N[C@@H]1CCOc2ccc(Br)cc21)[C@@H]1CCN(C)C1 ZINC000663788246 567531955 /nfs/dbraw/zinc/53/19/55/567531955.db2.gz ZGBUVVLRFHIHJN-UKRRQHHQSA-N 0 3 382.302 3.008 10 0 GGAEHN COc1ccc(C[C@@H](CO)CNCc2ccsc2Br)cc1O ZINC000529566245 567532332 /nfs/dbraw/zinc/53/23/32/567532332.db2.gz CZPCAGLSSJVWLB-GFCCVEGCSA-N 0 3 386.311 3.166 10 0 GGAEHN CN1CCC[C@@H](NC(=O)NCC2(c3ccccc3Br)CCC2)C1 ZINC000644123116 567534155 /nfs/dbraw/zinc/53/41/55/567534155.db2.gz ZRQHYHRQMGKVGQ-CQSZACIVSA-N 0 3 380.330 3.264 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)NCC1(N(C)C)CCC1 ZINC000438536369 567534240 /nfs/dbraw/zinc/53/42/40/567534240.db2.gz PNEGEPLMFYNXTM-UHFFFAOYSA-N 0 3 378.314 3.313 10 0 GGAEHN CN1CCC[C@H](NC(=O)NCC2(c3ccccc3Br)CCC2)C1 ZINC000644123115 567534325 /nfs/dbraw/zinc/53/43/25/567534325.db2.gz ZRQHYHRQMGKVGQ-AWEZNQCLSA-N 0 3 380.330 3.264 10 0 GGAEHN C[C@H](CSCCF)NCc1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1 ZINC000595016243 567535510 /nfs/dbraw/zinc/53/55/10/567535510.db2.gz JBSXRHFTTMVFOJ-HZPDHXFCSA-N 0 3 388.574 3.288 10 0 GGAEHN C[C@@H](CSCCF)NCc1ccc(Br)cc1N1CCOCC1 ZINC000595020840 567535565 /nfs/dbraw/zinc/53/55/65/567535565.db2.gz AIUOHANZOWRLOH-ZDUSSCGKSA-N 0 3 391.350 3.467 10 0 GGAEHN N[C@@H]1CN(C(=O)[C@H]2CCc3cc(Br)ccc32)C[C@H]1c1ccccc1 ZINC000571088316 567535601 /nfs/dbraw/zinc/53/56/01/567535601.db2.gz GCQOGYNLHYFWKM-GBESFXJTSA-N 0 3 385.305 3.432 10 0 GGAEHN C[C@@H](CSCCF)NCc1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1 ZINC000595016241 567535797 /nfs/dbraw/zinc/53/57/97/567535797.db2.gz JBSXRHFTTMVFOJ-CVEARBPZSA-N 0 3 388.574 3.288 10 0 GGAEHN C[C@H](CCN[C@H]1CCc2ccc(I)cc21)[S@@](C)=O ZINC000595021776 567536308 /nfs/dbraw/zinc/53/63/08/567536308.db2.gz GBALYKTZZHRAPX-FWVNDXEPSA-N 0 3 377.291 3.025 10 0 GGAEHN COc1c(Br)cccc1CNC[C@@H](Cc1ccc(F)cc1)C(N)=O ZINC000479441386 567536323 /nfs/dbraw/zinc/53/63/23/567536323.db2.gz UDMVILVWWUXRAM-CQSZACIVSA-N 0 3 395.272 3.031 10 0 GGAEHN CN(C)CCOc1ccc(NC(=O)c2csc(C(F)(F)F)n2)cc1F ZINC000458278714 567537816 /nfs/dbraw/zinc/53/78/16/567537816.db2.gz FUKVFPHRKKESLS-UHFFFAOYSA-N 0 3 377.363 3.494 10 0 GGAEHN COc1c(Br)cccc1CN1CCC(C)(N2CCOCC2)CC1 ZINC000529663928 567538275 /nfs/dbraw/zinc/53/82/75/567538275.db2.gz NHSMRMIKHAQJJS-UHFFFAOYSA-N 0 3 383.330 3.144 10 0 GGAEHN CC[C@H](N[C@H]1CCc2ccc(I)cc21)[C@H](O)C(F)F ZINC000595042503 567538941 /nfs/dbraw/zinc/53/89/41/567538941.db2.gz SGGBCGYWUFYBGE-AVGNSLFASA-N 0 3 381.204 3.273 10 0 GGAEHN CO[C@H](CN[C@H](C)c1ccc(F)c(I)c1)[C@@H]1CCOC1 ZINC000595062943 567540584 /nfs/dbraw/zinc/54/05/84/567540584.db2.gz YGEJJYNTMWPUFG-IXPVHAAZSA-N 0 3 393.240 3.132 10 0 GGAEHN CO[C@H](CN[C@@H](C)c1ccc(F)c(I)c1)[C@H]1CCOC1 ZINC000595062942 567541064 /nfs/dbraw/zinc/54/10/64/567541064.db2.gz YGEJJYNTMWPUFG-ITDIGPHOSA-N 0 3 393.240 3.132 10 0 GGAEHN COC[C@H](N[C@H](C)c1ccccc1I)C1CCOCC1 ZINC000595075628 567541097 /nfs/dbraw/zinc/54/10/97/567541097.db2.gz ZWILDKYLYDRBBV-WBMJQRKESA-N 0 3 389.277 3.383 10 0 GGAEHN O=C(NC[C@H]1CCCN1CCCO)N[C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000458368349 567541366 /nfs/dbraw/zinc/54/13/66/567541366.db2.gz JBVNULKOQQFRCQ-MLGOLLRUSA-N 0 3 386.323 3.127 10 0 GGAEHN C[C@H]1CCCN1C(=O)CCNC1(c2ccc(Br)cc2)CCOCC1 ZINC000438723964 567541532 /nfs/dbraw/zinc/54/15/32/567541532.db2.gz NAWXPHKDGGZKCL-HNNXBMFYSA-N 0 3 395.341 3.445 10 0 GGAEHN Cc1cncc(CCN[C@@H](C)c2ccc(F)c(I)c2)n1 ZINC000595092293 567542239 /nfs/dbraw/zinc/54/22/39/567542239.db2.gz XDXVABIEEDRNLC-NSHDSACASA-N 0 3 385.224 3.422 10 0 GGAEHN O=C(NC[C@@H]1CCCN1CCCO)N[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000458368347 567542101 /nfs/dbraw/zinc/54/21/01/567542101.db2.gz JBVNULKOQQFRCQ-LRDDRELGSA-N 0 3 386.323 3.127 10 0 GGAEHN O=C(N[C@H]1CCc2c1ccc(Cl)c2Cl)N[C@@H]1CCCN(CCCO)C1 ZINC000458383466 567543068 /nfs/dbraw/zinc/54/30/68/567543068.db2.gz ZRCINLPBAFPXFO-WBMJQRKESA-N 0 3 386.323 3.127 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCCC1)c1[nH]nc(C2CC2)c1Br ZINC000529720049 567543196 /nfs/dbraw/zinc/54/31/96/567543196.db2.gz OYJYUQUUDAWSCO-CYBMUJFWSA-N 0 3 381.318 3.186 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCCC1)c1c[nH]c2ncc(Br)cc12 ZINC000529715965 567543864 /nfs/dbraw/zinc/54/38/64/567543864.db2.gz LCOJGMGAKLWVDK-AWEZNQCLSA-N 0 3 391.313 3.462 10 0 GGAEHN CN1CCC[C@@H](CNC(=O)N2CC(F)(F)C(F)(F)C2)[C@@H]1c1cccs1 ZINC000458425747 567546265 /nfs/dbraw/zinc/54/62/65/567546265.db2.gz LRRVXGBVZKJZQZ-WCQYABFASA-N 0 3 379.423 3.427 10 0 GGAEHN CC[C@@H]1CN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)n2)C[C@H](C)N1 ZINC000620902470 567549014 /nfs/dbraw/zinc/54/90/14/567549014.db2.gz ZIEMDRIESMUZGM-SWLSCSKDSA-N 0 3 391.313 3.156 10 0 GGAEHN O[C@@H](CNc1ccc(Br)c(C(F)(F)F)n1)CN1CCCCC1 ZINC000664027061 567549148 /nfs/dbraw/zinc/54/91/48/567549148.db2.gz WEUPQRITSLQBHS-JTQLQIEISA-N 0 3 382.224 3.122 10 0 GGAEHN Cc1nc(NC(=O)C[C@H]2NCc3ccccc32)ccc1I ZINC000595252166 567549809 /nfs/dbraw/zinc/54/98/09/567549809.db2.gz BBVHFUJEDHDIBN-CQSZACIVSA-N 0 3 393.228 3.168 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1sccc1Br ZINC000620914638 567549872 /nfs/dbraw/zinc/54/98/72/567549872.db2.gz UAXYRUNPVQNCOX-GFCCVEGCSA-N 0 3 387.343 3.226 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1ccc(C(F)(F)F)s1 ZINC000620911605 567549887 /nfs/dbraw/zinc/54/98/87/567549887.db2.gz GSWRDIXNNAHFLV-GFCCVEGCSA-N 0 3 376.444 3.482 10 0 GGAEHN CCCOc1c(Br)cc(C(=O)N2C[C@@H](C)N[C@@H](CC)C2)cc1OC ZINC000620907163 567550206 /nfs/dbraw/zinc/55/02/06/567550206.db2.gz GKXKVVRUVGZYBZ-OCCSQVGLSA-N 0 3 399.329 3.459 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1ccc(Br)cc1 ZINC000620917208 567550659 /nfs/dbraw/zinc/55/06/59/567550659.db2.gz DGMCOFLZWHGLGF-INIZCTEOSA-N 0 3 381.314 3.165 10 0 GGAEHN Cc1oc(Br)cc1C(=O)N1CC2(CCCC2)OC[C@H]1CN(C)C ZINC000620917759 567550683 /nfs/dbraw/zinc/55/06/83/567550683.db2.gz MRJHCBAGAORKAS-CYBMUJFWSA-N 0 3 385.302 3.066 10 0 GGAEHN Cc1ncc(C(=O)N2CC3(CCCC3)OC[C@H]2CN(C)C)c(Cl)c1Cl ZINC000620910498 567550713 /nfs/dbraw/zinc/55/07/13/567550713.db2.gz RREYTJNGPYQNOZ-CYBMUJFWSA-N 0 3 386.323 3.412 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1csc(Br)c1 ZINC000620914567 567550986 /nfs/dbraw/zinc/55/09/86/567550986.db2.gz RIYJKZMJVQEOQN-ZDUSSCGKSA-N 0 3 387.343 3.226 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1ccc(F)cc1Br ZINC000620914487 567551066 /nfs/dbraw/zinc/55/10/66/567551066.db2.gz PZUUCJPROLDPGH-CQSZACIVSA-N 0 3 399.304 3.304 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1cc(F)ccc1Br ZINC000620914300 567551118 /nfs/dbraw/zinc/55/11/18/567551118.db2.gz MYBVWNGMYQMMJE-CQSZACIVSA-N 0 3 399.304 3.304 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNc1ncc(Cn2cc(Br)cn2)s1 ZINC000664142623 567554478 /nfs/dbraw/zinc/55/44/78/567554478.db2.gz KVUDOOPTRXOXOJ-GFCCVEGCSA-N 0 3 384.347 3.435 10 0 GGAEHN CCN(C(=O)NCCCc1ccc(Br)cc1F)[C@@H]1CCN(C)C1 ZINC000664148555 567554909 /nfs/dbraw/zinc/55/49/09/567554909.db2.gz BJSGDNKPHVTMSO-OAHLLOKOSA-N 0 3 386.309 3.256 10 0 GGAEHN C[C@@H](N[C@@H](CO)c1cccc(Br)c1)c1ccccc1-n1ccnn1 ZINC000552063084 567555009 /nfs/dbraw/zinc/55/50/09/567555009.db2.gz OPEHSEHPHLHUCE-DYVFJYSZSA-N 0 3 387.281 3.414 10 0 GGAEHN CC1(C)CN([C@H](CNC[C@@H](O)C(F)(F)F)c2ccc(Cl)cc2)CCO1 ZINC000644545385 567557579 /nfs/dbraw/zinc/55/75/79/567557579.db2.gz RATGDSKHERAYTJ-HUUCEWRRSA-N 0 3 380.838 3.005 10 0 GGAEHN C[NH+](C)CCc1ccc(CNC(=O)Cc2ccc(Br)cc2[O-])cc1 ZINC000505088094 567558313 /nfs/dbraw/zinc/55/83/13/567558313.db2.gz VQTIUKSOPIUFGZ-UHFFFAOYSA-N 0 3 391.309 3.118 10 0 GGAEHN CC[C@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccc(OC(F)F)cc1 ZINC000552097155 567558629 /nfs/dbraw/zinc/55/86/29/567558629.db2.gz UZJURAKHSDOJPH-ZBFHGGJFSA-N 0 3 376.469 3.143 10 0 GGAEHN C[C@H](Cc1c(Cl)cccc1Cl)NC[C@@H]1CCCCN1S(C)(=O)=O ZINC000552100754 567558769 /nfs/dbraw/zinc/55/87/69/567558769.db2.gz UAYNLQYHTBXFBI-OLZOCXBDSA-N 0 3 379.353 3.328 10 0 GGAEHN CN1CCCC(C)(C)[C@@H]1CNC(=O)c1cc(Br)cc2[nH]cnc21 ZINC000505096364 567558810 /nfs/dbraw/zinc/55/88/10/567558810.db2.gz LKRBSHXOTJNNSH-AWEZNQCLSA-N 0 3 379.302 3.176 10 0 GGAEHN Cc1ccnc(NCc2ccc(CN3CC[C@@H](O)C3)cc2)c1Br ZINC000664238113 567558977 /nfs/dbraw/zinc/55/89/77/567558977.db2.gz WGBQVBPKQDMIMW-MRXNPFEDSA-N 0 3 376.298 3.331 10 0 GGAEHN O=C(Cc1c(F)ccc(Br)c1F)NC[C@H]1CCCCN1C1CC1 ZINC000505107001 567559953 /nfs/dbraw/zinc/55/99/53/567559953.db2.gz FXTOSLUTQIEALF-GFCCVEGCSA-N 0 3 387.268 3.403 10 0 GGAEHN Cn1nccc1C1=CCN(CCC(=O)Nc2ccc(Br)cc2)CC1 ZINC000552123537 567560112 /nfs/dbraw/zinc/56/01/12/567560112.db2.gz VUSXPEOIOMKIGI-UHFFFAOYSA-N 0 3 389.297 3.301 10 0 GGAEHN O=C(COc1ccc(Br)cc1F)NC[C@@H]1CCN1C1CCCC1 ZINC000530025061 567561233 /nfs/dbraw/zinc/56/12/33/567561233.db2.gz GRKONKBNVCLCPQ-AWEZNQCLSA-N 0 3 385.277 3.100 10 0 GGAEHN CN(C)C[C@@H](NC(=O)[C@H]1CCn2ccnc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031238 567561501 /nfs/dbraw/zinc/56/15/01/567561501.db2.gz DAGUYTYOTAMQBP-XJKSGUPXSA-N 0 3 381.307 3.171 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCC1)c1cc(Br)cc2[nH]cnc21 ZINC000530028134 567561555 /nfs/dbraw/zinc/56/15/55/567561555.db2.gz NXJROOCXEWDREN-CYBMUJFWSA-N 0 3 377.286 3.072 10 0 GGAEHN C[C@H](N[C@@H]1CCN(CC(=O)OC(C)(C)C)C1=O)c1ccc(Br)cc1 ZINC000595414195 567561976 /nfs/dbraw/zinc/56/19/76/567561976.db2.gz JBSDODUVVVPFSL-SWLSCSKDSA-N 0 3 397.313 3.042 10 0 GGAEHN CN(C)C[C@@H](NC(=O)[C@H]1CCn2cncc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031265 567562089 /nfs/dbraw/zinc/56/20/89/567562089.db2.gz DMKMRTNRUNKZPA-SUMWQHHRSA-N 0 3 381.307 3.171 10 0 GGAEHN CN(C)C[C@@H](NC(=O)[C@@H]1CCn2cncc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031262 567562171 /nfs/dbraw/zinc/56/21/71/567562171.db2.gz DMKMRTNRUNKZPA-CXAGYDPISA-N 0 3 381.307 3.171 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCC1)[C@@H]1COc2ccc(Br)cc21 ZINC000530022633 567562492 /nfs/dbraw/zinc/56/24/92/567562492.db2.gz IRVXDYVYPCKJMU-GOEBONIOSA-N 0 3 379.298 3.058 10 0 GGAEHN CN(C)C[C@@H](NC(=O)[C@@H]1CCc2nccn2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031461 567562583 /nfs/dbraw/zinc/56/25/83/567562583.db2.gz JWWUSQLLGUSJDF-CZUORRHYSA-N 0 3 381.307 3.171 10 0 GGAEHN COc1cc(Br)c(C(=O)NC[C@@H]2CCN2C2CCCC2)cc1OC ZINC000530023868 567562696 /nfs/dbraw/zinc/56/26/96/567562696.db2.gz XHTHOAQMOUBLGZ-ZDUSSCGKSA-N 0 3 397.313 3.213 10 0 GGAEHN CN(C)C[C@@H](NC(=O)[C@H]1CCc2nccn2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031462 567562713 /nfs/dbraw/zinc/56/27/13/567562713.db2.gz JWWUSQLLGUSJDF-XJKSGUPXSA-N 0 3 381.307 3.171 10 0 GGAEHN Cc1cc(C(=O)N2CCN[C@H](C(C)C)C2)nn1-c1ccc(Br)cc1 ZINC000621154562 567562839 /nfs/dbraw/zinc/56/28/39/567562839.db2.gz NTAIHMMRWFDHAY-KRWDZBQOSA-N 0 3 391.313 3.013 10 0 GGAEHN COc1cc(C[NH2+]C[C@H](O)[C@@H](C)c2ccccc2)cc(Br)c1[O-] ZINC000644601350 567563035 /nfs/dbraw/zinc/56/30/35/567563035.db2.gz BHWOOTZKUREKPT-LRDDRELGSA-N 0 3 380.282 3.418 10 0 GGAEHN CN(C)C[C@H](NC(=O)[C@H]1CCc2nc[nH]c2C1)c1ccc(Cl)c(Cl)c1 ZINC000530032087 567563712 /nfs/dbraw/zinc/56/37/12/567563712.db2.gz FSLLOWKKHDFRJD-SJCJKPOMSA-N 0 3 381.307 3.241 10 0 GGAEHN CN(C)C[C@H](NC(=O)[C@H]1CCc2[nH]cnc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530032087 567563718 /nfs/dbraw/zinc/56/37/18/567563718.db2.gz FSLLOWKKHDFRJD-SJCJKPOMSA-N 0 3 381.307 3.241 10 0 GGAEHN CN(C)C[C@@H](NC(=O)[C@H]1CCc2nc[nH]c2C1)c1ccc(Cl)c(Cl)c1 ZINC000530032141 567564159 /nfs/dbraw/zinc/56/41/59/567564159.db2.gz FSLLOWKKHDFRJD-YVEFUNNKSA-N 0 3 381.307 3.241 10 0 GGAEHN CN(C)C[C@@H](NC(=O)[C@H]1CCc2[nH]cnc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530032141 567564163 /nfs/dbraw/zinc/56/41/63/567564163.db2.gz FSLLOWKKHDFRJD-YVEFUNNKSA-N 0 3 381.307 3.241 10 0 GGAEHN CN(C)C[C@@H](NC(=O)[C@H]1CCc2cncn2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031860 567564177 /nfs/dbraw/zinc/56/41/77/567564177.db2.gz CTOLTVONUHJALI-SUMWQHHRSA-N 0 3 381.307 3.171 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1cnn(-c2ccc(Br)cc2)c1 ZINC000479855799 567564390 /nfs/dbraw/zinc/56/43/90/567564390.db2.gz ISZTYJWWDJHQGX-AWEZNQCLSA-N 0 3 391.313 3.239 10 0 GGAEHN CCn1c(CNC[C@@H](O)CCOC(C)C)nc2cc(Br)ccc21 ZINC000644632149 567566694 /nfs/dbraw/zinc/56/66/94/567566694.db2.gz XOWFAGDSNUAJKH-AWEZNQCLSA-N 0 3 384.318 3.084 10 0 GGAEHN CC[C@@H](CN1CCCC1)NC(=O)Cc1noc2ccc(Br)cc21 ZINC000644641277 567567621 /nfs/dbraw/zinc/56/76/21/567567621.db2.gz XBEMIFQVIYOQJN-ZDUSSCGKSA-N 0 3 380.286 3.123 10 0 GGAEHN COc1ccccc1CCN(C)C[C@@H](O)COc1ccc(Br)cc1 ZINC000552196032 567568010 /nfs/dbraw/zinc/56/80/10/567568010.db2.gz NTGGZIQLUJKCOC-QGZVFWFLSA-N 0 3 394.309 3.372 10 0 GGAEHN Cn1cnc(CN2CC[C@@H](Cc3cccc(I)c3)C2)c1 ZINC000595505984 567569610 /nfs/dbraw/zinc/56/96/10/567569610.db2.gz ATJWFMABEWKSPV-AWEZNQCLSA-N 0 3 381.261 3.089 10 0 GGAEHN CCN(C(=O)N[C@@H](C)Cc1ccc(F)c(Br)c1)[C@H]1CCN(C)C1 ZINC000664460918 567569909 /nfs/dbraw/zinc/56/99/09/567569909.db2.gz KRGARASZJTZBQA-JSGCOSHPSA-N 0 3 386.309 3.255 10 0 GGAEHN CC(C)(C)OC(=O)CC1(NCc2ccc(Br)cn2)CCOCC1 ZINC000595540117 567571146 /nfs/dbraw/zinc/57/11/46/567571146.db2.gz GSOINUGTXXPUNE-UHFFFAOYSA-N 0 3 385.302 3.215 10 0 GGAEHN CCSC1(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CC1 ZINC000595597849 567572239 /nfs/dbraw/zinc/57/22/39/567572239.db2.gz BJSLRSPVCJFBSZ-UHFFFAOYSA-N 0 3 379.492 3.377 10 0 GGAEHN CN(C(=O)N[C@@H](c1cncc(Br)c1)C1CC1)[C@@H]1CCN(C2CC2)C1 ZINC000505393497 567572821 /nfs/dbraw/zinc/57/28/21/567572821.db2.gz BZWNGSVCKVORDK-IAGOWNOFSA-N 0 3 393.329 3.173 10 0 GGAEHN CCN(C(=O)N[C@@H](C)Cc1cc(Br)ccc1F)[C@H]1CCN(C)C1 ZINC000664527803 567573257 /nfs/dbraw/zinc/57/32/57/567573257.db2.gz WHIULBRXTNFVFC-WFASDCNBSA-N 0 3 386.309 3.255 10 0 GGAEHN CSC1(CNC(=O)N2CC[C@H](C(F)(F)F)C(C)(C)C2)CCN(C)CC1 ZINC000571580458 567573551 /nfs/dbraw/zinc/57/35/51/567573551.db2.gz ZNZOGWMGBZIRAI-ZDUSSCGKSA-N 0 3 381.508 3.434 10 0 GGAEHN COc1cc(CN[C@H]2CCN(C)[C@@H]2c2ccccc2)c(Br)cn1 ZINC000621290945 567574630 /nfs/dbraw/zinc/57/46/30/567574630.db2.gz AALSSWSXUBWRKM-FUHWJXTLSA-N 0 3 376.298 3.388 10 0 GGAEHN CSC1(CNC(=O)NCC(F)(F)c2ccc(F)cc2)CCN(C)CC1 ZINC000595634638 567575542 /nfs/dbraw/zinc/57/55/42/567575542.db2.gz HIUOPPOMTWFGJP-UHFFFAOYSA-N 0 3 375.460 3.044 10 0 GGAEHN CCCN(CCN1CCCCC1)C(=O)N[C@H](C)c1ncc(Br)cn1 ZINC000458828664 567576766 /nfs/dbraw/zinc/57/67/66/567576766.db2.gz FHNBYTYCJUYQHR-CQSZACIVSA-N 0 3 398.349 3.208 10 0 GGAEHN CCN(C(=O)N[C@H](C)[C@H](OC)c1ccc(Br)cc1)[C@H]1CCN(C)C1 ZINC000664583658 567577382 /nfs/dbraw/zinc/57/73/82/567577382.db2.gz YUMIVQUTUWBMEW-COXVUDFISA-N 0 3 398.345 3.261 10 0 GGAEHN CCN(C(=O)N[C@H](C)[C@@H](OC)c1ccc(Br)cc1)[C@@H]1CCN(C)C1 ZINC000664583659 567577699 /nfs/dbraw/zinc/57/76/99/567577699.db2.gz YUMIVQUTUWBMEW-KBRIMQKVSA-N 0 3 398.345 3.261 10 0 GGAEHN C[C@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccc(Br)c(F)c1 ZINC000552333386 567578996 /nfs/dbraw/zinc/57/89/96/567578996.db2.gz CZTDWZDJJVXTJP-AAEUAGOBSA-N 0 3 393.322 3.053 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Br)C(=O)N1CC[C@H]2CN(C)C[C@@H]21 ZINC000644811326 567578955 /nfs/dbraw/zinc/57/89/55/567578955.db2.gz BBGPJJVKYOHXBV-MJVIPROJSA-N 0 3 387.705 3.032 10 0 GGAEHN C[C@@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccc(F)c(Br)c1 ZINC000552333461 567579210 /nfs/dbraw/zinc/57/92/10/567579210.db2.gz FZEFTBRTUQSZKQ-YPMHNXCESA-N 0 3 393.322 3.053 10 0 GGAEHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)Cc1c(F)ccc(Br)c1F ZINC000552333015 567579358 /nfs/dbraw/zinc/57/93/58/567579358.db2.gz QSTYWQDXSGJTOF-VXGBXAGGSA-N 0 3 387.268 3.355 10 0 GGAEHN Cc1cc(Br)cc(C)c1N1CCC[C@@H](N[C@H]2CCCOC2)C1=O ZINC000552333624 567579412 /nfs/dbraw/zinc/57/94/12/567579412.db2.gz KFEVWUYCKAEIKU-JKSUJKDBSA-N 0 3 381.314 3.330 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Br)C(=O)N1CC[C@H]2CN(C)C[C@H]21 ZINC000644811321 567579489 /nfs/dbraw/zinc/57/94/89/567579489.db2.gz BBGPJJVKYOHXBV-COPLHBTASA-N 0 3 387.705 3.032 10 0 GGAEHN C[C@H](NC(=O)N1CC[C@@H](N2CC=CC2)C1)c1ccc(F)c(Br)c1 ZINC000458858211 567579614 /nfs/dbraw/zinc/57/96/14/567579614.db2.gz SYKKXOXYBPSFAA-GXTWGEPZSA-N 0 3 382.277 3.305 10 0 GGAEHN Cc1cc(Br)cn2c(CNc3ccc4c(c3)OCCNC4)cnc12 ZINC000530183653 567579873 /nfs/dbraw/zinc/57/98/73/567579873.db2.gz SLQAOMVOIWKSHO-UHFFFAOYSA-N 0 3 387.281 3.499 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)c2csc(-c3ccc(Br)s3)n2)C1 ZINC000644822376 567580182 /nfs/dbraw/zinc/58/01/82/567580182.db2.gz SCQMCNOVHYAWFY-ONGXEEELSA-N 0 3 398.351 3.410 10 0 GGAEHN CCCOc1c(Br)cc(C(=O)N2CC[C@H]3CN(C)C[C@H]32)cc1OC ZINC000644819961 567580305 /nfs/dbraw/zinc/58/03/05/567580305.db2.gz UMAJZNOCNOLAAE-SWLSCSKDSA-N 0 3 397.313 3.023 10 0 GGAEHN Cc1cc(SCC(=O)N2CC[C@@H]3CN(C)C[C@@H]32)c(C)cc1Br ZINC000644820137 567580575 /nfs/dbraw/zinc/58/05/75/567580575.db2.gz UQYMDEBRKXANCL-HIFRSBDPSA-N 0 3 383.355 3.321 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3ccc(Br)c(OC(F)(F)F)c3)[C@@H]2C1 ZINC000644814674 567580617 /nfs/dbraw/zinc/58/06/17/567580617.db2.gz LNQUBBQLFFRCBN-ZYHUDNBSSA-N 0 3 393.203 3.124 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)CCCCOc3ccc(Br)cc3)[C@@H]2C1 ZINC000644822160 567580779 /nfs/dbraw/zinc/58/07/79/567580779.db2.gz OYQPAINGXCVERK-WMLDXEAASA-N 0 3 381.314 3.161 10 0 GGAEHN Cc1nccc(NC(=O)N(C)CCCN(C)Cc2ccco2)c1Br ZINC000571669428 567580881 /nfs/dbraw/zinc/58/08/81/567580881.db2.gz QSJOTORSWGXXSH-UHFFFAOYSA-N 0 3 395.301 3.153 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3csc(-c4ccc(Br)s4)n3)[C@@H]2C1 ZINC000644822372 567580921 /nfs/dbraw/zinc/58/09/21/567580921.db2.gz SCQMCNOVHYAWFY-MWLCHTKSSA-N 0 3 398.351 3.410 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)c2cc(Br)sc2Br)C1 ZINC000644814043 567580965 /nfs/dbraw/zinc/58/09/65/567580965.db2.gz INCRDRAYXYOJML-CBAPKCEASA-N 0 3 394.132 3.049 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)c3cc(Br)cc(C(F)(F)F)c3)[C@@H]2C1 ZINC000644813353 567581093 /nfs/dbraw/zinc/58/10/93/567581093.db2.gz BEGSXNXPKLXSBE-TVQRCGJNSA-N 0 3 377.204 3.244 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)CCCCOc2ccc(Br)cc2)C1 ZINC000644822162 567581138 /nfs/dbraw/zinc/58/11/38/567581138.db2.gz OYQPAINGXCVERK-YOEHRIQHSA-N 0 3 381.314 3.161 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3coc(-c4ccc(Br)cc4F)n3)[C@H]2C1 ZINC000644816361 567581279 /nfs/dbraw/zinc/58/12/79/567581279.db2.gz VBVOCJOHWSPFCC-BMIGLBTASA-N 0 3 394.244 3.019 10 0 GGAEHN CCCOc1c(Br)cc(C(=O)N2CC[C@@H]3CN(C)C[C@H]32)cc1OC ZINC000644819960 567581367 /nfs/dbraw/zinc/58/13/67/567581367.db2.gz UMAJZNOCNOLAAE-IUODEOHRSA-N 0 3 397.313 3.023 10 0 GGAEHN CN1C[C@H]2CCN(Cc3ccc(OC(F)(F)F)c(Br)c3)[C@H]2C1 ZINC000644840285 567581707 /nfs/dbraw/zinc/58/17/07/567581707.db2.gz JUJOBIYXVMXPHX-YPMHNXCESA-N 0 3 379.220 3.484 10 0 GGAEHN CSc1ccc([C@@H](CNC(=O)N[C@@H](CO)c2ccsc2)N(C)C)cc1 ZINC000458878931 567582481 /nfs/dbraw/zinc/58/24/81/567582481.db2.gz BWKZNNISOUQTPT-DLBZAZTESA-N 0 3 379.551 3.106 10 0 GGAEHN CCCOc1c(Br)cc(CN2CC[C@H]3CN(C)C[C@H]32)cc1OC ZINC000644840509 567582511 /nfs/dbraw/zinc/58/25/11/567582511.db2.gz KPCFUZIRFAJLII-GOEBONIOSA-N 0 3 383.330 3.382 10 0 GGAEHN CCN(C(=O)NCc1ccc(Br)cc1OC)[C@H]1CCN(CC)C1 ZINC000664713743 567584316 /nfs/dbraw/zinc/58/43/16/567584316.db2.gz SLBSWZWDIWNFJP-HNNXBMFYSA-N 0 3 384.318 3.083 10 0 GGAEHN CCN(C(=O)N[C@H](C)c1ccc(Br)cc1OC)[C@H]1CCN(C)C1 ZINC000664730152 567585860 /nfs/dbraw/zinc/58/58/60/567585860.db2.gz PUVKIWGIDJSKGD-OCCSQVGLSA-N 0 3 384.318 3.254 10 0 GGAEHN CSCCCCN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480189067 567585896 /nfs/dbraw/zinc/58/58/96/567585896.db2.gz ADAPHGFNKUZCCA-ZDUSSCGKSA-N 0 3 378.357 3.400 10 0 GGAEHN C[C@@]1(CNC[C@@H](O)c2cccc(Br)c2)COc2ccccc2O1 ZINC000530236699 567586368 /nfs/dbraw/zinc/58/63/68/567586368.db2.gz WVAPQSQLCJXUTJ-CRAIPNDOSA-N 0 3 378.266 3.302 10 0 GGAEHN CN1C(=O)c2ccccc2[C@H]1CNC[C@@H](O)c1ccc(F)c(Br)c1 ZINC000530244902 567587244 /nfs/dbraw/zinc/58/72/44/567587244.db2.gz RAYMYJIUZNDJQO-IAGOWNOFSA-N 0 3 393.256 3.038 10 0 GGAEHN CN1C(=O)c2ccccc2[C@H]1CNC[C@H](O)c1ccc(F)c(Br)c1 ZINC000530244906 567587981 /nfs/dbraw/zinc/58/79/81/567587981.db2.gz RAYMYJIUZNDJQO-SJORKVTESA-N 0 3 393.256 3.038 10 0 GGAEHN C[C@@H](NCc1ccc(OCCN(C)C)cc1)c1ncc(Br)cn1 ZINC000644895159 567588293 /nfs/dbraw/zinc/58/82/93/567588293.db2.gz PTDOBZSRSRDLIS-CYBMUJFWSA-N 0 3 379.302 3.030 10 0 GGAEHN COC(=O)CC[C@H](N)C(=O)NC[C@H](Cc1ccc(Cl)cc1Cl)C(C)C ZINC000571795353 567589436 /nfs/dbraw/zinc/58/94/36/567589436.db2.gz VCMIPBHWCBVRGB-BBRMVZONSA-N 0 3 389.323 3.205 10 0 GGAEHN COC(=O)CC[C@@H](N)C(=O)NC[C@H](Cc1ccc(Cl)cc1Cl)C(C)C ZINC000571795356 567589744 /nfs/dbraw/zinc/58/97/44/567589744.db2.gz VCMIPBHWCBVRGB-XJKSGUPXSA-N 0 3 389.323 3.205 10 0 GGAEHN CCN(C(=O)N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1)[C@@H]1CCN(C)C1 ZINC000664785167 567589847 /nfs/dbraw/zinc/58/98/47/567589847.db2.gz HUCWSNQEAHIELU-DVOMOZLQSA-N 0 3 384.293 3.180 10 0 GGAEHN CN(CCC(=O)N[C@@H](c1cncc(Br)c1)C1CC1)c1ccncc1 ZINC000552429594 567590086 /nfs/dbraw/zinc/59/00/86/567590086.db2.gz AZJBTVBPMPWEPF-GOSISDBHSA-N 0 3 389.297 3.333 10 0 GGAEHN CCN(C(=O)N[C@H]1CCOc2c(Br)cccc21)[C@@H]1CCN(C)C1 ZINC000664823748 567592761 /nfs/dbraw/zinc/59/27/61/567592761.db2.gz JUZQTKYSURQUKT-DOMZBBRYSA-N 0 3 382.302 3.008 10 0 GGAEHN CN(C)[C@]1(CNC(=O)CSCc2cc(-c3cccs3)on2)CCSC1 ZINC000480269229 567592800 /nfs/dbraw/zinc/59/28/00/567592800.db2.gz VJZQJXRPNUAHHT-KRWDZBQOSA-N 0 3 397.591 3.190 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)c2cc3c(cccc3Br)[nH]2)CCSC1 ZINC000480272000 567592963 /nfs/dbraw/zinc/59/29/63/567592963.db2.gz AYODESJQBTUDRH-MRXNPFEDSA-N 0 3 382.327 3.098 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NC[C@]1(N(C)C)CCSC1 ZINC000480274847 567593469 /nfs/dbraw/zinc/59/34/69/567593469.db2.gz OOBZYWNGZBWAQW-MEDUHNTESA-N 0 3 377.337 3.314 10 0 GGAEHN CCN(C(=O)N[C@@H](c1cncc(Br)c1)C1CC1)[C@H]1CCN(C)C1 ZINC000664849564 567593500 /nfs/dbraw/zinc/59/35/00/567593500.db2.gz BVHLKXQFUIFCSB-JKSUJKDBSA-N 0 3 381.318 3.031 10 0 GGAEHN CN(C)CCOc1cc(CNC(=O)c2cc3cc(Cl)sc3[nH]2)ccn1 ZINC000571848905 567593724 /nfs/dbraw/zinc/59/37/24/567593724.db2.gz VRJXTHVKXSPSOW-UHFFFAOYSA-N 0 3 378.885 3.148 10 0 GGAEHN CCN(C(=O)N[C@@H](c1cncc(Br)c1)C1CC1)[C@@H]1CCN(C)C1 ZINC000664849563 567594130 /nfs/dbraw/zinc/59/41/30/567594130.db2.gz BVHLKXQFUIFCSB-HZPDHXFCSA-N 0 3 381.318 3.031 10 0 GGAEHN Cc1nccc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c1Br ZINC000530354405 567595243 /nfs/dbraw/zinc/59/52/43/567595243.db2.gz CXCSHUWXWIKKSM-NVXWUHKLSA-N 0 3 389.297 3.141 10 0 GGAEHN O=C(N[C@H]1CCc2c1ccc(F)c2Br)N1CCN2CCC1CC2 ZINC000459049719 567596685 /nfs/dbraw/zinc/59/66/85/567596685.db2.gz WERMLRWDNNPPIH-HNNXBMFYSA-N 0 3 382.277 3.065 10 0 GGAEHN CN(C(=O)N[C@H]1CCc2c1ccc(F)c2Br)[C@@H]1CCN(C2CC2)C1 ZINC000459070731 567598405 /nfs/dbraw/zinc/59/84/05/567598405.db2.gz RRNJAXCQSYVNAT-WBMJQRKESA-N 0 3 396.304 3.454 10 0 GGAEHN O=C(N[C@@H]1CCc2c1ccc(F)c2Br)N1CC[C@@H](N2CC=CC2)C1 ZINC000459072731 567598558 /nfs/dbraw/zinc/59/85/58/567598558.db2.gz SUZOEVMCLDXYQC-MLGOLLRUSA-N 0 3 394.288 3.231 10 0 GGAEHN CCN(C(=O)NCCc1c[nH]c2cccc(Br)c12)[C@@H]1CCN(C)C1 ZINC000664920280 567599206 /nfs/dbraw/zinc/59/92/06/567599206.db2.gz NRYXPMZOMQLFNY-CQSZACIVSA-N 0 3 393.329 3.209 10 0 GGAEHN CN1CCC[C@]2(CCN(C(=O)Nc3cnc4c(Br)cccn34)C2)C1 ZINC000645009521 567599384 /nfs/dbraw/zinc/59/93/84/567599384.db2.gz XDHPVLYPRIUAKD-KRWDZBQOSA-N 0 3 392.301 3.046 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)CSc2cccc(C(F)(F)F)c2)CCSC1 ZINC000480389317 567599695 /nfs/dbraw/zinc/59/96/95/567599695.db2.gz YHFBTPUTKQBTKM-OAHLLOKOSA-N 0 3 378.485 3.351 10 0 GGAEHN CCN(C(=O)N[C@H]1C[C@H](c2ccc(Br)cc2)C1)[C@H]1CCN(C)C1 ZINC000664938137 567600289 /nfs/dbraw/zinc/60/02/89/567600289.db2.gz MJPGLRANUSEYEB-XIRDDKMYSA-N 0 3 380.330 3.431 10 0 GGAEHN CN(C)CCOc1ccccc1C(=O)NCc1ccc(Br)c(F)c1 ZINC000621665515 567602339 /nfs/dbraw/zinc/60/23/39/567602339.db2.gz SEICDGFKHKBVEE-UHFFFAOYSA-N 0 3 395.272 3.459 10 0 GGAEHN CCN(CC)CC(=O)N1CCC[C@H]1c1ccccc1I ZINC000505960684 567605434 /nfs/dbraw/zinc/60/54/34/567605434.db2.gz XUQJXNBDEKJUSI-HNNXBMFYSA-N 0 3 386.277 3.297 10 0 GGAEHN OC[C@@H](CNCc1cc(O)ccc1Br)Cc1ccc(F)c(F)c1 ZINC000480463160 567606886 /nfs/dbraw/zinc/60/68/86/567606886.db2.gz SAMCXPIBKRRSRO-GFCCVEGCSA-N 0 3 386.236 3.374 10 0 GGAEHN CCN1CCN(CCCN[C@@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621750355 567608601 /nfs/dbraw/zinc/60/86/01/567608601.db2.gz NWYPABXJWNPANN-INIZCTEOSA-N 0 3 390.316 3.373 10 0 GGAEHN CCN1CCN(CCCN[C@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621750356 567609179 /nfs/dbraw/zinc/60/91/79/567609179.db2.gz NWYPABXJWNPANN-MRXNPFEDSA-N 0 3 390.316 3.373 10 0 GGAEHN CCOc1c(Cl)cccc1CC(=O)N1C[C@@H](SC)[C@@H](N2CCCC2)C1 ZINC000480572860 567612240 /nfs/dbraw/zinc/61/22/40/567612240.db2.gz BAZNDHDUARANMI-DLBZAZTESA-N 0 3 382.957 3.319 10 0 GGAEHN CCOc1c(Cl)cccc1CC(=O)N1C[C@H](SC)[C@@H](N2CCCC2)C1 ZINC000480572862 567612492 /nfs/dbraw/zinc/61/24/92/567612492.db2.gz BAZNDHDUARANMI-IRXDYDNUSA-N 0 3 382.957 3.319 10 0 GGAEHN CCCN(C(=O)N[C@H]1CCOc2ccc(Br)cc21)[C@H]1CCN(C)C1 ZINC000645204626 567613237 /nfs/dbraw/zinc/61/32/37/567613237.db2.gz LSZCZCGGJDHELF-HOCLYGCPSA-N 0 3 396.329 3.398 10 0 GGAEHN CCN(CC)CCNS(=O)(=O)c1ccc(-c2csc(COC)c2)cc1 ZINC000665220166 567614260 /nfs/dbraw/zinc/61/42/60/567614260.db2.gz UFLGJFPWUUPRCU-UHFFFAOYSA-N 0 3 382.551 3.182 10 0 GGAEHN CC(C)[C@]1(CO)CCCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000645248241 567614606 /nfs/dbraw/zinc/61/46/06/567614606.db2.gz LVKDOVAUQIRLIR-RDTXWAMCSA-N 0 3 376.324 3.464 10 0 GGAEHN COc1ccc(Br)cc1C1(NC(=O)NC[C@H](C)N(C)C2CC2)CC1 ZINC000645263038 567615630 /nfs/dbraw/zinc/61/56/30/567615630.db2.gz JAAAAKVHYLDRLX-LBPRGKRZSA-N 0 3 396.329 3.229 10 0 GGAEHN COc1ccc(Br)cc1C1(NC(=O)NC[C@@H](C)N(C)C2CC2)CC1 ZINC000645263037 567615728 /nfs/dbraw/zinc/61/57/28/567615728.db2.gz JAAAAKVHYLDRLX-GFCCVEGCSA-N 0 3 396.329 3.229 10 0 GGAEHN CCN(CC)[C@H](C)CNS(=O)(=O)Cc1ccc(Cl)cc1Br ZINC000480617172 567616306 /nfs/dbraw/zinc/61/63/06/567616306.db2.gz OCVOOQIKODQUPW-LLVKDONJSA-N 0 3 397.766 3.252 10 0 GGAEHN CCOc1cc(CN2CC[C@@H](C[NH+]3CCCC3)C2)cc(Br)c1[O-] ZINC000459337122 567616486 /nfs/dbraw/zinc/61/64/86/567616486.db2.gz FCYFUCSZWYHLSG-AWEZNQCLSA-N 0 3 383.330 3.471 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1cc(Br)c2ccccc2c1 ZINC000645308557 567617287 /nfs/dbraw/zinc/61/72/87/567617287.db2.gz ZLFKEXHAXBKMSD-INIZCTEOSA-N 0 3 391.309 3.443 10 0 GGAEHN Cn1cncc1CCN1CCC[C@@H]1c1ccccc1I ZINC000459384660 567619980 /nfs/dbraw/zinc/61/99/80/567619980.db2.gz XZFYEFASXLUJOK-MRXNPFEDSA-N 0 3 381.261 3.404 10 0 GGAEHN CCOc1cc(C[NH2+][C@H](CO)Cc2ccc(F)cc2)cc(Br)c1[O-] ZINC000459430636 567623931 /nfs/dbraw/zinc/62/39/31/567623931.db2.gz FAYMUAQGUGEHDI-HNNXBMFYSA-N 0 3 398.272 3.386 10 0 GGAEHN CCCN(CCN1CCCC1)C(=O)Cc1cc(Br)ccc1OC ZINC000553069085 567623928 /nfs/dbraw/zinc/62/39/28/567623928.db2.gz MPNXBYBKCJYAQR-UHFFFAOYSA-N 0 3 383.330 3.335 10 0 GGAEHN CCOc1cc(C[NH2+]CCCOC[C@H]2CCOC2)cc(Br)c1[O-] ZINC000459440447 567625896 /nfs/dbraw/zinc/62/58/96/567625896.db2.gz UXAYLUAGUQDEJO-CYBMUJFWSA-N 0 3 388.302 3.086 10 0 GGAEHN Cc1c(Br)cncc1C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000665535502 567628228 /nfs/dbraw/zinc/62/82/28/567628228.db2.gz VCGOZAIQUYUGBB-OAHLLOKOSA-N 0 3 376.298 3.055 10 0 GGAEHN CC[C@@H]1CC[C@@H](C)C[C@@H]1NCc1ccc(S(=O)(=O)N2CCOCC2)s1 ZINC000572341632 567632182 /nfs/dbraw/zinc/63/21/82/567632182.db2.gz XJKUNSXRPHCNMC-INMHGKMJSA-N 0 3 386.583 3.073 10 0 GGAEHN CN(C)CCN(Cc1cccc(O)c1)C(=O)Cc1cscc1Br ZINC000480851807 567636636 /nfs/dbraw/zinc/63/66/36/567636636.db2.gz XQEPLJPJJUCTGC-UHFFFAOYSA-N 0 3 397.338 3.349 10 0 GGAEHN C[C@H]1CCN(CC(=O)N2CCC(Oc3cccc(Br)c3)CC2)C1 ZINC000553221514 567636711 /nfs/dbraw/zinc/63/67/11/567636711.db2.gz FUTDSPQLOYUANA-AWEZNQCLSA-N 0 3 381.314 3.161 10 0 GGAEHN CN(C)CCN(Cc1cn2cccnc2n1)Cc1ccc(Br)cc1 ZINC000459557913 567637579 /nfs/dbraw/zinc/63/75/79/567637579.db2.gz KCCFIVIXFVQHRE-UHFFFAOYSA-N 0 3 388.313 3.056 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)NCc1ccccc1Br ZINC000622119440 567638150 /nfs/dbraw/zinc/63/81/50/567638150.db2.gz CLLPHRPUZUUDND-QGZVFWFLSA-N 0 3 390.325 3.421 10 0 GGAEHN CN(C)[C@]1(CNC(=O)c2cnc(-c3ccc(F)c(F)c3)s2)CCSC1 ZINC000506728293 567640307 /nfs/dbraw/zinc/64/03/07/567640307.db2.gz BQJAXUKNAXXRDK-KRWDZBQOSA-N 0 3 383.489 3.255 10 0 GGAEHN CCN(C(=O)Nc1ccc(I)cc1C)[C@@H]1CCN(C)C1 ZINC000596632138 567645033 /nfs/dbraw/zinc/64/50/33/567645033.db2.gz YJFQQDRODKMOCJ-CYBMUJFWSA-N 0 3 387.265 3.158 10 0 GGAEHN CC[C@H](Cn1cncn1)NCc1cc(Br)ccc1OC(F)F ZINC000572503316 567645150 /nfs/dbraw/zinc/64/51/50/567645150.db2.gz QBFMCMCKNFOEGN-GFCCVEGCSA-N 0 3 375.217 3.210 10 0 GGAEHN Cc1cc(C(=O)NC[C@H]2CCCN(C)C2)nn1-c1ccc(Br)cc1 ZINC000531188631 567645218 /nfs/dbraw/zinc/64/52/18/567645218.db2.gz HFVDPNOKWROMPS-CQSZACIVSA-N 0 3 391.313 3.015 10 0 GGAEHN Cc1cc(C(=O)NC[C@@H]2CCCN(C)C2)nn1-c1ccc(Br)cc1 ZINC000531188630 567645426 /nfs/dbraw/zinc/64/54/26/567645426.db2.gz HFVDPNOKWROMPS-AWEZNQCLSA-N 0 3 391.313 3.015 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1 ZINC000440963823 567649192 /nfs/dbraw/zinc/64/91/92/567649192.db2.gz WJQUISJUDCBJIU-DVOMOZLQSA-N 0 3 380.330 3.305 10 0 GGAEHN C[C@@H]1C[C@@H](NC(=O)CSCc2cc(-c3cccs3)on2)CN1C1CC1 ZINC000440925707 567649968 /nfs/dbraw/zinc/64/99/68/567649968.db2.gz NDLFAGDYELJAET-CHWSQXEVSA-N 0 3 377.535 3.378 10 0 GGAEHN CCOC(=O)c1cc(Br)ccc1NC(=O)N(CC)[C@H]1CCN(C)C1 ZINC000596805471 567654593 /nfs/dbraw/zinc/65/45/93/567654593.db2.gz FNWDUOMYOVMEIN-ZDUSSCGKSA-N 0 3 398.301 3.184 10 0 GGAEHN COc1cccc2c1OCC[C@@H]2N[C@H](C)Cn1cc(Br)ccc1=O ZINC000666100628 567654484 /nfs/dbraw/zinc/65/44/84/567654484.db2.gz PGZDHPDUKVRQOU-DOMZBBRYSA-N 0 3 393.281 3.121 10 0 GGAEHN OC[C@]1(O)CCCN(Cc2ccc(-c3ccccc3Br)s2)C1 ZINC000459719677 567655292 /nfs/dbraw/zinc/65/52/92/567655292.db2.gz NVTYWIFQPDWVTN-KRWDZBQOSA-N 0 3 382.323 3.497 10 0 GGAEHN OC[C@]1(O)CCCN(Cc2ccc(-c3ccccc3Br)cc2)C1 ZINC000459735583 567655843 /nfs/dbraw/zinc/65/58/43/567655843.db2.gz VTQGSLZVAQGMAR-IBGZPJMESA-N 0 3 376.294 3.435 10 0 GGAEHN Cc1ccc([C@@H](CNc2ncc(I)cn2)N(C)C)cc1 ZINC000572662616 567656729 /nfs/dbraw/zinc/65/67/29/567656729.db2.gz PQPJKHWIRUPVJC-CQSZACIVSA-N 0 3 382.249 3.104 10 0 GGAEHN NC(=O)C1(NCc2ccc(Br)c(F)c2)C2CC3CC(C2)CC1C3 ZINC000459770772 567658741 /nfs/dbraw/zinc/65/87/41/567658741.db2.gz IKSOZROQIFWFQV-UHFFFAOYSA-N 0 3 381.289 3.358 10 0 GGAEHN CCN(C(=O)Nc1cc(I)ccc1C)[C@H]1CCN(C)C1 ZINC000596844782 567658905 /nfs/dbraw/zinc/65/89/05/567658905.db2.gz LOAHLNMZAYCGIJ-ZDUSSCGKSA-N 0 3 387.265 3.158 10 0 GGAEHN O[C@H](COc1ccc(Cl)cc1Br)CN1C[C@@H]2C[C@H]1CS2 ZINC000459794542 567659921 /nfs/dbraw/zinc/65/99/21/567659921.db2.gz MZJXOIVNOGBPNG-SRVKXCTJSA-N 0 3 378.719 3.032 10 0 GGAEHN Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)NC[C@@]1(N(C)C)CCSC1 ZINC000481184299 567662170 /nfs/dbraw/zinc/66/21/70/567662170.db2.gz BFFNLFFPKLDRRH-SFHVURJKSA-N 0 3 383.583 3.208 10 0 GGAEHN CCN(CC)CCN(C(=O)c1ncccc1F)c1ccc(Br)cn1 ZINC000622860276 567662568 /nfs/dbraw/zinc/66/25/68/567662568.db2.gz TYMJRXBYBUTAME-UHFFFAOYSA-N 0 3 395.276 3.367 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@H](OC)C1CCC1)c1ccc(Br)cn1 ZINC000622860296 567663191 /nfs/dbraw/zinc/66/31/91/567663191.db2.gz UOPNLNGUTDORAY-QGZVFWFLSA-N 0 3 398.345 3.334 10 0 GGAEHN CCN1CC[C@H](NCCCS(=O)(=O)C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000572783462 567666339 /nfs/dbraw/zinc/66/63/39/567666339.db2.gz PWYJEUKARIDBKQ-ZWKOTPCHSA-N 0 3 390.952 3.417 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000507218789 567667542 /nfs/dbraw/zinc/66/75/42/567667542.db2.gz MIFKGTZOBVNZHU-WFASDCNBSA-N 0 3 382.302 3.056 10 0 GGAEHN CN1CC[C@@H]2CN(C(=O)N[C@H]3CSCc4ccc(Br)cc43)C[C@@H]21 ZINC000666400192 567672370 /nfs/dbraw/zinc/67/23/70/567672370.db2.gz DXPBZXVBMIHRMT-RLCCDNCMSA-N 0 3 396.354 3.083 10 0 GGAEHN CN(C[C@@H]1CCCN1C)C(=O)N[C@H]1CSCc2ccc(Br)cc21 ZINC000666400587 567672437 /nfs/dbraw/zinc/67/24/37/567672437.db2.gz NGKWOLBPNUZIKB-HOCLYGCPSA-N 0 3 398.370 3.473 10 0 GGAEHN CN(C)CC(C)(C)NC(=O)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000666400029 567672765 /nfs/dbraw/zinc/67/27/65/567672765.db2.gz AAOYYFXLDNQKIK-CQSZACIVSA-N 0 3 386.359 3.376 10 0 GGAEHN Cc1cc(Br)cc(C)c1S(=O)(=O)NC[C@@H](C)CN1CCCC1 ZINC000507308932 567674200 /nfs/dbraw/zinc/67/42/00/567674200.db2.gz IWKUGAJWOSPLER-GFCCVEGCSA-N 0 3 389.359 3.076 10 0 GGAEHN C[C@H]1CCCN(CCNC(=O)c2c(F)c(F)c(Br)c(F)c2F)C1 ZINC000666428044 567675924 /nfs/dbraw/zinc/67/59/24/567675924.db2.gz HHEVMLNBIVIGDF-QMMMGPOBSA-N 0 3 397.210 3.467 10 0 GGAEHN C[C@H](NCC1(O)Cc2ccccc2C1)c1ccccc1I ZINC000531721383 567676045 /nfs/dbraw/zinc/67/60/45/567676045.db2.gz FYMFQWGAHABDEL-ZDUSSCGKSA-N 0 3 393.268 3.472 10 0 GGAEHN Cc1cc(Br)c(S(=O)(=O)[N-]C2CCC(C[NH+](C)C)CC2)s1 ZINC000441883373 567677714 /nfs/dbraw/zinc/67/77/14/567677714.db2.gz MHJSRLJDLYVKEY-UHFFFAOYSA-N 0 3 395.388 3.218 10 0 GGAEHN CCN(C(=O)Nc1cnn(-c2ccccc2Br)c1)[C@@H]1CCN(C)C1 ZINC000666446835 567677848 /nfs/dbraw/zinc/67/78/48/567677848.db2.gz IMSBTSFPSJEKAT-CQSZACIVSA-N 0 3 392.301 3.193 10 0 GGAEHN CN(C)Cc1ccc(NC(=O)[C@H]2CNCc3ccccc32)cc1Br ZINC000572999453 567681145 /nfs/dbraw/zinc/68/11/45/567681145.db2.gz XQAUISYGWLVSBD-KRWDZBQOSA-N 0 3 388.309 3.336 10 0 GGAEHN NC[C@@H](C(=O)NCCCc1cccc(Br)c1)c1ccc(F)cc1 ZINC000645955770 567684048 /nfs/dbraw/zinc/68/40/48/567684048.db2.gz VZLHDBPULVYUAU-QGZVFWFLSA-N 0 3 379.273 3.380 10 0 GGAEHN NC[C@H](C(=O)NCCCc1cccc(Br)c1)c1ccc(F)cc1 ZINC000645955769 567684144 /nfs/dbraw/zinc/68/41/44/567684144.db2.gz VZLHDBPULVYUAU-KRWDZBQOSA-N 0 3 379.273 3.380 10 0 GGAEHN CCn1c(CN[C@H](C)[C@@H]2C[C@@H]2C(=O)OC)nc2cc(Br)ccc21 ZINC000597112684 567684168 /nfs/dbraw/zinc/68/41/68/567684168.db2.gz HMKZWLARBJBWFF-WXHSDQCUSA-N 0 3 380.286 3.106 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)NCCCc1cccc(Br)c1 ZINC000645955689 567684206 /nfs/dbraw/zinc/68/42/06/567684206.db2.gz LJTMBRYMDWVOTQ-MDZRGWNJSA-N 0 3 395.341 3.030 10 0 GGAEHN Cc1cc(I)cc(C(=O)N2CCC[C@H]2CN(C)C)c1C ZINC000481521051 567684973 /nfs/dbraw/zinc/68/49/73/567684973.db2.gz QIEAKUHLCPBIFI-AWEZNQCLSA-N 0 3 386.277 3.074 10 0 GGAEHN CS[C@H]1CN(CC(=O)Nc2cc(Cl)ccc2Cl)C[C@H]1N1CCCC1 ZINC000460351908 567685028 /nfs/dbraw/zinc/68/50/28/567685028.db2.gz BDOLKKKYMPLXNS-CVEARBPZSA-N 0 3 388.364 3.444 10 0 GGAEHN Cc1nc([C@H]2CCCN(Cc3nc4cc(Br)ccc4[nH]3)C2)n[nH]1 ZINC000460395168 567687747 /nfs/dbraw/zinc/68/77/47/567687747.db2.gz VFGDOOGPWPLMDT-NSHDSACASA-N 0 3 375.274 3.132 10 0 GGAEHN Cc1n[nH]c([C@H]2CCCN(Cc3nc4cc(Br)ccc4[nH]3)C2)n1 ZINC000460395168 567687756 /nfs/dbraw/zinc/68/77/56/567687756.db2.gz VFGDOOGPWPLMDT-NSHDSACASA-N 0 3 375.274 3.132 10 0 GGAEHN CC(C)(CNCc1cnc(-c2ccc(Br)cc2)s1)OCCO ZINC000573162211 567692448 /nfs/dbraw/zinc/69/24/48/567692448.db2.gz XHJNQFSEQCJWCP-UHFFFAOYSA-N 0 3 385.327 3.450 10 0 GGAEHN CC[C@H](NC[C@@](C)(O)CCC(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481652502 567693408 /nfs/dbraw/zinc/69/34/08/567693408.db2.gz AOTDGBJQDUGDJQ-WMZOPIPTSA-N 0 3 390.977 3.476 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N1CCN(C2CCC2)C[C@H](C)C1 ZINC000553864960 567693691 /nfs/dbraw/zinc/69/36/91/567693691.db2.gz FWTXZNQPFAQSGR-AWEZNQCLSA-N 0 3 395.341 3.333 10 0 GGAEHN O=C(c1ccc2c(c1)CNC2)N1CCc2ccc(F)c(Br)c2C1 ZINC000623233299 567693859 /nfs/dbraw/zinc/69/38/59/567693859.db2.gz VJHOHSNZUIFRDB-UHFFFAOYSA-N 0 3 375.241 3.390 10 0 GGAEHN Cc1sc2nc(C)nc(SCC(=O)N3CCC[C@H]3CN(C)C)c2c1C ZINC000532045917 567694193 /nfs/dbraw/zinc/69/41/93/567694193.db2.gz FMQZAWAIKXAUQC-AWEZNQCLSA-N 0 3 378.567 3.261 10 0 GGAEHN CC[C@@H](NCCc1ccccc1O)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481669547 567694728 /nfs/dbraw/zinc/69/47/28/567694728.db2.gz VNFBINSQYAIWPF-MRXNPFEDSA-N 0 3 382.913 3.237 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)N[C@H]2COc3c2ccc(Cl)c3Cl)CCSC1 ZINC000481699173 567696625 /nfs/dbraw/zinc/69/66/25/567696625.db2.gz VYULMHPKVPPQIK-BLLLJJGKSA-N 0 3 390.336 3.163 10 0 GGAEHN CN(C)[C@]1(CNC(=O)N[C@@H]2COc3c2ccc(Cl)c3Cl)CCSC1 ZINC000481699176 567697322 /nfs/dbraw/zinc/69/73/22/567697322.db2.gz VYULMHPKVPPQIK-WBMJQRKESA-N 0 3 390.336 3.163 10 0 GGAEHN Cc1ccc(NC(=O)N2CCOC3(CCN(C)CC3)C2)c(Br)c1 ZINC000646170506 567698120 /nfs/dbraw/zinc/69/81/20/567698120.db2.gz SPRNIARMHUNQBM-UHFFFAOYSA-N 0 3 382.302 3.086 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NC[C@H](C)N1CCC[C@@H](C)C1 ZINC000460718430 567699953 /nfs/dbraw/zinc/69/99/53/567699953.db2.gz LEWYCWYWCAYYOB-KGLIPLIRSA-N 0 3 383.330 3.237 10 0 GGAEHN CCSCc1ccnc(NC(=O)C(C[C@H]2COCCO2)C(F)(F)F)c1 ZINC000597455190 567700416 /nfs/dbraw/zinc/70/04/16/567700416.db2.gz HKDAJFSPLOOFAX-STQMWFEESA-N 0 3 378.416 3.257 10 0 GGAEHN Cc1cc(Br)c(CNCCCn2cncn2)cc1Br ZINC000623349640 567703023 /nfs/dbraw/zinc/70/30/23/567703023.db2.gz HRIQMYJFWVIYAX-UHFFFAOYSA-N 0 3 388.107 3.291 10 0 GGAEHN COC[C@@H](C)CNCc1cc(Cl)cc(Cl)c1OCCN1CCOCC1 ZINC000623378000 567704798 /nfs/dbraw/zinc/70/47/98/567704798.db2.gz OQFAYGRADYSCRA-AWEZNQCLSA-N 0 3 391.339 3.077 10 0 GGAEHN COc1ccc(COC[C@@H](O)CNCc2csc(C(F)(F)F)c2)cc1 ZINC000623379241 567705181 /nfs/dbraw/zinc/70/51/81/567705181.db2.gz FVHAHPWIZAZGQP-AWEZNQCLSA-N 0 3 375.412 3.443 10 0 GGAEHN CN(C)S(=O)(=O)c1ccc(CSCCN(C)Cc2ccccc2)s1 ZINC000573322845 567705169 /nfs/dbraw/zinc/70/51/69/567705169.db2.gz FUFNMWPEBOPIFH-UHFFFAOYSA-N 0 3 384.592 3.364 10 0 GGAEHN CN(C)[C@H]1CCCN(C(=O)N[C@H]2CCOc3c(Br)cccc32)C1 ZINC000507806916 567706857 /nfs/dbraw/zinc/70/68/57/567706857.db2.gz CVMCEHGCJNTEGC-WFASDCNBSA-N 0 3 382.302 3.008 10 0 GGAEHN O=C(CCOC1CNC1)Nc1ncc(Cc2cccc(Cl)c2Cl)s1 ZINC000573357684 567707488 /nfs/dbraw/zinc/70/74/88/567707488.db2.gz JDQLQTWEGYSZTI-UHFFFAOYSA-N 0 3 386.304 3.358 10 0 GGAEHN CC(C)Oc1cc(Cl)c(CNCCCN2CCCS2(=O)=O)cc1Cl ZINC000623404834 567707529 /nfs/dbraw/zinc/70/75/29/567707529.db2.gz MSJDTBMPUPOQPY-UHFFFAOYSA-N 0 3 395.352 3.296 10 0 GGAEHN CO[C@@H](C)CCNCc1cc(Cl)cc(Cl)c1OCCN1CCOCC1 ZINC000623396377 567707753 /nfs/dbraw/zinc/70/77/53/567707753.db2.gz QILZGFLYVUHMNH-AWEZNQCLSA-N 0 3 391.339 3.219 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N1CCC[C@H]1CN1CCCCC1 ZINC000460884367 567708563 /nfs/dbraw/zinc/70/85/63/567708563.db2.gz RWWNMBDTFDKDDE-KRWDZBQOSA-N 0 3 395.341 3.477 10 0 GGAEHN CN(C(=O)NCCOCc1ccc(Cl)cc1Cl)[C@@H]1CCN(C2CC2)C1 ZINC000554084530 567708657 /nfs/dbraw/zinc/70/86/57/567708657.db2.gz NLFYZTPHGQYQHR-MRXNPFEDSA-N 0 3 386.323 3.388 10 0 GGAEHN CC(C)N(CCN(C)C)C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000507813041 567708675 /nfs/dbraw/zinc/70/86/75/567708675.db2.gz QBZQJRPMQQNWNX-HNNXBMFYSA-N 0 3 384.318 3.254 10 0 GGAEHN Fc1c(Br)ccc(CNC2CCN(C[C@@H]3CCCO3)CC2)c1F ZINC000623418520 567708815 /nfs/dbraw/zinc/70/88/15/567708815.db2.gz UDXRYGWSTXVMEA-AWEZNQCLSA-N 0 3 389.284 3.460 10 0 GGAEHN Cc1cc(CNCCC(=O)N(C)Cc2ccccc2Br)ccn1 ZINC000623413068 567708924 /nfs/dbraw/zinc/70/89/24/567708924.db2.gz KBNIWDJGTFVEQX-UHFFFAOYSA-N 0 3 376.298 3.291 10 0 GGAEHN CC[C@H](COC)NCc1cc(Cl)cc(Cl)c1OCCN1CCOCC1 ZINC000623427066 567709082 /nfs/dbraw/zinc/70/90/82/567709082.db2.gz LGPQOMSFKKMHJZ-MRXNPFEDSA-N 0 3 391.339 3.219 10 0 GGAEHN CN(C(=O)N[C@@H]1CCOc2c(Br)cccc21)[C@H]1CCN(C2CC2)C1 ZINC000507827308 567709572 /nfs/dbraw/zinc/70/95/72/567709572.db2.gz RBENPQVSDYLZDY-XJKSGUPXSA-N 0 3 394.313 3.151 10 0 GGAEHN CN(C(=O)N[C@@H]1CCOc2c(Br)cccc21)[C@@H]1CCN(C2CC2)C1 ZINC000507827306 567709762 /nfs/dbraw/zinc/70/97/62/567709762.db2.gz RBENPQVSDYLZDY-CZUORRHYSA-N 0 3 394.313 3.151 10 0 GGAEHN C[N@H+](CCC[N-]S(=O)(=O)c1cnccc1C(F)(F)F)C1CCCCC1 ZINC000442816302 567710241 /nfs/dbraw/zinc/71/02/41/567710241.db2.gz DPVWUHNCOVOJOF-UHFFFAOYSA-N 0 3 379.448 3.033 10 0 GGAEHN C[N@@H+](CCC[N-]S(=O)(=O)c1cnccc1C(F)(F)F)C1CCCCC1 ZINC000442816302 567710250 /nfs/dbraw/zinc/71/02/50/567710250.db2.gz DPVWUHNCOVOJOF-UHFFFAOYSA-N 0 3 379.448 3.033 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NC[C@@H](C)N1CCC(C)CC1 ZINC000460920325 567710678 /nfs/dbraw/zinc/71/06/78/567710678.db2.gz BPBDXFHCCWMLFH-CQSZACIVSA-N 0 3 383.330 3.237 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)Nc1cc(Cl)c(F)c(Cl)c1)CCO2 ZINC000646385712 567714909 /nfs/dbraw/zinc/71/49/09/567714909.db2.gz PHMGXDYXDYGNKS-UHFFFAOYSA-N 0 3 376.259 3.461 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cn3cc(Cl)cc(Cl)c3n2)C[C@H]1N1CCCC1 ZINC000442889358 567715799 /nfs/dbraw/zinc/71/57/99/567715799.db2.gz GDJHPXSWBNYGJK-CABCVRRESA-N 0 3 399.347 3.293 10 0 GGAEHN CN1CC[C@H](NCc2cc(C(F)(F)F)cc(S(C)(=O)=O)c2)CC1(C)C ZINC000623516721 567717199 /nfs/dbraw/zinc/71/71/99/567717199.db2.gz BYSOKXXUZHXMHS-AWEZNQCLSA-N 0 3 378.460 3.071 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1cc(Cl)ccc1Br ZINC000646443228 567717471 /nfs/dbraw/zinc/71/74/71/567717471.db2.gz DKYHGWOZFQJEDW-CABCVRRESA-N 0 3 387.705 3.038 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1ccc(Br)cc1Cl ZINC000646456119 567718156 /nfs/dbraw/zinc/71/81/56/567718156.db2.gz SBRJMJAYSZCHRG-CABCVRRESA-N 0 3 387.705 3.038 10 0 GGAEHN Cc1cc(CCC(=O)N2CCOC[C@@H]2[C@@H]2CCCN2C)ccc1Br ZINC000646456464 567718248 /nfs/dbraw/zinc/71/82/48/567718248.db2.gz UCXYXGMNWIHGPX-ZWKOTPCHSA-N 0 3 395.341 3.012 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1ccc(C(F)(F)F)cc1Cl ZINC000646445682 567718388 /nfs/dbraw/zinc/71/83/88/567718388.db2.gz CCLRSQCPUNGPKH-CABCVRRESA-N 0 3 376.806 3.294 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1csc(-c2ccc(Cl)s2)n1 ZINC000646443609 567718402 /nfs/dbraw/zinc/71/84/02/567718402.db2.gz HFBOEOVDMMNCLB-OLZOCXBDSA-N 0 3 397.953 3.460 10 0 GGAEHN Cc1cc(Br)c(CNCC(C)(C)OCCO)cc1Br ZINC000623526777 567718622 /nfs/dbraw/zinc/71/86/22/567718622.db2.gz SBEDOTYWRRDDBW-UHFFFAOYSA-N 0 3 395.135 3.397 10 0 GGAEHN C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CCOC[C@@H]1[C@H]1CCCN1C ZINC000646449958 567718651 /nfs/dbraw/zinc/71/86/51/567718651.db2.gz SDYUIESRPKTTMM-JCURWCKSSA-N 0 3 387.307 3.082 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)c1cc2cc(Br)ccc2o1 ZINC000646448279 567718878 /nfs/dbraw/zinc/71/88/78/567718878.db2.gz ZMJVCGTWFUYSBR-GJZGRUSLSA-N 0 3 393.281 3.131 10 0 GGAEHN Cc1ccc(I)cc1C(=O)NC[C@H]1CCN1C(C)(C)C ZINC000597858118 567719022 /nfs/dbraw/zinc/71/90/22/567719022.db2.gz JSQFVPDYFRNRHH-CYBMUJFWSA-N 0 3 386.277 3.202 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)c1cc2cc(Br)ccc2o1 ZINC000646448281 567719002 /nfs/dbraw/zinc/71/90/02/567719002.db2.gz ZMJVCGTWFUYSBR-HUUCEWRRSA-N 0 3 393.281 3.131 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)c1cc(I)ccc1F ZINC000597856843 567719176 /nfs/dbraw/zinc/71/91/76/567719176.db2.gz BDWSIRTWINVVPB-NSHDSACASA-N 0 3 390.240 3.033 10 0 GGAEHN Cc1cc(CCC(=O)N2CCOC[C@@H]2[C@H]2CCCN2C)ccc1Br ZINC000646456462 567719229 /nfs/dbraw/zinc/71/92/29/567719229.db2.gz UCXYXGMNWIHGPX-QZTJIDSGSA-N 0 3 395.341 3.012 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)c1ccc(Br)cc1Cl ZINC000646456120 567719278 /nfs/dbraw/zinc/71/92/78/567719278.db2.gz SBRJMJAYSZCHRG-GJZGRUSLSA-N 0 3 387.705 3.038 10 0 GGAEHN COC[C@](C)(O)CCNCc1cc(Br)c(C)cc1Br ZINC000623536211 567719391 /nfs/dbraw/zinc/71/93/91/567719391.db2.gz PGZCQOOHPLJEOU-CQSZACIVSA-N 0 3 395.135 3.397 10 0 GGAEHN CC[C@@H](CNCc1cc(Cl)cc(Cl)c1OCCN1CCOCC1)OC ZINC000623528242 567719428 /nfs/dbraw/zinc/71/94/28/567719428.db2.gz BXRBFTICYKWNKQ-INIZCTEOSA-N 0 3 391.339 3.219 10 0 GGAEHN Cc1c(I)cccc1C(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000597859605 567719486 /nfs/dbraw/zinc/71/94/86/567719486.db2.gz WBPNEBYYLFVXAP-LBPRGKRZSA-N 0 3 386.277 3.202 10 0 GGAEHN COC(=O)c1ccc(CNC[C@@H](O)COc2c(Cl)cccc2Cl)s1 ZINC000573558433 567721960 /nfs/dbraw/zinc/72/19/60/567721960.db2.gz UIFFVYHZRGECJR-SNVBAGLBSA-N 0 3 390.288 3.371 10 0 GGAEHN CO[C@@H]1CCC[C@H]([C@@H](CO)NCc2ccc(Br)c(F)c2F)C1 ZINC000623562932 567722034 /nfs/dbraw/zinc/72/20/34/567722034.db2.gz IBNUUUXRTKGZNE-ZKYQVNSYSA-N 0 3 378.257 3.383 10 0 GGAEHN CS(=O)(=O)CC1(CCNCc2cccc(F)c2OCC(F)(F)F)CC1 ZINC000623562227 567722455 /nfs/dbraw/zinc/72/24/55/567722455.db2.gz MIKLTBNTXHVGRS-UHFFFAOYSA-N 0 3 383.407 3.071 10 0 GGAEHN CC[C@H](C)N[C@@H](CNC(=O)Nc1ccnc(C)c1Br)c1ccco1 ZINC000554346351 567723240 /nfs/dbraw/zinc/72/32/40/567723240.db2.gz BOUFTVPTPOGBNM-FZMZJTMJSA-N 0 3 395.301 3.418 10 0 GGAEHN C[C@@H](N[C@H](CO)c1cccc(Br)c1)c1cccc(-n2ccnn2)c1 ZINC000554370869 567724514 /nfs/dbraw/zinc/72/45/14/567724514.db2.gz CAUIUZBMGWSOOP-FZKQIMNGSA-N 0 3 387.281 3.414 10 0 GGAEHN CCN(C(=O)Nc1cnc2c(Br)cccn12)[C@H]1CCN(CC)C1 ZINC000667097894 567724989 /nfs/dbraw/zinc/72/49/89/567724989.db2.gz FVVXVSIIUIVEMB-LBPRGKRZSA-N 0 3 380.290 3.045 10 0 GGAEHN COc1cc(C[NH2+]C[C@@H]2Cc3ccccc3CO2)cc(Br)c1[O-] ZINC000623601848 567725194 /nfs/dbraw/zinc/72/51/94/567725194.db2.gz SGNOVHFMPVLBKY-HNNXBMFYSA-N 0 3 378.266 3.394 10 0 GGAEHN CCN(C(=O)Nc1nc(-c2ccc(SC)cc2)ns1)[C@H]1CCN(C)C1 ZINC000667111597 567725568 /nfs/dbraw/zinc/72/55/68/567725568.db2.gz DYBPZKJPZXOMTB-ZDUSSCGKSA-N 0 3 377.539 3.485 10 0 GGAEHN [O-]c1cccc(C[NH2+]CC2(OCCO)CCC(F)(F)CC2)c1Br ZINC000623638017 567726644 /nfs/dbraw/zinc/72/66/44/567726644.db2.gz RIWLTHGSMYJKGR-UHFFFAOYSA-N 0 3 394.256 3.201 10 0 GGAEHN CCN(CC(=O)NC1CCN(C2CC2)CC1)c1cccc(Br)c1 ZINC000532663566 567727286 /nfs/dbraw/zinc/72/72/86/567727286.db2.gz HSJSRVMUCYLYEW-UHFFFAOYSA-N 0 3 380.330 3.018 10 0 GGAEHN CCCn1cc(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)cn1 ZINC000623645197 567727603 /nfs/dbraw/zinc/72/76/03/567727603.db2.gz RPVIBQMOTWBUKB-SFHVURJKSA-N 0 3 378.314 3.065 10 0 GGAEHN OC[C@]1(NCc2cnc(C3CC3)nc2)CCc2cc(Br)ccc2C1 ZINC000623645370 567728036 /nfs/dbraw/zinc/72/80/36/567728036.db2.gz ZJJMWIMCUQUTGF-IBGZPJMESA-N 0 3 388.309 3.126 10 0 GGAEHN CC(C)Cn1nccc1CN[C@]1(CO)CCc2cc(Br)ccc2C1 ZINC000623644786 567728114 /nfs/dbraw/zinc/72/81/14/567728114.db2.gz AFSTWJAVWPNBKB-LJQANCHMSA-N 0 3 392.341 3.311 10 0 GGAEHN CC[C@H](Cc1ccc(Br)cc1)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000667132742 567728666 /nfs/dbraw/zinc/72/86/66/567728666.db2.gz HOLDOHJZSHXGJR-MSOLQXFVSA-N 0 3 392.341 3.426 10 0 GGAEHN CCC(F)(F)C(C)(C)CNCc1cc(Cl)c(OCC(N)=O)c(OC)c1 ZINC000623696806 567732414 /nfs/dbraw/zinc/73/24/14/567732414.db2.gz NHZJLGJXJJFFOJ-UHFFFAOYSA-N 0 3 378.847 3.374 10 0 GGAEHN CN(C)[C@]1(CNC(=O)NCCc2c[nH]c3c2cccc3Cl)CCSC1 ZINC000623708460 567732530 /nfs/dbraw/zinc/73/25/30/567732530.db2.gz JWOAPYCJEOOJRQ-SFHVURJKSA-N 0 3 380.945 3.100 10 0 GGAEHN O=C(NCC/C=C\c1ccc(Br)cc1)N[C@H]1CCN(C2CC2)C1 ZINC000623719178 567733328 /nfs/dbraw/zinc/73/33/28/567733328.db2.gz KBOFIGMQOYQRLI-SWQCVOCJSA-N 0 3 378.314 3.388 10 0 GGAEHN COc1cc(Br)ccc1[C@@H]1CCCN1C(=O)NC[C@@H]1CCCN1C ZINC000623716671 567733543 /nfs/dbraw/zinc/73/35/43/567733543.db2.gz WBPCSYRLUUMNGJ-HOCLYGCPSA-N 0 3 396.329 3.398 10 0 GGAEHN CCN(C(=O)c1cccc(C)c1I)[C@H]1CCN(CC)C1 ZINC000598041862 567733786 /nfs/dbraw/zinc/73/37/86/567733786.db2.gz OCKTWIZQEMDUQW-ZDUSSCGKSA-N 0 3 386.277 3.156 10 0 GGAEHN CCN(C(=O)c1scc(C)c1I)[C@@H]1CCN(CC)C1 ZINC000598040740 567733813 /nfs/dbraw/zinc/73/38/13/567733813.db2.gz RLXOJCSAKZPPNJ-LLVKDONJSA-N 0 3 392.306 3.217 10 0 GGAEHN C[C@H](CNC(=O)NCc1cc(F)c(Br)cc1F)N(C)C1CC1 ZINC000623726106 567733972 /nfs/dbraw/zinc/73/39/72/567733972.db2.gz YVYYVVSTCJARCY-SECBINFHSA-N 0 3 376.245 3.009 10 0 GGAEHN Cc1cc(CNC[C@@H]2CN(Cc3ccncc3)CCO2)ccc1Br ZINC000623781751 567737950 /nfs/dbraw/zinc/73/79/50/567737950.db2.gz ZZYHROGUNWFKQL-GOSISDBHSA-N 0 3 390.325 3.143 10 0 GGAEHN C[C@@H](NC[C@H]1CN(Cc2ccncc2)CCO1)c1ccc(Br)s1 ZINC000623782143 567738061 /nfs/dbraw/zinc/73/80/61/567738061.db2.gz KIALYYLOEQMQCH-HIFRSBDPSA-N 0 3 396.354 3.457 10 0 GGAEHN Cc1ccc(Br)cc1[C@H](C)NCc1cccc(OCC(N)=O)c1 ZINC000623899879 567745684 /nfs/dbraw/zinc/74/56/84/567745684.db2.gz WEQDLQCLKIOJJE-ZDUSSCGKSA-N 0 3 377.282 3.472 10 0 GGAEHN O=C(NC[C@H](c1cccs1)N1CCCC1)[C@H]1CCCN1CC(F)(F)F ZINC000461744091 567746505 /nfs/dbraw/zinc/74/65/05/567746505.db2.gz DFDIPADTFFVOTN-ZIAGYGMSSA-N 0 3 375.460 3.028 10 0 GGAEHN Cc1ccc(Br)cc1[C@@H](C)N[C@@H]1CCCN(c2ccn(C)n2)C1=O ZINC000623918600 567746737 /nfs/dbraw/zinc/74/67/37/567746737.db2.gz WITYJBBVHIUHKB-CZUORRHYSA-N 0 3 391.313 3.337 10 0 GGAEHN COCc1nc2n(n1)C[C@H](N[C@H](C)c1cc(Br)ccc1C)CC2 ZINC000623920080 567746884 /nfs/dbraw/zinc/74/68/84/567746884.db2.gz ZWKLHZBHOKEMEU-TZMCWYRMSA-N 0 3 379.302 3.161 10 0 GGAEHN Cc1ccc(Br)cc1[C@H](C)N[C@H]1CCN(C2CCOCC2)C1=O ZINC000623918579 567747098 /nfs/dbraw/zinc/74/70/98/567747098.db2.gz VKFVQODARSFDBW-GUYCJALGSA-N 0 3 381.314 3.188 10 0 GGAEHN O=C1NCCN1C1CCN(Cc2cc3cc(Br)ccc3o2)CC1 ZINC000667464785 567747860 /nfs/dbraw/zinc/74/78/60/567747860.db2.gz AYCBVQHNIDINIG-UHFFFAOYSA-N 0 3 378.270 3.185 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)C2(c3cccc(Br)c3)CCCC2)C1 ZINC000646920988 567748272 /nfs/dbraw/zinc/74/82/72/567748272.db2.gz YIBYGSDHPRUTLX-YOEHRIQHSA-N 0 3 377.326 3.423 10 0 GGAEHN Cc1onc(-c2cccc(Br)c2)c1C(=O)N1CC[C@H]2CN(C)C[C@H]21 ZINC000646916512 567748392 /nfs/dbraw/zinc/74/83/92/567748392.db2.gz KCEMVDOBYPHGJA-DZGCQCFKSA-N 0 3 390.281 3.189 10 0 GGAEHN Cc1cc(C(=O)N2CC[C@H]3CN(C)C[C@H]32)nn1-c1ccc(Cl)c(Cl)c1 ZINC000646934952 567749208 /nfs/dbraw/zinc/74/92/08/567749208.db2.gz YDDYVJKEUQBRNV-YVEFUNNKSA-N 0 3 379.291 3.264 10 0 GGAEHN Cc1cc(C(=O)N2CC[C@@H]3CN(C)C[C@@H]32)nn1-c1ccc(Cl)c(Cl)c1 ZINC000646934949 567749720 /nfs/dbraw/zinc/74/97/20/567749720.db2.gz YDDYVJKEUQBRNV-PXAZEXFGSA-N 0 3 379.291 3.264 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)Cc3csc(Cc4cccc(Cl)c4)n3)[C@@H]2C1 ZINC000646943411 567750467 /nfs/dbraw/zinc/75/04/67/567750467.db2.gz IPGWOHZERNNPHC-WMLDXEAASA-N 0 3 375.925 3.092 10 0 GGAEHN COCCn1cc(CN[C@H](C)Cc2ncc(C(F)(F)F)cc2Cl)cn1 ZINC000623977974 567751297 /nfs/dbraw/zinc/75/12/97/567751297.db2.gz GEDSELWUPGNOPC-LLVKDONJSA-N 0 3 376.810 3.318 10 0 GGAEHN C[C@@H](CNC(=O)N[C@H]1CCCN(C)C1)Sc1ccc(Br)cc1 ZINC000598258639 567751991 /nfs/dbraw/zinc/75/19/91/567751991.db2.gz NUNQOPMUQQWNKS-JSGCOSHPSA-N 0 3 386.359 3.323 10 0 GGAEHN C[C@@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccc(F)cc1C(F)(F)F ZINC000623982331 567752333 /nfs/dbraw/zinc/75/23/33/567752333.db2.gz OVLXLNOZWNEOGL-YPMHNXCESA-N 0 3 382.423 3.309 10 0 GGAEHN C[C@H](CC(=O)NCCNc1ccncc1)c1ccc(F)c(Br)c1 ZINC000461937637 567756091 /nfs/dbraw/zinc/75/60/91/567756091.db2.gz QTLQBZYJLDSOTK-GFCCVEGCSA-N 0 3 380.261 3.127 10 0 GGAEHN O=C(CCSc1ccccc1Br)N[C@H]1CNCCC1(F)F ZINC000647075760 567758544 /nfs/dbraw/zinc/75/85/44/567758544.db2.gz DUFDEECZYAEKIZ-LBPRGKRZSA-N 0 3 379.270 3.045 10 0 GGAEHN O=C(CCSc1ccc(Br)cc1)N[C@H]1CNCCC1(F)F ZINC000647076289 567759038 /nfs/dbraw/zinc/75/90/38/567759038.db2.gz HQTNYBNWXGYMNU-LBPRGKRZSA-N 0 3 379.270 3.045 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)NCc1csc(Br)c1 ZINC000574155873 567760114 /nfs/dbraw/zinc/76/01/14/567760114.db2.gz HIWFYUKXTWSEJZ-AWEZNQCLSA-N 0 3 380.311 3.278 10 0 GGAEHN C[C@H](N[C@@H]1CCN(c2ccc3nncn3n2)C1)c1cc(Cl)ccc1Cl ZINC000624114375 567760839 /nfs/dbraw/zinc/76/08/39/567760839.db2.gz YZABAQJAGWOPME-WCQYABFASA-N 0 3 377.279 3.361 10 0 GGAEHN C[C@H](N[C@@H]1CCN(c2ccc3nncn3n2)C1)c1ccc(Cl)c(Cl)c1 ZINC000624113915 567760950 /nfs/dbraw/zinc/76/09/50/567760950.db2.gz PGBXBTZVZZNCEU-WCQYABFASA-N 0 3 377.279 3.361 10 0 GGAEHN Cc1c(Br)cc(CN[C@H]2CCC(=O)N(C)C2)cc1Br ZINC000574182628 567761604 /nfs/dbraw/zinc/76/16/04/567761604.db2.gz AGNJQIOHGVVHRF-NSHDSACASA-N 0 3 390.119 3.230 10 0 GGAEHN COc1ncc(Br)cc1CNC1CCC(O)(C(F)(F)F)CC1 ZINC000624133412 567761638 /nfs/dbraw/zinc/76/16/38/567761638.db2.gz NQTRQZWFMQACQD-UHFFFAOYSA-N 0 3 383.208 3.178 10 0 GGAEHN Brc1ccc(C2(NCCOC[C@@H]3CCCO3)CCOCC2)cc1 ZINC000533352620 567764909 /nfs/dbraw/zinc/76/49/09/567764909.db2.gz UEFDNZWSYVTYFE-KRWDZBQOSA-N 0 3 384.314 3.240 10 0 GGAEHN C[C@@H](NC[C@H]1COCCN1C)c1ccc(Br)cc1C(F)(F)F ZINC000624175534 567764999 /nfs/dbraw/zinc/76/49/99/567764999.db2.gz RIDVWAFDIDLEMK-PWSUYJOCSA-N 0 3 381.236 3.449 10 0 GGAEHN C[C@@H](NC[C@@H]1COCCN1C)c1ccc(Br)cc1C(F)(F)F ZINC000624175535 567765043 /nfs/dbraw/zinc/76/50/43/567765043.db2.gz RIDVWAFDIDLEMK-ZYHUDNBSSA-N 0 3 381.236 3.449 10 0 GGAEHN C[C@@H](NC[C@H]1COCCN1C)c1ccc(Br)cc1Br ZINC000624171795 567765420 /nfs/dbraw/zinc/76/54/20/567765420.db2.gz CKMMPGPQTDLPCS-PWSUYJOCSA-N 0 3 392.135 3.193 10 0 GGAEHN CCn1nccc1CCN[C@H](C)c1cc2c(cc1Br)OCCO2 ZINC000555050203 567765731 /nfs/dbraw/zinc/76/57/31/567765731.db2.gz UHSIZKZNNWEBQO-GFCCVEGCSA-N 0 3 380.286 3.330 10 0 GGAEHN Cc1c(Br)cncc1C(=O)Nc1cccc(OCCN(C)C)c1 ZINC000667686233 567766626 /nfs/dbraw/zinc/76/66/26/567766626.db2.gz ZHWGASFSDXGCHT-UHFFFAOYSA-N 0 3 378.270 3.345 10 0 GGAEHN Brc1ccc(N2CC[C@@H](NCc3ccnn3-c3ccccn3)C2)cc1 ZINC000647179193 567768241 /nfs/dbraw/zinc/76/82/41/567768241.db2.gz GXZHGANBKVSCHV-MRXNPFEDSA-N 0 3 398.308 3.398 10 0 GGAEHN O=C1CCCN1CCCNCc1cc(OC(F)F)ccc1Br ZINC000647167996 567768296 /nfs/dbraw/zinc/76/82/96/567768296.db2.gz BFTSUHHCJOFXOZ-UHFFFAOYSA-N 0 3 377.229 3.153 10 0 GGAEHN C[C@H](N[C@H]1CCOC[C@@H]1O)c1ccc(Br)cc1Br ZINC000624235247 567769053 /nfs/dbraw/zinc/76/90/53/567769053.db2.gz HDLKDJUCJUXDQQ-HJIKLVIJSA-N 0 3 379.092 3.012 10 0 GGAEHN CC(C)Cc1ncc(CNC[C@H](c2cccs2)N2CCN(C)CC2)s1 ZINC000533449445 567769635 /nfs/dbraw/zinc/76/96/35/567769635.db2.gz MEZZCYNMWRQPJS-QGZVFWFLSA-N 0 3 378.611 3.481 10 0 GGAEHN CNC(=O)CCOC1CCN(Cc2cc3cc(Br)ccc3o2)CC1 ZINC000667693149 567769712 /nfs/dbraw/zinc/76/97/12/567769712.db2.gz CCMCHZMHQMGXQW-UHFFFAOYSA-N 0 3 395.297 3.312 10 0 GGAEHN C[C@H](NC[C@@H]1CN(Cc2ccncc2)CCO1)c1ccc(Br)cc1 ZINC000624266590 567770718 /nfs/dbraw/zinc/77/07/18/567770718.db2.gz QVXKDFNMJSPRLC-HNAYVOBHSA-N 0 3 390.325 3.396 10 0 GGAEHN COc1ncncc1CNC1CCN(Cc2cccc(Br)c2)CC1 ZINC000647218512 567770920 /nfs/dbraw/zinc/77/09/20/567770920.db2.gz RTGFFTGJBJSKMC-UHFFFAOYSA-N 0 3 391.313 3.002 10 0 GGAEHN C[C@H](NC[C@@H]1CN(Cc2ccncc2)CCO1)c1cccc(Br)c1 ZINC000624266627 567771551 /nfs/dbraw/zinc/77/15/51/567771551.db2.gz RSVOFHJNWJJNNW-HNAYVOBHSA-N 0 3 390.325 3.396 10 0 GGAEHN Cc1noc([C@@H]2OCC[C@@H]2N[C@@H]2CCc3c2cc(Br)cc3F)n1 ZINC000624303922 567772054 /nfs/dbraw/zinc/77/20/54/567772054.db2.gz RRKIVIPFARAIRG-QLFBSQMISA-N 0 3 382.233 3.387 10 0 GGAEHN c1nc(N2CCOCC2)sc1CNCC[C@@H]1CSc2ccccc2O1 ZINC000647227551 567772834 /nfs/dbraw/zinc/77/28/34/567772834.db2.gz CKLLQHHIXZAOSR-CQSZACIVSA-N 0 3 377.535 3.013 10 0 GGAEHN Cc1noc([C@@H]2OCC[C@@H]2N[C@H]2CCc3c2ccc(F)c3Br)n1 ZINC000624305681 567773983 /nfs/dbraw/zinc/77/39/83/567773983.db2.gz KOVMWNCCBYEBSQ-KCQAQPDRSA-N 0 3 382.233 3.387 10 0 GGAEHN CO[C@H]1C[C@@H](CN[C@H](C)c2nnn(-c3cccc(Br)c3)c2C)C1 ZINC000624309800 567774145 /nfs/dbraw/zinc/77/41/45/567774145.db2.gz XZHWRFFJAUCTFL-KFNAQCHYSA-N 0 3 379.302 3.414 10 0 GGAEHN CC(C)(CNCc1nc(-c2cccc(Br)c2)c[nH]1)[C@@]1(O)CCOC1 ZINC000647246795 567774413 /nfs/dbraw/zinc/77/44/13/567774413.db2.gz QMJYTCTXTKOPBG-GOSISDBHSA-N 0 3 394.313 3.106 10 0 GGAEHN CC(C)(CNCc1cccc(Br)c1OC(F)F)[C@@]1(O)CCOC1 ZINC000647247148 567774487 /nfs/dbraw/zinc/77/44/87/567774487.db2.gz ZKUFRTDNFPGZRR-MRXNPFEDSA-N 0 3 394.256 3.318 10 0 GGAEHN CSc1cc(Cl)c(C(F)(F)F)cc1NC(=O)NC[C@@]1(O)CCN(C)C1 ZINC000667824178 567775391 /nfs/dbraw/zinc/77/53/91/567775391.db2.gz LXDLXNZDECHXIC-AWEZNQCLSA-N 0 3 397.850 3.269 10 0 GGAEHN COC[C@](C)(CCO)NCc1cnc(-c2ccc(Br)cc2)s1 ZINC000533565170 567775370 /nfs/dbraw/zinc/77/53/70/567775370.db2.gz ZUORXMUZIBDFGX-INIZCTEOSA-N 0 3 385.327 3.450 10 0 GGAEHN CC(C)C[C@@H](NCCNS(=O)(=O)c1cccc(Cl)c1)c1ccncc1 ZINC000647286033 567777385 /nfs/dbraw/zinc/77/73/85/567777385.db2.gz BRSOCWXZOUGVCK-GOSISDBHSA-N 0 3 381.929 3.390 10 0 GGAEHN Cc1cc(S(=O)(=O)N2CCCc3cccc(CN)c32)ccc1Br ZINC000624388167 567777343 /nfs/dbraw/zinc/77/73/43/567777343.db2.gz OCPVMVLQBAHVTN-UHFFFAOYSA-N 0 3 395.322 3.358 10 0 GGAEHN NCc1cccc2c1N(S(=O)(=O)c1sccc1Br)CCC2 ZINC000624388614 567777415 /nfs/dbraw/zinc/77/74/15/567777415.db2.gz BPCHOVDWUBERBY-UHFFFAOYSA-N 0 3 387.324 3.111 10 0 GGAEHN NCc1cccc2c1N(S(=O)(=O)c1ccc(C(F)(F)F)s1)CCC2 ZINC000624389980 567777826 /nfs/dbraw/zinc/77/78/26/567777826.db2.gz RBGPFQNEIRAYCC-UHFFFAOYSA-N 0 3 376.425 3.367 10 0 GGAEHN NCc1cccc2c1N(S(=O)(=O)c1cccc(Br)c1)CCC2 ZINC000624387858 567777846 /nfs/dbraw/zinc/77/78/46/567777846.db2.gz DJPFIAXZAGTWFI-UHFFFAOYSA-N 0 3 381.295 3.049 10 0 GGAEHN Cc1cc(Br)cc(S(=O)(=O)N2CCCc3cccc(CN)c32)c1 ZINC000624390221 567777910 /nfs/dbraw/zinc/77/79/10/567777910.db2.gz YOLWJLXBMWGITE-UHFFFAOYSA-N 0 3 395.322 3.358 10 0 GGAEHN NCc1cccc2c1N(S(=O)(=O)c1ccc(Br)cc1)CCC2 ZINC000624388159 567777961 /nfs/dbraw/zinc/77/79/61/567777961.db2.gz NXFGGERTIRCWMP-UHFFFAOYSA-N 0 3 381.295 3.049 10 0 GGAEHN NCc1cccc2c1N(S(=O)(=O)c1cccc(Br)c1F)CCC2 ZINC000624389918 567777971 /nfs/dbraw/zinc/77/79/71/567777971.db2.gz PKUJZINMOYXBLA-UHFFFAOYSA-N 0 3 399.285 3.188 10 0 GGAEHN Cc1cccc(S(=O)(=O)N2CCCc3cccc(CN)c32)c1Br ZINC000624388860 567778018 /nfs/dbraw/zinc/77/80/18/567778018.db2.gz JWNZIVPDSUACGM-UHFFFAOYSA-N 0 3 395.322 3.358 10 0 GGAEHN C[C@H](NC[C@@H](CO)Cc1ccccc1Br)c1cc2n(n1)CCCC2 ZINC000647301391 567778548 /nfs/dbraw/zinc/77/85/48/567778548.db2.gz JJMVBVGCXBYXPQ-GJZGRUSLSA-N 0 3 392.341 3.484 10 0 GGAEHN C[C@@H](NC[C@@H](CO)Cc1ccc(Br)cc1)c1cc2n(n1)CCCC2 ZINC000647301296 567778840 /nfs/dbraw/zinc/77/88/40/567778840.db2.gz BEUPVOZRSPPWEK-ZBFHGGJFSA-N 0 3 392.341 3.484 10 0 GGAEHN C[C@@H](NC[C@@H](CO)Cc1ccccc1Br)c1cc2n(n1)CCCC2 ZINC000647301390 567779067 /nfs/dbraw/zinc/77/90/67/567779067.db2.gz JJMVBVGCXBYXPQ-CABCVRRESA-N 0 3 392.341 3.484 10 0 GGAEHN C[C@@H](NC[C@@H](CO)Cc1cccc(Br)c1)c1cc2n(n1)CCCC2 ZINC000647301484 567779160 /nfs/dbraw/zinc/77/91/60/567779160.db2.gz VJPGNTSUINAIDP-ZBFHGGJFSA-N 0 3 392.341 3.484 10 0 GGAEHN C[C@H](CS(=O)(=O)c1ccccc1)NCC[C@H]1CSc2ccccc2O1 ZINC000647320943 567779757 /nfs/dbraw/zinc/77/97/57/567779757.db2.gz NNKYFVFDHXEGCO-CVEARBPZSA-N 0 3 377.531 3.382 10 0 GGAEHN COc1ccc(Br)cc1C1(NC2CCN(C(=O)N(C)C)CC2)CC1 ZINC000647315244 567780025 /nfs/dbraw/zinc/78/00/25/567780025.db2.gz UVCBEAXCBQNPDJ-UHFFFAOYSA-N 0 3 396.329 3.182 10 0 GGAEHN C[C@@H](CS(=O)(=O)c1ccccc1)NCC[C@H]1CSc2ccccc2O1 ZINC000647320944 567780159 /nfs/dbraw/zinc/78/01/59/567780159.db2.gz NNKYFVFDHXEGCO-HOTGVXAUSA-N 0 3 377.531 3.382 10 0 GGAEHN CC(C)(CN[C@H]1CCCOc2c(Br)cccc21)[C@]1(O)CCOC1 ZINC000647340353 567780355 /nfs/dbraw/zinc/78/03/55/567780355.db2.gz IEODEPSEQXXNPO-YJBOKZPZSA-N 0 3 384.314 3.430 10 0 GGAEHN Cc1ccc(C(=O)N2CC[C@H](OCCN3CCCCC3)C2)c(Br)c1 ZINC000533649764 567781034 /nfs/dbraw/zinc/78/10/34/567781034.db2.gz XAQCZDNPBUPHRM-INIZCTEOSA-N 0 3 395.341 3.475 10 0 GGAEHN N[C@@H](CC(F)F)C(=O)NCc1ccc(Br)cc1C(F)(F)F ZINC000574516618 567782756 /nfs/dbraw/zinc/78/27/56/567782756.db2.gz OIPXWNHUIJJKEZ-VIFPVBQESA-N 0 3 375.135 3.067 10 0 GGAEHN O=C(NCC/C=C/c1ccc(Br)cc1)N1CCN2CCC1CC2 ZINC000624488400 567783972 /nfs/dbraw/zinc/78/39/72/567783972.db2.gz QUFDGPLOYAPESU-HNQUOIGGSA-N 0 3 378.314 3.342 10 0 GGAEHN O=C(NCC/C=C\c1ccc(Br)cc1)N1CCN2CCC1CC2 ZINC000624488401 567784039 /nfs/dbraw/zinc/78/40/39/567784039.db2.gz QUFDGPLOYAPESU-IWQZZHSRSA-N 0 3 378.314 3.342 10 0 GGAEHN Cc1cc(N2CCC[C@H](NCc3cc(Br)ccc3F)C2)n(C)n1 ZINC000444020528 567785440 /nfs/dbraw/zinc/78/54/40/567785440.db2.gz ZTICLYVAIHJPFH-HNNXBMFYSA-N 0 3 381.293 3.389 10 0 GGAEHN COc1ccc(Br)cc1CN[C@@H]1CCCN(c2cc(C)nn2C)C1 ZINC000444014388 567785674 /nfs/dbraw/zinc/78/56/74/567785674.db2.gz PJPSWJOESKHBNH-MRXNPFEDSA-N 0 3 393.329 3.258 10 0 GGAEHN Cc1cc(N2CCC[C@@H](NCc3ccc(F)cc3Br)C2)n(C)n1 ZINC000444016479 567785792 /nfs/dbraw/zinc/78/57/92/567785792.db2.gz ZNJCLBZOBSBIIU-OAHLLOKOSA-N 0 3 381.293 3.389 10 0 GGAEHN CC[C@H](Cc1cccc(Br)c1)C(=O)NCCNc1ccncc1 ZINC000533813327 567788276 /nfs/dbraw/zinc/78/82/76/567788276.db2.gz FTVQXMXEUMNYIG-OAHLLOKOSA-N 0 3 376.298 3.063 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)c1cc(-c2cccc(Br)c2)no1 ZINC000668012950 567788894 /nfs/dbraw/zinc/78/88/94/567788894.db2.gz OFROWSFYXDSWNF-AWEZNQCLSA-N 0 3 378.270 3.270 10 0 GGAEHN OC[C@@H](Cc1ccc(F)cc1)NC[C@H](O)COc1c(Cl)cccc1Cl ZINC000647529863 567789156 /nfs/dbraw/zinc/78/91/56/567789156.db2.gz NHEBHMUTMRUVGG-CABCVRRESA-N 0 3 388.266 3.065 10 0 GGAEHN O=C(Nc1cncc(Br)c1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000533862314 567790830 /nfs/dbraw/zinc/79/08/30/567790830.db2.gz QWZBXKCHVCUUQJ-CQSZACIVSA-N 0 3 375.270 3.090 10 0 GGAEHN CCO[C@@H]1C[C@@H](NCc2ccc(OC)c(Br)c2)[C@@H]1n1cccn1 ZINC000555646981 567792997 /nfs/dbraw/zinc/79/29/97/567792997.db2.gz LPDQWEGQOGXXAG-OIISXLGYSA-N 0 3 380.286 3.163 10 0 GGAEHN Cc1c(Br)cncc1C(=O)NCc1ccc(OCCN(C)C)cc1 ZINC000668077668 567794855 /nfs/dbraw/zinc/79/48/55/567794855.db2.gz URKFCUOEYWCHLO-UHFFFAOYSA-N 0 3 392.297 3.023 10 0 GGAEHN C[C@H](CNC(=O)c1c(F)c(F)c(Br)c(F)c1F)N(C)C1CC1 ZINC000668095844 567796056 /nfs/dbraw/zinc/79/60/56/567796056.db2.gz RQHKYBTZRQAZSB-ZCFIWIBFSA-N 0 3 383.183 3.218 10 0 GGAEHN N[C@@H]1CN(S(=O)(=O)c2cc(F)cc(Cl)c2)CC[C@H]1c1ccc(F)cc1 ZINC000574770907 567796546 /nfs/dbraw/zinc/79/65/46/567796546.db2.gz MBBKDPLPEUDVDQ-DLBZAZTESA-N 0 3 386.851 3.124 10 0 GGAEHN CCN(CCNC(=O)c1cc(Br)cc(N2CCCC2)c1)C1CC1 ZINC000668152022 567798484 /nfs/dbraw/zinc/79/84/84/567798484.db2.gz WXRSXVXJCLTUDV-UHFFFAOYSA-N 0 3 380.330 3.263 10 0 GGAEHN COc1ccc(CCC(=O)N2CCCC[C@H]2CN(C)C)c(Br)c1 ZINC000668211296 567801018 /nfs/dbraw/zinc/80/10/18/567801018.db2.gz BCLQZOVJDNXWCH-HNNXBMFYSA-N 0 3 383.330 3.333 10 0 GGAEHN CSCCNCc1cc(Cl)cc(Cl)c1OCCN1CCOCC1 ZINC000598951810 567801150 /nfs/dbraw/zinc/80/11/50/567801150.db2.gz CIEILOVKSOIBEM-UHFFFAOYSA-N 0 3 379.353 3.157 10 0 GGAEHN Cn1nc2c(c1CNC[C@H](O)COc1cc(Cl)ccc1Cl)CCCC2 ZINC000574871003 567801338 /nfs/dbraw/zinc/80/13/38/567801338.db2.gz JTEYCKKYWKYCEI-ZDUSSCGKSA-N 0 3 384.307 3.135 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)c1c(F)c(F)c(Br)c(F)c1F ZINC000668234740 567802544 /nfs/dbraw/zinc/80/25/44/567802544.db2.gz SIYMKMKZTNOHAJ-UHFFFAOYSA-N 0 3 397.210 3.419 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1cccc(Br)c1Cl ZINC000647823039 567802802 /nfs/dbraw/zinc/80/28/02/567802802.db2.gz BUHQZRDQWMGGRJ-UONOGXRCSA-N 0 3 387.705 3.038 10 0 GGAEHN C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)N1CCOC[C@H]1[C@@H]1CCCN1C ZINC000647823518 567803354 /nfs/dbraw/zinc/80/33/54/567803354.db2.gz JREKJTKDSZUAKX-BVGQSLNGSA-N 0 3 385.335 3.494 10 0 GGAEHN CCOC(=O)[C@@H]1CC[C@@H](NCc2cc(Br)cnc2OC)C[C@H]1C ZINC000599069659 567804526 /nfs/dbraw/zinc/80/45/26/567804526.db2.gz GMEZHIUHNMBEGP-KCPJHIHWSA-N 0 3 385.302 3.310 10 0 GGAEHN O=C1[C@@H](N[C@@H]2CCc3ccc(I)cc32)CCN1C1CCC1 ZINC000599092525 567804569 /nfs/dbraw/zinc/80/45/69/567804569.db2.gz JVDBBEQGPFMWOF-CVEARBPZSA-N 0 3 396.272 3.022 10 0 GGAEHN CCCN(CCC[NH+](C)C)C(=O)c1cnc2ccc(Br)cc2c1[O-] ZINC000444410918 567804487 /nfs/dbraw/zinc/80/44/87/567804487.db2.gz DLHLXZYJPGNLDN-UHFFFAOYSA-N 0 3 394.313 3.095 10 0 GGAEHN CSC1(CNC(=O)N[C@@H]2[C@@H]3Cc4c(cccc4Cl)[C@@H]32)CCN(C)CC1 ZINC000599066552 567804581 /nfs/dbraw/zinc/80/45/81/567804581.db2.gz SVWCWWTWOPSBIB-HYVNUMGLSA-N 0 3 379.957 3.105 10 0 GGAEHN CSC1(CNC(=O)N[C@@H]2[C@H]3Cc4c(cccc4Cl)[C@@H]23)CCN(C)CC1 ZINC000599066553 567804782 /nfs/dbraw/zinc/80/47/82/567804782.db2.gz SVWCWWTWOPSBIB-USXIJHARSA-N 0 3 379.957 3.105 10 0 GGAEHN C[C@@H](N[C@@H]1CCN(C2CCC2)C1=O)c1ccc(I)cc1 ZINC000599092945 567804942 /nfs/dbraw/zinc/80/49/42/567804942.db2.gz LBZDXQFUOJEIQR-IAQYHMDHSA-N 0 3 384.261 3.095 10 0 GGAEHN CC1(C)CN(CCC(=O)Nc2ccc(Br)cc2)C[C@@]2(CCOC2)O1 ZINC000574951842 567805461 /nfs/dbraw/zinc/80/54/61/567805461.db2.gz IJVREXSADAVCFQ-GOSISDBHSA-N 0 3 397.313 3.048 10 0 GGAEHN CCOC(=O)c1nccc(N[C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)n1 ZINC000599172069 567808530 /nfs/dbraw/zinc/80/85/30/567808530.db2.gz JYEHTAUALNYAJM-CQSZACIVSA-N 0 3 383.279 3.097 10 0 GGAEHN CCOC(=O)c1nccc(N[C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)n1 ZINC000599172068 567808540 /nfs/dbraw/zinc/80/85/40/567808540.db2.gz JYEHTAUALNYAJM-AWEZNQCLSA-N 0 3 383.279 3.097 10 0 GGAEHN C[C@@H](Cc1cc(Br)ccc1F)NC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000534379509 567809275 /nfs/dbraw/zinc/80/92/75/567809275.db2.gz CNPARHBWEMBSDO-BLLLJJGKSA-N 0 3 398.320 3.397 10 0 GGAEHN C[C@@H](Cc1cc(Br)ccc1F)NC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000534379510 567809285 /nfs/dbraw/zinc/80/92/85/567809285.db2.gz CNPARHBWEMBSDO-LRDDRELGSA-N 0 3 398.320 3.397 10 0 GGAEHN O[C@H](COc1ccc(Br)cc1)CN1CC[C@@H](CC(F)(F)F)C1 ZINC000444713757 567811755 /nfs/dbraw/zinc/81/17/55/567811755.db2.gz ZRGDVVZPXKRTIV-AAEUAGOBSA-N 0 3 382.220 3.463 10 0 GGAEHN CCO[C@H]1C[C@H](NCc2cc(Br)cc(Br)c2N)C1 ZINC000668512584 567812682 /nfs/dbraw/zinc/81/26/82/567812682.db2.gz SNWGEQPTOIVNFK-XYPYZODXSA-N 0 3 378.108 3.451 10 0 GGAEHN C[C@H]1C(=O)N(CCN(C)C)CN1Cc1csc(-c2ccc(Cl)cc2)n1 ZINC000648064471 567812921 /nfs/dbraw/zinc/81/29/21/567812921.db2.gz AEDLXSIIHDKCGE-ZDUSSCGKSA-N 0 3 378.929 3.015 10 0 GGAEHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)COC1(C)CNC1 ZINC000648075463 567813223 /nfs/dbraw/zinc/81/32/23/567813223.db2.gz FZLVAIRWDYRNHW-LLVKDONJSA-N 0 3 379.913 3.328 10 0 GGAEHN CN(Cc1cc(Br)ccc1OCc1ccccn1)CC1CN(C)C1 ZINC000668537796 567813241 /nfs/dbraw/zinc/81/32/41/567813241.db2.gz PCDRAUZDAOMOGB-UHFFFAOYSA-N 0 3 390.325 3.417 10 0 GGAEHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)COC1(C)CNC1 ZINC000648075464 567813481 /nfs/dbraw/zinc/81/34/81/567813481.db2.gz FZLVAIRWDYRNHW-NSHDSACASA-N 0 3 379.913 3.328 10 0 GGAEHN O[C@]1(C2CC2)CCCN(Cc2cnn(-c3ccc(Br)cc3)c2)C1 ZINC000668556486 567813682 /nfs/dbraw/zinc/81/36/82/567813682.db2.gz UYCXFAMPJBTZBI-GOSISDBHSA-N 0 3 376.298 3.372 10 0 GGAEHN C[C@H](Cc1ccc(Br)c(F)c1)N[C@@H]1CC[C@H](C)S(=O)(=O)C1 ZINC000668561685 567813915 /nfs/dbraw/zinc/81/39/15/567813915.db2.gz QFCZUSVBDMSZJL-NTZNESFSSA-N 0 3 378.307 3.075 10 0 GGAEHN C[C@H]1CC[C@@H](NC2CC(c3ccc(Br)cc3F)C2)CS1(=O)=O ZINC000668563513 567813924 /nfs/dbraw/zinc/81/39/24/567813924.db2.gz YLQQHFPGDCOQRW-YTOAPMJUSA-N 0 3 390.318 3.390 10 0 GGAEHN C[C@@H](CC(=O)Nc1ccc2c(c1F)CCNC2)n1cc(Br)cn1 ZINC000648132347 567814220 /nfs/dbraw/zinc/81/42/20/567814220.db2.gz CUJSUMOSMXOEMD-JTQLQIEISA-N 0 3 381.249 3.020 10 0 GGAEHN O=C(N[C@H]1CCN2CCCC[C@H]12)c1cc2c(cncc2Br)s1 ZINC000648244936 567816134 /nfs/dbraw/zinc/81/61/34/567816134.db2.gz JVDDNBKVHPTXPO-QWHCGFSZSA-N 0 3 380.311 3.415 10 0 GGAEHN CCN1CCN(Cc2ccc(CNC(=O)c3ccc4cc[nH]c4c3)cc2)CC1 ZINC000053238573 570244155 /nfs/dbraw/zinc/24/41/55/570244155.db2.gz HPRDEGIOFSTUGV-UHFFFAOYSA-N 0 3 376.504 3.235 10 0 GGAEHN CCC(C)(C)NC(=O)c1nnn(-c2cccc3c2CCN(CC2CC2)C3)c1C ZINC000071890389 570275283 /nfs/dbraw/zinc/27/52/83/570275283.db2.gz USYALEFKGWKQRD-UHFFFAOYSA-N 0 3 381.524 3.262 10 0 GGAEHN COc1cc(-c2nc(C(=O)NCCN(C)C)cs2)ccc1OCC(C)C ZINC000034712617 570303791 /nfs/dbraw/zinc/30/37/91/570303791.db2.gz GFQMNRHLMQZRJA-UHFFFAOYSA-N 0 3 377.510 3.145 10 0 GGAEHN CC[C@@H](C(=O)NCc1ccccc1)N1CCC[C@H](C(=O)Nc2ccccc2)C1 ZINC000012328396 570315882 /nfs/dbraw/zinc/31/58/82/570315882.db2.gz ILSLJICGBDOEPC-FPOVZHCZSA-N 0 3 379.504 3.432 10 0 GGAEHN CC(C)OCCOCc1cccc(NC(=O)N(C)[C@H]2CCN(C)C[C@H]2C)c1 ZINC000075110217 570318889 /nfs/dbraw/zinc/31/88/89/570318889.db2.gz OKZKMDVBTRPHKS-XLIONFOSSA-N 0 3 377.529 3.432 10 0 GGAEHN COCC(=O)N(C[C@@H]1CN(Cc2ccc[nH]2)C[C@@H]1c1ccccc1OC)C(C)C ZINC000034740895 570327722 /nfs/dbraw/zinc/32/77/22/570327722.db2.gz JONTVLQYLHESRM-RXVVDRJESA-N 0 3 399.535 3.122 10 0 GGAEHN CN(C)CCn1c2cc(NC(=O)C[C@@H]3CCOc4ccccc43)ccc2oc1=O ZINC000117635488 570330451 /nfs/dbraw/zinc/33/04/51/570330451.db2.gz PKGIZKCRTPJQAS-HNNXBMFYSA-N 0 3 395.459 3.051 10 0 GGAEHN C[C@@H](NCC1(N2CCOCC2)CCCCC1)C(=O)Nc1ccc(Cl)cc1F ZINC000022931446 570337102 /nfs/dbraw/zinc/33/71/02/570337102.db2.gz LJWWXBUPUYJUBU-OAHLLOKOSA-N 0 3 397.922 3.431 10 0 GGAEHN O=C(Cn1cccc1-c1nnc(C2CCC2)o1)N1CCN(C2CCCCC2)CC1 ZINC000035526489 570392500 /nfs/dbraw/zinc/39/25/00/570392500.db2.gz HOQHZLPKPDRDFD-UHFFFAOYSA-N 0 3 397.523 3.283 10 0 GGAEHN CCN(CC)S(=O)(=O)c1ccc(-c2ccc(CNC[C@H]3CCCO3)o2)cc1 ZINC000024773711 570392945 /nfs/dbraw/zinc/39/29/45/570392945.db2.gz DQOMVGFPAIIUFU-QGZVFWFLSA-N 0 3 392.521 3.246 10 0 GGAEHN CN(CCC(=O)NC(=O)NC1CCCC1)Cc1ccccc1OC(F)(F)F ZINC000024828723 570394264 /nfs/dbraw/zinc/39/42/64/570394264.db2.gz ZUAXMUQDMQXRPM-UHFFFAOYSA-N 0 3 387.402 3.176 10 0 GGAEHN COc1ccc(CN(C)CCC(=O)Nc2ccnn2C2CCCC2)cc1OC ZINC000032870762 570395833 /nfs/dbraw/zinc/39/58/33/570395833.db2.gz QIRBHJDWMCPEHF-UHFFFAOYSA-N 0 3 386.496 3.476 10 0 GGAEHN CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)N[C@H]2CCCN(C3CCCCC3)C2)C1 ZINC000241965694 570432197 /nfs/dbraw/zinc/43/21/97/570432197.db2.gz UVALKUHHBLZHRP-QAZPSSTNSA-N 0 3 383.602 3.163 10 0 GGAEHN COc1cccc(N2C(=O)CN([C@H]3CCN(Cc4ccccc4)C3)C[C@H]2C)c1 ZINC000244708239 570433132 /nfs/dbraw/zinc/43/31/32/570433132.db2.gz KPXXDRXWXMBHBQ-NQIIRXRSSA-N 0 3 379.504 3.007 10 0 GGAEHN COc1ccc(C(=O)C(=O)Nc2ccc(OCCN3CCCC3)c(C)c2)cc1 ZINC000133926955 570468778 /nfs/dbraw/zinc/46/87/78/570468778.db2.gz JHJYPZGCFWKCGB-UHFFFAOYSA-N 0 3 382.460 3.300 10 0 GGAEHN O=C(NCc1ccc2c(c1)OCO2)c1ccc(SCCN2CCCCC2)nc1 ZINC000033115220 570520517 /nfs/dbraw/zinc/52/05/17/570520517.db2.gz TUSOBVHJWWHMQC-UHFFFAOYSA-N 0 3 399.516 3.318 10 0 GGAEHN CC[C@H](C)N(C(=O)CN(C)C1CCN(Cc2cc(C)no2)CC1)[C@@H](C)CC ZINC000072308328 570527563 /nfs/dbraw/zinc/52/75/63/570527563.db2.gz QPWXLSYJABARCA-ROUUACIJSA-N 0 3 378.561 3.305 10 0 GGAEHN COc1ccc(OC[C@@H](O)CN(Cc2cc(OC)cc(OC)c2)C2CC2)cc1 ZINC000036095111 570534598 /nfs/dbraw/zinc/53/45/98/570534598.db2.gz VELIMQPYATYCCW-SFHVURJKSA-N 0 3 387.476 3.117 10 0 GGAEHN COCCCN(Cc1ccc(C)s1)C[C@@H](O)COc1ccc(OC)cc1 ZINC000036101420 570538454 /nfs/dbraw/zinc/53/84/54/570538454.db2.gz SLMKTNRWWMLMJQ-QGZVFWFLSA-N 0 3 379.522 3.344 10 0 GGAEHN CCn1nnc2cc(C(=O)N3c4ccc(C)cc4[C@H]4CN(C)CC[C@H]43)ccc21 ZINC000008745146 570539896 /nfs/dbraw/zinc/53/98/96/570539896.db2.gz IPAIELBNOFVNEU-YLJYHZDGSA-N 0 3 375.476 3.208 10 0 GGAEHN COC(=O)c1cccc(OC[C@@H](O)CN(C)[C@H](C)c2ccc(F)c(F)c2)c1 ZINC000034887447 570546239 /nfs/dbraw/zinc/54/62/39/570546239.db2.gz OQRDPNFIUUEVEG-CJNGLKHVSA-N 0 3 379.403 3.184 10 0 GGAEHN COc1ccc(-c2noc(-c3ccc(NCCN4CCCCCC4)nn3)n2)cc1 ZINC000064838051 570562104 /nfs/dbraw/zinc/56/21/04/570562104.db2.gz VYPNZOSFAYSOTL-UHFFFAOYSA-N 0 3 394.479 3.490 10 0 GGAEHN CC(C)CC(=O)Nc1nc(C(=O)N(CCN(C)C)Cc2ccccc2)cs1 ZINC000040355282 570566355 /nfs/dbraw/zinc/56/63/55/570566355.db2.gz LPAWIKGQDOXMJY-UHFFFAOYSA-N 0 3 388.537 3.332 10 0 GGAEHN C[C@H](NC[C@@H](O)Cc1ccc2ccccc2c1)c1ccc2c(c1)NC(=O)CO2 ZINC000225396654 570569910 /nfs/dbraw/zinc/56/99/10/570569910.db2.gz JRINESWTMRLYRQ-YWZLYKJASA-N 0 3 376.456 3.425 10 0 GGAEHN CC(C)S(=O)(=O)Oc1ccc(CN(CCN(C)C)C(=O)CC(C)(C)C)cc1 ZINC000006765938 570576775 /nfs/dbraw/zinc/57/67/75/570576775.db2.gz BFYYLEKTXBSSDG-UHFFFAOYSA-N 0 3 398.569 3.130 10 0 GGAEHN CCOC(=O)C1=C(CN2C[C@H](C)C[C@H](C)C2)NC(=O)N[C@H]1c1ccc(C)cc1 ZINC000034145578 570584290 /nfs/dbraw/zinc/58/42/90/570584290.db2.gz JOAZBEZPXLZMIT-YRNRMSPPSA-N 0 3 385.508 3.144 10 0 GGAEHN COCCN1CCC[C@@H]1CN[C@H](C)c1cnccc1NC(=O)OC(C)(C)C ZINC000225565773 570588928 /nfs/dbraw/zinc/58/89/28/570588928.db2.gz PFOPCHLPKUBFQB-HZPDHXFCSA-N 0 3 378.517 3.190 10 0 GGAEHN Cc1cc(C)n2c(CN[C@@H](CNC(=O)OC(C)(C)C)C(C)(C)C)cnc2n1 ZINC000225589294 570591802 /nfs/dbraw/zinc/59/18/02/570591802.db2.gz RYFTZFHDTFIFCO-INIZCTEOSA-N 0 3 375.517 3.375 10 0 GGAEHN Cc1ccc(Cn2nnc3cc(C(=O)NCCN4CCCCC4)ccc32)cc1 ZINC000065030501 570651175 /nfs/dbraw/zinc/65/11/75/570651175.db2.gz FFBMEHPQCZCAPT-UHFFFAOYSA-N 0 3 377.492 3.004 10 0 GGAEHN CC(=O)c1cccc(NC(=O)[C@@H](NCCCn2ccnc2)c2ccccc2)c1 ZINC000033040204 570678926 /nfs/dbraw/zinc/67/89/26/570678926.db2.gz BXCMFGLYXFNGME-NRFANRHFSA-N 0 3 376.460 3.445 10 0 GGAEHN O[C@@H](CN[C@H]1CCSc2ccc(F)cc21)COCc1ccc2c(c1)OCO2 ZINC000036396211 570679636 /nfs/dbraw/zinc/67/96/36/570679636.db2.gz QWMUNGGWXKVVCI-RDJZCZTQSA-N 0 3 391.464 3.259 10 0 GGAEHN COCCCN(Cc1cncnc1)[C@H]1CCCN(C(=O)OC(C)(C)C)CC1 ZINC000241316816 570686541 /nfs/dbraw/zinc/68/65/41/570686541.db2.gz LVCXVFSXASMGDI-SFHVURJKSA-N 0 3 378.517 3.105 10 0 GGAEHN Cc1cc(C(=O)NCc2cccc(CN(C)C)c2)c2nc3n(c2n1)CCCCC3 ZINC000046380164 570700195 /nfs/dbraw/zinc/70/01/95/570700195.db2.gz FMHBGMFEWUSAGC-UHFFFAOYSA-N 0 3 391.519 3.458 10 0 GGAEHN CCN(CC)Cc1ccccc1NC(=O)NCc1ccc(-n2cccn2)nc1 ZINC000058086202 570708852 /nfs/dbraw/zinc/70/88/52/570708852.db2.gz OCYOYCOFKOMQAY-UHFFFAOYSA-N 0 3 378.480 3.431 10 0 GGAEHN CCn1cc(-c2ccc(Cl)cc2)cc1C(=O)NCCN1CCN(CC)CC1 ZINC000065170490 570719935 /nfs/dbraw/zinc/71/99/35/570719935.db2.gz ZYWLPTWQOAMSFA-UHFFFAOYSA-N 0 3 388.943 3.196 10 0 GGAEHN O[C@@H](c1ccccc1)C1CCN(CCCc2nnnn2-c2ccccc2)CC1 ZINC000058251587 570723341 /nfs/dbraw/zinc/72/33/41/570723341.db2.gz MGWQBZSRYKKKDK-QFIPXVFZSA-N 0 3 377.492 3.041 10 0 GGAEHN CN(C)Cc1ccccc1CNC(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1 ZINC000058406739 570731754 /nfs/dbraw/zinc/73/17/54/570731754.db2.gz YMJUJJSCFLOYPL-QGZVFWFLSA-N 0 3 384.499 3.213 10 0 GGAEHN CN(C)CCOc1ccccc1C(=O)NCC(C)(C)N1CCc2ccccc2C1 ZINC000059003393 570737025 /nfs/dbraw/zinc/73/70/25/570737025.db2.gz FILTXHBOIXRWHW-UHFFFAOYSA-N 0 3 395.547 3.194 10 0 GGAEHN COc1ccc(-c2nc(-c3ccc4c(c3)nnn4CCN(C)C)no2)c(C)c1 ZINC000065254997 570752852 /nfs/dbraw/zinc/75/28/52/570752852.db2.gz BBTXCKKZLNECKL-UHFFFAOYSA-N 0 3 378.436 3.027 10 0 GGAEHN c1ccc(-c2nc(-c3ccc4c(c3)nnn4CCN3CCCCC3)no2)nc1 ZINC000065255009 570752896 /nfs/dbraw/zinc/75/28/96/570752896.db2.gz UAKZYSSMZQXTSR-UHFFFAOYSA-N 0 3 375.436 3.029 10 0 GGAEHN c1cncc(-c2nc(-c3ccc4c(c3)nnn4CCN3CCCCC3)no2)c1 ZINC000065255008 570752930 /nfs/dbraw/zinc/75/29/30/570752930.db2.gz LMYZZQMGENNFOU-UHFFFAOYSA-N 0 3 375.436 3.029 10 0 GGAEHN Cc1cccc(CNC(=O)c2cccnc2N2CCN[C@H](c3ccccc3)C2)c1 ZINC000065255780 570754138 /nfs/dbraw/zinc/75/41/38/570754138.db2.gz HOYRQANXDNYKNZ-QFIPXVFZSA-N 0 3 386.499 3.471 10 0 GGAEHN COc1cccc(NC(=O)c2cccnc2N2CCN[C@@H](c3ccccc3)C2)c1 ZINC000065255829 570754272 /nfs/dbraw/zinc/75/42/72/570754272.db2.gz HTCDGVVYUJSZGE-OAQYLSRUSA-N 0 3 388.471 3.493 10 0 GGAEHN O=C(NCc1cccs1)c1cccnc1N1CCN[C@@H](c2ccccc2)C1 ZINC000065255791 570754309 /nfs/dbraw/zinc/75/43/09/570754309.db2.gz VRFXUYHXHCJFLI-LJQANCHMSA-N 0 3 378.501 3.224 10 0 GGAEHN O=C(NCc1cccs1)c1ccc(N2CCN[C@@H](c3ccccc3)C2)nc1 ZINC000065256127 570754805 /nfs/dbraw/zinc/75/48/05/570754805.db2.gz OSYGOUIGBJRNKF-LJQANCHMSA-N 0 3 378.501 3.224 10 0 GGAEHN COc1cccc(NC(=O)c2ccc(N3CCN[C@@H](c4ccccc4)C3)nc2)c1 ZINC000065256159 570754835 /nfs/dbraw/zinc/75/48/35/570754835.db2.gz QFOWPBHXUZRONQ-OAQYLSRUSA-N 0 3 388.471 3.493 10 0 GGAEHN O=C(NCc1cccs1)c1ccnc(N2CCN[C@H](c3ccccc3)C2)c1 ZINC000065255955 570754858 /nfs/dbraw/zinc/75/48/58/570754858.db2.gz JIGFBYWFCWCBAU-IBGZPJMESA-N 0 3 378.501 3.224 10 0 GGAEHN O=C(NCc1cccs1)c1cccc(N2CCN[C@@H](c3ccccc3)C2)n1 ZINC000065256288 570755169 /nfs/dbraw/zinc/75/51/69/570755169.db2.gz BXQRRICQBQJHMS-LJQANCHMSA-N 0 3 378.501 3.224 10 0 GGAEHN COc1ccc(NC(=O)c2cccc(N3CCN[C@@H](c4ccccc4)C3)n2)cc1 ZINC000065256234 570755320 /nfs/dbraw/zinc/75/53/20/570755320.db2.gz UHYDSPULEDLXAG-OAQYLSRUSA-N 0 3 388.471 3.493 10 0 GGAEHN CCCOc1ccc(CNC(=O)c2nc(C)n(C3CCN(C)CC3)c2C)cc1 ZINC000065257277 570755890 /nfs/dbraw/zinc/75/58/90/570755890.db2.gz JDGIALODHIQNQF-UHFFFAOYSA-N 0 3 384.524 3.485 10 0 GGAEHN CCN(C(=O)C(=O)NCc1ccccc1CN1CCCCC1)c1cccc(F)c1 ZINC000052655836 570757848 /nfs/dbraw/zinc/75/78/48/570757848.db2.gz XVJCFHBUTAHNMZ-UHFFFAOYSA-N 0 3 397.494 3.481 10 0 GGAEHN CCCCN1CCN(c2nnc(-c3nnc(C4CC4)o3)c3ccccc32)CC1 ZINC000065258228 570759863 /nfs/dbraw/zinc/75/98/63/570759863.db2.gz ZCERWPMPXMITSC-UHFFFAOYSA-N 0 3 378.480 3.479 10 0 GGAEHN CN(Cc1ccc(C(=O)Nc2ccc3c(c2)CC(=O)N3)cc1)C[C@@H]1CCCO1 ZINC000065376521 570763148 /nfs/dbraw/zinc/76/31/48/570763148.db2.gz JMOSEVRZKVZPTN-IBGZPJMESA-N 0 3 379.460 3.044 10 0 GGAEHN CCc1nn(C)cc1CN1CCC2(C[C@H]2N(Cc2ccsc2)C(C)=O)CC1 ZINC000583622169 570802403 /nfs/dbraw/zinc/80/24/03/570802403.db2.gz UUIJHOGVFIKLMG-HXUWFJFHSA-N 0 3 386.565 3.447 10 0 GGAEHN CC(C)C[C@H](N[C@H](C)C(=O)Nc1cccc(S(N)(=O)=O)c1)c1ccccc1 ZINC000032806165 570822633 /nfs/dbraw/zinc/82/26/33/570822633.db2.gz IURZMOMMLGVOSA-BEFAXECRSA-N 0 3 389.521 3.038 10 0 GGAEHN CC(C)C[C@@H](N[C@H](C)C(=O)Nc1cccc(S(N)(=O)=O)c1)c1ccccc1 ZINC000032806163 570822691 /nfs/dbraw/zinc/82/26/91/570822691.db2.gz IURZMOMMLGVOSA-DNVCBOLYSA-N 0 3 389.521 3.038 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1 ZINC000065529288 570830039 /nfs/dbraw/zinc/83/00/39/570830039.db2.gz NIXFYENLBYHNMA-IRXDYDNUSA-N 0 3 378.948 3.340 10 0 GGAEHN O=c1cc(CN2CCCCCC2)nc2[nH]c(NCc3ccccc3Cl)nn21 ZINC000101796187 570834391 /nfs/dbraw/zinc/83/43/91/570834391.db2.gz HBEOZTYUXMAEPO-UHFFFAOYSA-N 0 3 386.887 3.059 10 0 GGAEHN CC(=O)NCCc1ccc([C@@H](C)NCc2ccc(-n3nc(C)cc3C)nc2)cc1 ZINC000170591502 570848942 /nfs/dbraw/zinc/84/89/42/570848942.db2.gz HZDYIUPVYJECAE-GOSISDBHSA-N 0 3 391.519 3.414 10 0 GGAEHN O=C(Cc1csc(-c2ccoc2)n1)Nc1cnn(CCN2CCCCC2)c1 ZINC000170591524 570849387 /nfs/dbraw/zinc/84/93/87/570849387.db2.gz RLGAHCZZMBFSNZ-UHFFFAOYSA-N 0 3 385.493 3.267 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)[C@@H]1CC(=O)N(c2ccc(F)c(Cl)c2)C1 ZINC000004711885 570857948 /nfs/dbraw/zinc/85/79/48/570857948.db2.gz GLZGXLACORESIS-QLFBSQMISA-N 0 3 395.906 3.211 10 0 GGAEHN O=C(CN1CCC(CCc2ccccc2)CC1)N1CCN(c2ccccn2)CC1 ZINC000032865347 570862676 /nfs/dbraw/zinc/86/26/76/570862676.db2.gz TVONZXRFFZEXDH-UHFFFAOYSA-N 0 3 392.547 3.075 10 0 GGAEHN C[C@H](NC(=O)c1cccs1)C(=O)NCc1ccccc1CN1CCCCC1 ZINC000032869206 570864457 /nfs/dbraw/zinc/86/44/57/570864457.db2.gz CEISXAOHXOBZML-INIZCTEOSA-N 0 3 385.533 3.169 10 0 GGAEHN O=C(CCN1CCC(C(=O)N2CCCCCC2)CC1)N1CCc2ccccc21 ZINC000032870887 570869839 /nfs/dbraw/zinc/86/98/39/570869839.db2.gz QQKIUDMTRSJEOA-UHFFFAOYSA-N 0 3 383.536 3.080 10 0 GGAEHN CC[C@@H]1c2ccsc2CCN1C[C@H](O)COCc1ccc2c(c1)OCO2 ZINC000037308305 570878906 /nfs/dbraw/zinc/87/89/06/570878906.db2.gz OZQYJNMRXUTVLF-DOTOQJQBSA-N 0 3 375.490 3.364 10 0 GGAEHN O=C(c1ccnc(N2CCN[C@H](c3ccccc3)C2)c1)N1CCc2ccccc2C1 ZINC000065256038 570881215 /nfs/dbraw/zinc/88/12/15/570881215.db2.gz VZMNGERVQGTTJS-QHCPKHFHSA-N 0 3 398.510 3.431 10 0 GGAEHN O=C(Cc1ccc(N2CCCC2=O)cc1)NC1CCN(Cc2ccccc2)CC1 ZINC000012589138 570883381 /nfs/dbraw/zinc/88/33/81/570883381.db2.gz NMHGHFLEGMFLKD-UHFFFAOYSA-N 0 3 391.515 3.137 10 0 GGAEHN O=C(CCN(Cc1ccccn1)C1CC1)NC(=O)NC12CC3CC(CC(C3)C1)C2 ZINC000012597988 570885578 /nfs/dbraw/zinc/88/55/78/570885578.db2.gz LPUQKJSCWFLQGC-UHFFFAOYSA-N 0 3 396.535 3.231 10 0 GGAEHN CCC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc3c(c2)OCCO3)cc1 ZINC000032899638 570895352 /nfs/dbraw/zinc/89/53/52/570895352.db2.gz CIAQBADRSAMMIY-YJBOKZPZSA-N 0 3 385.460 3.141 10 0 GGAEHN CCC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccc3c(c2)OCCO3)cc1 ZINC000032899640 570895384 /nfs/dbraw/zinc/89/53/84/570895384.db2.gz CIAQBADRSAMMIY-QAPCUYQASA-N 0 3 385.460 3.141 10 0 GGAEHN COCCn1c(C)cc(O)c([C@H](c2cccc(OC)c2)N2CCCCC2)c1=O ZINC000016993403 570923282 /nfs/dbraw/zinc/92/32/82/570923282.db2.gz IULKZXDYZQKZHF-NRFANRHFSA-N 0 3 386.492 3.093 10 0 GGAEHN CC[S@@](=O)[C@@H]1CCC[C@H](NC(=O)N[C@@H]2CCCN(C3CCCCC3)C2)C1 ZINC000078326243 570933130 /nfs/dbraw/zinc/93/31/30/570933130.db2.gz UVALKUHHBLZHRP-CBHOLEBRSA-N 0 3 383.602 3.163 10 0 GGAEHN COc1ccc([C@H](NC[C@H]([C@H]2CCOC2)N2CCOCC2)c2ccccc2)cc1 ZINC000108171271 570985084 /nfs/dbraw/zinc/98/50/84/570985084.db2.gz RCQXQJZICBGOCP-QPTUXGOLSA-N 0 3 396.531 3.112 10 0 GGAEHN O=C(CN1CCC[C@@H](c2nc[nH]n2)C1)Nc1cccc(Oc2ccccc2)c1 ZINC000252533081 570989813 /nfs/dbraw/zinc/98/98/13/570989813.db2.gz FUTKMIKYMLKKQW-MRXNPFEDSA-N 0 3 377.448 3.415 10 0 GGAEHN O=C(CN1CCC[C@H](c2nc[nH]n2)C1)Nc1ccc(Oc2ccccc2)cc1 ZINC000252552760 570995395 /nfs/dbraw/zinc/99/53/95/570995395.db2.gz UYOYYEOWYHJWGE-INIZCTEOSA-N 0 3 377.448 3.415 10 0 GGAEHN Cc1cccc(CN2CCC(NC(=O)N[C@@H]3COc4ccccc4C3)CC2)c1 ZINC000045743948 570996099 /nfs/dbraw/zinc/99/60/99/570996099.db2.gz UFPVZRAKYWLLSO-NRFANRHFSA-N 0 3 379.504 3.262 10 0 GGAEHN COc1ccc(CN(Cc2cc(=O)n3ccccc3n2)CC(C)C)cc1OC ZINC000045974052 571007240 /nfs/dbraw/zinc/00/72/40/571007240.db2.gz VZSZKCZBSWOBQO-UHFFFAOYSA-N 0 3 381.476 3.370 10 0 GGAEHN CC(C)C[C@H](N[C@@H](C)C(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccccc1 ZINC000019625356 571021809 /nfs/dbraw/zinc/02/18/09/571021809.db2.gz ZOHDYDWKZVMLMB-KXBFYZLASA-N 0 3 389.521 3.038 10 0 GGAEHN Cc1cccc([C@@H]2CC[C@H](C(=O)NCCN(C)C)CN2C(=O)C2CCCC2)c1 ZINC000037545812 571029210 /nfs/dbraw/zinc/02/92/10/571029210.db2.gz LIVKSFWUGVRFFF-SFTDATJTSA-N 0 3 385.552 3.143 10 0 GGAEHN CN(C)CCNC(=O)[C@H]1CC[C@H](c2ccccc2)N(C(=O)c2ccccc2F)C1 ZINC000037545745 571029336 /nfs/dbraw/zinc/02/93/36/571029336.db2.gz HREXZVDJFVYUGO-GHTZIAJQSA-N 0 3 397.494 3.097 10 0 GGAEHN CN1CCN(CCCNc2ncncc2Br)[C@@H](c2ccccc2)C1 ZINC000481707815 650651529 /nfs/dbraw/zinc/65/15/29/650651529.db2.gz PYCMBXSSHNLXPW-QGZVFWFLSA-N 0 3 390.329 3.030 10 0 GGAEHN CN1CCN(CCCNc2ncncc2Br)[C@H](c2ccccc2)C1 ZINC000481707814 650651584 /nfs/dbraw/zinc/65/15/84/650651584.db2.gz PYCMBXSSHNLXPW-KRWDZBQOSA-N 0 3 390.329 3.030 10 0 GGAEHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCN(c2ccccc2Cl)CC1 ZINC000053549124 1406439236 /nfs/dbraw/zinc/43/92/36/1406439236.db2.gz DWADWHKXMZMEIE-LJQANCHMSA-N 0 3 398.938 3.446 10 0 GGAEHN Cc1ccc(OC[C@@H](O)CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1 ZINC000055032016 1406874002 /nfs/dbraw/zinc/87/40/02/1406874002.db2.gz KZFQOFOYWRMEPY-FQEVSTJZSA-N 0 3 383.492 3.021 10 0 GGAEHN CC[NH+](CC)[C@H](CNC(=O)c1cc(NC(C)=O)ccc1[O-])c1cccc(OC)c1 ZINC000055164048 1406897014 /nfs/dbraw/zinc/89/70/14/1406897014.db2.gz ANNVCNLRGDTETM-HXUWFJFHSA-N 0 3 399.491 3.172 10 0 GGAEHN CS(=O)(=O)Nc1cccc(CNCc2c[nH]nc2-c2ccc(Cl)cc2)c1 ZINC000055373547 1406941583 /nfs/dbraw/zinc/94/15/83/1406941583.db2.gz GXKVBKLOGWUYMJ-UHFFFAOYSA-N 0 3 390.896 3.391 10 0 GGAEHN C/C=C/c1ccc(OC[C@@H](O)CNCc2ccc(OC)c(OC)c2)c(OC)c1 ZINC000007014913 1398584290 /nfs/dbraw/zinc/58/42/90/1398584290.db2.gz MPWATAZEHXNZCX-QWNKOJSDSA-N 0 3 387.476 3.275 10 0 GGAEHN Cc1ccccc1[C@@H](C)NC(=O)NCc1ccc(CN2CCN(C)CC2)cc1 ZINC000042799459 1400417029 /nfs/dbraw/zinc/41/70/29/1400417029.db2.gz CQTRTBUYARDLIG-LJQANCHMSA-N 0 3 380.536 3.303 10 0 GGAEHN CCN1CCN(Cc2ccccc2CNC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)CC1 ZINC000046940111 1404645308 /nfs/dbraw/zinc/64/53/08/1404645308.db2.gz FLJVGPDUZNBSJD-DHIUTWEWSA-N 0 3 395.522 3.383 10 0 GGAEHN O=C(NCCCN1CCN(Cc2ccccc2)CC1)[C@@H]1C[C@H]1c1ccc(F)cc1 ZINC000047459954 1404843910 /nfs/dbraw/zinc/84/39/10/1404843910.db2.gz FHOWTHMXBFPESC-XZOQPEGZSA-N 0 3 395.522 3.253 10 0 GGAEHN O=C(NCCCN1CCN(Cc2ccccc2)CC1)[C@@H]1C[C@@H]1c1ccc(F)cc1 ZINC000047459952 1404844165 /nfs/dbraw/zinc/84/41/65/1404844165.db2.gz FHOWTHMXBFPESC-DHIUTWEWSA-N 0 3 395.522 3.253 10 0 GGAEHN C[C@@H]1CN(c2ccccc2NC(=O)N2CCN(C3CCCC3)CC2)C[C@@H](C)O1 ZINC000047809186 1404958051 /nfs/dbraw/zinc/95/80/51/1404958051.db2.gz DODKXWAGNZWNTG-QZTJIDSGSA-N 0 3 386.540 3.392 10 0 GGAEHN CC(C)N1CCC(NS(=O)(=O)c2ccc(Br)cc2Cl)CC1 ZINC000047915324 1404995364 /nfs/dbraw/zinc/99/53/64/1404995364.db2.gz XKGITMIWVLLQAG-UHFFFAOYSA-N 0 3 395.750 3.254 10 0 GGAEHN COC(=O)Nc1ccc(CNC(=O)N(CCN(C)C)Cc2ccc(C)o2)cc1 ZINC000056876197 1407462283 /nfs/dbraw/zinc/46/22/83/1407462283.db2.gz HDXYFXRAZXMJFZ-UHFFFAOYSA-N 0 3 388.468 3.040 10 0 GGAEHN O=C(Nc1ccc(N2CCN(Cc3ccccc3)CC2)cc1)C1CCOCC1 ZINC000057634871 1407673362 /nfs/dbraw/zinc/67/33/62/1407673362.db2.gz VRHHGDPGVLFIMP-UHFFFAOYSA-N 0 3 379.504 3.374 10 0 GGAEHN O=C(NC[C@H](c1ccccc1)N1CCCC1)[C@@H]1CCC(=O)N1c1ccccc1 ZINC000062355632 1408241738 /nfs/dbraw/zinc/24/17/38/1408241738.db2.gz WUQODCSZYGQOGM-LEWJYISDSA-N 0 3 377.488 3.135 10 0 GGAEHN Cc1ccc([C@H](CNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)N(C)C)cc1 ZINC000062361524 1408243598 /nfs/dbraw/zinc/24/35/98/1408243598.db2.gz DDQANJZUZJYMER-MSOLQXFVSA-N 0 3 375.513 3.113 10 0 GGAEHN CCOC(=O)c1c(NC(=O)CN(C)C(C2CC2)C2CC2)sc2c1CCC2 ZINC000065243453 1408656313 /nfs/dbraw/zinc/65/63/13/1408656313.db2.gz BMVYLWQYIPQZCB-UHFFFAOYSA-N 0 3 376.522 3.472 10 0 GGAEHN COc1ccc(OC)c(CCNC(=O)N2CCN(CCC(C)(C)C)CC2)c1 ZINC000065538317 1408685854 /nfs/dbraw/zinc/68/58/54/1408685854.db2.gz BNFOMJRPEQYAAU-UHFFFAOYSA-N 0 3 377.529 3.010 10 0 GGAEHN Fc1cccc([C@@H](CNCc2cccc3c2OCCCO3)N2CCOCC2)c1 ZINC000066877225 1408939596 /nfs/dbraw/zinc/93/95/96/1408939596.db2.gz CXLADLLCTHEAOZ-HXUWFJFHSA-N 0 3 386.467 3.150 10 0 GGAEHN CN1CCN(c2ncccc2CNCc2ccc(OC(F)(F)F)cc2)CC1 ZINC000066876760 1408939795 /nfs/dbraw/zinc/93/97/95/1408939795.db2.gz AVQNCQFQPPOVNK-UHFFFAOYSA-N 0 3 380.414 3.022 10 0 GGAEHN C[C@@H]1CN(Cc2ccc(CNCc3nc4ccccc4n3C)cc2)C[C@H](C)O1 ZINC000066971273 1408968732 /nfs/dbraw/zinc/96/87/32/1408968732.db2.gz DJKOJCIRMVGOJE-HDICACEKSA-N 0 3 378.520 3.472 10 0 GGAEHN C[C@H]1CN(Cc2ccc(CNCc3nc4ccccc4n3C)cc2)C[C@H](C)O1 ZINC000066971274 1408968811 /nfs/dbraw/zinc/96/88/11/1408968811.db2.gz DJKOJCIRMVGOJE-ROUUACIJSA-N 0 3 378.520 3.472 10 0 GGAEHN c1cc(-c2nc(CNC[C@@]3(N4CCOCC4)CCSC3)cs2)cs1 ZINC000067218323 1409046082 /nfs/dbraw/zinc/04/60/82/1409046082.db2.gz HAKMQEVYKHABFQ-KRWDZBQOSA-N 0 3 381.592 3.169 10 0 GGAEHN CCOC(=O)COc1cccc(NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c1 ZINC000067664103 1409201777 /nfs/dbraw/zinc/20/17/77/1409201777.db2.gz FWFGEROVEAEAEF-HXUWFJFHSA-N 0 3 399.491 3.361 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)N[C@@H](C)COCC(F)(F)F)c1ccsc1 ZINC000067710392 1409212690 /nfs/dbraw/zinc/21/26/90/1409212690.db2.gz FTNBWXGBGAHCFL-GXTWGEPZSA-N 0 3 381.464 3.398 10 0 GGAEHN CN(CCNC(=O)COc1ccccc1OCC(F)(F)F)Cc1ccccc1 ZINC000067911294 1409254296 /nfs/dbraw/zinc/25/42/96/1409254296.db2.gz HSTKQLKXWDQRFX-UHFFFAOYSA-N 0 3 396.409 3.255 10 0 GGAEHN O=C(NC1CCN(C[C@H](O)COc2ccc(Cl)cc2)CC1)C1CCCCC1 ZINC000068335147 1409370417 /nfs/dbraw/zinc/37/04/17/1409370417.db2.gz KEWAMRXTKMHICX-IBGZPJMESA-N 0 3 394.943 3.241 10 0 GGAEHN CCOc1cc(CN[C@H](CN2CCN(C)CC2)c2ccccc2)ccc1OC ZINC000069171442 1409580446 /nfs/dbraw/zinc/58/04/46/1409580446.db2.gz DZTJRNRAEINXAP-OAQYLSRUSA-N 0 3 383.536 3.172 10 0 GGAEHN CCN1CCc2c(cccc2-n2nnc(C(=O)NC3CCCCCC3)c2C)C1 ZINC000069564880 1409653253 /nfs/dbraw/zinc/65/32/53/1409653253.db2.gz BOWSZFLYYNNNDI-UHFFFAOYSA-N 0 3 381.524 3.406 10 0 GGAEHN C[C@H](C(=O)N1c2ccccc2CC[C@@H]1C)N1CCC[C@H](Cc2nccn2C)C1 ZINC000090003867 1410059999 /nfs/dbraw/zinc/05/99/99/1410059999.db2.gz BXASEDOWLBMWTF-IPMKNSEASA-N 0 3 380.536 3.431 10 0 GGAEHN CCNC(=O)Nc1c[nH]nc1[C@H]1CCCN(Cc2c[nH]nc2-c2ccccc2)C1 ZINC000096000095 1410320123 /nfs/dbraw/zinc/32/01/23/1410320123.db2.gz TYEQKBQDVWAIGR-INIZCTEOSA-N 0 3 393.495 3.321 10 0 GGAEHN CCc1ccc([C@H](CNC(=O)/C=C\c2cc(C(=O)OC)c(C)o2)N(C)C)cc1 ZINC000096943729 1410339267 /nfs/dbraw/zinc/33/92/67/1410339267.db2.gz SCNMOAYTFDVQLY-DUQGCJEPSA-N 0 3 384.476 3.369 10 0 GGAEHN CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)C1(c2ccc(C(C)(C)C)cc2)CC1 ZINC000102162068 1410574448 /nfs/dbraw/zinc/57/44/48/1410574448.db2.gz AYPZHZNJCYSAQR-HXUWFJFHSA-N 0 3 399.579 3.075 10 0 GGAEHN C[C@@H](NCc1ccc2c(c1)OCCO2)c1cc(F)ccc1N1CCN(C)CC1 ZINC000105463028 1411068904 /nfs/dbraw/zinc/06/89/04/1411068904.db2.gz ANYIDSCIKXCFMY-MRXNPFEDSA-N 0 3 385.483 3.200 10 0 GGAEHN O=C(NCCCCN1CCN(c2ccccc2)CC1)[C@@H]1Cc2ccccc2S1 ZINC000108473720 1411513117 /nfs/dbraw/zinc/51/31/17/1411513117.db2.gz CZIOHPRDWDMKPT-QFIPXVFZSA-N 0 3 395.572 3.422 10 0 GGAEHN CN(C(=O)[C@H]1C[C@@H]1c1ccccc1Cl)C1CCN(CCn2cccn2)CC1 ZINC000109292829 1411733958 /nfs/dbraw/zinc/73/39/58/1411733958.db2.gz HRWHUYIUKQTGPE-MOPGFXCFSA-N 0 3 386.927 3.263 10 0 GGAEHN CN(C(=O)[C@H]1C[C@H]1c1ccccc1Cl)C1CCN(CCn2cccn2)CC1 ZINC000109292833 1411734101 /nfs/dbraw/zinc/73/41/01/1411734101.db2.gz HRWHUYIUKQTGPE-OALUTQOASA-N 0 3 386.927 3.263 10 0 GGAEHN CN(C(=O)/C=C/c1cc2ccccc2o1)C1CCN(CCn2cccn2)CC1 ZINC000109292334 1411734121 /nfs/dbraw/zinc/73/41/21/1411734121.db2.gz AORPGOJAORYYPF-BQYQJAHWSA-N 0 3 378.476 3.266 10 0 GGAEHN O=C1[C@H](NCc2ccc(-n3cnc4ccccc43)cc2)CCN1CC(F)(F)F ZINC000112101202 1412075909 /nfs/dbraw/zinc/07/59/09/1412075909.db2.gz AFTNJYOLYGNLNL-QGZVFWFLSA-N 0 3 388.393 3.278 10 0 GGAEHN C[C@H](CNC(=O)[C@H]1CCCC[C@@H]1C(=O)N1CCCC1)N(C)Cc1ccccc1 ZINC000112297555 1412126189 /nfs/dbraw/zinc/12/61/89/1412126189.db2.gz HXUZXMRCPAKTAO-GIVPXCGWSA-N 0 3 385.552 3.052 10 0 GGAEHN CCCNC(=O)CN1CCC(NCc2c(Cl)cccc2OC(F)F)CC1 ZINC000112709690 1412200903 /nfs/dbraw/zinc/20/09/03/1412200903.db2.gz IDPSIDOMVGZWME-UHFFFAOYSA-N 0 3 389.874 3.022 10 0 GGAEHN CCc1cc(N2CCC[C@@H](NCc3ccc(OC)cc3OC(F)F)C2)ncn1 ZINC000114766498 1412520905 /nfs/dbraw/zinc/52/09/05/1412520905.db2.gz GDDSOHHKPCZXNO-MRXNPFEDSA-N 0 3 392.450 3.408 10 0 GGAEHN COc1ccc(CNC[C@H]2CN(Cc3ccccc3)CCO2)c(OC(F)F)c1 ZINC000114758312 1412521112 /nfs/dbraw/zinc/52/11/12/1412521112.db2.gz GJLJOMZTHGWXEZ-IBGZPJMESA-N 0 3 392.446 3.287 10 0 GGAEHN COc1cccc([C@@H](O)CN2CCC(c3nc(-c4ccccn4)no3)CC2)c1 ZINC000115540635 1412703923 /nfs/dbraw/zinc/70/39/23/1412703923.db2.gz CAXMZRLTMMPRFO-IBGZPJMESA-N 0 3 380.448 3.053 10 0 GGAEHN CN(C)[C@@H](CNCc1ccccc1N1CCOCC1)c1c(F)cccc1F ZINC000115623581 1412736719 /nfs/dbraw/zinc/73/67/19/1412736719.db2.gz BIGYGXDVIWHZTI-FQEVSTJZSA-N 0 3 375.463 3.194 10 0 GGAEHN CN(C)C[C@@H]1CN(C(=O)NCC(C)(C)c2ccc(Cl)c(Cl)c2)CCO1 ZINC000117041354 1412985274 /nfs/dbraw/zinc/98/52/74/1412985274.db2.gz QLIANVULBTZWJG-CQSZACIVSA-N 0 3 388.339 3.243 10 0 GGAEHN COc1cc(OC)cc([C@H](O)CNCc2cc(Br)ccc2F)c1 ZINC000118451309 1413162100 /nfs/dbraw/zinc/16/21/00/1413162100.db2.gz HTRSCGZQBAXYEC-QGZVFWFLSA-N 0 3 384.245 3.429 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)N3CCO[C@H](c4ccccc4)C3)cc2)CC1 ZINC000118766208 1413217062 /nfs/dbraw/zinc/21/70/62/1413217062.db2.gz UWSYXSRGHKGCIH-QFIPXVFZSA-N 0 3 379.504 3.042 10 0 GGAEHN CN1CCN(c2cc(CNCc3ccc(-c4ccncc4)cc3F)ccn2)CC1 ZINC000119143815 1413354226 /nfs/dbraw/zinc/35/42/26/1413354226.db2.gz ASGWLWBPXFFWCW-UHFFFAOYSA-N 0 3 391.494 3.324 10 0 GGAEHN CCC(CC)(CNCC(=O)Nc1cc(C2CC2)nn1-c1ccccc1)C(=O)OC ZINC000120696023 1413877246 /nfs/dbraw/zinc/87/72/46/1413877246.db2.gz CJODTKAXHBPMRE-UHFFFAOYSA-N 0 3 398.507 3.257 10 0 GGAEHN CCN1CCN(Cc2ccc(NCc3c[nH]nc3-c3cccnc3)cc2)CC1 ZINC000121086109 1414002003 /nfs/dbraw/zinc/00/20/03/1414002003.db2.gz DMMGOEUSXCIXRV-UHFFFAOYSA-N 0 3 376.508 3.221 10 0 GGAEHN COc1ccccc1CN(CCO)C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000122207868 1414388290 /nfs/dbraw/zinc/38/82/90/1414388290.db2.gz FQSOYMCYVPNTBB-NRFANRHFSA-N 0 3 397.519 3.036 10 0 GGAEHN C[C@H](NCc1cc2c(c(Br)c1)OCO2)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000123091480 1414638973 /nfs/dbraw/zinc/63/89/73/1414638973.db2.gz IDFXSTJPCDXZIT-VIFPVBQESA-N 0 3 390.237 3.198 10 0 GGAEHN CC(C)N1CCN(c2ccc(C(=O)N3CC[C@@H](C)[C@H](n4ccnc4)C3)cc2)CC1 ZINC000123407732 1414720670 /nfs/dbraw/zinc/72/06/70/1414720670.db2.gz CTDPOZHFPCWLHQ-DENIHFKCSA-N 0 3 395.551 3.137 10 0 GGAEHN CC(C)N1CCN(c2ccc(C(=O)N3CC[C@H](C)[C@H](n4ccnc4)C3)cc2)CC1 ZINC000123407978 1414720733 /nfs/dbraw/zinc/72/07/33/1414720733.db2.gz CTDPOZHFPCWLHQ-SIKLNZKXSA-N 0 3 395.551 3.137 10 0 GGAEHN O=c1[nH]c2ccccc2cc1CNC[C@@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000123444289 1414733618 /nfs/dbraw/zinc/73/36/18/1414733618.db2.gz CUIHFVXJZRVQMH-MRXNPFEDSA-N 0 3 392.377 3.489 10 0 GGAEHN C[C@@H](NC(=O)[C@H](C)N1CCN(C2CCOCC2)CC1)c1cccc2ccccc21 ZINC000177746210 1428848991 /nfs/dbraw/zinc/84/89/91/1428848991.db2.gz BWOBULZMYWXMMV-MOPGFXCFSA-N 0 3 395.547 3.202 10 0 GGAEHN CCc1ccc([C@H]2CCCCN2CCOc2ccc(S(N)(=O)=O)cc2)o1 ZINC000124815683 1415050959 /nfs/dbraw/zinc/05/09/59/1415050959.db2.gz HUWPZKQMTSIEHR-GOSISDBHSA-N 0 3 378.494 3.095 10 0 GGAEHN CC(C)(CNC(=O)N1CC[C@H](Oc2cccnc2)C1)N1CCc2ccccc2C1 ZINC000177914866 1428890672 /nfs/dbraw/zinc/89/06/72/1428890672.db2.gz BRDLJZJDILYQII-NRFANRHFSA-N 0 3 394.519 3.081 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN[C@@H](C)CO[C@H]1CCOC1 ZINC000126515350 1415475377 /nfs/dbraw/zinc/47/53/77/1415475377.db2.gz FSLDJWLRPBPCTG-UGSOOPFHSA-N 0 3 394.313 3.227 10 0 GGAEHN COc1cc(CN2CCC(N3CCNC3=O)CC2)c(-c2ccccc2)cc1OC ZINC000127622161 1415821331 /nfs/dbraw/zinc/82/13/31/1415821331.db2.gz GQPJWUTUEMASOG-UHFFFAOYSA-N 0 3 395.503 3.360 10 0 GGAEHN COc1ccccc1CN(CCO)C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000128453304 1415990336 /nfs/dbraw/zinc/99/03/36/1415990336.db2.gz HFIRXWUZOFPENP-NRFANRHFSA-N 0 3 397.519 3.036 10 0 GGAEHN Cc1cccc(OC[C@H](O)CN2CCC(C(=O)N3CCc4ccccc43)CC2)c1 ZINC000129433607 1416208692 /nfs/dbraw/zinc/20/86/92/1416208692.db2.gz IPJNNJFQYYQJBN-OAQYLSRUSA-N 0 3 394.515 3.036 10 0 GGAEHN COC(=O)c1ccc(OCCN2CC[C@@H](C)[C@@H](n3ccnc3)C2)c(Cl)c1 ZINC000129837862 1416271724 /nfs/dbraw/zinc/27/17/24/1416271724.db2.gz GSYSBSUEBLWKAB-PBHICJAKSA-N 0 3 377.872 3.285 10 0 GGAEHN COc1ccccc1CC1CCN(Cc2c(C)nn(C)c2N2CCOCC2)CC1 ZINC000130451980 1416380570 /nfs/dbraw/zinc/38/05/70/1416380570.db2.gz FMMOMMUIHLCSNC-UHFFFAOYSA-N 0 3 398.551 3.028 10 0 GGAEHN C[C@@H](Cc1ccc(Cl)cc1)N(C)C(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000130509170 1416391099 /nfs/dbraw/zinc/39/10/99/1416391099.db2.gz GRSUXCFJXPSUKL-HNNXBMFYSA-N 0 3 387.911 3.430 10 0 GGAEHN C[C@H](Cc1ccc(Cl)cc1)N(C)C(=O)C(=O)Nc1cccc(CN(C)C)c1 ZINC000130509396 1416391280 /nfs/dbraw/zinc/39/12/80/1416391280.db2.gz GRSUXCFJXPSUKL-OAHLLOKOSA-N 0 3 387.911 3.430 10 0 GGAEHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@@H](C)N(C)CCCn1ccnc1C ZINC000130771494 1416446581 /nfs/dbraw/zinc/44/65/81/1416446581.db2.gz HJTNAZRFPAPZGO-GOSISDBHSA-N 0 3 394.523 3.343 10 0 GGAEHN CC(C)Cc1ccc([C@H](C)C(=O)NCCCN2CCC[C@@H]2C(=O)N(C)C)cc1 ZINC000130779162 1416448617 /nfs/dbraw/zinc/44/86/17/1416448617.db2.gz HSKKAKBPCUGDQH-GHTZIAJQSA-N 0 3 387.568 3.048 10 0 GGAEHN O=C(OCCC(F)(F)F)C1CCN(c2ccccc2Br)C1=O ZINC000130937181 1416484402 /nfs/dbraw/zinc/48/44/02/1416484402.db2.gz GONQACXHVKUSNI-VIFPVBQESA-N 0 3 380.160 3.298 10 0 GGAEHN C[C@H](N[C@@H]1CCCC[C@@H]1C(N)=O)C(=O)Nc1ccccc1Cc1ccccc1 ZINC000131239213 1416527886 /nfs/dbraw/zinc/52/78/86/1416527886.db2.gz BQVVCGWGOAFKAC-NBHGPNQESA-N 0 3 379.504 3.238 10 0 GGAEHN O=C(Nc1ccc(CNCc2c[nH]nc2-c2cccnc2)cc1)c1cccnc1 ZINC000131491873 1416566285 /nfs/dbraw/zinc/56/62/85/1416566285.db2.gz HUWMETFJTWBPTA-UHFFFAOYSA-N 0 3 384.443 3.409 10 0 GGAEHN CN1CCN(c2ncc(CN[C@@H](c3ccc(F)cc3F)C(C)(C)C)cn2)CC1 ZINC000134410925 1417066774 /nfs/dbraw/zinc/06/67/74/1417066774.db2.gz FBCVABATMAOLEQ-IBGZPJMESA-N 0 3 389.494 3.384 10 0 GGAEHN O=C(C1CCCC1)N1CC[C@H](NCc2cc3c(c(Br)c2)OCO3)C1 ZINC000134560470 1417086896 /nfs/dbraw/zinc/08/68/96/1417086896.db2.gz BJXNOVREEBDSQG-AWEZNQCLSA-N 0 3 395.297 3.059 10 0 GGAEHN CC(C)Sc1ccccc1NC(=O)NCCCN1CCC[C@H]1C(=O)N(C)C ZINC000135376019 1417212761 /nfs/dbraw/zinc/21/27/61/1417212761.db2.gz FMLSNHRCYDOPOC-KRWDZBQOSA-N 0 3 392.569 3.251 10 0 GGAEHN Clc1nc2ccccn2c1CNC[C@H](c1cccs1)N1CCOCC1 ZINC000139263598 1417454681 /nfs/dbraw/zinc/45/46/81/1417454681.db2.gz HJUFLYNCKWZZIZ-CQSZACIVSA-N 0 3 376.913 3.212 10 0 GGAEHN CCCn1nc(C)c(CNC[C@H](O)c2cc(Cl)c3c(c2)OCCO3)c1C ZINC000150970436 1417845962 /nfs/dbraw/zinc/84/59/62/1417845962.db2.gz ALYNPXJHJQWYQG-KRWDZBQOSA-N 0 3 379.888 3.158 10 0 GGAEHN COc1cc(OC)c(OC)cc1CN[C@@H]1CCN(c2ncccc2Cl)C1 ZINC000151222878 1417896838 /nfs/dbraw/zinc/89/68/38/1417896838.db2.gz BNWLASUPZDHJTG-CQSZACIVSA-N 0 3 377.872 3.129 10 0 GGAEHN Fc1ccc([C@H](CNCc2ncccc2C(F)(F)F)N2CCOCC2)cc1 ZINC000152026512 1418124240 /nfs/dbraw/zinc/12/42/40/1418124240.db2.gz FHYJKTPSUJGMEL-SFHVURJKSA-N 0 3 383.389 3.403 10 0 GGAEHN O=C(CN1CCC(NCc2ncccc2C(F)(F)F)CC1)Nc1ccccc1 ZINC000152106048 1418146992 /nfs/dbraw/zinc/14/69/92/1418146992.db2.gz GICYZSLOQCFPDS-UHFFFAOYSA-N 0 3 392.425 3.293 10 0 GGAEHN C[C@H]1CCc2nc(CNCc3ccc(CN4CCN(C)CC4)cc3)sc2C1 ZINC000152214586 1418175744 /nfs/dbraw/zinc/17/57/44/1418175744.db2.gz BJULRMDFTIJNIU-KRWDZBQOSA-N 0 3 384.593 3.305 10 0 GGAEHN Fc1cccc([C@H](CNCc2ncccc2C(F)(F)F)N2CCOCC2)c1 ZINC000152367113 1422084719 /nfs/dbraw/zinc/08/47/19/1422084719.db2.gz GFPMUKYJZSDOST-SFHVURJKSA-N 0 3 383.389 3.403 10 0 GGAEHN O[C@H](CNCc1cnn(Cc2ccccc2)c1)c1cc(Cl)c2c(c1)OCCO2 ZINC000152969796 1422311845 /nfs/dbraw/zinc/31/18/45/1422311845.db2.gz HHPIJKQAWZOXJX-LJQANCHMSA-N 0 3 399.878 3.179 10 0 GGAEHN O=C(CCc1ccccc1)N1CC[C@H](NCc2cc3ccccc3[nH]c2=O)C1 ZINC000154024484 1422827499 /nfs/dbraw/zinc/82/74/99/1422827499.db2.gz FGIVEWBCTHKEFB-FQEVSTJZSA-N 0 3 375.472 3.264 10 0 GGAEHN CN(CC(=O)N[C@H](c1cccs1)c1ccc(F)cc1)CC1CCOCC1 ZINC000155898419 1423584233 /nfs/dbraw/zinc/58/42/33/1423584233.db2.gz DJPOLCMFEXDAGN-FQEVSTJZSA-N 0 3 376.497 3.451 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)N[C@@H]3CCO[C@@H](c4ccccc4)C3)cc2)CC1 ZINC000158486988 1424269580 /nfs/dbraw/zinc/26/95/80/1424269580.db2.gz ZLZTXTCKTGHASJ-FYYLOGMGSA-N 0 3 393.531 3.479 10 0 GGAEHN O=C(NC[C@H]1CCCO1)c1cccc(CNCc2ccc(-n3ccnc3)cc2)c1 ZINC000166067062 1425205651 /nfs/dbraw/zinc/20/56/51/1425205651.db2.gz ABBHYLDKOGGCHG-JOCHJYFZSA-N 0 3 390.487 3.071 10 0 GGAEHN Cc1ncsc1CN1CCC2(CC1)C[C@@H](CC(=O)N1CCCC1)CCO2 ZINC000169774172 1425252575 /nfs/dbraw/zinc/25/25/75/1425252575.db2.gz BDKGUHDKRWUNOX-QGZVFWFLSA-N 0 3 377.554 3.225 10 0 GGAEHN COc1ccc(CN2CC[C@@H](C3CCN(C(C)=O)CC3)C2)c(Cl)c1OC ZINC000169781517 1425255615 /nfs/dbraw/zinc/25/56/15/1425255615.db2.gz YPQKPFUSZVVLHD-MRXNPFEDSA-N 0 3 380.916 3.438 10 0 GGAEHN COC[C@@H]1CN(C(C)=O)CC12CCN(Cc1ccccc1C(F)(F)F)CC2 ZINC000169782737 1425256109 /nfs/dbraw/zinc/25/61/09/1425256109.db2.gz WQJMMWXVPZNINR-KRWDZBQOSA-N 0 3 384.442 3.412 10 0 GGAEHN CNC(=O)N1CCC([C@@H]2CCN(Cc3ccc(OC)c(OC)c3Cl)C2)CC1 ZINC000169781629 1425256192 /nfs/dbraw/zinc/25/61/92/1425256192.db2.gz LYWAGXGASWIEBC-OAHLLOKOSA-N 0 3 395.931 3.231 10 0 GGAEHN COc1ccc(OC[C@@H](O)CNC2(c3ccc(Br)cc3)CC2)cc1 ZINC000170871906 1425375764 /nfs/dbraw/zinc/37/57/64/1425375764.db2.gz KFKXFFFHTZVLSA-INIZCTEOSA-N 0 3 392.293 3.476 10 0 GGAEHN Cc1cccc(NC[C@@H]2CCN(CC(=O)N[C@@H](c3ccccc3)C3CC3)C2)n1 ZINC000171650263 1425772955 /nfs/dbraw/zinc/77/29/55/1425772955.db2.gz XMAJWYWMJLFZPP-MBSDFSHPSA-N 0 3 378.520 3.391 10 0 GGAEHN Cc1cccc(NC[C@H]2CCN(CC(=O)N[C@@H](c3ccccc3)C3CC3)C2)n1 ZINC000171650269 1425772987 /nfs/dbraw/zinc/77/29/87/1425772987.db2.gz XMAJWYWMJLFZPP-JPYJTQIMSA-N 0 3 378.520 3.391 10 0 GGAEHN CN(C(=O)/C=C/c1cn(C)c2ccccc12)C1CCN(CCn2cccn2)CC1 ZINC000173279634 1426456639 /nfs/dbraw/zinc/45/66/39/1426456639.db2.gz FTIJWVXMLXECKV-CMDGGOBGSA-N 0 3 391.519 3.011 10 0 GGAEHN COc1cccc(CNC(=O)[C@H](C)N[C@H](C)c2ccc(-n3cccn3)cc2)c1 ZINC000174368769 1427124193 /nfs/dbraw/zinc/12/41/93/1427124193.db2.gz GPKLCWUEVNEDFN-SJORKVTESA-N 0 3 378.476 3.236 10 0 GGAEHN C[C@@H](N[C@@H](C)C(=O)NCCc1ccc(F)cc1)c1ccc(-n2cccn2)cc1 ZINC000174373330 1427126141 /nfs/dbraw/zinc/12/61/41/1427126141.db2.gz DKLQKSOWLJWJDS-SJORKVTESA-N 0 3 380.467 3.409 10 0 GGAEHN Cc1cc(NC(=O)N2CCN([C@@H]3C[C@H]4CC[C@@H]3C4)CC2)ccc1C(=O)N(C)C ZINC000175410194 1427739265 /nfs/dbraw/zinc/73/92/65/1427739265.db2.gz BWYLYLDGQLLSIV-SQGPQFPESA-N 0 3 384.524 3.035 10 0 GGAEHN O[C@H](COCc1ccccc1)CN1CCC(Oc2ccc(F)cc2F)CC1 ZINC000175713032 1427867403 /nfs/dbraw/zinc/86/74/03/1427867403.db2.gz JDZFIGZBEOPBMO-SFHVURJKSA-N 0 3 377.431 3.386 10 0 GGAEHN C[C@@H](NC(=O)NCCN(C)Cc1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000175816411 1427908478 /nfs/dbraw/zinc/90/84/78/1427908478.db2.gz CWVXILXZYBESKJ-GOSISDBHSA-N 0 3 377.492 3.365 10 0 GGAEHN COc1cccc(CS(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c1 ZINC000175844139 1427926149 /nfs/dbraw/zinc/92/61/49/1427926149.db2.gz NNJYGGLEKWXHOY-FXAWDEMLSA-N 0 3 388.533 3.168 10 0 GGAEHN C[C@@H](NCC(=O)N(C)CCOc1ccccc1F)c1ccc(-n2cccn2)cc1 ZINC000180843502 1430066436 /nfs/dbraw/zinc/06/64/36/1430066436.db2.gz HTCHOHQGQXFTIT-QGZVFWFLSA-N 0 3 396.466 3.199 10 0 GGAEHN C[C@@H](NCCn1c(=O)oc2cccnc21)c1ccc(OCC(F)(F)F)cc1 ZINC000180949293 1430130540 /nfs/dbraw/zinc/13/05/40/1430130540.db2.gz RESDKXNWMSIRPB-GFCCVEGCSA-N 0 3 381.354 3.281 10 0 GGAEHN CC(=O)c1oc2ccccc2c1NC(=O)[C@@H](C)N[C@@H](CC(N)=O)C1CCCCC1 ZINC000182077413 1430406911 /nfs/dbraw/zinc/40/69/11/1430406911.db2.gz ICJQLXRHNDUZOK-DYVFJYSZSA-N 0 3 399.491 3.376 10 0 GGAEHN Cc1ccc(Cl)c(OC[C@H](O)CN[C@@H](C)c2ccc(S(C)(=O)=O)cc2)c1 ZINC000182674468 1430514498 /nfs/dbraw/zinc/51/44/98/1430514498.db2.gz DHXKXEASNRKUQB-GOEBONIOSA-N 0 3 397.924 3.142 10 0 GGAEHN Cc1cnc(C(C)(C)N[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)s1 ZINC000183921948 1430813629 /nfs/dbraw/zinc/81/36/29/1430813629.db2.gz CHQJBEISDTWZND-FUHWJXTLSA-N 0 3 386.565 3.055 10 0 GGAEHN CC(C)(C)OC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C[C@H](O)COCc1ccco1 ZINC000185945351 1431289865 /nfs/dbraw/zinc/28/98/65/1431289865.db2.gz AJFWVKJUCWOJJW-CAMMJAKZSA-N 0 3 379.497 3.132 10 0 GGAEHN COc1ccc(OC)c(CN2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)[C@H]3C2)c1 ZINC000186037273 1431316787 /nfs/dbraw/zinc/31/67/87/1431316787.db2.gz QWRTZHPYSCICAT-WBAXXEDZSA-N 0 3 376.497 3.439 10 0 GGAEHN COc1cc(S(=O)(=O)NCC2CCN(Cc3ccccc3)CC2)ccc1F ZINC000190564559 1432407808 /nfs/dbraw/zinc/40/78/08/1432407808.db2.gz TWCZPHUXIGWURY-UHFFFAOYSA-N 0 3 392.496 3.025 10 0 GGAEHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)/C=C/c2ccc3c(c2)CCO3)C1 ZINC000190576169 1432411639 /nfs/dbraw/zinc/41/16/39/1432411639.db2.gz IFZKSZATRGUXIK-CYXJOQHWSA-N 0 3 377.488 3.010 10 0 GGAEHN CN(Cc1cccnc1)C[C@H]1CCN(C(=O)c2ccc(N3CCCC3)c(F)c2)C1 ZINC000190654480 1432431872 /nfs/dbraw/zinc/43/18/72/1432431872.db2.gz BOBXRYJODZDFTJ-LJQANCHMSA-N 0 3 396.510 3.415 10 0 GGAEHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)c2ccc(N3CCCC3)c(F)c2)C1 ZINC000190654457 1432432400 /nfs/dbraw/zinc/43/24/00/1432432400.db2.gz BOBXRYJODZDFTJ-IBGZPJMESA-N 0 3 396.510 3.415 10 0 GGAEHN CCc1nc(C2CCN(CC(=O)N(C)[C@H](C)c3ccc(F)c(F)c3)CC2)n[nH]1 ZINC000190665667 1432436969 /nfs/dbraw/zinc/43/69/69/1432436969.db2.gz IOQUXOHHJOPBBT-CYBMUJFWSA-N 0 3 391.466 3.044 10 0 GGAEHN CCc1n[nH]c(C2CCN(CC(=O)N(C)[C@H](C)c3ccc(F)c(F)c3)CC2)n1 ZINC000190665667 1432436979 /nfs/dbraw/zinc/43/69/79/1432436979.db2.gz IOQUXOHHJOPBBT-CYBMUJFWSA-N 0 3 391.466 3.044 10 0 GGAEHN CCc1nnc(C2CCN(CC(=O)N(C)[C@H](C)c3ccc(F)c(F)c3)CC2)[nH]1 ZINC000190665667 1432436987 /nfs/dbraw/zinc/43/69/87/1432436987.db2.gz IOQUXOHHJOPBBT-CYBMUJFWSA-N 0 3 391.466 3.044 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)NCc2cc(F)cc(F)c2)C1 ZINC000190690078 1432443878 /nfs/dbraw/zinc/44/38/78/1432443878.db2.gz CHBBJZOISOJYHS-AWEZNQCLSA-N 0 3 394.491 3.393 10 0 GGAEHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)N[C@@H]1C[C@@H]1c1cccc(F)c1 ZINC000192362882 1432837261 /nfs/dbraw/zinc/83/72/61/1432837261.db2.gz DMMJVWQFNWINNW-YPAWHYETSA-N 0 3 397.494 3.272 10 0 GGAEHN CNC(=O)c1cccc(NC(=O)[C@@H](C)N[C@H](C[C@@H]2CCOC2)c2ccccc2)c1 ZINC000192741862 1432883241 /nfs/dbraw/zinc/88/32/41/1432883241.db2.gz FECYZXSBTISHHP-LLGFUMIMSA-N 0 3 395.503 3.131 10 0 GGAEHN COc1ccc(OC[C@@H](O)CN2CCC(Oc3ccc(F)cc3F)CC2)cc1 ZINC000193671206 1433037764 /nfs/dbraw/zinc/03/77/64/1433037764.db2.gz ZDSQFKZLYJTMRF-INIZCTEOSA-N 0 3 393.430 3.257 10 0 GGAEHN CC(C)(C)OC(=O)N1CCC2(CCN2C[C@@H](O)COc2ccc(F)cc2)CC1 ZINC000193751821 1433052124 /nfs/dbraw/zinc/05/21/24/1433052124.db2.gz YKZFABLEINQESU-QGZVFWFLSA-N 0 3 394.487 3.041 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)[C@H]1CCCCC(=O)N1)c1ccc(C(F)(F)F)cc1 ZINC000193921884 1433085048 /nfs/dbraw/zinc/08/50/48/1433085048.db2.gz HKBAEDFNCQRKGG-SJORKVTESA-N 0 3 399.457 3.263 10 0 GGAEHN COc1cccc2c1CCC[C@H]2NCc1cccc(N2CCCS2(=O)=O)c1 ZINC000194960336 1433272751 /nfs/dbraw/zinc/27/27/51/1433272751.db2.gz IBSCFGXKTMQEBT-HXUWFJFHSA-N 0 3 386.517 3.402 10 0 GGAEHN CCCN(CC)CCNS(=O)(=O)c1ccc(Br)cc1Cl ZINC000218906835 1433365150 /nfs/dbraw/zinc/36/51/50/1433365150.db2.gz BDMXZTZQPSLBMT-UHFFFAOYSA-N 0 3 383.739 3.113 10 0 GGAEHN CCOc1c(Cl)cc(CNC[C@@H](O)COc2ccc(F)cc2)cc1OC ZINC000236845875 1433380945 /nfs/dbraw/zinc/38/09/45/1433380945.db2.gz BGFHQKNXKBWMDH-OAHLLOKOSA-N 0 3 383.847 3.416 10 0 GGAEHN Cc1nn(C)c(OCC(F)(F)F)c1CNC[C@H](c1cccc(F)c1)N(C)C ZINC000237006945 1433385648 /nfs/dbraw/zinc/38/56/48/1433385648.db2.gz AOSNDSKYFGEUCR-MRXNPFEDSA-N 0 3 388.409 3.201 10 0 GGAEHN CN1CCN(Cc2cccc(NCc3cc(Cl)c4c(c3)OCCO4)c2)CC1 ZINC000237093980 1433388644 /nfs/dbraw/zinc/38/86/44/1433388644.db2.gz HFQFPYSAAUWHGK-UHFFFAOYSA-N 0 3 387.911 3.471 10 0 GGAEHN COc1ccccc1[C@H](CNC(=O)[C@@H]1Cc2ccccc2CN1)N1CCCCC1 ZINC000237259631 1433394693 /nfs/dbraw/zinc/39/46/93/1433394693.db2.gz GOGRHACESMCQAL-VXKWHMMOSA-N 0 3 393.531 3.053 10 0 GGAEHN COc1ccc([C@H](CNC(=O)[C@@H]2Cc3ccccc3CN2)N2CCCCC2)cc1 ZINC000237351668 1433398399 /nfs/dbraw/zinc/39/83/99/1433398399.db2.gz CEXNWWCOMMSGCJ-GOTSBHOMSA-N 0 3 393.531 3.053 10 0 GGAEHN COc1cc2c(c(CNC[C@@H](c3cccc(C)c3)N3CCOCC3)c1)O[C@@H](C)C2 ZINC000237402246 1433400683 /nfs/dbraw/zinc/40/06/83/1433400683.db2.gz HMKCLKMKTHEDCV-MBSDFSHPSA-N 0 3 396.531 3.490 10 0 GGAEHN COc1cc2c(c(CNC[C@H](c3cccc(C)c3)N3CCOCC3)c1)O[C@@H](C)C2 ZINC000237400255 1433400766 /nfs/dbraw/zinc/40/07/66/1433400766.db2.gz HMKCLKMKTHEDCV-FDDCHVKYSA-N 0 3 396.531 3.490 10 0 GGAEHN Cc1cccc(NC[C@H]2CCN(CC(=O)N[C@H](c3ccccc3)C3CC3)C2)n1 ZINC000246200547 1433581200 /nfs/dbraw/zinc/58/12/00/1433581200.db2.gz XMAJWYWMJLFZPP-WZONZLPQSA-N 0 3 378.520 3.391 10 0 GGAEHN COc1cccc(CN2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)[C@@H]3C2)c1OC ZINC000248588270 1433810003 /nfs/dbraw/zinc/81/00/03/1433810003.db2.gz GQRIOBMWLZOXPG-UAGQMJEPSA-N 0 3 376.497 3.439 10 0 GGAEHN CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(C[C@H](O)c3ccc(F)c(F)c3)C[C@@H]12 ZINC000248593602 1433810251 /nfs/dbraw/zinc/81/02/51/1433810251.db2.gz LSTMNBJZYBNANX-DTDBQYNISA-N 0 3 382.451 3.233 10 0 GGAEHN C[C@H](N[C@@H]1CCCC[C@H]1C(N)=O)C(=O)Nc1ccccc1Cc1ccccc1 ZINC000249085752 1433834499 /nfs/dbraw/zinc/83/44/99/1433834499.db2.gz BQVVCGWGOAFKAC-LDQXTDLNSA-N 0 3 379.504 3.238 10 0 GGAEHN C[C@H](N[C@@H](C)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1nnc2n1CCCC2 ZINC000253370850 1433866309 /nfs/dbraw/zinc/86/63/09/1433866309.db2.gz XFTRBDDRZMLNDR-JYJNAYRXSA-N 0 3 377.533 3.301 10 0 GGAEHN C[C@@H](N[C@@H](C)c1nnc2n1CCCC2)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000253370851 1433866407 /nfs/dbraw/zinc/86/64/07/1433866407.db2.gz XFTRBDDRZMLNDR-PMPSAXMXSA-N 0 3 377.533 3.301 10 0 GGAEHN C[C@H](NC(=O)/C=C\c1ccccc1)C(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000254871647 1433872301 /nfs/dbraw/zinc/87/23/01/1433872301.db2.gz CZEZYUOAKSKIBY-UMZMSADGSA-N 0 3 397.544 3.219 10 0 GGAEHN Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3ccncc3)CCC(=O)NCC2)cc1 ZINC000257175707 1433893368 /nfs/dbraw/zinc/89/33/68/1433893368.db2.gz BKIOVUPDTJLHMP-HXUWFJFHSA-N 0 3 394.519 3.137 10 0 GGAEHN CCOc1ccc(-c2n[nH]cc2CN2CCC3(CC2)C[C@@](C)(O)CCO3)cc1 ZINC000257175460 1433893389 /nfs/dbraw/zinc/89/33/89/1433893389.db2.gz PFRDCXYIKVEVPR-NRFANRHFSA-N 0 3 385.508 3.371 10 0 GGAEHN COCCO[C@@H]1CN(C2CCN(C(=O)NC(C)(C)C)CC2)C12CCCCC2 ZINC000257182695 1433893969 /nfs/dbraw/zinc/89/39/69/1433893969.db2.gz PXEWOAAZJZHGFT-GOSISDBHSA-N 0 3 381.561 3.009 10 0 GGAEHN Cc1ccc(CN2CCC[C@@H](C(=O)NCc3ccccc3)CCNC(=O)CC2)o1 ZINC000257184872 1433894152 /nfs/dbraw/zinc/89/41/52/1433894152.db2.gz VMSZNKBOXSHUMB-HXUWFJFHSA-N 0 3 397.519 3.013 10 0 GGAEHN CC(C)Oc1ccccc1CN1CCC2(CC[C@H](CN3CCOCC3)O2)CC1 ZINC000257189468 1433894343 /nfs/dbraw/zinc/89/43/43/1433894343.db2.gz IYHRHHJWEOGOBL-OAQYLSRUSA-N 0 3 388.552 3.320 10 0 GGAEHN Cc1ccc(-c2nc(CC(=O)Nc3ccc(=O)n(CCN(C)C)c3)cs2)cc1 ZINC000270064416 1434698743 /nfs/dbraw/zinc/69/87/43/1434698743.db2.gz FVEKFDXQVSCEDL-UHFFFAOYSA-N 0 3 396.516 3.023 10 0 GGAEHN CC[C@H](N[C@@H](C)C(=O)Nc1cccc(NC(C)=O)c1)c1ccc2c(c1)OCCO2 ZINC000271635830 1434840681 /nfs/dbraw/zinc/84/06/81/1434840681.db2.gz FEHKWPZCTDDSEH-LIRRHRJNSA-N 0 3 397.475 3.484 10 0 GGAEHN CN(C)Cc1ccc(-c2noc([C@H]3CCS(=O)(=O)c4ccccc43)n2)cc1 ZINC000283802878 1435926477 /nfs/dbraw/zinc/92/64/77/1435926477.db2.gz HYKCPLARGXJXDI-KRWDZBQOSA-N 0 3 383.473 3.108 10 0 GGAEHN COC(=O)c1ccc(-c2ccc(CNC3(CO)Cc4ccccc4C3)o2)cc1 ZINC000482224162 1126095014 /nfs/dbraw/zinc/09/50/14/1126095014.db2.gz PHVOSASJUGPUCI-UHFFFAOYSA-N 0 3 377.440 3.353 10 0 GGAEHN COc1ccccc1C[C@@](C)(CO)NCc1cnc(-c2ccccc2OC)nc1 ZINC000631235804 1126101796 /nfs/dbraw/zinc/10/17/96/1126101796.db2.gz SJRJHMINBIBIBX-QHCPKHFHSA-N 0 3 393.487 3.244 10 0 GGAEHN COc1ccccc1-c1ncc(CN[C@](C)(CO)Cc2ccc(F)cc2)cn1 ZINC000631236700 1126102056 /nfs/dbraw/zinc/10/20/56/1126102056.db2.gz HZRYAOYMKHVAFF-QFIPXVFZSA-N 0 3 381.451 3.375 10 0 GGAEHN OC[C@]1(NCc2cnc(-c3ccccn3)s2)CCCN(Cc2ccccc2)C1 ZINC000674675882 1126105048 /nfs/dbraw/zinc/10/50/48/1126105048.db2.gz KPDZGWJCOOJQKI-QFIPXVFZSA-N 0 3 394.544 3.322 10 0 GGAEHN OC[C@@]1(NCc2cnc(-c3ccccn3)s2)CCCN(Cc2ccccc2)C1 ZINC000674675881 1126105196 /nfs/dbraw/zinc/10/51/96/1126105196.db2.gz KPDZGWJCOOJQKI-JOCHJYFZSA-N 0 3 394.544 3.322 10 0 GGAEHN OC[C@]1(NCc2cnc([C@@H]3CCCO3)s2)CCCN(Cc2ccccc2)C1 ZINC000677322550 1126105329 /nfs/dbraw/zinc/10/53/29/1126105329.db2.gz PTPHDKQCESSRBZ-FPOVZHCZSA-N 0 3 387.549 3.111 10 0 GGAEHN C[C@H](O)c1ncc(CN[C@@](C)(CO)Cc2ccc(Br)cc2)s1 ZINC000865714887 1126114668 /nfs/dbraw/zinc/11/46/68/1126114668.db2.gz FUKJNROBMGXHRG-MEDUHNTESA-N 0 3 385.327 3.042 10 0 GGAEHN Cc1nn(C)c2nc(Cl)c(CN[C@](C)(CO)Cc3ccc(F)cc3)cc12 ZINC000865715182 1126114861 /nfs/dbraw/zinc/11/48/61/1126114861.db2.gz LAZNOOZHRLQNMN-IBGZPJMESA-N 0 3 376.863 3.153 10 0 GGAEHN C[C@@](CO)(Cc1ccc(Br)cc1)NCc1cc2c(cc[nH]c2=O)o1 ZINC000865715154 1126114881 /nfs/dbraw/zinc/11/48/81/1126114881.db2.gz KKSZQHACRWVOEK-SFHVURJKSA-N 0 3 391.265 3.379 10 0 GGAEHN COc1ccccc1C[C@@](C)(CO)[NH2+]Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC001460698158 1126191945 /nfs/dbraw/zinc/19/19/45/1126191945.db2.gz PZRQIUOXEIVUBG-QFIPXVFZSA-N 0 3 393.443 3.174 10 0 GGAEHN C[C@@](CO)(Cc1ccc(Br)cc1)NCc1cc(CO)ccc1F ZINC001473840361 1126200790 /nfs/dbraw/zinc/20/07/90/1126200790.db2.gz WFHIRRLVVXGMEY-SFHVURJKSA-N 0 3 382.273 3.164 10 0 GGAEHN COc1ncc(Br)cc1CN[C@@](C)(CO)Cc1ccc(F)cc1 ZINC001620624657 1126241761 /nfs/dbraw/zinc/24/17/61/1126241761.db2.gz BOEKZADEBODRKG-QGZVFWFLSA-N 0 3 383.261 3.075 10 0 GGAEHN C[C@@](CO)(Cc1ccc(F)cc1)NCc1cn2cc(Br)ccc2n1 ZINC001654940743 1126254867 /nfs/dbraw/zinc/25/48/67/1126254867.db2.gz PTNNZESFLGEODW-SFHVURJKSA-N 0 3 392.272 3.319 10 0 GGAEHN Cn1c2ccccc2nc1CN[C@](C)(CO)Cc1ccc(Br)cc1 ZINC001660388547 1126264161 /nfs/dbraw/zinc/26/41/61/1126264161.db2.gz JJIMVLDLZCZPON-IBGZPJMESA-N 0 3 388.309 3.419 10 0 GGAEHN COC(=O)c1cc(CN[C@](C)(CO)Cc2ccc(Br)cc2)c(C)o1 ZINC001660389542 1126264460 /nfs/dbraw/zinc/26/44/60/1126264460.db2.gz OYGOEBHEADKIKP-SFHVURJKSA-N 0 3 396.281 3.220 10 0 GGAEHN CC(=O)N[C@H](CC(=O)NC[C@@H]1CCCN(Cc2cccs2)C1)c1ccccc1 ZINC000359996517 212130820 /nfs/dbraw/zinc/13/08/20/212130820.db2.gz RISQIIQEGABPIX-GHTZIAJQSA-N 0 3 399.560 3.344 10 0 GGAEHN CC(C)OC(=O)C1(C(=O)OC(C)C)CC(N[C@@H](C)[C@@H]2COc3ccccc32)C1 ZINC000359906095 212123846 /nfs/dbraw/zinc/12/38/46/212123846.db2.gz VVJMZHJZJZRIQZ-YJBOKZPZSA-N 0 3 389.492 3.193 10 0 GGAEHN CC(C)OC(=O)C1(C(=O)OC(C)C)CC(N[C@@H](C)[C@H]2COc3ccccc32)C1 ZINC000359906093 212123911 /nfs/dbraw/zinc/12/39/11/212123911.db2.gz VVJMZHJZJZRIQZ-MAUKXSAKSA-N 0 3 389.492 3.193 10 0 GGAEHN O=c1c2cc(Cl)ccc2nc(N2CCNCC2)n1Cc1cccc(Cl)c1 ZINC000040351904 212118789 /nfs/dbraw/zinc/11/87/89/212118789.db2.gz KRYKMAGFDVKJMD-UHFFFAOYSA-N 0 3 389.286 3.161 10 0 GGAEHN COc1ccc(CN[C@H]2CCCN(c3cccnn3)C2)cc1Br ZINC000109071228 212098879 /nfs/dbraw/zinc/09/88/79/212098879.db2.gz FQKBPSRVJHYEMK-AWEZNQCLSA-N 0 3 377.286 3.006 10 0 GGAEHN Cc1cc(NC(=O)[C@@H](NC[C@H]2CCO[C@@H]2c2ccccc2)c2ccccc2)no1 ZINC000328614521 212085743 /nfs/dbraw/zinc/08/57/43/212085743.db2.gz AHHMTAIXMYXXHS-BAGYTPMASA-N 0 3 391.471 3.452 10 0 GGAEHN O=C(NCCN1CCCCCC1)c1cnn(-c2ccccc2)c1-n1cccc1 ZINC000006807043 220964679 /nfs/dbraw/zinc/96/46/79/220964679.db2.gz LGJIHXSCEAYHLT-UHFFFAOYSA-N 0 3 377.492 3.269 10 0 GGAEHN CCOc1ccc(NC(=O)NC(=O)CN(C)C2CCCCC2)cc1OCC ZINC000007786478 221012217 /nfs/dbraw/zinc/01/22/17/221012217.db2.gz CTIJUJHAUZWUKZ-UHFFFAOYSA-N 0 3 377.485 3.397 10 0 GGAEHN Cc1cc(Br)ccc1NC(=O)CNC(=O)CN(C)C1CCCCC1 ZINC000007786469 221012462 /nfs/dbraw/zinc/01/24/62/221012462.db2.gz KNSLMUQOLLIJFP-UHFFFAOYSA-N 0 3 396.329 3.077 10 0 GGAEHN CN(C)C[C@H](NC(=O)C1CCN(C(=O)c2cccs2)CC1)c1ccccc1 ZINC000007818149 221013291 /nfs/dbraw/zinc/01/32/91/221013291.db2.gz NDRJJWMREYLRDL-SFHVURJKSA-N 0 3 385.533 3.019 10 0 GGAEHN CCOC(=O)c1cc(NC(=O)N(C(C)C)C2CCN(C)CC2)c(C)nc1C ZINC000008337986 221038302 /nfs/dbraw/zinc/03/83/02/221038302.db2.gz AKVCCLUEFBSCCD-UHFFFAOYSA-N 0 3 376.501 3.212 10 0 GGAEHN CN(C)[C@H](CNC(=O)c1ccc(NC(=O)c2ccco2)cc1)Cc1ccccc1 ZINC000008777358 221058030 /nfs/dbraw/zinc/05/80/30/221058030.db2.gz ATQSETBSHUUXOP-FQEVSTJZSA-N 0 3 391.471 3.435 10 0 GGAEHN CCn1nnc2cc(C(=O)N3c4ccc(C)cc4[C@@H]4CN(C)CC[C@@H]43)ccc21 ZINC000008745145 221054459 /nfs/dbraw/zinc/05/44/59/221054459.db2.gz IPAIELBNOFVNEU-PXNSSMCTSA-N 0 3 375.476 3.208 10 0 GGAEHN O=C(NCc1ccccc1CN1CCCCC1)c1ccc(-n2cncn2)cc1 ZINC000009217334 221073421 /nfs/dbraw/zinc/07/34/21/221073421.db2.gz NNVBPFKBGPXDKF-UHFFFAOYSA-N 0 3 375.476 3.183 10 0 GGAEHN CCOc1cc(CNCCOCCO)ccc1OCc1ccccc1Cl ZINC000010435671 221102732 /nfs/dbraw/zinc/10/27/32/221102732.db2.gz SMNKWKJSZPRSOS-UHFFFAOYSA-N 0 3 379.884 3.416 10 0 GGAEHN COc1cc(CNCCOCCO)cc(Cl)c1OCc1ccc(C)cc1 ZINC000010436362 221102890 /nfs/dbraw/zinc/10/28/90/221102890.db2.gz WAKTZLMOTSDHJK-UHFFFAOYSA-N 0 3 379.884 3.335 10 0 GGAEHN O=C(Cn1c(=O)oc2ccccc21)NCCCN(Cc1ccco1)C1CCCC1 ZINC000009688491 221090033 /nfs/dbraw/zinc/09/00/33/221090033.db2.gz XTKUBJNWJWOJJI-UHFFFAOYSA-N 0 3 397.475 3.139 10 0 GGAEHN CN(Cc1ccno1)Cc1ccc(OC[C@H](O)CN(C)Cc2ccccc2)cc1 ZINC000012313943 221179095 /nfs/dbraw/zinc/17/90/95/221179095.db2.gz SBNQLYAQDHGTJQ-OAQYLSRUSA-N 0 3 395.503 3.178 10 0 GGAEHN COc1cccc(CN2CCC[C@@]3(CCN(Cc4ccncc4)C3)C2=O)c1OC ZINC000012435538 221192890 /nfs/dbraw/zinc/19/28/90/221192890.db2.gz JHIVBUADAVVAPZ-QHCPKHFHSA-N 0 3 395.503 3.114 10 0 GGAEHN CCN1CCN(c2ccc(NC(=O)CN3CCC[C@@H](C(F)(F)F)C3)cc2)CC1 ZINC000012517064 221199854 /nfs/dbraw/zinc/19/98/54/221199854.db2.gz GAQMYXXCZHBJGH-MRXNPFEDSA-N 0 3 398.473 3.041 10 0 GGAEHN CC(C)[C@@H](NCC(=O)N1CCN(c2ccccn2)CC1)c1ccc(Cl)cc1 ZINC000012919196 221245563 /nfs/dbraw/zinc/24/55/63/221245563.db2.gz LVHMNEXNUQACNG-OAQYLSRUSA-N 0 3 386.927 3.371 10 0 GGAEHN COc1ccc(CN(CCCN2CCOCC2)Cc2ccncc2)c(C)c1C ZINC000013989996 221296087 /nfs/dbraw/zinc/29/60/87/221296087.db2.gz SSNUCHOFNZRPMA-UHFFFAOYSA-N 0 3 383.536 3.432 10 0 GGAEHN O[C@H](COc1ccccc1CN1CCCCC1)CN1CCc2ccccc2C1 ZINC000015073025 221331259 /nfs/dbraw/zinc/33/12/59/221331259.db2.gz OXATVEAULSWRBR-QHCPKHFHSA-N 0 3 380.532 3.471 10 0 GGAEHN Cc1oc2ncnc(N3CCCCC3)c2c1C(=O)NCCN1C[C@H](C)C[C@H](C)C1 ZINC000015727612 221341091 /nfs/dbraw/zinc/34/10/91/221341091.db2.gz BOFVIDYWLXDPJP-IYBDPMFKSA-N 0 3 399.539 3.229 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)C1=Cc2cc(Br)ccc2OC1 ZINC000015786379 221345731 /nfs/dbraw/zinc/34/57/31/221345731.db2.gz XXOUCPZILQGRMA-ZDUSSCGKSA-N 0 3 379.298 3.216 10 0 GGAEHN Cc1nn(-c2ccc(C)cc2C)nc1C(=O)NCc1ccc(CN(C)C)cc1 ZINC000016102299 221357621 /nfs/dbraw/zinc/35/76/21/221357621.db2.gz MVZSXPZJEDUEPL-UHFFFAOYSA-N 0 3 377.492 3.184 10 0 GGAEHN COc1cc(CNCCc2nnc3ccccn32)cc(Cl)c1OC(F)F ZINC000017319095 221383294 /nfs/dbraw/zinc/38/32/94/221383294.db2.gz YZBTZPHLMGUJDX-UHFFFAOYSA-N 0 3 382.798 3.325 10 0 GGAEHN O=C(C1=CCN(Cc2ccccc2)CC1)N1CCN(c2ccccc2F)CC1 ZINC000064817935 136157797 /nfs/dbraw/zinc/15/77/97/136157797.db2.gz FCZSQWYBGXVTTP-UHFFFAOYSA-N 0 3 379.479 3.307 10 0 GGAEHN O=C(C1=CCN(Cc2ccccc2)CC1)N1CCN(c2ccc(F)cc2)CC1 ZINC000064817955 136157921 /nfs/dbraw/zinc/15/79/21/136157921.db2.gz FMHUHBLCFOGSMA-UHFFFAOYSA-N 0 3 379.479 3.307 10 0 GGAEHN COc1ccccc1NC(=O)c1ccc(N2CCN[C@H](c3ccccc3)C2)nc1 ZINC000065256074 136161815 /nfs/dbraw/zinc/16/18/15/136161815.db2.gz NLOFLVMUWHNJSK-FQEVSTJZSA-N 0 3 388.471 3.493 10 0 GGAEHN O=C(NCc1cccc(F)c1)c1ccc(N2CCN[C@H](c3ccccc3)C2)nc1 ZINC000065256118 136161985 /nfs/dbraw/zinc/16/19/85/136161985.db2.gz NWGWDARMQSOWFS-NRFANRHFSA-N 0 3 390.462 3.302 10 0 GGAEHN CN(C)C[C@H](NC(=O)C1CCN(C(=O)c2ccsc2)CC1)c1ccccc1 ZINC000030521817 221699367 /nfs/dbraw/zinc/69/93/67/221699367.db2.gz QLDDJLIKNLHJNV-IBGZPJMESA-N 0 3 385.533 3.019 10 0 GGAEHN CC(C)[C@H](CNC(=O)[C@@H](C)Sc1nncs1)N1CCc2ccccc2C1 ZINC000052531756 222006418 /nfs/dbraw/zinc/00/64/18/222006418.db2.gz JLVGKBZWFYKPSA-PBHICJAKSA-N 0 3 390.578 3.218 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)N[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000054814946 222013103 /nfs/dbraw/zinc/01/31/03/222013103.db2.gz HKNPPRQEXQHMAO-UKRRQHHQSA-N 0 3 382.302 3.056 10 0 GGAEHN CCCCN1CCN(C(=O)c2cc3c(n2C)CCN(Cc2ccccc2)C3)CC1 ZINC000065210850 222110993 /nfs/dbraw/zinc/11/09/93/222110993.db2.gz MQKRRFOFCOZZCB-UHFFFAOYSA-N 0 3 394.563 3.141 10 0 GGAEHN Cc1onc(-c2ccc(Br)s2)c1C(=O)NCCN1CCCC1 ZINC000064820209 222083304 /nfs/dbraw/zinc/08/33/04/222083304.db2.gz FEUHKNYNBGSGDT-UHFFFAOYSA-N 0 3 384.299 3.300 10 0 GGAEHN COc1ccc(-c2noc(-c3ccc(NCCN4CCC(C)CC4)nn3)n2)cc1 ZINC000064838055 222084000 /nfs/dbraw/zinc/08/40/00/222084000.db2.gz MWQJEDLSJZXWCC-UHFFFAOYSA-N 0 3 394.479 3.346 10 0 GGAEHN O=C(CCc1ccnc(N2CCCC2)c1)NC1CCN(Cc2ccccc2)CC1 ZINC000065269594 222119070 /nfs/dbraw/zinc/11/90/70/222119070.db2.gz OGXKOLZRNRFZIJ-UHFFFAOYSA-N 0 3 392.547 3.395 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1 ZINC000065529285 222132621 /nfs/dbraw/zinc/13/26/21/222132621.db2.gz NIXFYENLBYHNMA-SJORKVTESA-N 0 3 378.948 3.340 10 0 GGAEHN CCN1CCc2c(cccc2-n2nnc(C(=O)Nc3cccc(F)c3)c2C)C1 ZINC000069842354 222175441 /nfs/dbraw/zinc/17/54/41/222175441.db2.gz LBCZOQSUIDKDPT-UHFFFAOYSA-N 0 3 379.439 3.345 10 0 GGAEHN Cc1c(C(=O)N[C@@H](C)C(C)C)nnn1-c1cccc2c1CCN(CC1CC1)C2 ZINC000071890394 222200231 /nfs/dbraw/zinc/20/02/31/222200231.db2.gz VQDGYWNGFBGPKG-HNNXBMFYSA-N 0 3 381.524 3.118 10 0 GGAEHN c1ccc(CN2CCC(Nc3nc(-c4cccnc4)nc4c3CNC4)CC2)cc1 ZINC000072156991 222213328 /nfs/dbraw/zinc/21/33/28/222213328.db2.gz VFOYQVZRNODMJX-UHFFFAOYSA-N 0 3 386.503 3.218 10 0 GGAEHN COC(=O)[C@@H]1CCCCC[C@H]1NCC(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000095941461 222362741 /nfs/dbraw/zinc/36/27/41/222362741.db2.gz LZGDYCAXOSWHCU-HUUCEWRRSA-N 0 3 388.386 3.235 10 0 GGAEHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ccc2nc3n(c2c1)CCC3 ZINC000095956406 222364144 /nfs/dbraw/zinc/36/41/44/222364144.db2.gz DKCXYJARDXATJW-UHFFFAOYSA-N 0 3 380.467 3.326 10 0 GGAEHN CC(C)[C@H](NC(=O)CN(C)C(C)C)c1ccccc1NC(=O)CN(C)C(C)C ZINC000095976321 222366804 /nfs/dbraw/zinc/36/68/04/222366804.db2.gz OQDUVTYCJXGWNF-QFIPXVFZSA-N 0 3 390.572 3.119 10 0 GGAEHN c1nn(CCN2CCCCC2)cc1Nc1ccc2nnc(-c3ccccc3)n2n1 ZINC000095983476 222367079 /nfs/dbraw/zinc/36/70/79/222367079.db2.gz KCGHDIACJWZPED-UHFFFAOYSA-N 0 3 388.479 3.217 10 0 GGAEHN Cc1nccn1[C@@H](C)c1nc(CC2CCN(C)CC2)nn1Cc1ccccc1 ZINC000096133439 222386410 /nfs/dbraw/zinc/38/64/10/222386410.db2.gz GYLFKKUSXYJVJZ-KRWDZBQOSA-N 0 3 378.524 3.325 10 0 GGAEHN CCN(CC)C[C@@H](NC(=O)CCN1C(=O)COc2ccccc21)c1ccccc1 ZINC000040007678 520722217 /nfs/dbraw/zinc/72/22/17/520722217.db2.gz ATIRXSCZXJPVNW-LJQANCHMSA-N 0 3 395.503 3.001 10 0 GGAEHN CN1CCN(Cc2nc3ccccc3n2Cc2nc3ccc(Cl)cc3[nH]2)CC1 ZINC000073636127 523913497 /nfs/dbraw/zinc/91/34/97/523913497.db2.gz RKFJPMOFFVTOAM-UHFFFAOYSA-N 0 3 394.910 3.362 10 0 GGAEHN Cc1cccc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1I ZINC000123056068 564437698 /nfs/dbraw/zinc/43/76/98/564437698.db2.gz MUNDJIDMKXAXAR-CHWSQXEVSA-N 0 3 386.277 3.154 10 0 GGAEHN Cc1cccc(C(=O)NCCN2CCCC[C@@H]2C)c1I ZINC000047144293 564514389 /nfs/dbraw/zinc/51/43/89/564514389.db2.gz ZBMFOEMARPCMHB-ZDUSSCGKSA-N 0 3 386.277 3.204 10 0 GGAEHN CN(C[C@@H]1CCN(C)C1)C(=O)c1cc(Br)cc(Br)c1 ZINC000222910795 565906568 /nfs/dbraw/zinc/90/65/68/565906568.db2.gz YVEOYZSMKWQCES-SNVBAGLBSA-N 0 3 390.119 3.235 10 0 GGAEHN COCC[C@H](COC)N[C@@H](C)c1ccc(F)c(I)c1 ZINC000453257600 567068406 /nfs/dbraw/zinc/06/84/06/567068406.db2.gz SHYWVKQWTWWCMO-CMPLNLGQSA-N 0 3 381.229 3.132 10 0 GGAEHN CC(C)(C)c1cc(C[C@@H]2CC[C@H](O)[C@@H](CNCc3cccc(F)c3)O2)no1 ZINC000096296008 560060273 /nfs/dbraw/zinc/06/02/73/560060273.db2.gz WQPKGYQZSQQOIN-GBESFXJTSA-N 0 3 376.472 3.352 10 0 GGAEHN C[C@]1(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1(Cl)Cl ZINC000115158291 564187019 /nfs/dbraw/zinc/18/70/19/564187019.db2.gz XVEWZKYVCMZUGY-SJLPKXTDSA-N 0 3 385.335 3.132 10 0 GGAEHN Cc1ccc(I)c(C(=O)N(C)C[C@@H]2CCCN(C)C2)c1 ZINC000115432562 564193599 /nfs/dbraw/zinc/19/35/99/564193599.db2.gz ACYAZLMVDRNSGH-CYBMUJFWSA-N 0 3 386.277 3.013 10 0 GGAEHN Cn1cc([C@H]2CCN(CCC(=O)Nc3ccc(Br)cc3)C2)cn1 ZINC000116315794 564207338 /nfs/dbraw/zinc/20/73/38/564207338.db2.gz WNZMGJBXXNZVEG-ZDUSSCGKSA-N 0 3 377.286 3.001 10 0 GGAEHN Cn1cc([C@H]2CCN(CCC(=O)Nc3ccc(Br)cc3F)C2)cn1 ZINC000116314240 564207703 /nfs/dbraw/zinc/20/77/03/564207703.db2.gz WNCIPUFAXYMXKF-LBPRGKRZSA-N 0 3 395.276 3.140 10 0 GGAEHN CN(C)C[C@@H]1CN(C(=O)CSc2cccc3cccc(Cl)c32)CCO1 ZINC000116798175 564216982 /nfs/dbraw/zinc/21/69/82/564216982.db2.gz XUMOTRWWGJYEIT-OAHLLOKOSA-N 0 3 378.925 3.374 10 0 GGAEHN Cc1nc(-c2cccc(Cl)c2)sc1C(=O)N1CCO[C@H](CN(C)C)C1 ZINC000116797703 564217029 /nfs/dbraw/zinc/21/70/29/564217029.db2.gz FEMJMCXBGZQXBE-OAHLLOKOSA-N 0 3 379.913 3.175 10 0 GGAEHN C[C@@H](NC(=O)N1CCO[C@@H](CN(C)C)C1)c1c(Cl)ccc(F)c1Cl ZINC000117036690 564222000 /nfs/dbraw/zinc/22/20/00/564222000.db2.gz BPFCHJPZRDXDHU-MNOVXSKESA-N 0 3 378.275 3.166 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)c2cc(Cl)ccc2I)C1 ZINC000117706034 564230360 /nfs/dbraw/zinc/23/03/60/564230360.db2.gz SECTVFIMOYAEST-LLVKDONJSA-N 0 3 392.668 3.159 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c1 ZINC000119253384 564261687 /nfs/dbraw/zinc/26/16/87/564261687.db2.gz FJARZDFSIGWKCV-BBRMVZONSA-N 0 3 398.288 3.156 10 0 GGAEHN C[C@@H]1C[C@H](NCc2ccc(S(=O)(=O)N3CCOCC3)s2)CC(C)(C)C1 ZINC000119355110 564266946 /nfs/dbraw/zinc/26/69/46/564266946.db2.gz CCIXLWHWPWAQKO-CABCVRRESA-N 0 3 386.583 3.073 10 0 GGAEHN C/C(=C/c1ccc(Cl)cc1)CNC[C@H](O)CS(=O)(=O)c1cccs1 ZINC000119875469 564292993 /nfs/dbraw/zinc/29/29/93/564292993.db2.gz TXTFFEAESUFVGX-OVHOFWQVSA-N 0 3 385.938 3.229 10 0 GGAEHN NC(=O)[C@@H]1CCC[C@@H](NCc2cc(Br)ccc2OC(F)F)C1 ZINC000120068681 564303136 /nfs/dbraw/zinc/30/31/36/564303136.db2.gz GJJCQXSCWCURHW-BXKDBHETSA-N 0 3 377.229 3.184 10 0 GGAEHN COc1ccc(CNCCSc2nnnn2-c2ccccc2)cc1Cl ZINC000020928077 564307379 /nfs/dbraw/zinc/30/73/79/564307379.db2.gz GFKWMMBZBVDUQO-UHFFFAOYSA-N 0 3 375.885 3.206 10 0 GGAEHN CCCOc1c(CNCCCN2CCCC2=O)cc(Br)cc1OC ZINC000020934486 564308059 /nfs/dbraw/zinc/30/80/59/564308059.db2.gz CAOSUXAHTWSRBX-UHFFFAOYSA-N 0 3 399.329 3.349 10 0 GGAEHN COc1sc(CN(C)[C@@H]2CCCN(c3cccnn3)C2)cc1Br ZINC000120187674 564309017 /nfs/dbraw/zinc/30/90/17/564309017.db2.gz LOKDECYJXFZKSY-GFCCVEGCSA-N 0 3 397.342 3.410 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)c1ccc(F)cc1I ZINC000120245509 564312135 /nfs/dbraw/zinc/31/21/35/564312135.db2.gz YHWIISDCIXRNTJ-LBPRGKRZSA-N 0 3 392.256 3.136 10 0 GGAEHN C[C@H](CC(=O)Nc1ccn(CCN(C)C)n1)c1ccc(Br)cc1 ZINC000120323514 564315658 /nfs/dbraw/zinc/31/56/58/564315658.db2.gz JNVXHAAUOWRDLZ-CYBMUJFWSA-N 0 3 379.302 3.340 10 0 GGAEHN CCOc1c(Br)cc(CNC2(CO)CC2)cc1Br ZINC000120330176 564315878 /nfs/dbraw/zinc/31/58/78/564315878.db2.gz FNJVRKJODXPHDD-UHFFFAOYSA-N 0 3 379.092 3.225 10 0 GGAEHN Cc1cc(C(=O)C(C(=S)[N-]C[C@H]2CCCO2)[n+]2ccccc2)c(C)s1 ZINC000022692230 564319226 /nfs/dbraw/zinc/31/92/26/564319226.db2.gz RVRGTJBOUWZPKT-OAHLLOKOSA-O 0 3 375.539 3.360 10 0 GGAEHN CCCc1nc(CS(=O)(=O)C(C)C(=O)N[C@H](C)c2ccccc2)cs1 ZINC000120630763 564329654 /nfs/dbraw/zinc/32/96/54/564329654.db2.gz ZQSMQAMOJRUFLL-KGLIPLIRSA-N 0 3 380.535 3.276 10 0 GGAEHN C[C@@H](CN1CCCN(Cc2cnn(C)c2)CC1)c1cccc(Br)c1 ZINC000121594812 564376735 /nfs/dbraw/zinc/37/67/35/564376735.db2.gz CAFNRNPIEUKNHE-INIZCTEOSA-N 0 3 391.357 3.494 10 0 GGAEHN C[C@@H](NC[C@H](O)COc1ccc(Br)cc1)c1ccc2c(c1)OCO2 ZINC000030536007 564382390 /nfs/dbraw/zinc/38/23/90/564382390.db2.gz VAPVULBAABRVHJ-DOMZBBRYSA-N 0 3 394.265 3.268 10 0 GGAEHN C[C@H](NC[C@H](O)COc1cccc(Br)c1)c1ccc2c(c1)OCO2 ZINC000030535977 564382459 /nfs/dbraw/zinc/38/24/59/564382459.db2.gz XDRYRFKVZQHXHP-WFASDCNBSA-N 0 3 394.265 3.268 10 0 GGAEHN C[C@H](NC[C@@H](O)COc1cccc(Br)c1)c1ccc2c(c1)OCO2 ZINC000030535972 564382590 /nfs/dbraw/zinc/38/25/90/564382590.db2.gz XDRYRFKVZQHXHP-SWLSCSKDSA-N 0 3 394.265 3.268 10 0 GGAEHN CN(C)S(=O)(=O)c1ccc(OCCN(C)Cc2ccc(Cl)cc2)cc1 ZINC000031005891 564386430 /nfs/dbraw/zinc/38/64/30/564386430.db2.gz BAAJCZLCAANRJT-UHFFFAOYSA-N 0 3 382.913 3.101 10 0 GGAEHN O=C(NC[C@H](O)CN1CCCCC1)c1ccc2cc(Br)ccc2c1 ZINC000121792290 564387988 /nfs/dbraw/zinc/38/79/88/564387988.db2.gz FLHDQVXDHOZVFP-SFHVURJKSA-N 0 3 391.309 3.179 10 0 GGAEHN CN(C)C[C@H](NC(=O)COc1ccccc1Br)c1ccccc1 ZINC000122507416 564416259 /nfs/dbraw/zinc/41/62/59/564416259.db2.gz XQBYOAMVMYLMQL-INIZCTEOSA-N 0 3 377.282 3.247 10 0 GGAEHN C[C@H](NCc1cc(Br)cs1)c1ccc(S(N)(=O)=O)cc1 ZINC000036954960 564419958 /nfs/dbraw/zinc/41/99/58/564419958.db2.gz LAQJIGISRDECDS-VIFPVBQESA-N 0 3 375.313 3.009 10 0 GGAEHN COc1c(Br)cc(CN[C@H]2CCCN(C)C2)cc1Br ZINC000040672957 564428293 /nfs/dbraw/zinc/42/82/93/564428293.db2.gz CNGYLIWDILQLRR-NSHDSACASA-N 0 3 392.135 3.404 10 0 GGAEHN CNS(=O)(=O)c1cccc([C@H](C)NCCc2ccc(OC)cc2Cl)c1 ZINC000122894479 564431596 /nfs/dbraw/zinc/43/15/96/564431596.db2.gz OYZDFFBFRBUIPO-ZDUSSCGKSA-N 0 3 382.913 3.150 10 0 GGAEHN C[C@H]1C[C@@H](N(C)Cc2nc(-c3cccc(Br)c3)no2)CCN1C ZINC000123225163 564442985 /nfs/dbraw/zinc/44/29/85/564442985.db2.gz VWRPDPOCSYGJAQ-WFASDCNBSA-N 0 3 379.302 3.414 10 0 GGAEHN CN(C)C[C@@H](NC(=O)c1ccccc1I)c1ccccc1 ZINC000042301992 564445339 /nfs/dbraw/zinc/44/53/39/564445339.db2.gz CWYXNJBZBOJWHH-MRXNPFEDSA-N 0 3 394.256 3.324 10 0 GGAEHN C[C@@H]1C[C@H](N(C)Cc2nc(-c3cc(Br)cs3)no2)CCN1C ZINC000123388663 564446719 /nfs/dbraw/zinc/44/67/19/564446719.db2.gz SAQIQJVALIGAMQ-ZYHUDNBSSA-N 0 3 385.331 3.475 10 0 GGAEHN C[C@H]1C[C@H](N(C)Cc2nc(-c3cc(Br)cs3)no2)CCN1C ZINC000123388944 564446912 /nfs/dbraw/zinc/44/69/12/564446912.db2.gz SAQIQJVALIGAMQ-CMPLNLGQSA-N 0 3 385.331 3.475 10 0 GGAEHN O=C(NC[C@@H](O)CN1CCCCC1)Nc1ccc(Br)cc1Cl ZINC000043420316 564457903 /nfs/dbraw/zinc/45/79/03/564457903.db2.gz HKVKZFVPQZFCIL-GFCCVEGCSA-N 0 3 390.709 3.071 10 0 GGAEHN CN(C)CCn1cc(NC(=O)Cc2cc(Cl)ccc2Br)cn1 ZINC000123682312 564458183 /nfs/dbraw/zinc/45/81/83/564458183.db2.gz PGTOTMLSVQFHCF-UHFFFAOYSA-N 0 3 385.693 3.042 10 0 GGAEHN C[C@@H]1C[C@H](N(C)Cc2nc(-c3ccc(Br)s3)no2)CCN1C ZINC000123928134 564466324 /nfs/dbraw/zinc/46/63/24/564466324.db2.gz FCVXGRNGTFDDMJ-GHMZBOCLSA-N 0 3 385.331 3.475 10 0 GGAEHN C[C@H]1C[C@H](N(C)Cc2nc(Cc3cccc(Br)c3)no2)CCN1C ZINC000123926111 564466352 /nfs/dbraw/zinc/46/63/52/564466352.db2.gz PGYJCQMNXFKTIR-XJKSGUPXSA-N 0 3 393.329 3.337 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)c2ccn(-c3cccc(Br)c3)n2)CCN1C ZINC000124029438 564469194 /nfs/dbraw/zinc/46/91/94/564469194.db2.gz BHXBCEWBQVUHRA-DZGCQCFKSA-N 0 3 391.313 3.190 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)Cc1c[nH]c2cc(Br)ccc12 ZINC000124194323 564474525 /nfs/dbraw/zinc/47/45/25/564474525.db2.gz NBSLGYYMXMASMW-HNNXBMFYSA-N 0 3 378.314 3.416 10 0 GGAEHN CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)NCc1ccc([O-])c(Br)c1 ZINC000124331646 564478851 /nfs/dbraw/zinc/47/88/51/564478851.db2.gz KMELVXXVQBIRGO-CQSZACIVSA-N 0 3 384.318 3.074 10 0 GGAEHN CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)NCc1ccc([O-])c(Br)c1 ZINC000124331646 564478855 /nfs/dbraw/zinc/47/88/55/564478855.db2.gz KMELVXXVQBIRGO-CQSZACIVSA-N 0 3 384.318 3.074 10 0 GGAEHN O=C1C[C@@H]([C@H]2CCCCN2Cc2cc(Br)cc3cccnc32)CN1 ZINC000125203414 564506283 /nfs/dbraw/zinc/50/62/83/564506283.db2.gz RVMYZUBVPZCXJI-RHSMWYFYSA-N 0 3 388.309 3.488 10 0 GGAEHN Cc1sc2ncnc(SCC(=O)NCCN3CCCC[C@H]3C)c2c1C ZINC000047142644 564513477 /nfs/dbraw/zinc/51/34/77/564513477.db2.gz AKIJSGTUCSSHNT-GFCCVEGCSA-N 0 3 378.567 3.391 10 0 GGAEHN Brc1cncnc1NCc1ccc(OCCN2CCCC2)cc1 ZINC000481987370 564531334 /nfs/dbraw/zinc/53/13/34/564531334.db2.gz XQZHCRBPTLVOFK-UHFFFAOYSA-N 0 3 377.286 3.326 10 0 GGAEHN C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NCCN1CCCC[C@H]1C ZINC000048221204 564534357 /nfs/dbraw/zinc/53/43/57/564534357.db2.gz CGJSNWIQUMFWOO-CHWSQXEVSA-N 0 3 386.323 3.102 10 0 GGAEHN CN(C)CCOc1ccc(CNC(=O)c2cccc(Br)c2)cc1 ZINC000048356493 564537608 /nfs/dbraw/zinc/53/76/08/564537608.db2.gz CUSWJWJMVKVLSM-UHFFFAOYSA-N 0 3 377.282 3.320 10 0 GGAEHN CCCN(C)[C@H](CNC(=O)Nc1nnc(OC)s1)c1ccc(Cl)cc1 ZINC000482444639 564542566 /nfs/dbraw/zinc/54/25/66/564542566.db2.gz HGBRCUQLIRAXOC-CYBMUJFWSA-N 0 3 383.905 3.405 10 0 GGAEHN O=C(NCc1ccc([O-])c(Br)c1)N1CCC(C[NH+]2CCCC2)CC1 ZINC000126277945 564543473 /nfs/dbraw/zinc/54/34/73/564543473.db2.gz ZVAYPRKGUWIGBB-UHFFFAOYSA-N 0 3 396.329 3.172 10 0 GGAEHN CN1CCC[C@@H](NC(=O)Nc2ccc(I)cc2Cl)C1 ZINC000048770502 564545411 /nfs/dbraw/zinc/54/54/11/564545411.db2.gz OQIQXACWTYHAFZ-SNVBAGLBSA-N 0 3 393.656 3.160 10 0 GGAEHN CC(C(=O)N1CCC(c2nc3cc(Cl)ccc3s2)CC1)S(C)(=O)=O ZINC000049621316 564552032 /nfs/dbraw/zinc/55/20/32/564552032.db2.gz FUXNEEYEUSVURO-JTQLQIEISA-N 0 3 386.926 3.089 10 0 GGAEHN Cc1ccc(Br)c(S(=O)(=O)N2CCC(N3CCCC3)CC2)c1 ZINC000126566849 564553089 /nfs/dbraw/zinc/55/30/89/564553089.db2.gz FKYYQKJTNLIRJV-UHFFFAOYSA-N 0 3 387.343 3.006 10 0 GGAEHN Cc1nc(C)n(C[C@H]2CCCN(CCOc3ccccc3Br)C2)n1 ZINC000126678118 564557675 /nfs/dbraw/zinc/55/76/75/564557675.db2.gz NEBHCZLQTJLZIF-INIZCTEOSA-N 0 3 393.329 3.448 10 0 GGAEHN O=C(C(=O)N1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(Br)cc1 ZINC000126753994 564561093 /nfs/dbraw/zinc/56/10/93/564561093.db2.gz BKHXIKPEGXIPBY-WMLDXEAASA-N 0 3 391.309 3.107 10 0 GGAEHN CN1CCC[C@@H]1CNC(=O)CSCc1ccc(Br)cc1F ZINC000051383511 564563669 /nfs/dbraw/zinc/56/36/69/564563669.db2.gz MEFBYXZVIQOYAS-CYBMUJFWSA-N 0 3 375.307 3.032 10 0 GGAEHN CCN1CCC[C@H](NC(=O)N[C@@H](C)c2ccc(OC)c(Br)c2)C1 ZINC000052518839 564573437 /nfs/dbraw/zinc/57/34/37/564573437.db2.gz IYHFZDDHIBMDSM-JSGCOSHPSA-N 0 3 384.318 3.302 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)N[C@@H](C)c2ccc(OC)c(Br)c2)C1 ZINC000052518840 564573491 /nfs/dbraw/zinc/57/34/91/564573491.db2.gz IYHFZDDHIBMDSM-GXTWGEPZSA-N 0 3 384.318 3.302 10 0 GGAEHN COc1ccc(Br)c(C(=O)N[C@@H](CN(C)C)c2ccccc2)c1 ZINC000052555116 564574272 /nfs/dbraw/zinc/57/42/72/564574272.db2.gz VNQWBBQBIRODID-KRWDZBQOSA-N 0 3 377.282 3.490 10 0 GGAEHN NC(=O)c1cccc(CNC2(c3ccc(Br)cc3)CCOCC2)c1 ZINC000052833969 564577529 /nfs/dbraw/zinc/57/75/29/564577529.db2.gz FZEJJZVWKKQWGS-UHFFFAOYSA-N 0 3 389.293 3.344 10 0 GGAEHN CCN(CC)[C@H](C)CN[C@H](C)c1ccc(S(=O)(=O)C(F)F)c(OC)c1 ZINC000127597502 564590015 /nfs/dbraw/zinc/59/00/15/564590015.db2.gz VJUYMCFIGRYVLF-CHWSQXEVSA-N 0 3 378.485 3.072 10 0 GGAEHN COc1ccc(Br)c(CN[C@@H]2CCCN(c3cccnn3)C2)c1 ZINC000127756439 564594185 /nfs/dbraw/zinc/59/41/85/564594185.db2.gz WBKZETPEOUZARA-CQSZACIVSA-N 0 3 377.286 3.006 10 0 GGAEHN C[C@H]1CN(CCCNc2ncnc3ccc(Br)cc32)CCCO1 ZINC000519868040 564594313 /nfs/dbraw/zinc/59/43/13/564594313.db2.gz WDBUZJCCVFRPFV-ZDUSSCGKSA-N 0 3 379.302 3.305 10 0 GGAEHN CC[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1cc(C)ccc1Br ZINC000127886686 564599911 /nfs/dbraw/zinc/59/99/11/564599911.db2.gz TVIFIIWCXLNIJZ-ZIAGYGMSSA-N 0 3 387.343 3.005 10 0 GGAEHN NC(=O)c1ccc(CNC2(c3ccc(Br)cc3)CCOCC2)cc1 ZINC000054394343 564604778 /nfs/dbraw/zinc/60/47/78/564604778.db2.gz SATPDQJPMLMTSO-UHFFFAOYSA-N 0 3 389.293 3.344 10 0 GGAEHN O[C@H](COc1ccc(Cl)cc1Br)CN1CCCSCC1 ZINC000129367013 564646448 /nfs/dbraw/zinc/64/64/48/564646448.db2.gz YUHGPOYKWMJCGE-LBPRGKRZSA-N 0 3 380.735 3.281 10 0 GGAEHN Cc1nn(CC(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)c(C)c1Cl ZINC000129790186 564661332 /nfs/dbraw/zinc/66/13/32/564661332.db2.gz BCFJNIFSBBJZHE-KSSFIOAISA-N 0 3 380.945 3.414 10 0 GGAEHN CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccc([O-])c(Br)c2)[C@H](C)C1 ZINC000130237362 564674831 /nfs/dbraw/zinc/67/48/31/564674831.db2.gz YLWHCYXCOVTYLX-DOMZBBRYSA-N 0 3 384.318 3.026 10 0 GGAEHN CC[N@H+]1CC[C@H](N(C)C(=O)NCc2ccc([O-])c(Br)c2)[C@H](C)C1 ZINC000130237362 564674836 /nfs/dbraw/zinc/67/48/36/564674836.db2.gz YLWHCYXCOVTYLX-DOMZBBRYSA-N 0 3 384.318 3.026 10 0 GGAEHN CCc1cnc(CCN[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)s1 ZINC000130256429 564674990 /nfs/dbraw/zinc/67/49/90/564674990.db2.gz KNNSTBBJMPTWLY-CQSZACIVSA-N 0 3 379.551 3.139 10 0 GGAEHN CCc1cnc(CCN[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)s1 ZINC000130256201 564675500 /nfs/dbraw/zinc/67/55/00/564675500.db2.gz KNNSTBBJMPTWLY-AWEZNQCLSA-N 0 3 379.551 3.139 10 0 GGAEHN CC(C)Cn1c(=O)c2cc(Br)ccc2nc1SCCN(C)C ZINC000058945952 564691496 /nfs/dbraw/zinc/69/14/96/564691496.db2.gz CMZCWSIAWLGALS-UHFFFAOYSA-N 0 3 384.343 3.469 10 0 GGAEHN CS(=O)(=O)N1CCC[C@H](CN(Cc2cccs2)Cc2cccs2)C1 ZINC000130896010 564695315 /nfs/dbraw/zinc/69/53/15/564695315.db2.gz GAHHIEGEGSHXFQ-OAHLLOKOSA-N 0 3 384.592 3.483 10 0 GGAEHN O=C1CCCN1CCCNCc1cc(Br)ccc1OC(F)F ZINC000061002978 564704259 /nfs/dbraw/zinc/70/42/59/564704259.db2.gz DDXURDIIYLUVHG-UHFFFAOYSA-N 0 3 377.229 3.153 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)NC[C@@H](C)N1CCCC1 ZINC000063732670 564721703 /nfs/dbraw/zinc/72/17/03/564721703.db2.gz GCMFGKHQGKYTNX-CYBMUJFWSA-N 0 3 378.314 3.313 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)C(=O)Nc1cnn(CCN(C)C)c1 ZINC000132178813 564736624 /nfs/dbraw/zinc/73/66/24/564736624.db2.gz ZSIGRRYWHAMQQL-ZDUSSCGKSA-N 0 3 379.302 3.025 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)C(=O)Nc1cnn(CCN(C)C)c1 ZINC000132178949 564736774 /nfs/dbraw/zinc/73/67/74/564736774.db2.gz ZSIGRRYWHAMQQL-CYBMUJFWSA-N 0 3 379.302 3.025 10 0 GGAEHN OC[C@@]1(NC[C@H](O)COc2c(Cl)cccc2Cl)CCc2ccccc21 ZINC000132316284 564739759 /nfs/dbraw/zinc/73/97/59/564739759.db2.gz YGCDLOKNQIPRLO-LIRRHRJNSA-N 0 3 382.287 3.157 10 0 GGAEHN O=C(CNC1(c2cccc(Br)c2)CCOCC1)NC1CCCCC1 ZINC000065604399 564745497 /nfs/dbraw/zinc/74/54/97/564745497.db2.gz NVVFWEDBTAUONS-UHFFFAOYSA-N 0 3 395.341 3.493 10 0 GGAEHN COC[C@@](C)(CCO)NCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000132562295 564746700 /nfs/dbraw/zinc/74/67/00/564746700.db2.gz WWYFKYQHAHDLHF-SJLPKXTDSA-N 0 3 389.323 3.034 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)NCCc1cc(Br)ccc1F ZINC000065698801 564747668 /nfs/dbraw/zinc/74/76/68/564747668.db2.gz MEZZIPHJERWVEW-ZDUSSCGKSA-N 0 3 386.309 3.304 10 0 GGAEHN C[C@@H]1CN(CCCCNC(=O)Nc2cccc(Br)c2)C[C@@H](C)O1 ZINC000132645701 564749032 /nfs/dbraw/zinc/74/90/32/564749032.db2.gz FXEMLSFKQQUKPV-ZIAGYGMSSA-N 0 3 384.318 3.460 10 0 GGAEHN FC(F)(F)c1cc(Br)ccc1OCCNCc1cncnc1 ZINC000132826273 564753609 /nfs/dbraw/zinc/75/36/09/564753609.db2.gz ZXRLZBYMHNQCIX-UHFFFAOYSA-N 0 3 376.176 3.427 10 0 GGAEHN O=S(=O)(c1ccc(F)c(C(F)(F)F)c1)N1CCC(N2CCCC2)CC1 ZINC000066000796 564753943 /nfs/dbraw/zinc/75/39/43/564753943.db2.gz CYDGXYKHTNILOK-UHFFFAOYSA-N 0 3 380.407 3.093 10 0 GGAEHN O=C(N[C@H]1CCOc2ccc(Br)cc21)N1CC[C@H](N2CCCC2)C1 ZINC000066188033 564756930 /nfs/dbraw/zinc/75/69/30/564756930.db2.gz DNIFRZGNBXBTQF-HOCLYGCPSA-N 0 3 394.313 3.152 10 0 GGAEHN O=C(N[C@H]1CCOc2ccc(Br)cc21)N1CC[C@@H](N2CCCC2)C1 ZINC000066188035 564757079 /nfs/dbraw/zinc/75/70/79/564757079.db2.gz DNIFRZGNBXBTQF-ZBFHGGJFSA-N 0 3 394.313 3.152 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N1CC[C@H](N2CCCC2)C1 ZINC000066186696 564757258 /nfs/dbraw/zinc/75/72/58/564757258.db2.gz AQDYXCOZOLYORX-PBHICJAKSA-N 0 3 380.330 3.260 10 0 GGAEHN CC(C)N1CCN(CCCOc2cccc(I)c2)CC1 ZINC000066420804 564765802 /nfs/dbraw/zinc/76/58/02/564765802.db2.gz CGIDQRNZBCUOAP-UHFFFAOYSA-N 0 3 388.293 3.086 10 0 GGAEHN C[C@@H]1CN(C2CCN(CC(=O)Nc3cccc(Cl)c3Cl)CC2)CCO1 ZINC000066562159 564769001 /nfs/dbraw/zinc/76/90/01/564769001.db2.gz LRSGXEHXKIXNPE-CYBMUJFWSA-N 0 3 386.323 3.117 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNCC[C@@H](C)[S@](C)=O ZINC000133435452 564773796 /nfs/dbraw/zinc/77/37/96/564773796.db2.gz AHRXUAJKRLVDRA-SFDCACGMSA-N 0 3 398.370 3.498 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)N2CCO[C@H](c3ccc(Br)cc3)C2)C1 ZINC000067605525 564796009 /nfs/dbraw/zinc/79/60/09/564796009.db2.gz ORCSKBHTXUBZPH-SJORKVTESA-N 0 3 396.329 3.016 10 0 GGAEHN CNS(=O)(=O)CCCN(C)[C@@H](C)c1sc(-c2ccc(C)cc2)nc1C ZINC000134211441 564796048 /nfs/dbraw/zinc/79/60/48/564796048.db2.gz ORSQXJWOVYWJMK-HNNXBMFYSA-N 0 3 381.567 3.359 10 0 GGAEHN COc1c(Br)cc(Br)cc1CN[C@@H]1CCO[C@H]1C ZINC000134244281 564797277 /nfs/dbraw/zinc/79/72/77/564797277.db2.gz BMHDJVZIYHDEGN-QPUJVOFHSA-N 0 3 379.092 3.487 10 0 GGAEHN CC(C)N1CCCN(Cc2nnc(-c3ccccc3Br)o2)CC1 ZINC000069082922 564832780 /nfs/dbraw/zinc/83/27/80/564832780.db2.gz HJLDZXIRLVIQBM-UHFFFAOYSA-N 0 3 379.302 3.415 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Cc1csc(-c2ccc(Cl)s2)n1 ZINC000069499209 564840526 /nfs/dbraw/zinc/84/05/26/564840526.db2.gz DTYOGIBXUIAWQA-ZDUSSCGKSA-N 0 3 399.969 3.295 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Cc1csc(-c2ccc(Cl)s2)n1 ZINC000069499205 564840920 /nfs/dbraw/zinc/84/09/20/564840920.db2.gz DTYOGIBXUIAWQA-CYBMUJFWSA-N 0 3 399.969 3.295 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)C1(c2ccc(Br)cc2)CCC1 ZINC000069577681 564842140 /nfs/dbraw/zinc/84/21/40/564842140.db2.gz HXLZWSUHKSDYJA-KRWDZBQOSA-N 0 3 395.341 3.098 10 0 GGAEHN CCC[C@@H](C(=O)N1CCN(C(=O)c2ccc(Cl)cc2Cl)CC1)N(C)C ZINC000135860122 564842112 /nfs/dbraw/zinc/84/21/12/564842112.db2.gz ABDJRCSCXFTGHP-INIZCTEOSA-N 0 3 386.323 3.008 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)Nc2cc(I)ccc2Cl)C1 ZINC000136359052 564849383 /nfs/dbraw/zinc/84/93/83/564849383.db2.gz LPYJUIFCSNZCNQ-SNVBAGLBSA-N 0 3 393.656 3.112 10 0 GGAEHN C[C@@H](NC(=O)N(CCN(C)C)CCN(C)C)c1ccc(Cl)cc1Cl ZINC000077752481 564862637 /nfs/dbraw/zinc/86/26/37/564862637.db2.gz HDWPCUXTLYSPIB-CYBMUJFWSA-N 0 3 375.344 3.189 10 0 GGAEHN CCN1CC[C@H]2CC[C@@H](C1)N2CC(=O)Nc1ccc(C)c(Br)c1 ZINC000084789085 564869021 /nfs/dbraw/zinc/86/90/21/564869021.db2.gz XOGCDHIGYAXUML-CVEARBPZSA-N 0 3 380.330 3.255 10 0 GGAEHN COc1c(Br)cc(Br)cc1CNC[C@H]1CCC[C@H]1O ZINC000091316094 564870027 /nfs/dbraw/zinc/87/00/27/564870027.db2.gz HODWTLUAIQAROF-NOZJJQNGSA-N 0 3 393.119 3.471 10 0 GGAEHN COc1c(Br)cc(Br)cc1CNCC1CC(O)C1 ZINC000091426661 564871655 /nfs/dbraw/zinc/87/16/55/564871655.db2.gz BGJURESLYAKUFJ-UHFFFAOYSA-N 0 3 379.092 3.081 10 0 GGAEHN CC(C)N1C[C@H](NC(=O)C(=O)Nc2cc(Cl)c(Cl)cc2Cl)[C@@H](C)C1 ZINC000150785334 564891241 /nfs/dbraw/zinc/89/12/41/564891241.db2.gz QNBMFZQRNKVRIG-XPTSAGLGSA-N 0 3 392.714 3.430 10 0 GGAEHN C[C@H](NCC(C)(C)C(N)=O)c1ccc(Br)cc1Br ZINC000095462745 564898552 /nfs/dbraw/zinc/89/85/52/564898552.db2.gz ZXNDYPQWCVBVTD-QMMMGPOBSA-N 0 3 378.108 3.374 10 0 GGAEHN COc1ccc(Br)cc1CNC[C@@H](Cc1ccc(F)cc1)C(N)=O ZINC000095452880 564898891 /nfs/dbraw/zinc/89/88/91/564898891.db2.gz GTXLVSRNHPVSSS-CQSZACIVSA-N 0 3 395.272 3.031 10 0 GGAEHN OC[C@@H]1CN(Cc2ccccc2)CC[C@H]1NCc1ccccc1Br ZINC000095400277 564898941 /nfs/dbraw/zinc/89/89/41/564898941.db2.gz BWBCWGDOLIIYDN-AZUAARDMSA-N 0 3 389.337 3.422 10 0 GGAEHN COc1ccc(Br)cc1CNC[C@H](Cc1ccc(F)cc1)C(N)=O ZINC000095452881 564899309 /nfs/dbraw/zinc/89/93/09/564899309.db2.gz GTXLVSRNHPVSSS-AWEZNQCLSA-N 0 3 395.272 3.031 10 0 GGAEHN CC[C@H](N[C@@H]1CCN(C2CCOCC2)C1=O)c1ccc(Br)cc1 ZINC000150981350 564900110 /nfs/dbraw/zinc/90/01/10/564900110.db2.gz MDKSXTYGVXYXBM-DLBZAZTESA-N 0 3 381.314 3.270 10 0 GGAEHN CC[C@@H](N[C@H]1CCN(C2CCOCC2)C1=O)c1ccc(Br)cc1 ZINC000150981497 564901201 /nfs/dbraw/zinc/90/12/01/564901201.db2.gz MDKSXTYGVXYXBM-SJORKVTESA-N 0 3 381.314 3.270 10 0 GGAEHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1)[C@@H]1CCCO1 ZINC000098027050 564911421 /nfs/dbraw/zinc/91/14/21/564911421.db2.gz FZGJZWRIGVSICN-PBHICJAKSA-N 0 3 398.345 3.090 10 0 GGAEHN O[C@@H](CSc1ccc(Br)cn1)CN1CCc2ccccc2C1 ZINC000098144706 564914237 /nfs/dbraw/zinc/91/42/37/564914237.db2.gz YTRJURYQXDATFG-MRXNPFEDSA-N 0 3 379.323 3.355 10 0 GGAEHN Cc1[nH]c(=S)sc1CC(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000102648113 564931888 /nfs/dbraw/zinc/93/18/88/564931888.db2.gz WFXDKTZWLKQPNJ-STQMWFEESA-N 0 3 383.583 3.004 10 0 GGAEHN C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1cccc(Br)c1 ZINC000102675213 564932122 /nfs/dbraw/zinc/93/21/22/564932122.db2.gz VELBMWUJHMQYID-GFCCVEGCSA-N 0 3 383.311 3.290 10 0 GGAEHN C[NH+](C)CC1CCC([N-]S(=O)(=O)c2ccc(F)cc2C(F)(F)F)CC1 ZINC000151735629 564935458 /nfs/dbraw/zinc/93/54/58/564935458.db2.gz FRWQHNBUDDHVDT-UHFFFAOYSA-N 0 3 382.423 3.243 10 0 GGAEHN Cc1ccc(I)c(C(=O)N(C)CC2CCN(C)CC2)c1 ZINC000103450935 564948965 /nfs/dbraw/zinc/94/89/65/564948965.db2.gz QJKDRHOILHPURA-UHFFFAOYSA-N 0 3 386.277 3.013 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)CSCc1cc(-c2cccs2)on1 ZINC000103451126 564949051 /nfs/dbraw/zinc/94/90/51/564949051.db2.gz HTCHEYYXUWEZTH-UHFFFAOYSA-N 0 3 379.551 3.437 10 0 GGAEHN Brc1ccc(N2CCN(CCCCCn3cccn3)CC2)nc1 ZINC000104673564 564958578 /nfs/dbraw/zinc/95/85/78/564958578.db2.gz DWGNRFPWOHSBRF-UHFFFAOYSA-N 0 3 378.318 3.033 10 0 GGAEHN C[C@@H](Cc1ccccc1Br)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000152610319 564965488 /nfs/dbraw/zinc/96/54/88/564965488.db2.gz VXXDGFYHJAHONZ-HOCLYGCPSA-N 0 3 378.314 3.036 10 0 GGAEHN CC[C@H]1CN(CCC(=O)Nc2cc(Cl)ccc2Cl)CCN1C[C@@H](C)O ZINC000106102760 564978374 /nfs/dbraw/zinc/97/83/74/564978374.db2.gz SVWNYZDULMDBGR-HIFRSBDPSA-N 0 3 388.339 3.099 10 0 GGAEHN COCCN(CCN(C)C)C(=O)N[C@H](c1ccc(Cl)cc1)C(F)(F)F ZINC000153454128 564996291 /nfs/dbraw/zinc/99/62/91/564996291.db2.gz MVGBVCZVRCRRFH-CQSZACIVSA-N 0 3 381.826 3.163 10 0 GGAEHN COC(=O)c1cc(Br)ccc1NC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1 ZINC000153551300 565000376 /nfs/dbraw/zinc/00/03/76/565000376.db2.gz JYGYOEMVNSNISP-YPMHNXCESA-N 0 3 398.301 3.182 10 0 GGAEHN CN(C)CCOc1ccccc1C(=O)N(C)Cc1cc(Br)cn1C ZINC000153561763 565000675 /nfs/dbraw/zinc/00/06/75/565000675.db2.gz XAHLVJCHNJSZEC-UHFFFAOYSA-N 0 3 394.313 3.000 10 0 GGAEHN CCc1nc(CNC(=O)NCC2CCN(Cc3cccs3)CC2)cs1 ZINC000107741666 565002532 /nfs/dbraw/zinc/00/25/32/565002532.db2.gz JPORVWLWIMUFRN-UHFFFAOYSA-N 0 3 378.567 3.478 10 0 GGAEHN CC[C@@H](CNC(=O)N1CC[C@@H](N(C)C)C1)Cc1cccc(Br)c1 ZINC000153828249 565013510 /nfs/dbraw/zinc/01/35/10/565013510.db2.gz QSROQWPCYXKCLG-RHSMWYFYSA-N 0 3 382.346 3.363 10 0 GGAEHN COc1ccsc1S(=O)(=O)NCc1ccccc1CN1CCCCC1 ZINC000154261709 565031935 /nfs/dbraw/zinc/03/19/35/565031935.db2.gz KKUJBYXBNFTVRB-UHFFFAOYSA-N 0 3 380.535 3.221 10 0 GGAEHN Clc1ccc2c(c1)[C@@H](NC[C@@]1(N3CCOCC3)CCSC1)CCCO2 ZINC000154392466 565036637 /nfs/dbraw/zinc/03/66/37/565036637.db2.gz AYKKUMSQMCPREJ-HKUYNNGSSA-N 0 3 382.957 3.351 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)c2ccc(Br)cc2Br)C1 ZINC000154491626 565041655 /nfs/dbraw/zinc/04/16/55/565041655.db2.gz WHAKRSGZFHZRBU-LLVKDONJSA-N 0 3 390.119 3.426 10 0 GGAEHN O=C(NC[C@H](O)CN1CCCCC1)Nc1ccc(C(F)(F)F)cc1Cl ZINC000111768024 565057503 /nfs/dbraw/zinc/05/75/03/565057503.db2.gz QZPXVWJVRQTOQO-LBPRGKRZSA-N 0 3 379.810 3.327 10 0 GGAEHN O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccc(Cl)s1 ZINC000112255885 565061102 /nfs/dbraw/zinc/06/11/02/565061102.db2.gz ASRHDNHFFHAZFB-UHFFFAOYSA-N 0 3 377.897 3.479 10 0 GGAEHN CCc1nc2n(n1)C[C@@H](N[C@H](C)C(=O)Nc1ccc(Cl)c(Cl)c1)CC2 ZINC000112551009 565064508 /nfs/dbraw/zinc/06/45/08/565064508.db2.gz ULVIPARLXUALDF-PWSUYJOCSA-N 0 3 382.295 3.079 10 0 GGAEHN CCc1nc2n(n1)C[C@H](N[C@H](C)C(=O)Nc1ccc(Cl)cc1Cl)CC2 ZINC000112550696 565064524 /nfs/dbraw/zinc/06/45/24/565064524.db2.gz ADXHKRBGVFCCQD-ZYHUDNBSSA-N 0 3 382.295 3.079 10 0 GGAEHN CCc1nc2n(n1)C[C@H](N[C@H](C)C(=O)Nc1ccc(Cl)c(Cl)c1)CC2 ZINC000112551008 565064534 /nfs/dbraw/zinc/06/45/34/565064534.db2.gz ULVIPARLXUALDF-ZYHUDNBSSA-N 0 3 382.295 3.079 10 0 GGAEHN CCc1nc2n(n1)C[C@H](N[C@@H](C)C(=O)Nc1ccc(Cl)cc1Cl)CC2 ZINC000112550692 565064539 /nfs/dbraw/zinc/06/45/39/565064539.db2.gz ADXHKRBGVFCCQD-CMPLNLGQSA-N 0 3 382.295 3.079 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)cc1OC ZINC000155386334 565066949 /nfs/dbraw/zinc/06/69/49/565066949.db2.gz WHGIKQSJRLJAPK-WFASDCNBSA-N 0 3 399.329 3.315 10 0 GGAEHN C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc2c(cc(Br)cc2F)[nH]1 ZINC000113226207 565068524 /nfs/dbraw/zinc/06/85/24/565068524.db2.gz AWKRYEABENXYLG-ZYHUDNBSSA-N 0 3 380.261 3.378 10 0 GGAEHN C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1 ZINC000113222307 565068531 /nfs/dbraw/zinc/06/85/31/565068531.db2.gz BUNHZJYYFADIEM-SWLSCSKDSA-N 0 3 379.291 3.488 10 0 GGAEHN Cc1sc2ncnc(SCC(=O)N3C[C@@H]4CCCN4C[C@@H]3C)c2c1C ZINC000113223544 565068543 /nfs/dbraw/zinc/06/85/43/565068543.db2.gz HXKWXWRQRVCOAV-FZMZJTMJSA-N 0 3 376.551 3.095 10 0 GGAEHN C[C@H]1CN2CCC[C@@H]2CN1Cc1nnc(-c2ccccc2Br)o1 ZINC000113270479 565068740 /nfs/dbraw/zinc/06/87/40/565068740.db2.gz SJUMBQHLCUTQCA-QWHCGFSZSA-N 0 3 377.286 3.168 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)c1csc(I)c1 ZINC000113426423 565069765 /nfs/dbraw/zinc/06/97/65/565069765.db2.gz ACBJUDMRVURXNT-NSHDSACASA-N 0 3 380.295 3.059 10 0 GGAEHN C[C@@H](NC(=O)Nc1ccn(CCN(C)C)n1)c1cccc(Br)c1 ZINC000156230975 565075897 /nfs/dbraw/zinc/07/58/97/565075897.db2.gz PCZSNNCACQLYQI-GFCCVEGCSA-N 0 3 380.290 3.090 10 0 GGAEHN CC[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1cccc(C)c1Br ZINC000156435535 565086715 /nfs/dbraw/zinc/08/67/15/565086715.db2.gz YTKGOBDUQSAKGN-ZIAGYGMSSA-N 0 3 387.343 3.005 10 0 GGAEHN O=C(NCCc1nc2cc(Cl)ccc2s1)N1CC[C@@H](N2CC=CC2)C1 ZINC000266669788 565087850 /nfs/dbraw/zinc/08/78/50/565087850.db2.gz NCQCBPRYCURNLZ-CQSZACIVSA-N 0 3 376.913 3.148 10 0 GGAEHN CCC[C@H](C)NC(=O)C(C)S(=O)(=O)Cc1sc(C)nc1C(F)(F)F ZINC000183711656 565089830 /nfs/dbraw/zinc/08/98/30/565089830.db2.gz OYYFEKRRWBICME-DTWKUNHWSA-N 0 3 386.461 3.078 10 0 GGAEHN Cc1nc(C(F)(F)F)c(CS(=O)(=O)C(C)C(=O)N2CCC(C)CC2)s1 ZINC000183708455 565090284 /nfs/dbraw/zinc/09/02/84/565090284.db2.gz DJISQCXIHXENGR-JTQLQIEISA-N 0 3 398.472 3.032 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CCOc3ccc(Br)cc32)CCN1C ZINC000266833213 565092772 /nfs/dbraw/zinc/09/27/72/565092772.db2.gz ZQFQRFNXAUQALZ-XNRPHZJLSA-N 0 3 396.329 3.397 10 0 GGAEHN CC(C)N1CCN(C2CCN(Cc3ncc(C(F)(F)F)s3)CC2)CC1 ZINC000369482152 565093859 /nfs/dbraw/zinc/09/38/59/565093859.db2.gz NSNDGSXENLGLDS-UHFFFAOYSA-N 0 3 376.492 3.152 10 0 GGAEHN CC(C)(C)OC[C@@H](O)CN1CCC(Oc2cccc(Br)c2)CC1 ZINC000183824027 565096663 /nfs/dbraw/zinc/09/66/63/565096663.db2.gz OHLOUQSHEBQEKS-HNNXBMFYSA-N 0 3 386.330 3.468 10 0 GGAEHN CC[C@@H]1CN(CCC(=O)Nc2ccccc2Br)C[C@@]2(CCOC2)O1 ZINC000369545697 565096884 /nfs/dbraw/zinc/09/68/84/565096884.db2.gz JEZBJWLLYJKZMH-RDTXWAMCSA-N 0 3 397.313 3.048 10 0 GGAEHN OC[C@H](NCCCOc1ccc2c(c1)OCO2)c1cccc(Br)c1 ZINC000183901198 565102352 /nfs/dbraw/zinc/10/23/52/565102352.db2.gz MCEMVVVNFYICMI-INIZCTEOSA-N 0 3 394.265 3.270 10 0 GGAEHN Cc1ccccc1NC(=O)CCN[C@H](CO)c1cccc(Br)c1 ZINC000183898205 565103325 /nfs/dbraw/zinc/10/33/25/565103325.db2.gz UHQKVVSHYFRKBE-QGZVFWFLSA-N 0 3 377.282 3.409 10 0 GGAEHN O=C(CCN[C@H](CO)c1cccc(Br)c1)Nc1ccc(F)cc1 ZINC000183919786 565104003 /nfs/dbraw/zinc/10/40/03/565104003.db2.gz LLXBETPOWQARLS-MRXNPFEDSA-N 0 3 381.245 3.240 10 0 GGAEHN O=C(CCN[C@@H](CO)c1cccc(Br)c1)Nc1ccc(F)cc1 ZINC000183919813 565104821 /nfs/dbraw/zinc/10/48/21/565104821.db2.gz LLXBETPOWQARLS-INIZCTEOSA-N 0 3 381.245 3.240 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)Cc1c[nH]c2cccc(Br)c12 ZINC000157289235 565126934 /nfs/dbraw/zinc/12/69/34/565126934.db2.gz UOFTZGIOZMNPDE-CQSZACIVSA-N 0 3 378.314 3.416 10 0 GGAEHN C[C@H](CC(=O)N[C@@H](C)CCN1CCN(C)CC1)c1ccc(Br)cc1 ZINC000184334355 565129355 /nfs/dbraw/zinc/12/93/55/565129355.db2.gz TVVGOIPYBLVXEK-CVEARBPZSA-N 0 3 396.373 3.085 10 0 GGAEHN Cc1nc([C@@H]2CCCN(C[C@@](C)(O)c3ccc(Br)cc3F)C2)n[nH]1 ZINC000292774493 565132880 /nfs/dbraw/zinc/13/28/80/565132880.db2.gz KALLMIRCRCHBNX-SJKOYZFVSA-N 0 3 397.292 3.102 10 0 GGAEHN Cc1n[nH]c([C@@H]2CCCN(C[C@@](C)(O)c3ccc(Br)cc3F)C2)n1 ZINC000292774493 565132884 /nfs/dbraw/zinc/13/28/84/565132884.db2.gz KALLMIRCRCHBNX-SJKOYZFVSA-N 0 3 397.292 3.102 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)c1ccc(Sc2ccccc2Cl)nn1 ZINC000268145422 565142065 /nfs/dbraw/zinc/14/20/65/565142065.db2.gz ODRSGMPDXATDIB-CYBMUJFWSA-N 0 3 376.913 3.447 10 0 GGAEHN C[C@](O)(CN1CCC2(CC1)OCCCO2)c1ccc(Br)cc1F ZINC000292951681 565143078 /nfs/dbraw/zinc/14/30/78/565143078.db2.gz IROQRQZHVONTNC-INIZCTEOSA-N 0 3 388.277 3.025 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)c2ccn(-c3ccc(Br)cc3)n2)CCN1C ZINC000293050017 565147836 /nfs/dbraw/zinc/14/78/36/565147836.db2.gz AFYLBFOJJPGLJB-CJNGLKHVSA-N 0 3 391.313 3.190 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)c2ccn(-c3ccc(Br)cc3)n2)CCN1C ZINC000293050015 565147999 /nfs/dbraw/zinc/14/79/99/565147999.db2.gz AFYLBFOJJPGLJB-BBRMVZONSA-N 0 3 391.313 3.190 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)c2ccn(-c3ccc(Br)cc3)n2)CCN1C ZINC000293050022 565148420 /nfs/dbraw/zinc/14/84/20/565148420.db2.gz AFYLBFOJJPGLJB-XJKSGUPXSA-N 0 3 391.313 3.190 10 0 GGAEHN CC(C)N(CCN(C)C)C(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000157965641 565150343 /nfs/dbraw/zinc/15/03/43/565150343.db2.gz YQGLVUIMZNZKGT-HNNXBMFYSA-N 0 3 384.318 3.254 10 0 GGAEHN CC(C)OCCN1CCC(NC(=O)Cc2cscc2Br)CC1 ZINC000293155193 565153249 /nfs/dbraw/zinc/15/32/49/565153249.db2.gz HZFVKTUIHFPZFO-UHFFFAOYSA-N 0 3 389.359 3.059 10 0 GGAEHN COc1ccc(-c2nc(C)c([C@H](C)NC[C@@H](C)CS(C)(=O)=O)s2)cc1 ZINC000184787719 565156811 /nfs/dbraw/zinc/15/68/11/565156811.db2.gz CUTQRPOEHYPAPO-OLZOCXBDSA-N 0 3 382.551 3.458 10 0 GGAEHN COc1ccc(-c2nc(C)c([C@@H](C)NC[C@@H](C)CS(C)(=O)=O)s2)cc1 ZINC000184787702 565156826 /nfs/dbraw/zinc/15/68/26/565156826.db2.gz CUTQRPOEHYPAPO-CHWSQXEVSA-N 0 3 382.551 3.458 10 0 GGAEHN OCCN(Cc1ccc(Cl)c(Cl)c1)C[C@H](O)COCc1ccccc1 ZINC000158131315 565157284 /nfs/dbraw/zinc/15/72/84/565157284.db2.gz WFAHGOFDPSKBQE-KRWDZBQOSA-N 0 3 384.303 3.365 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)Cc2c[nH]c3cc(Br)ccc23)CCN1C ZINC000158450328 565169956 /nfs/dbraw/zinc/16/99/56/565169956.db2.gz ZDOQPQKSGQWRIG-WFASDCNBSA-N 0 3 378.314 3.414 10 0 GGAEHN Cc1cnn([C@@H]2CCN(C[C@@](C)(O)c3ccc(Br)cc3F)C2)c1 ZINC000293533494 565173364 /nfs/dbraw/zinc/17/33/64/565173364.db2.gz JPHXTEPBZBHEJR-RHSMWYFYSA-N 0 3 382.277 3.248 10 0 GGAEHN Cc1cccc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1I ZINC000158988624 565190474 /nfs/dbraw/zinc/19/04/74/565190474.db2.gz VVHUTANILOAXBV-GXTWGEPZSA-N 0 3 386.277 3.058 10 0 GGAEHN CCN(CCc1nccs1)C[C@@H](O)COc1ccc(Br)cc1 ZINC000159307238 565202104 /nfs/dbraw/zinc/20/21/04/565202104.db2.gz RDMONVNRHZPWJY-CQSZACIVSA-N 0 3 385.327 3.210 10 0 GGAEHN COc1cc(Br)c(C(=O)NCCN2CCCC[C@H]2C)cc1OC ZINC000294548142 565217494 /nfs/dbraw/zinc/21/74/94/565217494.db2.gz QTDIMWFTBVTSMC-GFCCVEGCSA-N 0 3 385.302 3.071 10 0 GGAEHN CCN1CCC[C@H](NC(=O)c2cc(Br)ccc2Br)C1 ZINC000160454731 565245496 /nfs/dbraw/zinc/24/54/96/565245496.db2.gz NRRQRLDJBLTLAJ-NSHDSACASA-N 0 3 390.119 3.426 10 0 GGAEHN CC[C@@H](Cc1ccccc1Br)N(C)C[C@@H](C)CS(C)(=O)=O ZINC000185923295 565228757 /nfs/dbraw/zinc/22/87/57/565228757.db2.gz MRMBECHRMDQNHJ-HIFRSBDPSA-N 0 3 376.360 3.383 10 0 GGAEHN O=C(Cc1sccc1Br)NCC1CCN(c2ccncc2)CC1 ZINC000294839437 565230596 /nfs/dbraw/zinc/23/05/96/565230596.db2.gz AYBHWOWLVXMECH-UHFFFAOYSA-N 0 3 394.338 3.481 10 0 GGAEHN C[C@@H]1CN(CCCCNC(=O)Cc2cscc2Br)C[C@H](C)O1 ZINC000294856337 565231883 /nfs/dbraw/zinc/23/18/83/565231883.db2.gz GIQPJSMISUQIPY-BETUJISGSA-N 0 3 389.359 3.059 10 0 GGAEHN COc1cc(Br)c(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1OC ZINC000294876875 565233599 /nfs/dbraw/zinc/23/35/99/565233599.db2.gz HTNQTRLMHPHSFC-NWDGAFQWSA-N 0 3 385.302 3.021 10 0 GGAEHN COc1cc(Br)c(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1OC ZINC000294876876 565233624 /nfs/dbraw/zinc/23/36/24/565233624.db2.gz HTNQTRLMHPHSFC-RYUDHWBXSA-N 0 3 385.302 3.021 10 0 GGAEHN O=S1(=O)CCC(CN2CCC[C@H]2Cc2ccc(Br)cc2)CC1 ZINC000372417826 565236073 /nfs/dbraw/zinc/23/60/73/565236073.db2.gz YCFQSQAGGCAKRG-KRWDZBQOSA-N 0 3 386.355 3.281 10 0 GGAEHN C[C@H](CN[C@H](c1ccc(Br)cc1)c1cncnc1)N(C)C1CC1 ZINC000186177691 565244854 /nfs/dbraw/zinc/24/48/54/565244854.db2.gz YLGDXGHEVCIOCK-FZKQIMNGSA-N 0 3 375.314 3.401 10 0 GGAEHN CN(C[C@H]1CCN(C)C1)C(=O)c1cc(Br)ccc1Br ZINC000160549911 565250512 /nfs/dbraw/zinc/25/05/12/565250512.db2.gz VULBTCHIMXKOPN-JTQLQIEISA-N 0 3 390.119 3.235 10 0 GGAEHN CS(=O)(=O)[C@@H]1CCC[C@@H](N[C@@H]2CCOc3c(Br)cccc32)C1 ZINC000271496357 565255566 /nfs/dbraw/zinc/25/55/66/565255566.db2.gz MLADHOVTYVKFHK-LALPHHSUSA-N 0 3 388.327 3.218 10 0 GGAEHN C[C@@H](c1ccc(CN2CCC(CNS(C)(=O)=O)CC2)cc1)C(F)(F)F ZINC000295391638 565263783 /nfs/dbraw/zinc/26/37/83/565263783.db2.gz VCXQWKVMJKMGKE-ZDUSSCGKSA-N 0 3 378.460 3.114 10 0 GGAEHN COC(=O)c1cc(NC(=O)N2CCCN(C(C)C)CC2)ccc1Br ZINC000271715016 565266062 /nfs/dbraw/zinc/26/60/62/565266062.db2.gz OZVDATQAECSOPC-UHFFFAOYSA-N 0 3 398.301 3.184 10 0 GGAEHN Cc1noc(Cl)c1CC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000373481746 565287820 /nfs/dbraw/zinc/28/78/20/565287820.db2.gz QNONSYJSVCXUQT-UHFFFAOYSA-N 0 3 379.810 3.100 10 0 GGAEHN CNC(=O)[C@H](C)Oc1ccc(Br)cc1CNCCCC(C)(F)F ZINC000295968140 565296072 /nfs/dbraw/zinc/29/60/72/565296072.db2.gz IHELZDFULSUTIF-NSHDSACASA-N 0 3 393.272 3.487 10 0 GGAEHN CCC[C@H](C(=O)NCc1cc(Br)ccc1OC(F)F)N(C)C ZINC000161892550 565296708 /nfs/dbraw/zinc/29/67/08/565296708.db2.gz AUDSZUOBVPQRJM-GFCCVEGCSA-N 0 3 379.245 3.397 10 0 GGAEHN C[C@@H](CC(=O)NCCCCN1CCN(C)CC1)c1ccc(Br)cc1 ZINC000161901157 565297604 /nfs/dbraw/zinc/29/76/04/565297604.db2.gz DIJQPVSHDFEJDG-INIZCTEOSA-N 0 3 396.373 3.087 10 0 GGAEHN C[C@@H](NC(=O)N[C@H]1CCOc2ccc(Br)cc21)C1=CCN(C)CC1 ZINC000272855934 565299530 /nfs/dbraw/zinc/29/95/30/565299530.db2.gz UPXYMQCEFHHMFU-WBMJQRKESA-N 0 3 394.313 3.222 10 0 GGAEHN C[C@@H](N[C@@H](C)Cc1ccc(Br)cc1F)C(=O)NCc1ccco1 ZINC000161985359 565299992 /nfs/dbraw/zinc/29/99/92/565299992.db2.gz CDIVZNKHCZVDTI-NWDGAFQWSA-N 0 3 383.261 3.407 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)N[C@H](C)C(=O)NCc1ccco1 ZINC000161985441 565300396 /nfs/dbraw/zinc/30/03/96/565300396.db2.gz CDIVZNKHCZVDTI-VXGBXAGGSA-N 0 3 383.261 3.407 10 0 GGAEHN CCN1CCC[C@H](NCc2cc(Br)cc(Br)c2N)C1 ZINC000187135886 565312228 /nfs/dbraw/zinc/31/22/28/565312228.db2.gz VEJJFHLHTJRSMU-LBPRGKRZSA-N 0 3 391.151 3.368 10 0 GGAEHN CN1CCC(CC(=O)N2CCO[C@@H](c3ccc(Br)cc3)C2)CC1 ZINC000273295960 565315712 /nfs/dbraw/zinc/31/57/12/565315712.db2.gz YUXAHKRVIWKRFM-QGZVFWFLSA-N 0 3 381.314 3.081 10 0 GGAEHN COc1c(Br)cccc1CN[C@@H]1CCCN(c2cccnn2)C1 ZINC000187217630 565317519 /nfs/dbraw/zinc/31/75/19/565317519.db2.gz VTPZVDUJFGWDIV-CQSZACIVSA-N 0 3 377.286 3.006 10 0 GGAEHN CC(C)[C@@H]1CCCC[C@@H]1NCC(=O)Nc1cc(S(C)(=O)=O)ccc1Cl ZINC000162597788 565322256 /nfs/dbraw/zinc/32/22/56/565322256.db2.gz CZAGRJBEWYLFII-HOCLYGCPSA-N 0 3 386.945 3.486 10 0 GGAEHN CC(C)[C@H]1CCCC[C@@H]1NCC(=O)Nc1cc(S(C)(=O)=O)ccc1Cl ZINC000162597921 565322453 /nfs/dbraw/zinc/32/24/53/565322453.db2.gz CZAGRJBEWYLFII-ZBFHGGJFSA-N 0 3 386.945 3.486 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(C)cc(Br)c2)[C@H](C)C1 ZINC000187337418 565324038 /nfs/dbraw/zinc/32/40/38/565324038.db2.gz HIAGHSKINUYQMN-CJNGLKHVSA-N 0 3 389.359 3.108 10 0 GGAEHN C[C@H](C1CCN(C)CC1)N(C)C(=O)NCCc1ccccc1Br ZINC000273621707 565327703 /nfs/dbraw/zinc/32/77/03/565327703.db2.gz RFIGYRIQALKIBW-CQSZACIVSA-N 0 3 382.346 3.363 10 0 GGAEHN Nc1c(Br)cc(Br)cc1CNC[C@H]1CCCC[C@H]1O ZINC000187400618 565329815 /nfs/dbraw/zinc/32/98/15/565329815.db2.gz MFWXJZAZEOTNIY-NOZJJQNGSA-N 0 3 392.135 3.435 10 0 GGAEHN CCS(=O)(=O)CCCCCN[C@@H]1CCOc2c(Br)cccc21 ZINC000374300330 565331657 /nfs/dbraw/zinc/33/16/57/565331657.db2.gz CYMIDSXQRXXQFW-OAHLLOKOSA-N 0 3 390.343 3.467 10 0 GGAEHN CN1CCC2(CCCN2C(=O)c2cc(Br)cc3nc[nH]c32)CC1 ZINC000374365800 565333986 /nfs/dbraw/zinc/33/39/86/565333986.db2.gz PWIXCEWPPQNAEC-UHFFFAOYSA-N 0 3 377.286 3.026 10 0 GGAEHN O=C(N[C@@H]1CCOc2c(Br)cccc21)N1CC[C@H](N2CCCC2)C1 ZINC000374392363 565336179 /nfs/dbraw/zinc/33/61/79/565336179.db2.gz AESJAHVVIAPJBO-XJKSGUPXSA-N 0 3 394.313 3.152 10 0 GGAEHN O=C(N[C@H]1CCOc2c(Br)cccc21)N1CC[C@@H](N2CCCC2)C1 ZINC000374392359 565336518 /nfs/dbraw/zinc/33/65/18/565336518.db2.gz AESJAHVVIAPJBO-CJNGLKHVSA-N 0 3 394.313 3.152 10 0 GGAEHN O=C(N[C@@H]1CCOc2c(Br)cccc21)N1CC[C@@H](N2CCCC2)C1 ZINC000374392362 565336547 /nfs/dbraw/zinc/33/65/47/565336547.db2.gz AESJAHVVIAPJBO-CZUORRHYSA-N 0 3 394.313 3.152 10 0 GGAEHN O=C(CSCC(=O)c1ccc(Cl)cc1)NC1CCN(C2CCC2)CC1 ZINC000296882640 565343666 /nfs/dbraw/zinc/34/36/66/565343666.db2.gz HWXXRUCRGPSFOW-UHFFFAOYSA-N 0 3 380.941 3.389 10 0 GGAEHN CS[C@@H]1CN(CC(=O)Nc2cccc(Cl)c2Cl)C[C@H]1N1CCCC1 ZINC000273966789 565349442 /nfs/dbraw/zinc/34/94/42/565349442.db2.gz GHKFNIPYIUAQQR-HUUCEWRRSA-N 0 3 388.364 3.444 10 0 GGAEHN O[C@@H]1[C@H](CNCc2cc(Br)cc3c2OCC3)CCC12CCOCC2 ZINC000374672265 565350407 /nfs/dbraw/zinc/35/04/07/565350407.db2.gz CFMAXPVIIZOCHI-KBXCAEBGSA-N 0 3 396.325 3.041 10 0 GGAEHN O[C@H]1[C@H](CNCc2cc(Br)cc3c2OCC3)CCC12CCOCC2 ZINC000374672267 565351147 /nfs/dbraw/zinc/35/11/47/565351147.db2.gz CFMAXPVIIZOCHI-KSSFIOAISA-N 0 3 396.325 3.041 10 0 GGAEHN COc1cc(Br)ccc1CNC[C@H]1CCC2(CCOCC2)[C@@H]1O ZINC000374724125 565353408 /nfs/dbraw/zinc/35/34/08/565353408.db2.gz UEOKMMAZDVWIFS-RHSMWYFYSA-N 0 3 384.314 3.115 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000187843796 565358547 /nfs/dbraw/zinc/35/85/47/565358547.db2.gz ROCPTWWPAWYKHB-IUODEOHRSA-N 0 3 384.318 3.082 10 0 GGAEHN C[C@H]1CN(Cc2cc(Br)cc3cccnc32)C[C@@H]1N1CCOCC1 ZINC000164298277 565358980 /nfs/dbraw/zinc/35/89/80/565358980.db2.gz RLCIBAACGNEMLI-KSSFIOAISA-N 0 3 390.325 3.150 10 0 GGAEHN O=C1C[C@@H]([C@H]2CCCCN2Cc2ccc(Br)c3cccnc23)CN1 ZINC000374894632 565359567 /nfs/dbraw/zinc/35/95/67/565359567.db2.gz LTBXZSHDMYBWET-RHSMWYFYSA-N 0 3 388.309 3.488 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000187843874 565359620 /nfs/dbraw/zinc/35/96/20/565359620.db2.gz ROCPTWWPAWYKHB-WFASDCNBSA-N 0 3 384.318 3.082 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)Nc2cnc(Cl)c(Br)c2)CCN1C ZINC000274327932 565367771 /nfs/dbraw/zinc/36/77/71/565367771.db2.gz DKEKPAASJVRWIP-GXSJLCMTSA-N 0 3 375.698 3.444 10 0 GGAEHN CCOc1cc(CN[C@H]2COc3ccccc3[C@@H]2O)cc(Br)c1O ZINC000297405833 565371086 /nfs/dbraw/zinc/37/10/86/565371086.db2.gz KVBQDVSSOYKBGW-YOEHRIQHSA-N 0 3 394.265 3.138 10 0 GGAEHN CNS(=O)(=O)c1ccc([C@H](C)NCc2ccc(F)cc2CSC)cc1 ZINC000167131968 565376892 /nfs/dbraw/zinc/37/68/92/565376892.db2.gz OYEFYJDJJNEBNS-ZDUSSCGKSA-N 0 3 382.526 3.448 10 0 GGAEHN O=C(CN1CC[C@H](N2CCCC2)C1)Nc1c(Cl)cccc1C(F)(F)F ZINC000170745490 565390962 /nfs/dbraw/zinc/39/09/62/565390962.db2.gz DTNHAPRITRYHFY-LBPRGKRZSA-N 0 3 375.822 3.467 10 0 GGAEHN C[C@@H](NC[C@@H]1CN(C)CCO1)c1ccc(Br)cc1C(F)(F)F ZINC000188268450 565392282 /nfs/dbraw/zinc/39/22/82/565392282.db2.gz NXGYDQYYWKYQNQ-ZYHUDNBSSA-N 0 3 381.236 3.449 10 0 GGAEHN C[C@@H](NC[C@H]1CN(C)CCO1)c1ccc(Br)cc1C(F)(F)F ZINC000188268495 565392457 /nfs/dbraw/zinc/39/24/57/565392457.db2.gz NXGYDQYYWKYQNQ-PWSUYJOCSA-N 0 3 381.236 3.449 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cccn2Cc2cccs2)C[C@@H]1N1CCCC1 ZINC000275075391 565392678 /nfs/dbraw/zinc/39/26/78/565392678.db2.gz CMBDRZNOJWYHTM-ROUUACIJSA-N 0 3 375.563 3.250 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)c2ccc(I)cc2Cl)C1 ZINC000170827893 565394944 /nfs/dbraw/zinc/39/49/44/565394944.db2.gz YSBCPZVAQFBFEJ-LLVKDONJSA-N 0 3 392.668 3.159 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)c2ccc(COc3cccc(Br)c3)o2)C1 ZINC000170865394 565396001 /nfs/dbraw/zinc/39/60/01/565396001.db2.gz YCEJJROWEZKLNO-CQSZACIVSA-N 0 3 393.281 3.397 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)c2csc(-c3cc(Br)cs3)n2)C1 ZINC000170864675 565396209 /nfs/dbraw/zinc/39/62/09/565396209.db2.gz BKFQZQMMXFYOPU-JTQLQIEISA-N 0 3 386.340 3.410 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)c2cccnc2Oc2ccc(Br)cc2)C1 ZINC000170866333 565397107 /nfs/dbraw/zinc/39/71/07/565397107.db2.gz MKXYUEVJVFIYBO-AWEZNQCLSA-N 0 3 390.281 3.413 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)c1cccc(CN(C)C)c1 ZINC000188438312 565401355 /nfs/dbraw/zinc/40/13/55/565401355.db2.gz ZZYPRRWNWDQTFS-UHFFFAOYSA-N 0 3 377.282 3.449 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)Nc2ccc(Br)cc2Br)C1 ZINC000171070065 565406670 /nfs/dbraw/zinc/40/66/70/565406670.db2.gz ZYDMJMNIDJPFPC-SNVBAGLBSA-N 0 3 391.107 3.379 10 0 GGAEHN CCOc1cc(C[NH2+]C2CCN(C(=O)C(C)C)CC2)cc(Br)c1[O-] ZINC000298428065 565413314 /nfs/dbraw/zinc/41/33/14/565413314.db2.gz UXLSJALUYISJQH-UHFFFAOYSA-N 0 3 399.329 3.290 10 0 GGAEHN CCN1CC[C@H]2OCCN(CCC(=O)Nc3cc(Cl)ccc3Cl)[C@H]2C1 ZINC000298467073 565415320 /nfs/dbraw/zinc/41/53/20/565415320.db2.gz SAPAOLWDCAJFJB-DLBZAZTESA-N 0 3 386.323 3.117 10 0 GGAEHN CCOc1cc(C[NH2+]C2CCC(NC(C)=O)CC2)cc(Br)c1[O-] ZINC000298525995 565418340 /nfs/dbraw/zinc/41/83/40/565418340.db2.gz RUMPHWUPPZRPCT-UHFFFAOYSA-N 0 3 385.302 3.090 10 0 GGAEHN CC(C)(C)N1CC[C@H](NCCS(C)(=O)=O)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000298535747 565419190 /nfs/dbraw/zinc/41/91/90/565419190.db2.gz MQIQKQKVBVHWHQ-HOTGVXAUSA-N 0 3 376.925 3.027 10 0 GGAEHN CCOc1cc(C[NH2+]C[C@@H](O)c2cccc(OC)c2)cc(Br)c1[O-] ZINC000298547435 565419441 /nfs/dbraw/zinc/41/94/41/565419441.db2.gz UHBPCFAWIDYIJK-MRXNPFEDSA-N 0 3 396.281 3.385 10 0 GGAEHN C[C@H](NCCC(=O)Nc1ccccc1Cl)c1ccc(S(C)(=O)=O)cc1 ZINC000298701853 565425895 /nfs/dbraw/zinc/42/58/95/565425895.db2.gz AANLZQBRGDFDGV-ZDUSSCGKSA-N 0 3 380.897 3.423 10 0 GGAEHN COc1cc(CN(C)CC2(CO)CC2)cc(Br)c1OC(F)F ZINC000188950788 565435527 /nfs/dbraw/zinc/43/55/27/565435527.db2.gz CTVJMYHARPGLOT-UHFFFAOYSA-N 0 3 380.229 3.263 10 0 GGAEHN COc1cc(C[NH2+][C@@H](CO)Cc2ccc(C)cc2)cc(Br)c1[O-] ZINC000188989548 565436785 /nfs/dbraw/zinc/43/67/85/565436785.db2.gz HPSXKVONZQFKSP-OAHLLOKOSA-N 0 3 380.282 3.165 10 0 GGAEHN CCOc1cc(C[NH2+]C[C@@H](O)c2ccccc2OC)cc(Br)c1[O-] ZINC000299064589 565437832 /nfs/dbraw/zinc/43/78/32/565437832.db2.gz UAQXADBHMAVKSO-OAHLLOKOSA-N 0 3 396.281 3.385 10 0 GGAEHN O=C(CCCCOc1ccc(Br)cc1)N1CCN2CCC[C@@H]2C1 ZINC000171716549 565447417 /nfs/dbraw/zinc/44/74/17/565447417.db2.gz QQTOMVDLKOXNII-MRXNPFEDSA-N 0 3 381.314 3.305 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)N(C)CC1CCN(C)CC1 ZINC000171742949 565448408 /nfs/dbraw/zinc/44/84/08/565448408.db2.gz RHIVGBDIRQBDKI-AWEZNQCLSA-N 0 3 382.346 3.363 10 0 GGAEHN O[C@@H](COc1cccc(Br)c1)CN1CCC([C@@H]2CCCO2)CC1 ZINC000189170204 565448907 /nfs/dbraw/zinc/44/89/07/565448907.db2.gz MBTFWIDDFWOXDT-AEFFLSMTSA-N 0 3 384.314 3.080 10 0 GGAEHN O=C(c1n[nH]c2ccc(Br)cc21)N1CCC[C@@H]1CN1CCCC1 ZINC000171797677 565451558 /nfs/dbraw/zinc/45/15/58/565451558.db2.gz RIMPQLNONOLUPA-CYBMUJFWSA-N 0 3 377.286 3.026 10 0 GGAEHN CN(C(=O)/C=C/c1ccc(Cl)s1)C1CCN(CCn2cccn2)CC1 ZINC000171934545 565458274 /nfs/dbraw/zinc/45/82/74/565458274.db2.gz RWSJOGFKXFRSAV-GQCTYLIASA-N 0 3 378.929 3.234 10 0 GGAEHN CN(C)Cc1ccccc1CNC(=O)c1[nH]nc2ccc(Br)cc21 ZINC000171947805 565458710 /nfs/dbraw/zinc/45/87/10/565458710.db2.gz OJONOYFLDKHOSF-UHFFFAOYSA-N 0 3 387.281 3.317 10 0 GGAEHN O=C(NC[C@@H]1CCCSC1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000376979143 565461789 /nfs/dbraw/zinc/46/17/89/565461789.db2.gz NEUHJGPKPIYSML-GRTSSRMGSA-N 0 3 379.492 3.234 10 0 GGAEHN CNc1snc(C)c1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000376973657 565461870 /nfs/dbraw/zinc/46/18/70/565461870.db2.gz XRWLDZFWIQAKKY-UHFFFAOYSA-N 0 3 376.448 3.028 10 0 GGAEHN O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C[C@H](O)CC(F)(F)F)CC1 ZINC000189379079 565462851 /nfs/dbraw/zinc/46/28/51/565462851.db2.gz SJXOGRCWGBJPOR-GFCCVEGCSA-N 0 3 382.785 3.443 10 0 GGAEHN CN(C)Cc1c2ccccc2oc1C(=O)Nc1cc(Br)c[nH]c1=O ZINC000172054443 565464078 /nfs/dbraw/zinc/46/40/78/565464078.db2.gz GNGDRQYSNXVKKU-UHFFFAOYSA-N 0 3 390.237 3.198 10 0 GGAEHN C[C@@H](NC(=O)N1CCO[C@H](CN(C)C)C1)c1cc(F)c(Cl)cc1Cl ZINC000172115580 565467510 /nfs/dbraw/zinc/46/75/10/565467510.db2.gz WPOMSYXQVVLWPK-GHMZBOCLSA-N 0 3 378.275 3.166 10 0 GGAEHN C[C@H](NC(=O)N1CCO[C@@H](CN(C)C)C1)c1cc(F)c(Cl)cc1Cl ZINC000172115585 565467623 /nfs/dbraw/zinc/46/76/23/565467623.db2.gz WPOMSYXQVVLWPK-QWRGUYRKSA-N 0 3 378.275 3.166 10 0 GGAEHN O=S(=O)(c1ccc(N2CCCC[C@H](N3CCCC3)C2)cc1)C(F)(F)F ZINC000301183998 565470939 /nfs/dbraw/zinc/47/09/39/565470939.db2.gz JAYQEBWVUUSCKW-HNNXBMFYSA-N 0 3 376.444 3.435 10 0 GGAEHN O=C(NCCCc1ccc(Br)cc1F)N1CCN2CCC[C@@H]2C1 ZINC000172195214 565472061 /nfs/dbraw/zinc/47/20/61/565472061.db2.gz OGGWFGVRMSQVAB-OAHLLOKOSA-N 0 3 384.293 3.010 10 0 GGAEHN COC(=O)C1CCN(CCCNC(=O)c2c(Cl)cc(F)cc2Cl)CC1 ZINC000277207381 565482598 /nfs/dbraw/zinc/48/25/98/565482598.db2.gz KDFNUYYBEZYXRL-UHFFFAOYSA-N 0 3 391.270 3.137 10 0 GGAEHN CN1CCC[C@H](CNc2cnn(C)c(=O)c2Br)[C@@H]1c1cccs1 ZINC000301403117 565484122 /nfs/dbraw/zinc/48/41/22/565484122.db2.gz DORNWIBWOYNBJL-IAQYHMDHSA-N 0 3 397.342 3.099 10 0 GGAEHN CN1CC[C@@H](NC(=O)Nc2cccnc2Br)[C@@H]1c1ccccc1 ZINC000189740525 565484350 /nfs/dbraw/zinc/48/43/50/565484350.db2.gz UKIMKWHBIKRURQ-HIFRSBDPSA-N 0 3 375.270 3.411 10 0 GGAEHN C[C@H]1COCC[C@H]1NCc1coc(-c2ccc(I)cc2)n1 ZINC000277302081 565488211 /nfs/dbraw/zinc/48/82/11/565488211.db2.gz CLPJAIHTPJMHJJ-XHDPSFHLSA-N 0 3 398.244 3.461 10 0 GGAEHN CC(C)S(=O)(=O)CCCN[C@@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000377663784 565491672 /nfs/dbraw/zinc/49/16/72/565491672.db2.gz COJINOBBVBFXKM-SJORKVTESA-N 0 3 376.925 3.027 10 0 GGAEHN CN1CCN(CC2CCN(C(=O)c3c(Cl)cc(F)cc3Cl)CC2)CC1 ZINC000277374909 565492570 /nfs/dbraw/zinc/49/25/70/565492570.db2.gz YYWNYZRYBQSTOP-UHFFFAOYSA-N 0 3 388.314 3.232 10 0 GGAEHN O=S(=O)(c1ccc(CC(F)(F)F)cc1)N1CCC(N2CCCC2)CC1 ZINC000189862938 565492992 /nfs/dbraw/zinc/49/29/92/565492992.db2.gz XQLDZBBNSMCUQE-UHFFFAOYSA-N 0 3 376.444 3.040 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(CC(F)(F)F)cc2)[C@H](C)C1 ZINC000190007453 565502230 /nfs/dbraw/zinc/50/22/30/565502230.db2.gz RRRBGXFLTXJICJ-CZUORRHYSA-N 0 3 378.460 3.142 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1CC[C@H](O)[C@H](C)C1 ZINC000190057816 565505589 /nfs/dbraw/zinc/50/55/89/565505589.db2.gz AVTHREXUFSHSEN-XIKOKIGWSA-N 0 3 378.314 3.454 10 0 GGAEHN CC1CCC(N2CCN(c3cc(Br)cc(F)c3C(N)=O)CC2)CC1 ZINC000301921859 565518479 /nfs/dbraw/zinc/51/84/79/565518479.db2.gz DUKKKKVXXVZWKT-UHFFFAOYSA-N 0 3 398.320 3.388 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NCc1cccc(CN(C)C)c1 ZINC000173030883 565521461 /nfs/dbraw/zinc/52/14/61/565521461.db2.gz VPBBILWGFMOZOI-UHFFFAOYSA-N 0 3 391.309 3.378 10 0 GGAEHN CN(C)CCOc1ccc(CNC(=O)[C@@H]2SCCc3sccc32)cc1 ZINC000173031210 565521675 /nfs/dbraw/zinc/52/16/75/565521675.db2.gz FXERLCYDQZXOHM-GOSISDBHSA-N 0 3 376.547 3.335 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N1CCN(C2CCCC2)CC1 ZINC000173051492 565523756 /nfs/dbraw/zinc/52/37/56/565523756.db2.gz APKFCYKDKIRNDJ-UHFFFAOYSA-N 0 3 381.314 3.087 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2cn(C)nc2-c2cccs2)n1 ZINC000190349026 565524103 /nfs/dbraw/zinc/52/41/03/565524103.db2.gz KNIZDMGLCCRFRR-UHFFFAOYSA-N 0 3 376.507 3.114 10 0 GGAEHN CN(C)C[C@H]1CN(c2ccc3cc(Br)cc(Cl)c3n2)CCO1 ZINC000302016767 565525387 /nfs/dbraw/zinc/52/53/87/565525387.db2.gz LXRXJWLQIVUQNL-ZDUSSCGKSA-N 0 3 384.705 3.418 10 0 GGAEHN C[C@H](CN(C)C[C@H](O)COC[C@@H]1CCCO1)Oc1ccc(Cl)c(Cl)c1 ZINC000190355762 565525575 /nfs/dbraw/zinc/52/55/75/565525575.db2.gz LAIVCQIWEKIUHA-YCPHGPKFSA-N 0 3 392.323 3.249 10 0 GGAEHN COC[C@@](C)(O)CN[C@@H](C)c1ccc(Br)cc1Br ZINC000382575256 565543236 /nfs/dbraw/zinc/54/32/36/565543236.db2.gz VJFXVJWQHIKIKZ-ZANVPECISA-N 0 3 381.108 3.260 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)C(=O)Nc1cc(Cl)c(F)c(Cl)c1 ZINC000190366587 565526912 /nfs/dbraw/zinc/52/69/12/565526912.db2.gz ALACGCCELWBPAL-NSHDSACASA-N 0 3 378.275 3.164 10 0 GGAEHN COCC[C@@H](COC)NCc1ccc(Br)c(Br)c1 ZINC000385738157 565545802 /nfs/dbraw/zinc/54/58/02/565545802.db2.gz PRKLCTCTSSPSOY-NSHDSACASA-N 0 3 381.108 3.353 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NCCC(=O)Nc1cc(C)on1 ZINC000190433736 565532025 /nfs/dbraw/zinc/53/20/25/565532025.db2.gz FVZNBIMYSKZFRI-NSHDSACASA-N 0 3 382.258 3.434 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC[C@H](O)COCc1ccco1 ZINC000190438499 565532359 /nfs/dbraw/zinc/53/23/59/565532359.db2.gz TWOBLEZJRWFXFX-OCCSQVGLSA-N 0 3 384.270 3.279 10 0 GGAEHN COc1sc(CN(C)C2CCN(c3cnccn3)CC2)cc1Br ZINC000378558586 565533749 /nfs/dbraw/zinc/53/37/49/565533749.db2.gz IFDZJFKAMGRDJX-UHFFFAOYSA-N 0 3 397.342 3.410 10 0 GGAEHN C[C@H]1OCCC[C@H]1C(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000190479573 565535467 /nfs/dbraw/zinc/53/54/67/565535467.db2.gz GXERSQCNNCHJKG-RHSMWYFYSA-N 0 3 383.330 3.154 10 0 GGAEHN C[C@@H]1OCCC[C@@H]1C(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000190479631 565535887 /nfs/dbraw/zinc/53/58/87/565535887.db2.gz GXERSQCNNCHJKG-YOEHRIQHSA-N 0 3 383.330 3.154 10 0 GGAEHN Cn1ncc(Br)c1CNC[C@@H]1CCCCN1Cc1ccccc1 ZINC000379632505 565538332 /nfs/dbraw/zinc/53/83/32/565538332.db2.gz NTFVCLDUFOMLOW-INIZCTEOSA-N 0 3 377.330 3.327 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)c2coc(Br)c2)C1 ZINC000190521709 565538731 /nfs/dbraw/zinc/53/87/31/565538731.db2.gz NHZAXJLJIUXRDZ-GFCCVEGCSA-N 0 3 398.326 3.401 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)c2ccc(Cl)nc2C)C1 ZINC000190525241 565538744 /nfs/dbraw/zinc/53/87/44/565538744.db2.gz IJZWNZNBTBNQNY-CQSZACIVSA-N 0 3 378.929 3.402 10 0 GGAEHN CC(C)[N@H+](C)C[C@@H](C)[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000380560701 565539823 /nfs/dbraw/zinc/53/98/23/565539823.db2.gz RJXGQVJINKSVQT-SNVBAGLBSA-N 0 3 383.739 3.110 10 0 GGAEHN CC(C)[N@@H+](C)C[C@@H](C)[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000380560701 565539826 /nfs/dbraw/zinc/53/98/26/565539826.db2.gz RJXGQVJINKSVQT-SNVBAGLBSA-N 0 3 383.739 3.110 10 0 GGAEHN COCc1ccsc1C(=O)N1CC[C@@H](CN(C)Cc2scnc2C)C1 ZINC000190533507 565539839 /nfs/dbraw/zinc/53/98/39/565539839.db2.gz OBNIGLFNFRXMCC-AWEZNQCLSA-N 0 3 379.551 3.254 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)c2ccc(Br)o2)C1 ZINC000190534959 565539867 /nfs/dbraw/zinc/53/98/67/565539867.db2.gz SQUDYLMVUTUFCJ-GFCCVEGCSA-N 0 3 398.326 3.401 10 0 GGAEHN CC(C)[N@H+](C)C[C@H](C)[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000380725958 565540012 /nfs/dbraw/zinc/54/00/12/565540012.db2.gz RJXGQVJINKSVQT-JTQLQIEISA-N 0 3 383.739 3.110 10 0 GGAEHN CC(C)[N@@H+](C)C[C@H](C)[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000380725958 565540018 /nfs/dbraw/zinc/54/00/18/565540018.db2.gz RJXGQVJINKSVQT-JTQLQIEISA-N 0 3 383.739 3.110 10 0 GGAEHN CCCc1ncc(C(=O)N2CC[C@@H](CN(C)Cc3scnc3C)C2)s1 ZINC000190548317 565541444 /nfs/dbraw/zinc/54/14/44/565541444.db2.gz UXKVQNDZJYUIOE-AWEZNQCLSA-N 0 3 378.567 3.455 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)Cc2cccc(C(F)(F)F)c2)[C@H](C)C1 ZINC000173256037 565541701 /nfs/dbraw/zinc/54/17/01/565541701.db2.gz CZVXRUXVEDRKOA-CZUORRHYSA-N 0 3 378.460 3.197 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)Cc2cccc(C(F)(F)F)c2)[C@H](C)C1 ZINC000173256021 565541955 /nfs/dbraw/zinc/54/19/55/565541955.db2.gz CZVXRUXVEDRKOA-CJNGLKHVSA-N 0 3 378.460 3.197 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(Br)c(C)c2)[C@H](C)C1 ZINC000173256288 565542214 /nfs/dbraw/zinc/54/22/14/565542214.db2.gz BPZCTKLDXHJDCC-CJNGLKHVSA-N 0 3 389.359 3.108 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)Cc2c(Cl)cccc2Cl)[C@H](C)C1 ZINC000173257271 565542340 /nfs/dbraw/zinc/54/23/40/565542340.db2.gz QDTRTSBQXAPPLJ-MLGOLLRUSA-N 0 3 379.353 3.485 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)C(=O)Nc1cc(Cl)c(F)c(Cl)c1 ZINC000190577667 565543501 /nfs/dbraw/zinc/54/35/01/565543501.db2.gz UWYVZCJUISSFJL-NSHDSACASA-N 0 3 376.259 3.014 10 0 GGAEHN CN1CCN([C@@H]2CCCCN(C(=O)Cc3ccc(Cl)c(Cl)c3)C2)CC1 ZINC000173288762 565544606 /nfs/dbraw/zinc/54/46/06/565544606.db2.gz NRRNFLLPZNPXJP-MRXNPFEDSA-N 0 3 384.351 3.164 10 0 GGAEHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)c2nc(Cl)ccc2Cl)C1 ZINC000190612478 565546371 /nfs/dbraw/zinc/54/63/71/565546371.db2.gz MCPMNADNSFAHLM-AWEZNQCLSA-N 0 3 379.291 3.378 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)NCCc2ccsc2)C1 ZINC000190693491 565552769 /nfs/dbraw/zinc/55/27/69/565552769.db2.gz HQKRXJVBZWSGKQ-INIZCTEOSA-N 0 3 378.567 3.219 10 0 GGAEHN CN(Cc1cccnc1)C[C@H]1CCN(C(=O)NCc2ccc(Cl)s2)C1 ZINC000190695731 565552896 /nfs/dbraw/zinc/55/28/96/565552896.db2.gz KNTJRPZUZZSSHT-OAHLLOKOSA-N 0 3 378.929 3.460 10 0 GGAEHN CCN1CC[C@@H](NCc2cc(Br)c(OC)c(Br)c2)C1 ZINC000389281803 565553582 /nfs/dbraw/zinc/55/35/82/565553582.db2.gz UTRUDPBMQQRZTH-LLVKDONJSA-N 0 3 392.135 3.404 10 0 GGAEHN Cn1ncc(Br)c1CNC[C@H]1CCCN(Cc2cccs2)C1 ZINC000278346379 565553589 /nfs/dbraw/zinc/55/35/89/565553589.db2.gz HJFIVWBILDDTLQ-CYBMUJFWSA-N 0 3 383.359 3.246 10 0 GGAEHN CCSCC[C@@H](C)NC(=O)N1CC[C@H](CN(C)Cc2scnc2C)C1 ZINC000190721369 565554492 /nfs/dbraw/zinc/55/44/92/565554492.db2.gz ZJTNDOSTPCOXGP-GDBMZVCRSA-N 0 3 384.615 3.447 10 0 GGAEHN CCN1CC[C@@H](NC(=O)c2cc(Br)sc2Br)C1 ZINC000389962975 565554624 /nfs/dbraw/zinc/55/46/24/565554624.db2.gz GEWPZUKGNOJCJE-SSDOTTSWSA-N 0 3 382.121 3.097 10 0 GGAEHN C[C@@H](NC(=O)N(CCN(C)C)C[C@H]1CCCO1)c1ccccc1Br ZINC000173400752 565555000 /nfs/dbraw/zinc/55/50/00/565555000.db2.gz WHYCWWVAKXJYJB-HUUCEWRRSA-N 0 3 398.345 3.262 10 0 GGAEHN CCN1CC[C@H](NC(=O)c2ccc(Br)cc2Br)C1 ZINC000390029432 565555111 /nfs/dbraw/zinc/55/51/11/565555111.db2.gz YKCUGVJWVRCXMR-JTQLQIEISA-N 0 3 376.092 3.036 10 0 GGAEHN C[C@@H]1CCCCN1CCNc1ncc(Cn2cc(Br)cn2)s1 ZINC000302839529 565560633 /nfs/dbraw/zinc/56/06/33/565560633.db2.gz ZJCVRQPAJXEXPK-GFCCVEGCSA-N 0 3 384.347 3.437 10 0 GGAEHN Cc1c([C@H](C)N[C@@H]2CCOC[C@@H]2C)nnn1-c1cccc(Br)c1 ZINC000278467672 565561382 /nfs/dbraw/zinc/56/13/82/565561382.db2.gz JOPNNUFOHDIFGP-MQIPJXDCSA-N 0 3 379.302 3.414 10 0 GGAEHN Cc1c([C@H](C)N[C@H]2CCOC[C@@H]2C)nnn1-c1cccc(Br)c1 ZINC000278467671 565561405 /nfs/dbraw/zinc/56/14/05/565561405.db2.gz JOPNNUFOHDIFGP-MKBNYLNASA-N 0 3 379.302 3.414 10 0 GGAEHN COc1ccc(CCNCc2c(Br)cnn2C)cc1OC(F)F ZINC000278571865 565565597 /nfs/dbraw/zinc/56/55/97/565565597.db2.gz XMFNIESPGUELIH-UHFFFAOYSA-N 0 3 390.228 3.125 10 0 GGAEHN Cc1cc(N2CCC[C@@H](NCc3ccc(Br)c(C)c3)C2=O)n(C)n1 ZINC000173569911 565568837 /nfs/dbraw/zinc/56/88/37/565568837.db2.gz PMCXKNFYRJWKMX-MRXNPFEDSA-N 0 3 391.313 3.085 10 0 GGAEHN CCN(CCNC(=O)Cn1c(C)c(Br)c2ccccc21)C1CC1 ZINC000303166434 565569059 /nfs/dbraw/zinc/56/90/59/565569059.db2.gz QIKURUWKDIGREI-UHFFFAOYSA-N 0 3 378.314 3.313 10 0 GGAEHN COc1c(Br)cc(Br)cc1CN[C@H](C)C(C)(C)O ZINC000393965797 565569994 /nfs/dbraw/zinc/56/99/94/565569994.db2.gz OQTOSYYLEALZOS-MRVPVSSYSA-N 0 3 381.108 3.469 10 0 GGAEHN CCc1nc2n(n1)C[C@@H](NCc1cc(Br)c(Cl)s1)CC2 ZINC000190973617 565573607 /nfs/dbraw/zinc/57/36/07/565573607.db2.gz KJAWQEDOAWRNAC-QMMMGPOBSA-N 0 3 375.723 3.423 10 0 GGAEHN CC[C@H](Cc1cccc(Br)c1)C(=O)NC[C@H]1CCCN1CCOC ZINC000303679881 565573822 /nfs/dbraw/zinc/57/38/22/565573822.db2.gz MBOSZSXXNSTVQZ-SJLPKXTDSA-N 0 3 397.357 3.245 10 0 GGAEHN OC1(CNc2ncc(Br)cc2F)CCN(Cc2ccccc2)CC1 ZINC000397546688 565575221 /nfs/dbraw/zinc/57/52/21/565575221.db2.gz ZHURVUWRDABQSX-UHFFFAOYSA-N 0 3 394.288 3.422 10 0 GGAEHN CC(C)[C@H](CN(C)Cc1ccccc1)NCc1c(Br)cnn1C ZINC000397963106 565577064 /nfs/dbraw/zinc/57/70/64/565577064.db2.gz QFAWUQNFKQIUEC-KRWDZBQOSA-N 0 3 379.346 3.429 10 0 GGAEHN CN(C(=O)c1cc(Br)cn1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000309804416 565577558 /nfs/dbraw/zinc/57/75/58/565577558.db2.gz TUHMWVOXDQRZQQ-MRXNPFEDSA-N 0 3 376.298 3.134 10 0 GGAEHN Cc1nn(C)c(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)c1Br ZINC000309752466 565578041 /nfs/dbraw/zinc/57/80/41/565578041.db2.gz ZWSHYBRWDNNYKZ-MRXNPFEDSA-N 0 3 377.330 3.197 10 0 GGAEHN NC[C@@H](NC(=O)c1ccc(Br)cc1C(F)(F)F)C(F)(F)F ZINC000401741486 565582073 /nfs/dbraw/zinc/58/20/73/565582073.db2.gz HARCIKLBPJXMHT-MRVPVSSYSA-N 0 3 379.098 3.087 10 0 GGAEHN C[C@@H](NCC[C@]1(O)CCOC1)c1ccc(Br)cc1Br ZINC000404197933 565582970 /nfs/dbraw/zinc/58/29/70/565582970.db2.gz GLIIXXAAZWTVOF-YGRLFVJLSA-N 0 3 393.119 3.404 10 0 GGAEHN CC[NH+](CC)C[C@@H](C)[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000312928887 565582931 /nfs/dbraw/zinc/58/29/31/565582931.db2.gz XRCRUSYHNRVKFB-SNVBAGLBSA-N 0 3 383.739 3.111 10 0 GGAEHN CC[NH+](CC)C[C@H](C)[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000312928884 565583391 /nfs/dbraw/zinc/58/33/91/565583391.db2.gz XRCRUSYHNRVKFB-JTQLQIEISA-N 0 3 383.739 3.111 10 0 GGAEHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1nscc1Br ZINC000404858445 565584419 /nfs/dbraw/zinc/58/44/19/565584419.db2.gz TUICZOCZHRPXMJ-FZMZJTMJSA-N 0 3 380.311 3.156 10 0 GGAEHN CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)c1nscc1Br ZINC000404820065 565584576 /nfs/dbraw/zinc/58/45/76/565584576.db2.gz MGLRSXRJELHRLJ-AWEZNQCLSA-N 0 3 394.338 3.500 10 0 GGAEHN C[C@H](C[N-]S(=O)(=O)c1c(Cl)cccc1Br)C[NH+]1CCCC1 ZINC000314115512 565585713 /nfs/dbraw/zinc/58/57/13/565585713.db2.gz AMATUIDHOOGYAO-LLVKDONJSA-N 0 3 395.750 3.113 10 0 GGAEHN C[C@H](NC(=O)N(CCN(C)C)C[C@@H]1CCCO1)c1cccc(Br)c1 ZINC000173792388 565585816 /nfs/dbraw/zinc/58/58/16/565585816.db2.gz QCUONYLVECBQBQ-YOEHRIQHSA-N 0 3 398.345 3.262 10 0 GGAEHN C[C@@]1(NC(=O)c2nscc2Br)CCN(Cc2ccccc2)C1 ZINC000406011607 565587062 /nfs/dbraw/zinc/58/70/62/565587062.db2.gz SUBOFNUIBWLKJQ-MRXNPFEDSA-N 0 3 380.311 3.300 10 0 GGAEHN CC[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc(C)cc1Br ZINC000173829618 565590666 /nfs/dbraw/zinc/59/06/66/565590666.db2.gz YYJSWMSYIRKFAL-ZIAGYGMSSA-N 0 3 387.343 3.005 10 0 GGAEHN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCN2CCCC[C@@H]2C1 ZINC000408023657 565591171 /nfs/dbraw/zinc/59/11/71/565591171.db2.gz UCPFCKFWWNBUGF-OAHLLOKOSA-N 0 3 389.297 3.150 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1cc(Cl)c(Cl)cc1OC ZINC000191267342 565592688 /nfs/dbraw/zinc/59/26/88/565592688.db2.gz RTDVPPPLDWVTJE-NSHDSACASA-N 0 3 376.284 3.234 10 0 GGAEHN O=C(NCCCNCc1cccnc1)c1cccc(Br)c1Cl ZINC000317990163 565595564 /nfs/dbraw/zinc/59/55/64/565595564.db2.gz MWMLMJYGEMNEIU-UHFFFAOYSA-N 0 3 382.689 3.407 10 0 GGAEHN C[C@@H]1CN(C(=O)Nc2cc(Cl)c(Cl)cn2)CCN1C1CCN(C)CC1 ZINC000408257778 565600485 /nfs/dbraw/zinc/60/04/85/565600485.db2.gz VVVVXDZXZCTGEU-GFCCVEGCSA-N 0 3 386.327 3.021 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000191446716 565605119 /nfs/dbraw/zinc/60/51/19/565605119.db2.gz BUYFDBOTJZZZRE-DZGCQCFKSA-N 0 3 394.313 3.174 10 0 GGAEHN CCOC(=O)C1CCC(O)(CN(C)Cc2csc(Br)c2)CC1 ZINC000191442705 565605133 /nfs/dbraw/zinc/60/51/33/565605133.db2.gz GNEOLVMZNUHFRN-UHFFFAOYSA-N 0 3 390.343 3.427 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C ZINC000191441054 565605225 /nfs/dbraw/zinc/60/52/25/565605225.db2.gz LUTRQSMWGYUFJH-CFVMTHIKSA-N 0 3 396.329 3.397 10 0 GGAEHN COc1ccc(C(=O)N2CCc3ccccc3[C@@H]2CN)cc1Br ZINC000321858595 565607148 /nfs/dbraw/zinc/60/71/48/565607148.db2.gz LVGYLCKZGJYXOF-INIZCTEOSA-N 0 3 375.266 3.156 10 0 GGAEHN CC(C)(CNC(=O)N1CC[C@H](N2CC=CC2)C1)c1ccc(Br)cc1 ZINC000174050729 565609597 /nfs/dbraw/zinc/60/95/97/565609597.db2.gz ZYASYICWVYTKQO-KRWDZBQOSA-N 0 3 392.341 3.382 10 0 GGAEHN O=C(CN1CCCC[C@@H]1[C@H]1CCC[C@H]1O)Nc1ccc(Br)cc1 ZINC000322656191 565610892 /nfs/dbraw/zinc/61/08/92/565610892.db2.gz ZJADWMRICATEQQ-BRWVUGGUSA-N 0 3 381.314 3.403 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000174075723 565611457 /nfs/dbraw/zinc/61/14/57/565611457.db2.gz PJOSKPFZWMAURW-PBHICJAKSA-N 0 3 378.314 3.036 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC1CCN(C(=O)N(C)C)CC1 ZINC000191632670 565618467 /nfs/dbraw/zinc/61/84/67/565618467.db2.gz BLALZCFIGDSPAD-LBPRGKRZSA-N 0 3 384.318 3.254 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)NCCc2ccc(F)c(Br)c2)CCN1C ZINC000174183160 565619416 /nfs/dbraw/zinc/61/94/16/565619416.db2.gz AYKHZXIPSMZLDU-GXTWGEPZSA-N 0 3 386.309 3.255 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)NCCc2ccc(F)c(Br)c2)CCN1C ZINC000174183184 565620233 /nfs/dbraw/zinc/62/02/33/565620233.db2.gz AYKHZXIPSMZLDU-JSGCOSHPSA-N 0 3 386.309 3.255 10 0 GGAEHN C[C@@H](Cc1cccc(Br)c1)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000174349082 565630826 /nfs/dbraw/zinc/63/08/26/565630826.db2.gz FPWUBQTUXQWVCO-YOEHRIQHSA-N 0 3 378.314 3.036 10 0 GGAEHN COCc1csc(NC(=O)NC[C@H]2CCCN(Cc3cccs3)C2)n1 ZINC000174388134 565632346 /nfs/dbraw/zinc/63/23/46/565632346.db2.gz WKIJLPAHBZBLOS-CYBMUJFWSA-N 0 3 380.539 3.385 10 0 GGAEHN CCN1CCCC[C@@H]1CNC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000409677381 565632677 /nfs/dbraw/zinc/63/26/77/565632677.db2.gz AIWCOLSIPMKGFL-CJNGLKHVSA-N 0 3 396.329 3.446 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)N[C@H]2CCOc3c(Br)cccc32)CCN1C ZINC000409697756 565633610 /nfs/dbraw/zinc/63/36/10/565633610.db2.gz NKQZWEVDNCZURU-JMSVASOKSA-N 0 3 382.302 3.055 10 0 GGAEHN CCN1CCN(c2ccccc2NCc2c(Br)c(C)nn2C)CC1 ZINC000279803945 565634300 /nfs/dbraw/zinc/63/43/00/565634300.db2.gz KILWZDFCWHUFRM-UHFFFAOYSA-N 0 3 392.345 3.245 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)Nc2cccc(I)c2)CCN1C ZINC000174425852 565634548 /nfs/dbraw/zinc/63/45/48/565634548.db2.gz VAOZGKUJIOTQLC-FZMZJTMJSA-N 0 3 387.265 3.238 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)Nc2cccc(I)c2)CCN1C ZINC000174425828 565634833 /nfs/dbraw/zinc/63/48/33/565634833.db2.gz VAOZGKUJIOTQLC-SMDDNHRTSA-N 0 3 387.265 3.238 10 0 GGAEHN CC1CCN(CCNC(=O)N[C@H]2CCOc3c(Br)cccc32)CC1 ZINC000409716040 565636370 /nfs/dbraw/zinc/63/63/70/565636370.db2.gz VRWHXCSXCKGGPZ-INIZCTEOSA-N 0 3 396.329 3.304 10 0 GGAEHN COc1ccc(Br)cc1CNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1 ZINC000174458085 565637646 /nfs/dbraw/zinc/63/76/46/565637646.db2.gz OATREGISFQJPFK-DOMZBBRYSA-N 0 3 384.318 3.082 10 0 GGAEHN CN(C)CCOc1ccc(CNC(=O)c2cccc(Br)c2F)cc1 ZINC000192041269 565651630 /nfs/dbraw/zinc/65/16/30/565651630.db2.gz GQGQZGAYOUYPOO-UHFFFAOYSA-N 0 3 395.272 3.459 10 0 GGAEHN C[C@H](NCCCc1ccccn1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000280208037 565659064 /nfs/dbraw/zinc/65/90/64/565659064.db2.gz TYKMHMWGMABGER-NSHDSACASA-N 0 3 388.320 3.319 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000410053156 565660813 /nfs/dbraw/zinc/66/08/13/565660813.db2.gz RREAMVUIQODEDI-XJKSGUPXSA-N 0 3 396.329 3.446 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000410053154 565660989 /nfs/dbraw/zinc/66/09/89/565660989.db2.gz RREAMVUIQODEDI-CJNGLKHVSA-N 0 3 396.329 3.446 10 0 GGAEHN CN(C(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O)[C@H]1CN2CCC1CC2 ZINC000329514707 565668572 /nfs/dbraw/zinc/66/85/72/565668572.db2.gz YFMNKEMUBXAUMR-GOEBONIOSA-N 0 3 379.913 3.345 10 0 GGAEHN O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1coc(Br)c1 ZINC000192211541 565670065 /nfs/dbraw/zinc/67/00/65/565670065.db2.gz ORADYECNCMYNTI-INIZCTEOSA-N 0 3 393.281 3.063 10 0 GGAEHN C[C@H]1CN(C)CC[C@H]1N(C)C(=O)N[C@@H]1C[C@H]1c1ccccc1Br ZINC000280418631 565670745 /nfs/dbraw/zinc/67/07/45/565670745.db2.gz AHORFLJXQKNOIE-GUDXXQAFSA-N 0 3 380.330 3.287 10 0 GGAEHN C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cc(-c2ccc(Br)cc2)n[nH]1 ZINC000329582633 565671164 /nfs/dbraw/zinc/67/11/64/565671164.db2.gz XIWREZOFVRXUNL-DOMZBBRYSA-N 0 3 389.297 3.148 10 0 GGAEHN COC(=O)c1cccc(NC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1Br ZINC000192424476 565689551 /nfs/dbraw/zinc/68/95/51/565689551.db2.gz ZITBVENEWJJSGX-NWDGAFQWSA-N 0 3 398.301 3.182 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)Nc1cccc(C(=O)OC)c1Br ZINC000192424778 565689863 /nfs/dbraw/zinc/68/98/63/565689863.db2.gz NWIJEBLIUAMAJH-GFCCVEGCSA-N 0 3 398.301 3.184 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cccc(Br)c2C)[C@H](C)C1 ZINC000175305499 565692708 /nfs/dbraw/zinc/69/27/08/565692708.db2.gz UNWJOOVIYWPBBP-IUODEOHRSA-N 0 3 389.359 3.108 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)N[C@@H]2C[C@H]2c2ccccc2Br)CCN1C ZINC000280743182 565692841 /nfs/dbraw/zinc/69/28/41/565692841.db2.gz PGFAGVJVWWKAHD-GZIXRCOHSA-N 0 3 380.330 3.429 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2C)[C@H](C)C1 ZINC000175305526 565693002 /nfs/dbraw/zinc/69/30/02/565693002.db2.gz CCKGUALUAAGPSW-HIFRSBDPSA-N 0 3 378.460 3.365 10 0 GGAEHN CCN1CCC[C@H]1CN(C)Cc1noc(Cc2ccc(Br)cc2)n1 ZINC000175339019 565693816 /nfs/dbraw/zinc/69/38/16/565693816.db2.gz BCRFYEWPDSXCCN-INIZCTEOSA-N 0 3 393.329 3.339 10 0 GGAEHN O=C(NC[C@H](c1cccs1)N1CCCC1)[C@@H]1CCCN1c1nccs1 ZINC000192516390 565697485 /nfs/dbraw/zinc/69/74/85/565697485.db2.gz ZGSNLSMRYXGPCM-LSDHHAIUSA-N 0 3 376.551 3.127 10 0 GGAEHN C[C@H]1C[C@@H](NC(=O)N2CCc3cccc(Br)c3C2)CN1C1CC1 ZINC000175556524 565708526 /nfs/dbraw/zinc/70/85/26/565708526.db2.gz MSJIUYOOWYCDFX-GXTWGEPZSA-N 0 3 378.314 3.142 10 0 GGAEHN CNC(=O)CN1CCC(N[C@H](C)c2cc3cc(Br)ccc3o2)CC1 ZINC000192753472 565708923 /nfs/dbraw/zinc/70/89/23/565708923.db2.gz KVXQGAAUKFZCBD-GFCCVEGCSA-N 0 3 394.313 3.056 10 0 GGAEHN O=C(NC[C@@H](O)CN1CCCCC1)N[C@H]1CCSc2ccc(Cl)cc21 ZINC000192803302 565710704 /nfs/dbraw/zinc/71/07/04/565710704.db2.gz HISXFGKGMDJTNY-ZBFHGGJFSA-N 0 3 383.945 3.023 10 0 GGAEHN CCCCCNC(=O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000411339643 565725341 /nfs/dbraw/zinc/72/53/41/565725341.db2.gz MNJLVKWMISVZSZ-UHFFFAOYSA-N 0 3 383.330 3.351 10 0 GGAEHN O=C(CCN[C@@H](c1ccc(Cl)cc1)C1CC1)NC(=O)NCC(F)(F)F ZINC000411438346 565730019 /nfs/dbraw/zinc/73/00/19/565730019.db2.gz NCEGIHCFYJAIHZ-CQSZACIVSA-N 0 3 377.794 3.159 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)NCC(=O)Nc1cc(Cl)ccc1Cl ZINC000193098111 565732164 /nfs/dbraw/zinc/73/21/64/565732164.db2.gz YAYKBYIGKIUUOC-ZDUSSCGKSA-N 0 3 389.327 3.207 10 0 GGAEHN CC(C)C[C@H](CN(C)C)NC(=O)NCC(=O)Nc1cc(Cl)ccc1Cl ZINC000193098122 565732195 /nfs/dbraw/zinc/73/21/95/565732195.db2.gz YAYKBYIGKIUUOC-CYBMUJFWSA-N 0 3 389.327 3.207 10 0 GGAEHN CN1CCN([C@@H]2CCCCN(C(=O)Cc3cc(Cl)ccc3Cl)C2)CC1 ZINC000175991192 565739166 /nfs/dbraw/zinc/73/91/66/565739166.db2.gz FJVPOGAQUPNQFN-QGZVFWFLSA-N 0 3 384.351 3.164 10 0 GGAEHN CC(C)N1CC[C@H](NC[C@H](C)S(C)(=O)=O)[C@H]1c1ccc(Cl)c(F)c1 ZINC000411645898 565742506 /nfs/dbraw/zinc/74/25/06/565742506.db2.gz LQTFWXMRGAZVSA-AFAVFJNCSA-N 0 3 376.925 3.026 10 0 GGAEHN C[C@@H](CC(=O)NCCN1CCN(C)C(C)(C)C1)c1ccc(Br)cc1 ZINC000281705990 565743347 /nfs/dbraw/zinc/74/33/47/565743347.db2.gz HJQKYWZNKXNVAH-HNNXBMFYSA-N 0 3 396.373 3.085 10 0 GGAEHN C[C@H](CN[C@@H]1CCN(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1)S(C)(=O)=O ZINC000411702588 565746896 /nfs/dbraw/zinc/74/68/96/565746896.db2.gz ZJYSRUVBBZPNQV-CSMYWGQOSA-N 0 3 390.952 3.416 10 0 GGAEHN O=C(CNC1(c2ccc(Br)cc2)CCOCC1)N1CCCCCC1 ZINC000193352130 565747364 /nfs/dbraw/zinc/74/73/64/565747364.db2.gz WLDGMFBZDDUGSX-UHFFFAOYSA-N 0 3 395.341 3.447 10 0 GGAEHN C[C@](CO)(NCCC(=O)Nc1cccc(F)c1)c1ccc(Br)cc1 ZINC000411716571 565748479 /nfs/dbraw/zinc/74/84/79/565748479.db2.gz GMUXZDVBVXDYEQ-GOSISDBHSA-N 0 3 395.272 3.414 10 0 GGAEHN CN(Cc1cccs1)C(=O)CN[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000411749915 565748955 /nfs/dbraw/zinc/74/89/55/565748955.db2.gz PRNPBZWOGOLEBL-PKOBYXMFSA-N 0 3 377.941 3.395 10 0 GGAEHN CC(C)C(=O)N1CCC(NCc2c(F)ccc(Br)c2F)CC1 ZINC000281844254 565751881 /nfs/dbraw/zinc/75/18/81/565751881.db2.gz AUKXLMJMJFCWDY-UHFFFAOYSA-N 0 3 375.257 3.464 10 0 GGAEHN CN(C)C(=O)N1CCC(N[C@H]2CCOc3c(Br)cccc32)CC1 ZINC000281933239 565756586 /nfs/dbraw/zinc/75/65/86/565756586.db2.gz BCDUFSRPYZBRQI-HNNXBMFYSA-N 0 3 382.302 3.008 10 0 GGAEHN CCN1CCC(NC(=O)N[C@@H]2CCOc3c(Br)cccc32)CC1 ZINC000281992556 565759270 /nfs/dbraw/zinc/75/92/70/565759270.db2.gz SXAAPJBJILXPFV-OAHLLOKOSA-N 0 3 382.302 3.056 10 0 GGAEHN C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ccccc1CSC1=NCCS1 ZINC000176307879 565763284 /nfs/dbraw/zinc/76/32/84/565763284.db2.gz AANAABMXVAPOPY-GOEBONIOSA-N 0 3 375.563 3.331 10 0 GGAEHN COC(=O)[C@@]1(C)CCCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000412111378 565770933 /nfs/dbraw/zinc/77/09/33/565770933.db2.gz VWPLUUQCIIWJQS-PXAZEXFGSA-N 0 3 376.280 3.008 10 0 GGAEHN C[C@H](NC(=O)NC[C@H](O)CN1CCCCC1)c1c(Cl)ccc(F)c1Cl ZINC000193901988 565781858 /nfs/dbraw/zinc/78/18/58/565781858.db2.gz OXCYXKCVXDPRAW-RYUDHWBXSA-N 0 3 392.302 3.340 10 0 GGAEHN COc1sc(CNC[C@@H]2CCC3(CCOCC3)[C@H]2O)cc1Br ZINC000282692931 565793150 /nfs/dbraw/zinc/79/31/50/565793150.db2.gz LIGBDKQRDZBCNL-FZMZJTMJSA-N 0 3 390.343 3.177 10 0 GGAEHN Cc1nccn1CCCCNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000282819466 565798381 /nfs/dbraw/zinc/79/83/81/565798381.db2.gz RSSTYIXLJCJBHQ-UHFFFAOYSA-N 0 3 376.258 3.041 10 0 GGAEHN C[C@H]1C[C@@H](C(=O)Nc2nnc(COc3ccc(Cl)cc3)s2)CCN1C ZINC000412598799 565798478 /nfs/dbraw/zinc/79/84/78/565798478.db2.gz HPEXLMBMAOCCNT-RYUDHWBXSA-N 0 3 380.901 3.439 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(Br)c(C)c1F ZINC000194212666 565801955 /nfs/dbraw/zinc/80/19/55/565801955.db2.gz FFWLFPBDPFMKSB-GFCCVEGCSA-N 0 3 388.281 3.129 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)[C@@H](C)NC(=O)c1cccc(Cl)c1Cl ZINC000176980054 565819773 /nfs/dbraw/zinc/81/97/73/565819773.db2.gz CMUAQFAHTHDDQV-OLZOCXBDSA-N 0 3 386.323 3.054 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)c1cnn(-c2cccc(Br)c2)c1 ZINC000177003653 565821808 /nfs/dbraw/zinc/82/18/08/565821808.db2.gz AJXFRRPCSXMMEQ-KRWDZBQOSA-N 0 3 391.313 3.191 10 0 GGAEHN CCCOc1c(Br)cc(C(=O)N[C@H]2CCCN(CC)C2)cc1OC ZINC000194624206 565826472 /nfs/dbraw/zinc/82/64/72/565826472.db2.gz VWNXARYOQGTROG-AWEZNQCLSA-N 0 3 399.329 3.461 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1C(=O)NC[C@@H]1CCCN1C ZINC000194692829 565831397 /nfs/dbraw/zinc/83/13/97/565831397.db2.gz UNXFJQJXOSYEJY-INIZCTEOSA-N 0 3 391.313 3.076 10 0 GGAEHN CC(C)[C@H](CNc1nccc2cc(Br)ccc21)N1CCN(C)CC1 ZINC000413044551 565831955 /nfs/dbraw/zinc/83/19/55/565831955.db2.gz OPRPAIFPASNVLQ-SFHVURJKSA-N 0 3 391.357 3.103 10 0 GGAEHN CC(C)(C)[C@H](O)C[C@H](CO)NCc1ccc(Br)c2cccnc12 ZINC000283826795 565832447 /nfs/dbraw/zinc/83/24/47/565832447.db2.gz DRQGTUGAEPMHSV-CZUORRHYSA-N 0 3 381.314 3.245 10 0 GGAEHN CCN1CCN(C[C@H](C)CNc2nccc3cc(Br)ccc32)CC1 ZINC000413082115 565833044 /nfs/dbraw/zinc/83/30/44/565833044.db2.gz QJJIXMXRUMOWFA-OAHLLOKOSA-N 0 3 391.357 3.105 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000177176327 565833411 /nfs/dbraw/zinc/83/34/11/565833411.db2.gz VZTZFYDHRXJOEQ-ZDUSSCGKSA-N 0 3 388.269 3.135 10 0 GGAEHN CN1CC[C@@H](NCC(=O)Nc2ccccc2Br)[C@@H]1c1ccccc1 ZINC000283918596 565835084 /nfs/dbraw/zinc/83/50/84/565835084.db2.gz GIFAUJAHZBZPBU-MJGOQNOKSA-N 0 3 388.309 3.423 10 0 GGAEHN C[C@H](NC(=O)C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1)c1ccc(Cl)cc1Cl ZINC000284370266 565851383 /nfs/dbraw/zinc/85/13/83/565851383.db2.gz LQGUSGPDBMNXPU-SGMGOOAPSA-N 0 3 386.323 3.112 10 0 GGAEHN C[C@H](NC(=O)C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1)c1ccc(Cl)cc1Cl ZINC000284370223 565851572 /nfs/dbraw/zinc/85/15/72/565851572.db2.gz LQGUSGPDBMNXPU-DYEKYZERSA-N 0 3 386.323 3.112 10 0 GGAEHN CC[C@H](C(=O)N1CCC[C@H]1c1ccccc1I)N(C)C ZINC000413450403 565852687 /nfs/dbraw/zinc/85/26/87/565852687.db2.gz FYRUYEZPVFBSKX-CABCVRRESA-N 0 3 386.277 3.295 10 0 GGAEHN CN(CC1CCN(C[C@@H](O)c2ccccc2)CC1)C(=O)[C@H]1CC1(Cl)Cl ZINC000177467569 565853135 /nfs/dbraw/zinc/85/31/35/565853135.db2.gz IWBMGUBZZQIDDT-IAGOWNOFSA-N 0 3 385.335 3.084 10 0 GGAEHN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCN2CCCC[C@@H]2C1 ZINC000195045243 565856104 /nfs/dbraw/zinc/85/61/04/565856104.db2.gz YBRPVKJAEVIEIT-CQSZACIVSA-N 0 3 389.297 3.150 10 0 GGAEHN CC[C@@H](C(=O)N1CCC[C@@H]1c1ccc(I)cc1)N(C)C ZINC000413528051 565858409 /nfs/dbraw/zinc/85/84/09/565858409.db2.gz CXAVNXAAMLLJSG-LSDHHAIUSA-N 0 3 386.277 3.295 10 0 GGAEHN CC[C@H](C(=O)N1CCC[C@H]1c1ccc(I)cc1)N(C)C ZINC000413528045 565858453 /nfs/dbraw/zinc/85/84/53/565858453.db2.gz CXAVNXAAMLLJSG-CABCVRRESA-N 0 3 386.277 3.295 10 0 GGAEHN CNC(=O)Cc1nc(CNC(C)(C)Cc2ccc(Br)cc2)cs1 ZINC000177602823 565861721 /nfs/dbraw/zinc/86/17/21/565861721.db2.gz DEADHESHZAPRIM-UHFFFAOYSA-N 0 3 396.354 3.305 10 0 GGAEHN O=C(NCc1cccc(Br)c1Cl)N1CC[C@@H](N2CC=CC2)C1 ZINC000413661422 565866015 /nfs/dbraw/zinc/86/60/15/565866015.db2.gz XUOYSFSHBYXULN-CYBMUJFWSA-N 0 3 384.705 3.258 10 0 GGAEHN CCCCOC[C@H](O)CN1CCC(Oc2cccc(Br)c2)CC1 ZINC000195218452 565866375 /nfs/dbraw/zinc/86/63/75/565866375.db2.gz RZNSPBHWXFQLOP-MRXNPFEDSA-N 0 3 386.330 3.470 10 0 GGAEHN CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)N1CCN2CCC[C@@H]2C1 ZINC000177698597 565867407 /nfs/dbraw/zinc/86/74/07/565867407.db2.gz MIIHNTOURGXDCN-CYBMUJFWSA-N 0 3 381.929 3.086 10 0 GGAEHN O=C(NCc1cc(Cl)cc(Br)c1)N1CC[C@H](N2CC=CC2)C1 ZINC000413697489 565868007 /nfs/dbraw/zinc/86/80/07/565868007.db2.gz GJDRINIERMXGDJ-HNNXBMFYSA-N 0 3 384.705 3.258 10 0 GGAEHN CN(Cc1ccc(Br)c(F)c1)[C@H]1CCCN(c2cccnn2)C1 ZINC000177708688 565869301 /nfs/dbraw/zinc/86/93/01/565869301.db2.gz DXVDNMFKUODDJJ-AWEZNQCLSA-N 0 3 379.277 3.479 10 0 GGAEHN C[C@@H](N[C@@H](C)Cn1cc(Br)cn1)c1ccc(N2CCOC2=O)cc1 ZINC000177754106 565871100 /nfs/dbraw/zinc/87/11/00/565871100.db2.gz QMNCMHUIVQMSOX-QWHCGFSZSA-N 0 3 393.285 3.342 10 0 GGAEHN C[C@H](Cn1cc(Br)cn1)N[C@@H](C)c1ccc(N2CCOC2=O)cc1 ZINC000177754092 565871997 /nfs/dbraw/zinc/87/19/97/565871997.db2.gz QMNCMHUIVQMSOX-OLZOCXBDSA-N 0 3 393.285 3.342 10 0 GGAEHN C[C@H](N[C@@H](CO)c1cccc(Br)c1)C1CN(C(=O)OC(C)(C)C)C1 ZINC000284912386 565876187 /nfs/dbraw/zinc/87/61/87/565876187.db2.gz CQOXEEFNWKRILC-LRDDRELGSA-N 0 3 399.329 3.328 10 0 GGAEHN Cn1nccc1C1CCN(C[C@H](O)COc2ccc(Cl)cc2Cl)CC1 ZINC000195503998 565889395 /nfs/dbraw/zinc/88/93/95/565889395.db2.gz MCAHYUDDVNGULU-HNNXBMFYSA-N 0 3 384.307 3.346 10 0 GGAEHN C[C@H](NCCOCCN(C)C)c1ccc(Br)cc1Br ZINC000219324685 565901957 /nfs/dbraw/zinc/90/19/57/565901957.db2.gz BXDQKTGBHKGRAE-NSHDSACASA-N 0 3 394.151 3.440 10 0 GGAEHN CCOCc1ccccc1CN[C@@H](C)Cn1cc(Br)ccc1=O ZINC000414065753 565891912 /nfs/dbraw/zinc/89/19/12/565891912.db2.gz OXHUBUMSHXLKTM-AWEZNQCLSA-N 0 3 379.298 3.326 10 0 GGAEHN COc1ccc([C@@H](C)NCc2cccnc2-n2cncn2)cc1Br ZINC000178048012 565892107 /nfs/dbraw/zinc/89/21/07/565892107.db2.gz RDULFIOSRYECFE-GFCCVEGCSA-N 0 3 388.269 3.284 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@@H](C)c1ccc2c(c1)OCO2 ZINC000414059810 565892154 /nfs/dbraw/zinc/89/21/54/565892154.db2.gz IUOBADUMBHLYAS-NEPJUHHUSA-N 0 3 379.254 3.079 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@@H](C)c1ccc2c(c1)OCO2 ZINC000414059814 565892237 /nfs/dbraw/zinc/89/22/37/565892237.db2.gz IUOBADUMBHLYAS-RYUDHWBXSA-N 0 3 379.254 3.079 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NCCOc1cccc(Cl)c1 ZINC000414082402 565893315 /nfs/dbraw/zinc/89/33/15/565893315.db2.gz WASXLOBZTITYQA-GFCCVEGCSA-N 0 3 385.689 3.321 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@H](C)c1ccc([S@](C)=O)cc1 ZINC000414092027 565894357 /nfs/dbraw/zinc/89/43/57/565894357.db2.gz DSGYUKXXQIHOMC-RFIQDPTOSA-N 0 3 397.338 3.088 10 0 GGAEHN COc1cccc(C2(N[C@H](C)Cn3cc(Br)ccc3=O)CC2)c1 ZINC000414093774 565894619 /nfs/dbraw/zinc/89/46/19/565894619.db2.gz HPSOKNQBALWZML-CYBMUJFWSA-N 0 3 377.282 3.287 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@@H](CCO)c1ccc(Cl)cc1 ZINC000414123903 565896584 /nfs/dbraw/zinc/89/65/84/565896584.db2.gz CAUNNPJHQOCMHS-LRDDRELGSA-N 0 3 399.716 3.366 10 0 GGAEHN Cn1cnc(CCN[C@@H]2CCCOc3ccc(I)cc32)c1 ZINC000414120005 565896701 /nfs/dbraw/zinc/89/67/01/565896701.db2.gz AEFWXDMPYWQASQ-OAHLLOKOSA-N 0 3 397.260 3.071 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@@H](C)[C@H]1OCCc2sccc21 ZINC000414138734 565897680 /nfs/dbraw/zinc/89/76/80/565897680.db2.gz KIDTVFKYIDQEHT-BWACUDIHSA-N 0 3 397.338 3.353 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@@H](C)[C@@H]1OCCc2sccc21 ZINC000414138751 565898434 /nfs/dbraw/zinc/89/84/34/565898434.db2.gz KIDTVFKYIDQEHT-PEBVRCNWSA-N 0 3 397.338 3.353 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NCc1cc(Cl)cc2c1OCC2 ZINC000414129824 565898456 /nfs/dbraw/zinc/89/84/56/565898456.db2.gz IUECJHWXIXCKCG-LLVKDONJSA-N 0 3 397.700 3.377 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)c1ccc(Br)cc1Br ZINC000219301935 565901802 /nfs/dbraw/zinc/90/18/02/565901802.db2.gz KNPFEYUEILPKGH-LLVKDONJSA-N 0 3 390.119 3.378 10 0 GGAEHN C[C@H](N[C@@H](C)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cccs1 ZINC000178178519 565904293 /nfs/dbraw/zinc/90/42/93/565904293.db2.gz LQYDCKBLMPMRLE-GJZGRUSLSA-N 0 3 380.535 3.181 10 0 GGAEHN COC[C@@H](O)CCN[C@H](C)c1ccc(Br)cc1Br ZINC000222709073 565906305 /nfs/dbraw/zinc/90/63/05/565906305.db2.gz KWXHHCNWBBEOHZ-KOLCDFICSA-N 0 3 381.108 3.260 10 0 GGAEHN CC(C)(CCN[C@@H]1CCCOc2ccc(Br)cc21)S(C)(=O)=O ZINC000414271132 565907369 /nfs/dbraw/zinc/90/73/69/565907369.db2.gz WATNCOMETBKESJ-CQSZACIVSA-N 0 3 390.343 3.466 10 0 GGAEHN CS(=O)(=O)c1ccccc1CN[C@@H]1CCc2cccc(Br)c2C1 ZINC000414271673 565907402 /nfs/dbraw/zinc/90/74/02/565907402.db2.gz ZXUVKKKILIJMFX-OAHLLOKOSA-N 0 3 394.334 3.500 10 0 GGAEHN CCc1ccc(CNCc2ccc(S(N)(=O)=O)c(Br)c2)s1 ZINC000414289082 565908147 /nfs/dbraw/zinc/90/81/47/565908147.db2.gz QVPNCPLQDCTAOC-UHFFFAOYSA-N 0 3 389.340 3.010 10 0 GGAEHN Cc1cccc(C(=O)N[C@@H](CC(C)C)CN(C)C)c1I ZINC000223506195 565909023 /nfs/dbraw/zinc/90/90/23/565909023.db2.gz XCZLRMTVEOJKDG-ZDUSSCGKSA-N 0 3 388.293 3.306 10 0 GGAEHN Cc1ccc2c(c1)CC[C@H]2NCc1ccc(S(N)(=O)=O)c(Br)c1 ZINC000414304527 565909416 /nfs/dbraw/zinc/90/94/16/565909416.db2.gz OVRJAEHVNXWVQR-MRXNPFEDSA-N 0 3 395.322 3.182 10 0 GGAEHN Cc1ccc2c(c1)CC[C@@H]2NCc1ccc(S(N)(=O)=O)c(Br)c1 ZINC000414304519 565909877 /nfs/dbraw/zinc/90/98/77/565909877.db2.gz OVRJAEHVNXWVQR-INIZCTEOSA-N 0 3 395.322 3.182 10 0 GGAEHN CCOC(=O)COc1c(Br)cc(C)cc1CNc1nccn1C ZINC000414310087 565909967 /nfs/dbraw/zinc/90/99/67/565909967.db2.gz VZBKGLQWYUJBFT-UHFFFAOYSA-N 0 3 382.258 3.045 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000178300162 565911149 /nfs/dbraw/zinc/91/11/49/565911149.db2.gz UGSXXXSYJITOEJ-CABCVRRESA-N 0 3 384.307 3.403 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000178300146 565911318 /nfs/dbraw/zinc/91/13/18/565911318.db2.gz UGSXXXSYJITOEJ-GJZGRUSLSA-N 0 3 384.307 3.403 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1CC(=O)Nc1ccc(Br)c(C)c1 ZINC000178303023 565912421 /nfs/dbraw/zinc/91/24/21/565912421.db2.gz MBRVHSRNAUAZPC-MRXNPFEDSA-N 0 3 391.313 3.366 10 0 GGAEHN CS(=O)(=O)CC1(CN[C@H]2CCc3c2ccc(F)c3Br)CCC1 ZINC000414338047 565912447 /nfs/dbraw/zinc/91/24/47/565912447.db2.gz YBDSHBTVKQJTNB-AWEZNQCLSA-N 0 3 390.318 3.380 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1Cc1ccc(I)cc1 ZINC000178325584 565912616 /nfs/dbraw/zinc/91/26/16/565912616.db2.gz VIJNUVFCLHDJAQ-MRXNPFEDSA-N 0 3 381.261 3.461 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1[C@@H](C)C(=O)Nc1cccc(Br)c1 ZINC000178311047 565912690 /nfs/dbraw/zinc/91/26/90/565912690.db2.gz NUKTYOULGOBBEG-SUMWQHHRSA-N 0 3 391.313 3.446 10 0 GGAEHN CCS(=O)(=O)CCCN[C@H]1CCCOc2ccc(Br)cc21 ZINC000414345432 565913423 /nfs/dbraw/zinc/91/34/23/565913423.db2.gz SWLHGZZRLBQWDV-AWEZNQCLSA-N 0 3 376.316 3.077 10 0 GGAEHN C[C@H]1Cc2ccccc2[C@@H]1NCc1ccc(S(N)(=O)=O)c(Br)c1 ZINC000414350574 565913589 /nfs/dbraw/zinc/91/35/89/565913589.db2.gz LTKBMBJYZYFMAY-APPDUMDISA-N 0 3 395.322 3.120 10 0 GGAEHN CN1CCC[C@H](CNCc2ccc(S(C)(=O)=O)s2)[C@@H]1c1cccs1 ZINC000414359404 565914866 /nfs/dbraw/zinc/91/48/66/565914866.db2.gz OFAIRGJSDOZUEV-CXAGYDPISA-N 0 3 384.592 3.386 10 0 GGAEHN CN1CCC[C@@H](CNCc2ccc(S(C)(=O)=O)s2)[C@@H]1c1cccs1 ZINC000414359407 565915158 /nfs/dbraw/zinc/91/51/58/565915158.db2.gz OFAIRGJSDOZUEV-SUMWQHHRSA-N 0 3 384.592 3.386 10 0 GGAEHN O[C@@H](COc1cccc(Br)c1)CN1CCN(C2CCCCC2)CC1 ZINC000178446450 565919783 /nfs/dbraw/zinc/91/97/83/565919783.db2.gz LTQNNFXEOPRQSA-GOSISDBHSA-N 0 3 397.357 3.139 10 0 GGAEHN O=C(NCCN[C@H]1CCCOc2ccc(Br)cc21)c1ccco1 ZINC000178488372 565921560 /nfs/dbraw/zinc/92/15/60/565921560.db2.gz CKAWXKDRAVHZEI-AWEZNQCLSA-N 0 3 379.254 3.275 10 0 GGAEHN Cc1cccc(C(C)(C)NCc2ccc(S(N)(=O)=O)c(Br)c2)c1 ZINC000414389936 565921850 /nfs/dbraw/zinc/92/18/50/565921850.db2.gz HMZIRONOTAACII-UHFFFAOYSA-N 0 3 397.338 3.430 10 0 GGAEHN C[NH+](C)Cc1ccc([N-]S(=O)(=O)c2ccc(C(F)(F)F)nc2)c(F)c1 ZINC000414394010 565923392 /nfs/dbraw/zinc/92/33/92/565923392.db2.gz HNPSLFHYFDOYQK-UHFFFAOYSA-N 0 3 377.363 3.102 10 0 GGAEHN CC(C)(C)OC[C@@H](O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000178513594 565923468 /nfs/dbraw/zinc/92/34/68/565923468.db2.gz XYAXVNBXZQATNE-INIZCTEOSA-N 0 3 386.330 3.220 10 0 GGAEHN C[C@H](NC[C@]1(O)CCO[C@@H]1C)c1ccc(Br)cc1Br ZINC000228065241 565924854 /nfs/dbraw/zinc/92/48/54/565924854.db2.gz GSWYOPIIHMTTJZ-IMSIIYSGSA-N 0 3 393.119 3.402 10 0 GGAEHN C[C@@]1(CNCc2ccc(S(C)(=O)=O)s2)CCCN1Cc1ccccc1 ZINC000414431914 565931282 /nfs/dbraw/zinc/93/12/82/565931282.db2.gz LWAJWOOFGGYMOJ-IBGZPJMESA-N 0 3 378.563 3.296 10 0 GGAEHN COc1ccc(CNC[C@H]2CCC3(CCOCC3)[C@H]2O)c(Br)c1 ZINC000285932119 565934168 /nfs/dbraw/zinc/93/41/68/565934168.db2.gz LUMZPICXBQVDRH-PBHICJAKSA-N 0 3 384.314 3.115 10 0 GGAEHN CS(=O)(=O)c1ccc(CNC2CC(N3CCC(C(F)(F)F)CC3)C2)s1 ZINC000414448943 565935164 /nfs/dbraw/zinc/93/51/64/565935164.db2.gz UCKXGFCAVJGEIS-UHFFFAOYSA-N 0 3 396.500 3.047 10 0 GGAEHN OC[C@@H](NCc1cnc(-c2ccc(Br)cc2)s1)[C@@H]1CCCOC1 ZINC000414544772 565947014 /nfs/dbraw/zinc/94/70/14/565947014.db2.gz FHEJFHILGYRDQQ-CZUORRHYSA-N 0 3 397.338 3.450 10 0 GGAEHN OC[C@@H](NCc1cnc(-c2ccc(Br)cc2)s1)[C@H]1CCCOC1 ZINC000414544773 565947172 /nfs/dbraw/zinc/94/71/72/565947172.db2.gz FHEJFHILGYRDQQ-XJKSGUPXSA-N 0 3 397.338 3.450 10 0 GGAEHN CS(=O)(=O)CC1(CNCc2cnc(-c3c(F)cccc3F)s2)CCC1 ZINC000414554821 565948531 /nfs/dbraw/zinc/94/85/31/565948531.db2.gz LKESOXJFKHCCOZ-UHFFFAOYSA-N 0 3 386.489 3.393 10 0 GGAEHN CC(C)N(Cc1ccnc2c(Br)cccc12)C[C@@H]1CCC(=O)N1 ZINC000414565665 565949740 /nfs/dbraw/zinc/94/97/40/565949740.db2.gz FCUHEJAOUMIKGE-AWEZNQCLSA-N 0 3 376.298 3.486 10 0 GGAEHN COc1cc(CNCCOc2cccc(Br)c2)cc2c1OCCO2 ZINC000237183442 565952754 /nfs/dbraw/zinc/95/27/54/565952754.db2.gz QEMOPGAHSVJGKI-UHFFFAOYSA-N 0 3 394.265 3.398 10 0 GGAEHN CN1CCC(Oc2ccc(CNc3ncncc3Br)cc2)CC1 ZINC000286326255 565953957 /nfs/dbraw/zinc/95/39/57/565953957.db2.gz GCXGDNMMWIUCKD-UHFFFAOYSA-N 0 3 377.286 3.324 10 0 GGAEHN COc1c(CNC[C@H]2CCN(c3cccc(Br)c3)C2)c(C)nn1C ZINC000237203436 565954079 /nfs/dbraw/zinc/95/40/79/565954079.db2.gz DFQIQTRHDZTBFQ-CQSZACIVSA-N 0 3 393.329 3.116 10 0 GGAEHN COc1c(CNC[C@@H]2CCN(c3cccc(Br)c3)C2)c(C)nn1C ZINC000237202449 565954151 /nfs/dbraw/zinc/95/41/51/565954151.db2.gz DFQIQTRHDZTBFQ-AWEZNQCLSA-N 0 3 393.329 3.116 10 0 GGAEHN O=C(Cc1c[nH]c2cccc(Br)c12)N1CCCN(C2CC2)CC1 ZINC000179193888 565964362 /nfs/dbraw/zinc/96/43/62/565964362.db2.gz IVBJRKYPMBOSRK-UHFFFAOYSA-N 0 3 376.298 3.170 10 0 GGAEHN Cc1ccc(Br)cc1NC(=O)NCCCNCc1cccnc1 ZINC000414912747 565965044 /nfs/dbraw/zinc/96/50/44/565965044.db2.gz VTFCCFHIRQEYGM-UHFFFAOYSA-N 0 3 377.286 3.454 10 0 GGAEHN CN(C)C[C@@H]1CN(Cc2csc(-c3cccc(Br)c3)n2)CCO1 ZINC000179217929 565967175 /nfs/dbraw/zinc/96/71/75/565967175.db2.gz GTUXMLFVKABVFA-MRXNPFEDSA-N 0 3 396.354 3.335 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN[C@@H]1CNCCC1(F)F ZINC000415008539 565969707 /nfs/dbraw/zinc/96/97/07/565969707.db2.gz WDOFRPARWNMAJJ-MRXNPFEDSA-N 0 3 399.283 3.338 10 0 GGAEHN Cc1c(Br)cccc1NC(=O)NCCCNCc1cccnc1 ZINC000415096448 565972592 /nfs/dbraw/zinc/97/25/92/565972592.db2.gz PYXYFNVOCYNJDF-UHFFFAOYSA-N 0 3 377.286 3.454 10 0 GGAEHN C[C@@H]1C[C@@H](N[C@H]2CCN(C3CCOCC3)C2=O)c2cccc(Br)c21 ZINC000362303199 565978265 /nfs/dbraw/zinc/97/82/65/565978265.db2.gz JPJCYXZDTUKMRZ-OAUYIBNBSA-N 0 3 393.325 3.367 10 0 GGAEHN O=C(Nc1ccc(Cl)cc1OCC(F)(F)F)N[C@H]1CNCCC1(F)F ZINC000415177548 565978553 /nfs/dbraw/zinc/97/85/53/565978553.db2.gz QUQHNWOOVUETKC-NSHDSACASA-N 0 3 387.736 3.400 10 0 GGAEHN O=C(NCCCNCc1cccnc1)Nc1ccc(Br)c(F)c1 ZINC000415235840 565980518 /nfs/dbraw/zinc/98/05/18/565980518.db2.gz XECFMZSCXQDUCZ-UHFFFAOYSA-N 0 3 381.249 3.285 10 0 GGAEHN FC(F)Oc1ccc(Br)cc1CN[C@H]1CCO[C@]2(CCOC2)C1 ZINC000362644103 565981120 /nfs/dbraw/zinc/98/11/20/565981120.db2.gz YJCOURVMWRCGHF-XJKSGUPXSA-N 0 3 392.240 3.478 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000240786134 565984094 /nfs/dbraw/zinc/98/40/94/565984094.db2.gz IATCLQRMOITSCY-CJNGLKHVSA-N 0 3 396.329 3.446 10 0 GGAEHN C[C@@H](NC[C@@H]1CCCN(S(C)(=O)=O)C1)c1c(Cl)ccc(F)c1Cl ZINC000179540920 565987467 /nfs/dbraw/zinc/98/74/67/565987467.db2.gz HZJYGVCIPKVICH-MNOVXSKESA-N 0 3 383.316 3.455 10 0 GGAEHN CC[C@@H]1CN2CCC[C@H]2CN1C(=O)CSCC(=O)c1ccc(Cl)cc1 ZINC000245422319 565988348 /nfs/dbraw/zinc/98/83/48/565988348.db2.gz PIOGZNGZDSCQQV-SJORKVTESA-N 0 3 380.941 3.341 10 0 GGAEHN C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ccccc1CSC1=NCCS1 ZINC000245412525 565988815 /nfs/dbraw/zinc/98/88/15/565988815.db2.gz AANAABMXVAPOPY-HOCLYGCPSA-N 0 3 375.563 3.331 10 0 GGAEHN CCN(C(=O)CSc1nncs1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000363034903 565988959 /nfs/dbraw/zinc/98/89/59/565988959.db2.gz BNZXVLFEKXOKCI-GOEBONIOSA-N 0 3 376.551 3.314 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)NCCc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000179559584 565989105 /nfs/dbraw/zinc/98/91/05/565989105.db2.gz LKIGKLOCLRYQPY-INIZCTEOSA-N 0 3 378.929 3.352 10 0 GGAEHN CCC[C@H](C(=O)NC[C@@H]1CCN(c2ccc(Br)cc2)C1)N(C)C ZINC000179575767 565990498 /nfs/dbraw/zinc/99/04/98/565990498.db2.gz RECOOJRQBKJNQX-WMLDXEAASA-N 0 3 382.346 3.122 10 0 GGAEHN O=S1(=O)CCC[C@H](CN[C@@H]2CCCOc3ccc(Br)cc32)C1 ZINC000287043196 565994352 /nfs/dbraw/zinc/99/43/52/565994352.db2.gz MKGWVSWATRDOPK-IUODEOHRSA-N 0 3 388.327 3.077 10 0 GGAEHN CN(CCc1nccs1)C(=O)NC[C@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000245544520 565994323 /nfs/dbraw/zinc/99/43/23/565994323.db2.gz MGLZXULPPIHMSM-PBHICJAKSA-N 0 3 378.567 3.472 10 0 GGAEHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2c[nH]c3cccc(Br)c23)C1 ZINC000245596573 565996846 /nfs/dbraw/zinc/99/68/46/565996846.db2.gz NHVLUSNVAOOUMR-BLLLJJGKSA-N 0 3 376.298 3.487 10 0 GGAEHN Cc1n[nH]c(C)c1[C@H]1CCCN1C[C@@H](O)COc1cccc(Br)c1 ZINC000245571840 565997313 /nfs/dbraw/zinc/99/73/13/565997313.db2.gz BYGYMAYPWJMXKV-NVXWUHKLSA-N 0 3 394.313 3.366 10 0 GGAEHN CC(C)N1CC[C@@H](N[C@H](C)CS(C)(=O)=O)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245608783 565998828 /nfs/dbraw/zinc/99/88/28/565998828.db2.gz UDTDSJIDGMRIGM-CSMYWGQOSA-N 0 3 376.925 3.026 10 0 GGAEHN CC(C)N1CC[C@@H](N[C@H](C)CS(C)(=O)=O)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000245608792 565998948 /nfs/dbraw/zinc/99/89/48/565998948.db2.gz UDTDSJIDGMRIGM-JLZZUVOBSA-N 0 3 376.925 3.026 10 0 GGAEHN CN1CCC(C(=O)N2CCC[C@H]2c2ccccc2I)CC1 ZINC000363301653 565998928 /nfs/dbraw/zinc/99/89/28/565998928.db2.gz BDCFKGFVFVCXOE-INIZCTEOSA-N 0 3 398.288 3.297 10 0 GGAEHN O=C(NCCCNCc1cccnc1)Nc1cc(Br)c(F)cc1F ZINC000415567835 566005298 /nfs/dbraw/zinc/00/52/98/566005298.db2.gz QKSZYNUUEUTXKT-UHFFFAOYSA-N 0 3 399.239 3.424 10 0 GGAEHN CC(C(=O)N[C@@H]1CCCC[C@H]1C)S(=O)(=O)Cc1nc(C(C)(C)C)cs1 ZINC000245859296 566008067 /nfs/dbraw/zinc/00/80/67/566008067.db2.gz HJUJOFWJKCLMNR-HZSPNIEDSA-N 0 3 386.583 3.439 10 0 GGAEHN O=C(N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F)N[C@@H]1CNCCC1(F)F ZINC000415618853 566008810 /nfs/dbraw/zinc/00/88/10/566008810.db2.gz RSVCYPSHVFCNEC-MNOVXSKESA-N 0 3 389.727 3.379 10 0 GGAEHN CN1CCC[C@H](CNC(=O)NC[C@H]2CSCCS2)[C@@H]1c1cccs1 ZINC000245865853 566008955 /nfs/dbraw/zinc/00/89/55/566008955.db2.gz DVLRNYRLFRZOMB-IJEWVQPXSA-N 0 3 385.624 3.279 10 0 GGAEHN CC[C@H]1CN(Cc2ccc(Br)c3cccnc23)CCN1C[C@H](C)O ZINC000245951848 566012691 /nfs/dbraw/zinc/01/26/91/566012691.db2.gz LFWPUHKTRAUEIH-HOCLYGCPSA-N 0 3 392.341 3.274 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(F)cc2C(F)(F)F)[C@@H](C)C1 ZINC000246065324 566014454 /nfs/dbraw/zinc/01/44/54/566014454.db2.gz DPKSHJHQHUUFJC-FZMZJTMJSA-N 0 3 382.423 3.195 10 0 GGAEHN C[C@@H](CN1CCC[C@H](C(=O)N2CCOCC2)C1)c1cccc(Br)c1 ZINC000179894487 566016083 /nfs/dbraw/zinc/01/60/83/566016083.db2.gz DFAXTLVOPIQQQU-RDJZCZTQSA-N 0 3 395.341 3.123 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(F)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC000246118513 566017143 /nfs/dbraw/zinc/01/71/43/566017143.db2.gz IWTVQPIFOIJHBZ-XHDPSFHLSA-N 0 3 382.423 3.195 10 0 GGAEHN O=C(c1cc(Br)cc(Br)c1)N1CCN2CCC[C@@H]2C1 ZINC000179913252 566018085 /nfs/dbraw/zinc/01/80/85/566018085.db2.gz RGWGDVDKQSRFBW-CYBMUJFWSA-N 0 3 388.103 3.132 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(Br)ccc2C)[C@@H](C)C1 ZINC000246138441 566018839 /nfs/dbraw/zinc/01/88/39/566018839.db2.gz KEFUTZDGXIOKFV-DZGCQCFKSA-N 0 3 389.359 3.108 10 0 GGAEHN CNCc1ccccc1NC(=O)N[C@](C)(CO)c1ccc(Br)cc1 ZINC000415895955 566021046 /nfs/dbraw/zinc/02/10/46/566021046.db2.gz CIRWGOHBLQJDHQ-GOSISDBHSA-N 0 3 392.297 3.198 10 0 GGAEHN C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ccn(-c2ccc(Cl)cc2Cl)n1 ZINC000179944114 566020952 /nfs/dbraw/zinc/02/09/52/566020952.db2.gz FMATUTVCIBJDRS-GXTWGEPZSA-N 0 3 379.291 3.488 10 0 GGAEHN CN(C[C@@H](O)COc1c(Cl)cccc1Cl)[C@H]1CCCc2c1cnn2C ZINC000246195951 566021564 /nfs/dbraw/zinc/02/15/64/566021564.db2.gz ABNBLMGETLKHJH-WBMJQRKESA-N 0 3 384.307 3.476 10 0 GGAEHN Brc1ccc2c(c1)[C@H](NC[C@H]1COC3(CCOCC3)O1)CCCO2 ZINC000179979265 566023042 /nfs/dbraw/zinc/02/30/42/566023042.db2.gz ABBYXFDYDFKYOL-GOEBONIOSA-N 0 3 398.297 3.175 10 0 GGAEHN OCCN1CCCN(c2ccc3c(Br)ccc(Cl)c3n2)CC1 ZINC000179994115 566023988 /nfs/dbraw/zinc/02/39/88/566023988.db2.gz WJJPKHZDZUCWCI-UHFFFAOYSA-N 0 3 384.705 3.155 10 0 GGAEHN O=C(CCN1CCN2CCCC[C@H]2C1)Nc1ccc(Br)cc1F ZINC000246263116 566023952 /nfs/dbraw/zinc/02/39/52/566023952.db2.gz YVLGCPFMAXEGQY-AWEZNQCLSA-N 0 3 384.293 3.087 10 0 GGAEHN CC[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1cccc(C)c1Br ZINC000246366160 566027200 /nfs/dbraw/zinc/02/72/00/566027200.db2.gz YTKGOBDUQSAKGN-KGLIPLIRSA-N 0 3 387.343 3.005 10 0 GGAEHN COCCN(CC(F)F)C(=O)NC[C@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000246412141 566028690 /nfs/dbraw/zinc/02/86/90/566028690.db2.gz SBXIBEAAVVVPSR-CJNGLKHVSA-N 0 3 375.485 3.054 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(C)c(Br)s2)[C@@H](C)C1 ZINC000246504773 566031479 /nfs/dbraw/zinc/03/14/79/566031479.db2.gz NKHPCYNRNYXZFV-NWDGAFQWSA-N 0 3 395.388 3.170 10 0 GGAEHN COCc1c(Br)cccc1NC(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C ZINC000246536199 566032763 /nfs/dbraw/zinc/03/27/63/566032763.db2.gz VEJLCQYCBBJVGM-BLLLJJGKSA-N 0 3 384.318 3.446 10 0 GGAEHN C[C@H]1CN(Cc2cc(Br)cc3cccnc32)C[C@H]1N1CCOCC1 ZINC000246564611 566033806 /nfs/dbraw/zinc/03/38/06/566033806.db2.gz RLCIBAACGNEMLI-KBXCAEBGSA-N 0 3 390.325 3.150 10 0 GGAEHN CC[C@H]1CCCCN1CCNC(=O)N[C@H](CO)c1cccc(Br)c1 ZINC000246608419 566034080 /nfs/dbraw/zinc/03/40/80/566034080.db2.gz DJAJCEARBZMTCF-DLBZAZTESA-N 0 3 398.345 3.046 10 0 GGAEHN CC(C)c1csc([C@@H]2CCCN(C[C@H]3CCCN(S(C)(=O)=O)C3)C2)n1 ZINC000246578022 566034590 /nfs/dbraw/zinc/03/45/90/566034590.db2.gz WNVVYLREUXWOSO-HZPDHXFCSA-N 0 3 385.599 3.118 10 0 GGAEHN C[C@H](NC[C@H](O)c1c(Cl)cccc1Cl)c1ccc(S(N)(=O)=O)cc1 ZINC000180182901 566041512 /nfs/dbraw/zinc/04/15/12/566041512.db2.gz VQBVUJAFMNXRJV-BONVTDFDSA-N 0 3 389.304 3.025 10 0 GGAEHN CC(C)(C)OC(=O)[C@@H]1CCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000246810891 566042753 /nfs/dbraw/zinc/04/27/53/566042753.db2.gz AAVAYYITOYWBRJ-CHWSQXEVSA-N 0 3 390.307 3.397 10 0 GGAEHN O=S(=O)(C[C@H](O)CN[C@@H](c1ccc(Cl)cc1)C1CC1)c1cccs1 ZINC000180201850 566044255 /nfs/dbraw/zinc/04/42/55/566044255.db2.gz YGDJDSKVFKYERK-NVXWUHKLSA-N 0 3 385.938 3.277 10 0 GGAEHN C[C@H](NC(=O)CCN1CCc2ccccc2C1)c1ccc(Br)cn1 ZINC000416220135 566045128 /nfs/dbraw/zinc/04/51/28/566045128.db2.gz WOWSMEKGINHKSV-AWEZNQCLSA-N 0 3 388.309 3.470 10 0 GGAEHN C[C@H]1CN(CC2=Cc3cc(Cl)cc(Cl)c3OC2)C[C@@H]1N1CCOCC1 ZINC000180226439 566046289 /nfs/dbraw/zinc/04/62/89/566046289.db2.gz JDWNKPHQDZBLHM-UGSOOPFHSA-N 0 3 383.319 3.422 10 0 GGAEHN C[C@H](Oc1ccc(F)cc1Br)C(=O)N1C[C@@H]2CCCN2C[C@H]1C ZINC000246960948 566047069 /nfs/dbraw/zinc/04/70/69/566047069.db2.gz DJPQJTLXCLUYNQ-DYEKYZERSA-N 0 3 385.277 3.051 10 0 GGAEHN C[C@H](Oc1ccc(F)cc1Br)C(=O)N1C[C@@H]2CCCN2C[C@@H]1C ZINC000246961001 566048794 /nfs/dbraw/zinc/04/87/94/566048794.db2.gz DJPQJTLXCLUYNQ-OBJOEFQTSA-N 0 3 385.277 3.051 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)N[C@@H](c2cncc(Br)c2)C2CC2)CCN1C ZINC000287955459 566049639 /nfs/dbraw/zinc/04/96/39/566049639.db2.gz VLFGSRJPKFMDGK-OAUYIBNBSA-N 0 3 395.345 3.419 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)N[C@@H](c2cncc(Br)c2)C2CC2)CCN1C ZINC000287955448 566049749 /nfs/dbraw/zinc/04/97/49/566049749.db2.gz VLFGSRJPKFMDGK-CSMYWGQOSA-N 0 3 395.345 3.419 10 0 GGAEHN C[C@H](Cc1ccc(F)c(Br)c1)C(=O)N1C[C@@H]2CCCN2C[C@H]1C ZINC000247076069 566051733 /nfs/dbraw/zinc/05/17/33/566051733.db2.gz QNFXSBSCRADISP-NFAWXSAZSA-N 0 3 383.305 3.462 10 0 GGAEHN C[C@H](Cc1ccc(F)c(Br)c1)C(=O)N1C[C@H]2CCCN2C[C@@H]1C ZINC000247076108 566051758 /nfs/dbraw/zinc/05/17/58/566051758.db2.gz QNFXSBSCRADISP-VNHYZAJKSA-N 0 3 383.305 3.462 10 0 GGAEHN Cc1ccc(I)c(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1 ZINC000247086479 566051911 /nfs/dbraw/zinc/05/19/11/566051911.db2.gz JJCHVKNNXYBQII-DOMZBBRYSA-N 0 3 386.277 3.058 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)NCc2cc(F)c(F)cc2Br)CCN1C ZINC000288010081 566052026 /nfs/dbraw/zinc/05/20/26/566052026.db2.gz BPXVUMWLTDFLHA-PWSUYJOCSA-N 0 3 390.272 3.351 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)NCc2cc(F)c(F)cc2Br)CCN1C ZINC000288010084 566052150 /nfs/dbraw/zinc/05/21/50/566052150.db2.gz BPXVUMWLTDFLHA-ZYHUDNBSSA-N 0 3 390.272 3.351 10 0 GGAEHN CN(C)C1(CNC(=O)CSCc2ccc(Br)cc2F)CC1 ZINC000416303749 566052506 /nfs/dbraw/zinc/05/25/06/566052506.db2.gz SIJMXWUXAVAKHP-UHFFFAOYSA-N 0 3 375.307 3.032 10 0 GGAEHN C[C@H]1CN2CCC[C@H]2CN1C(=O)c1[nH]nc(-c2ccccc2)c1Br ZINC000247123478 566053002 /nfs/dbraw/zinc/05/30/02/566053002.db2.gz JCQZNSKVKLHAFE-JSGCOSHPSA-N 0 3 389.297 3.148 10 0 GGAEHN Cc1ccc(OCCC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c(Br)c1 ZINC000247152252 566053967 /nfs/dbraw/zinc/05/39/67/566053967.db2.gz ADWNMSIMKMSOFH-GJZGRUSLSA-N 0 3 383.330 3.468 10 0 GGAEHN C[C@H](Oc1ccc(F)cc1Br)C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000247342193 566059368 /nfs/dbraw/zinc/05/93/68/566059368.db2.gz JFNAYDGQBIJKOU-MBNYWOFBSA-N 0 3 387.293 3.297 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)cc1OC ZINC000247474013 566061974 /nfs/dbraw/zinc/06/19/74/566061974.db2.gz RYNLRVLATSQIOL-TZMCWYRMSA-N 0 3 397.313 3.165 10 0 GGAEHN Cc1ccc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1I ZINC000247559675 566062354 /nfs/dbraw/zinc/06/23/54/566062354.db2.gz ZMFKRQOEMUWCFC-JSGCOSHPSA-N 0 3 386.277 3.154 10 0 GGAEHN CCOCCN1CCN(CCC(=O)Nc2c(Cl)cccc2Cl)C[C@H]1C ZINC000247536369 566063206 /nfs/dbraw/zinc/06/32/06/566063206.db2.gz COAXYPAEFXHFKT-CQSZACIVSA-N 0 3 388.339 3.365 10 0 GGAEHN C[C@H](NC(=O)C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1)c1cccc(Cl)c1Cl ZINC000288241885 566064316 /nfs/dbraw/zinc/06/43/16/566064316.db2.gz QPODXMYGBMSLCL-FRRDWIJNSA-N 0 3 386.323 3.112 10 0 GGAEHN Cc1cnn([C@@H]2CCCN(C[C@@H](O)COc3ccc(Br)cc3)C2)c1 ZINC000247768815 566066180 /nfs/dbraw/zinc/06/61/80/566066180.db2.gz OOOIRNZZGSXBLF-IAGOWNOFSA-N 0 3 394.313 3.031 10 0 GGAEHN CCOCCN1CCN(CCC(=O)Nc2cc(Cl)ccc2Cl)C[C@H]1C ZINC000247775830 566066910 /nfs/dbraw/zinc/06/69/10/566066910.db2.gz QOOHFYHMJLVWNC-CQSZACIVSA-N 0 3 388.339 3.365 10 0 GGAEHN C[C@@H](NC(=O)N[C@@H](CCO)c1ccc(Cl)c(Cl)c1)C1=CCN(C)CC1 ZINC000288328334 566068228 /nfs/dbraw/zinc/06/82/28/566068228.db2.gz VENIYNZEBUGCPC-PXAZEXFGSA-N 0 3 386.323 3.367 10 0 GGAEHN C[C@H](NC(=O)N[C@H](CCO)c1ccc(Cl)c(Cl)c1)C1=CCN(C)CC1 ZINC000288328347 566068635 /nfs/dbraw/zinc/06/86/35/566068635.db2.gz VENIYNZEBUGCPC-YVEFUNNKSA-N 0 3 386.323 3.367 10 0 GGAEHN C[C@@H](c1cccc(Br)c1)N1CCC[C@@H](C(=O)N2CCOCC2)C1 ZINC000248005385 566070823 /nfs/dbraw/zinc/07/08/23/566070823.db2.gz KUAVDWKLEVNGQI-GOEBONIOSA-N 0 3 381.314 3.081 10 0 GGAEHN CCc1nc2n(n1)C[C@@H](N[C@H]1CCCOc3ccc(Br)cc31)CC2 ZINC000180612385 566076915 /nfs/dbraw/zinc/07/69/15/566076915.db2.gz PFXQZVHABJVMJB-ZFWWWQNUSA-N 0 3 391.313 3.421 10 0 GGAEHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)c1n[nH]c2ccc(Br)cc21 ZINC000288511456 566077958 /nfs/dbraw/zinc/07/79/58/566077958.db2.gz STDXVWRAQDADEW-WCQYABFASA-N 0 3 377.286 3.024 10 0 GGAEHN CCc1nc2n(n1)C[C@H](N[C@@H](C)c1ccc(I)cc1)CC2 ZINC000180625798 566078391 /nfs/dbraw/zinc/07/83/91/566078391.db2.gz WDQRFKNXFXRUII-SMDDNHRTSA-N 0 3 396.276 3.111 10 0 GGAEHN CCOCCN1CCN(CCCc2ccc(Br)cc2OC)C[C@H]1C ZINC000248440229 566078940 /nfs/dbraw/zinc/07/89/40/566078940.db2.gz CWLIAFGXOKOBDD-MRXNPFEDSA-N 0 3 399.373 3.433 10 0 GGAEHN CC[C@H]1CN(CCCc2ccc(Br)cc2OC)CCN1C[C@H](C)O ZINC000248455174 566079013 /nfs/dbraw/zinc/07/90/13/566079013.db2.gz KTXKNKXBSMUDFP-YJBOKZPZSA-N 0 3 399.373 3.167 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1C[C@@H](O)c1ccc(F)c(Br)c1 ZINC000248565383 566081087 /nfs/dbraw/zinc/08/10/87/566081087.db2.gz ORKLMHRUCKREHF-RHSMWYFYSA-N 0 3 382.277 3.291 10 0 GGAEHN O[C@@H]1CCCC[C@H]1CN[C@H](c1ccc(Br)cc1)c1cncnc1 ZINC000248552332 566081621 /nfs/dbraw/zinc/08/16/21/566081621.db2.gz JCIKTBVVQMRYLY-BMGDILEWSA-N 0 3 376.298 3.469 10 0 GGAEHN CCN1CCC[C@H](N[C@H](c2ccc(Br)cc2)c2cncnc2)C1 ZINC000248584473 566083262 /nfs/dbraw/zinc/08/32/62/566083262.db2.gz WZQHIMYZZSFSLX-ZWKOTPCHSA-N 0 3 375.314 3.402 10 0 GGAEHN Cn1nc(Br)cc1C(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1 ZINC000248672716 566085258 /nfs/dbraw/zinc/08/52/58/566085258.db2.gz RHRZJZSPLGWJTI-IAQYHMDHSA-N 0 3 397.342 3.057 10 0 GGAEHN CN1CC[C@H]2[C@@H](CCCN2C(=O)C2(c3ccccc3Br)CC2)C1 ZINC000248886833 566090961 /nfs/dbraw/zinc/09/09/61/566090961.db2.gz HUACGBKGYZOPNM-YOEHRIQHSA-N 0 3 377.326 3.423 10 0 GGAEHN CN1CC[C@@H](NC(=O)Nc2cccnc2Br)[C@H]1c1ccccc1 ZINC000249089377 566096814 /nfs/dbraw/zinc/09/68/14/566096814.db2.gz UKIMKWHBIKRURQ-UKRRQHHQSA-N 0 3 375.270 3.411 10 0 GGAEHN C[C@H](CN(C)C[C@H](O)COC[C@H]1CCCO1)Oc1ccc(Cl)c(Cl)c1 ZINC000249281866 566100740 /nfs/dbraw/zinc/10/07/40/566100740.db2.gz LAIVCQIWEKIUHA-IJEWVQPXSA-N 0 3 392.323 3.249 10 0 GGAEHN Cc1csc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1I ZINC000249390899 566101799 /nfs/dbraw/zinc/10/17/99/566101799.db2.gz RWVGXHOVADWOBP-KOLCDFICSA-N 0 3 392.306 3.120 10 0 GGAEHN CN1CCCN(c2ccc(-c3noc(-c4nc(Cl)cs4)n3)cn2)CC1 ZINC000289044695 566103423 /nfs/dbraw/zinc/10/34/23/566103423.db2.gz XRYYRSPINNOEMA-UHFFFAOYSA-N 0 3 376.873 3.050 10 0 GGAEHN CN1CCC(Cc2nc(CC(=O)Nc3cccc(Cl)c3Cl)no2)CC1 ZINC000289211942 566112104 /nfs/dbraw/zinc/11/21/04/566112104.db2.gz RXKZLXKJQBWADU-UHFFFAOYSA-N 0 3 383.279 3.442 10 0 GGAEHN OC[C@H]1CN(Cc2ccccc2)CC[C@H]1NCc1ccccc1Br ZINC000252476800 566114427 /nfs/dbraw/zinc/11/44/27/566114427.db2.gz BWBCWGDOLIIYDN-UYAOXDASSA-N 0 3 389.337 3.422 10 0 GGAEHN C[C@@H]1C[C@@H](O)C[C@H](C)N1C[C@@H](O)COc1ccc(Cl)cc1Br ZINC000253335858 566117221 /nfs/dbraw/zinc/11/72/21/566117221.db2.gz ATKXPQJIKRDZIF-ZMJPVWNMSA-N 0 3 392.721 3.076 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)NC[C@H](N)c1ccccc1 ZINC000417097003 566124554 /nfs/dbraw/zinc/12/45/54/566124554.db2.gz DDZKLBABJQFQRI-DYVFJYSZSA-N 0 3 376.298 3.379 10 0 GGAEHN O=C1[C@H](NC2CC(c3ccc(Br)cc3)C2)CCN1C1CCOCC1 ZINC000365880262 566125407 /nfs/dbraw/zinc/12/54/07/566125407.db2.gz LGUQWMRGQXXUAR-JFUPDXTOSA-N 0 3 393.325 3.065 10 0 GGAEHN Brc1cccc(-c2c[nH]c(CN3CCNC[C@@H]3c3cccnc3)n2)c1 ZINC000261669509 566127559 /nfs/dbraw/zinc/12/75/59/566127559.db2.gz IXZQWPPBBIWFOJ-GOSISDBHSA-N 0 3 398.308 3.381 10 0 GGAEHN Brc1cccc(-c2c[nH]c(CN3CCNC[C@H]3c3cccnc3)n2)c1 ZINC000261669514 566128175 /nfs/dbraw/zinc/12/81/75/566128175.db2.gz IXZQWPPBBIWFOJ-SFHVURJKSA-N 0 3 398.308 3.381 10 0 GGAEHN C[C@@](N)(C(=O)Nc1ccc2c(c1F)CCNC2)c1ccc(Br)cc1 ZINC000261748204 566132437 /nfs/dbraw/zinc/13/24/37/566132437.db2.gz IVQFHFIGDUWAJI-SFHVURJKSA-N 0 3 392.272 3.047 10 0 GGAEHN CCNC(=O)N1CC[C@@H](N[C@@H]2CCCOc3ccc(Br)cc32)C1 ZINC000181329398 566132631 /nfs/dbraw/zinc/13/26/31/566132631.db2.gz FBAGAHCBUSOUNR-UKRRQHHQSA-N 0 3 382.302 3.056 10 0 GGAEHN Brc1ccc(-n2cc(CN3CCNC[C@@H]3c3cccnc3)cn2)cc1 ZINC000261769455 566133222 /nfs/dbraw/zinc/13/32/22/566133222.db2.gz RZJBVUDFRGYZHX-LJQANCHMSA-N 0 3 398.308 3.176 10 0 GGAEHN CO[C@H](c1noc(CC2CCN(C)CC2)n1)c1ccc(Br)cc1 ZINC000289663474 566133571 /nfs/dbraw/zinc/13/35/71/566133571.db2.gz KLALXCCXSJTGMF-INIZCTEOSA-N 0 3 380.286 3.452 10 0 GGAEHN N[C@H](C(=O)Nc1cc(Br)cc(C(F)(F)F)c1)C1CCOCC1 ZINC000261761907 566133639 /nfs/dbraw/zinc/13/36/39/566133639.db2.gz LTBFGGZVTGXKEN-LBPRGKRZSA-N 0 3 381.192 3.160 10 0 GGAEHN CCNC(=O)N1CC[C@@H](N[C@@H](CCCOC)c2ccc(Br)cc2)C1 ZINC000181330929 566133800 /nfs/dbraw/zinc/13/38/00/566133800.db2.gz XMJRLJJGOCRDJP-SJORKVTESA-N 0 3 398.345 3.310 10 0 GGAEHN CCNC(=O)N1CC[C@@H](N[C@@H]2CCSc3ccc(Br)cc32)C1 ZINC000181335249 566133838 /nfs/dbraw/zinc/13/38/38/566133838.db2.gz YBVXGEOSGREYFO-TZMCWYRMSA-N 0 3 384.343 3.379 10 0 GGAEHN NC1(C(=O)NCC2(c3ccc(Br)cc3)CCCCC2)CCOCC1 ZINC000261797206 566134584 /nfs/dbraw/zinc/13/45/84/566134584.db2.gz IQPRMICPMVQPLQ-UHFFFAOYSA-N 0 3 395.341 3.275 10 0 GGAEHN C[C@@H](CCc1ccc(Br)cc1)NC(=O)N[C@H]1CNCCC1(F)F ZINC000417221623 566138319 /nfs/dbraw/zinc/13/83/19/566138319.db2.gz DAYIWKKLMSDNPJ-FZMZJTMJSA-N 0 3 390.272 3.067 10 0 GGAEHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)C1(N)CCOCC1 ZINC000261915057 566140334 /nfs/dbraw/zinc/14/03/34/566140334.db2.gz UHAJTQBAYRSAHC-GFCCVEGCSA-N 0 3 379.913 3.457 10 0 GGAEHN CC(C)(C(=O)NC1CCN([C@H]2CCOC2)CC1)c1cccc(Br)c1 ZINC000366191545 566140283 /nfs/dbraw/zinc/14/02/83/566140283.db2.gz KXHVAUONRKYNDC-KRWDZBQOSA-N 0 3 395.341 3.096 10 0 GGAEHN C[C@@H](Cc1cccc(Br)c1)NC(=O)NC[C@H](N)c1ccccc1 ZINC000417278227 566142390 /nfs/dbraw/zinc/14/23/90/566142390.db2.gz IPQVKPPCZAIFEJ-GUYCJALGSA-N 0 3 376.298 3.379 10 0 GGAEHN C[C@@H](Cc1cccc(Br)c1)NC(=O)NC[C@@H](N)c1ccccc1 ZINC000417278229 566142523 /nfs/dbraw/zinc/14/25/23/566142523.db2.gz IPQVKPPCZAIFEJ-SUMWQHHRSA-N 0 3 376.298 3.379 10 0 GGAEHN C[C@H](Cc1cccc(Br)c1)NC(=O)NC[C@H](N)c1ccccc1 ZINC000417278225 566142627 /nfs/dbraw/zinc/14/26/27/566142627.db2.gz IPQVKPPCZAIFEJ-DYVFJYSZSA-N 0 3 376.298 3.379 10 0 GGAEHN C[C@H](NCC1(C(N)=O)CCOCC1)c1cc2cc(Br)ccc2o1 ZINC000181484882 566142898 /nfs/dbraw/zinc/14/28/98/566142898.db2.gz RAJFCBQGJPETHH-NSHDSACASA-N 0 3 381.270 3.128 10 0 GGAEHN O=C(NCCCC(F)(F)F)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000366230289 566143367 /nfs/dbraw/zinc/14/33/67/566143367.db2.gz LEFXEYIRWXOLFO-UHFFFAOYSA-N 0 3 375.357 3.433 10 0 GGAEHN Fc1cc(Br)cc(OCCN2CCNC[C@H]2c2cccnc2)c1 ZINC000262114643 566147150 /nfs/dbraw/zinc/14/71/50/566147150.db2.gz KYAVGQSAYLMGQT-KRWDZBQOSA-N 0 3 380.261 3.009 10 0 GGAEHN [NH3+]C1(C[N-]S(=O)(=O)c2cccc(Br)c2Cl)CCCCC1 ZINC000262163571 566148300 /nfs/dbraw/zinc/14/83/00/566148300.db2.gz ACZWUHCTOMEEFG-UHFFFAOYSA-N 0 3 381.723 3.042 10 0 GGAEHN CN(Cc1cc(Br)cs1)C(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C ZINC000262401697 566151969 /nfs/dbraw/zinc/15/19/69/566151969.db2.gz CHGFFOQJBAQSSY-WOSRLPQWSA-N 0 3 387.343 3.002 10 0 GGAEHN O=S(=O)(Cc1ccc(Cl)cc1Cl)NC1CCN(CC2CC2)CC1 ZINC000181616879 566152713 /nfs/dbraw/zinc/15/27/13/566152713.db2.gz KKDYCZNBVZUIRO-UHFFFAOYSA-N 0 3 377.337 3.287 10 0 GGAEHN COC[C@H](NC[C@@H](O)COc1cccc(Br)c1)c1ccccc1 ZINC000181645502 566156005 /nfs/dbraw/zinc/15/60/05/566156005.db2.gz RGDLPWWNOZQPJQ-AEFFLSMTSA-N 0 3 380.282 3.166 10 0 GGAEHN Cc1nc2ccccn2c(=O)c1CCN(C)Cc1ccc(Br)o1 ZINC000290108015 566157513 /nfs/dbraw/zinc/15/75/13/566157513.db2.gz XKEUNRFJWNCQTQ-UHFFFAOYSA-N 0 3 376.254 3.033 10 0 GGAEHN COC[C@@H](NC[C@@H](O)COc1ccc(Br)cc1)c1ccccc1 ZINC000181683199 566158283 /nfs/dbraw/zinc/15/82/83/566158283.db2.gz YTOMWUHFQLPLGY-SJLPKXTDSA-N 0 3 380.282 3.166 10 0 GGAEHN CCSc1nccnc1C(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1 ZINC000366579621 566159584 /nfs/dbraw/zinc/15/95/84/566159584.db2.gz KNMVSAOQLGMFAQ-CZUORRHYSA-N 0 3 376.551 3.463 10 0 GGAEHN O=C(NCCOCc1ccc(Cl)cc1Cl)N1CC[C@@H](N2CC=CC2)C1 ZINC000181711603 566160380 /nfs/dbraw/zinc/16/03/80/566160380.db2.gz ORMOLWSCWPXLOB-MRXNPFEDSA-N 0 3 384.307 3.166 10 0 GGAEHN CNS(=O)(=O)c1cccc([C@H](C)NCCOCc2ccc(Cl)cc2)c1 ZINC000181711321 566160415 /nfs/dbraw/zinc/16/04/15/566160415.db2.gz TUUZTMURJSOEOQ-AWEZNQCLSA-N 0 3 382.913 3.116 10 0 GGAEHN CN1CCC[C@H]2CN(S(=O)(=O)Cc3ccc(Cl)cc3Cl)CC[C@@H]21 ZINC000181707413 566160874 /nfs/dbraw/zinc/16/08/74/566160874.db2.gz YZXLVNSGTVNFNL-LRDDRELGSA-N 0 3 377.337 3.239 10 0 GGAEHN C[C@H](CN1CCN(C)CC1)N[C@@H](C)c1cc2cc(Br)ccc2o1 ZINC000181720920 566161527 /nfs/dbraw/zinc/16/15/27/566161527.db2.gz WYBAZQOCXCZFGR-KGLIPLIRSA-N 0 3 380.330 3.482 10 0 GGAEHN C[C@@H](CN1CCN(C)CC1)N[C@@H](C)c1cc2cc(Br)ccc2o1 ZINC000181720902 566162031 /nfs/dbraw/zinc/16/20/31/566162031.db2.gz WYBAZQOCXCZFGR-KBPBESRZSA-N 0 3 380.330 3.482 10 0 GGAEHN CN1CCN(CC2(C)CCN(Cc3ncc(C(F)(F)F)s3)CC2)CC1 ZINC000366734915 566166820 /nfs/dbraw/zinc/16/68/20/566166820.db2.gz DQPYFNSYXMRBPV-UHFFFAOYSA-N 0 3 376.492 3.011 10 0 GGAEHN CCN1CCN(CCNC(=O)c2sc3ccccc3c2Br)CC1 ZINC000290364485 566168526 /nfs/dbraw/zinc/16/85/26/566168526.db2.gz HEORDOZQAKDXET-UHFFFAOYSA-N 0 3 396.354 3.031 10 0 GGAEHN Cn1cc(CN2CCCN(CCCc3ccccc3Br)CC2)cn1 ZINC000181848319 566169612 /nfs/dbraw/zinc/16/96/12/566169612.db2.gz RCRMVTUJGMFUHE-UHFFFAOYSA-N 0 3 391.357 3.323 10 0 GGAEHN FC(F)(F)C1CCN(C2CC(Nc3ncncc3Br)C2)CC1 ZINC000366854348 566173525 /nfs/dbraw/zinc/17/35/25/566173525.db2.gz DEPKXNKGXWOSIO-UHFFFAOYSA-N 0 3 379.224 3.456 10 0 GGAEHN C[C@H](CNC(=O)NC[C@H](N)c1ccccc1)Oc1ccc(Br)cc1 ZINC000417774024 566175495 /nfs/dbraw/zinc/17/54/95/566175495.db2.gz KHAXEMYLVMJMQO-DYVFJYSZSA-N 0 3 392.297 3.216 10 0 GGAEHN C[C@H](CNC(=O)NC[C@H](N)c1ccccc1)Oc1ccccc1Br ZINC000417828935 566176648 /nfs/dbraw/zinc/17/66/48/566176648.db2.gz QRZUHXGJCQDBQI-CJNGLKHVSA-N 0 3 392.297 3.216 10 0 GGAEHN C[C@H](N[C@@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccccc1Br ZINC000182070789 566181028 /nfs/dbraw/zinc/18/10/28/566181028.db2.gz AVWIWAYXZYQPKT-LRDDRELGSA-N 0 3 396.329 3.190 10 0 GGAEHN Ic1cccc(CNCc2ccnc(-n3ccnc3)c2)c1 ZINC000367069738 566183529 /nfs/dbraw/zinc/18/35/29/566183529.db2.gz YPOCOPFTJWDEKN-UHFFFAOYSA-N 0 3 390.228 3.162 10 0 GGAEHN C[C@H](NC[C@@H]1CC[C@H](C(=O)N(C)C)O1)c1cc2cc(Br)ccc2o1 ZINC000182107506 566183937 /nfs/dbraw/zinc/18/39/37/566183937.db2.gz TZSRWYZAVIHHKH-HZUKXOBISA-N 0 3 395.297 3.482 10 0 GGAEHN COC(=O)c1cc(NC(=O)N(CCN(C)C)C(C)C)ccc1Br ZINC000182142641 566185503 /nfs/dbraw/zinc/18/55/03/566185503.db2.gz NMMVNDDAHUPRKS-UHFFFAOYSA-N 0 3 386.290 3.040 10 0 GGAEHN COc1cc(Br)ccc1CN(C)[C@H]1CCCN(c2cccnn2)C1 ZINC000182170345 566186619 /nfs/dbraw/zinc/18/66/19/566186619.db2.gz RHECNNQNPJMGLN-INIZCTEOSA-N 0 3 391.313 3.349 10 0 GGAEHN CS(=O)(=O)N1CC[C@H](CN2CCC(Sc3ccc(Cl)cc3)CC2)C1 ZINC000367274571 566192703 /nfs/dbraw/zinc/19/27/03/566192703.db2.gz NICAUHFRDCCJJW-CQSZACIVSA-N 0 3 388.986 3.178 10 0 GGAEHN CCn1nncc1CN[C@H]1CCCN(c2c(C)cc(Br)cc2C)C1 ZINC000418053103 566193466 /nfs/dbraw/zinc/19/34/66/566193466.db2.gz BGKCWMQMGLQKRV-INIZCTEOSA-N 0 3 392.345 3.436 10 0 GGAEHN COc1c(Br)cc(Br)cc1CN[C@H]1C[C@@](C)(O)C1 ZINC000418111777 566197889 /nfs/dbraw/zinc/19/78/89/566197889.db2.gz KWGQOVFOHKBGTD-GSJFWJNXSA-N 0 3 379.092 3.223 10 0 GGAEHN CC[C@@H](NC(=O)N[C@H]1CNCCC1(F)F)c1cc(F)cc(Br)c1 ZINC000418145572 566200412 /nfs/dbraw/zinc/20/04/12/566200412.db2.gz OKMKEFKFORTFIW-OLZOCXBDSA-N 0 3 394.235 3.336 10 0 GGAEHN O=C(NCc1cnc(-c2ccc(Cl)cc2)s1)N[C@H]1CNCCC1(F)F ZINC000418177534 566202769 /nfs/dbraw/zinc/20/27/69/566202769.db2.gz HTFKICRPGFHRHA-ZDUSSCGKSA-N 0 3 386.855 3.260 10 0 GGAEHN Cc1cc(CNC(=O)NCCCNCc2cccnc2)ccc1Br ZINC000418281023 566208184 /nfs/dbraw/zinc/20/81/84/566208184.db2.gz MYGLRNHEIARRMC-UHFFFAOYSA-N 0 3 391.313 3.132 10 0 GGAEHN COc1ccc(NC(=O)CCN[C@H](CO)c2cccc(Br)c2)cc1 ZINC000182503091 566208581 /nfs/dbraw/zinc/20/85/81/566208581.db2.gz DVIVXGHVVRSVFT-QGZVFWFLSA-N 0 3 393.281 3.110 10 0 GGAEHN COc1ccc(NC(=O)CCN[C@@H](CO)c2cccc(Br)c2)cc1 ZINC000182503074 566208645 /nfs/dbraw/zinc/20/86/45/566208645.db2.gz DVIVXGHVVRSVFT-KRWDZBQOSA-N 0 3 393.281 3.110 10 0 GGAEHN O=C(NCCCNCc1cccnc1)N1CCc2ccc(Br)cc21 ZINC000418329161 566209273 /nfs/dbraw/zinc/20/92/73/566209273.db2.gz ATMSYSPBWRAABW-UHFFFAOYSA-N 0 3 389.297 3.096 10 0 GGAEHN Cc1ccsc1[C@H](NCCCNS(C)(=O)=O)c1ccc(Cl)cc1F ZINC000182530329 566210444 /nfs/dbraw/zinc/21/04/44/566210444.db2.gz MKDMUZMBQFYGIP-OAHLLOKOSA-N 0 3 390.933 3.467 10 0 GGAEHN OC[C@H](NC1CCN(c2nccs2)CC1)c1cccc(Br)c1 ZINC000291245750 566210922 /nfs/dbraw/zinc/21/09/22/566210922.db2.gz VKELJMNHIAUJMS-HNNXBMFYSA-N 0 3 382.327 3.198 10 0 GGAEHN CN1CCN(CC2CCN(Cc3ccc(Br)c(F)c3)CC2)CC1 ZINC000367669043 566211139 /nfs/dbraw/zinc/21/11/39/566211139.db2.gz KFLDNLMGOMAJIO-UHFFFAOYSA-N 0 3 384.337 3.048 10 0 GGAEHN COc1ccc(Br)cc1CN(C)C(=O)NC[C@@H](N)c1ccccc1 ZINC000418421059 566212258 /nfs/dbraw/zinc/21/22/58/566212258.db2.gz BVGKDYXOOGDBJV-MRXNPFEDSA-N 0 3 392.297 3.299 10 0 GGAEHN CN(CCc1cccc(Br)c1)C(=O)NC[C@H](N)c1ccccc1 ZINC000418453014 566212951 /nfs/dbraw/zinc/21/29/51/566212951.db2.gz ONCMGZFMERJFMS-KRWDZBQOSA-N 0 3 376.298 3.333 10 0 GGAEHN N[C@H](CNC(=O)N1CCc2cc(Br)cc(F)c2C1)c1ccccc1 ZINC000418430207 566213593 /nfs/dbraw/zinc/21/35/93/566213593.db2.gz OTMNTTLEFBFYQY-QGZVFWFLSA-N 0 3 392.272 3.356 10 0 GGAEHN COc1ccc([C@H](C)C[NH2+]CC[N-]S(=O)(=O)c2ccc(Cl)s2)cc1 ZINC000182651896 566217510 /nfs/dbraw/zinc/21/75/10/566217510.db2.gz YZHQPDNQWKZRSY-GFCCVEGCSA-N 0 3 388.942 3.082 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)N(Cc1cccc(Br)c1)C1CC1 ZINC000418753384 566221852 /nfs/dbraw/zinc/22/18/52/566221852.db2.gz VNJLBWVPDLIYHB-AWEZNQCLSA-N 0 3 388.256 3.120 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)N1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000418745078 566222314 /nfs/dbraw/zinc/22/23/14/566222314.db2.gz GCTRSSOKOMDKFC-ZIAGYGMSSA-N 0 3 375.872 3.137 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)N(Cc1cccc(Br)c1)C1CC1 ZINC000418753385 566222349 /nfs/dbraw/zinc/22/23/49/566222349.db2.gz VNJLBWVPDLIYHB-CQSZACIVSA-N 0 3 388.256 3.120 10 0 GGAEHN OC[C@H](CN[C@@H]1CCCOc2cc(Br)ccc21)c1cccnc1 ZINC000367896497 566222463 /nfs/dbraw/zinc/22/24/63/566222463.db2.gz AZSDUGNUHNEPCA-WMLDXEAASA-N 0 3 377.282 3.424 10 0 GGAEHN CCN(Cc1cc(Br)ccc1F)C(=O)N[C@H]1CNCCC1(F)F ZINC000418747002 566222432 /nfs/dbraw/zinc/22/24/32/566222432.db2.gz IVEAMFNUIOVRHC-ZDUSSCGKSA-N 0 3 394.235 3.117 10 0 GGAEHN CC(C)N(Cc1cccc(Br)c1)C(=O)N[C@@H]1CNCCC1(F)F ZINC000418745097 566222447 /nfs/dbraw/zinc/22/24/47/566222447.db2.gz GEGAUVQJRRZKMI-CQSZACIVSA-N 0 3 390.272 3.366 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)N1CC[C@H](Sc2cccc(Cl)c2)C1 ZINC000418751419 566222495 /nfs/dbraw/zinc/22/24/95/566222495.db2.gz RALATCBACCUUEU-UONOGXRCSA-N 0 3 375.872 3.213 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)N1CCC[C@H]1c1ccc(Br)s1 ZINC000418764070 566222745 /nfs/dbraw/zinc/22/27/45/566222745.db2.gz NRKIUCABDGKEJU-ONGXEEELSA-N 0 3 394.285 3.354 10 0 GGAEHN CN(Cc1cc(Br)ccc1Cl)C(=O)N[C@H]1CNCCC1(F)F ZINC000418768220 566222900 /nfs/dbraw/zinc/22/29/00/566222900.db2.gz QZQHQPGWFWTLIV-LBPRGKRZSA-N 0 3 396.663 3.241 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)N1CCC[C@@H]1c1ccc(Br)s1 ZINC000418764068 566223471 /nfs/dbraw/zinc/22/34/71/566223471.db2.gz NRKIUCABDGKEJU-MWLCHTKSSA-N 0 3 394.285 3.354 10 0 GGAEHN Clc1ccc2c(c1)nccc2SCCN1CC[C@@H](N2CCOCC2)C1 ZINC000182811673 566225389 /nfs/dbraw/zinc/22/53/89/566225389.db2.gz FFGBMASCTUGJPM-MRXNPFEDSA-N 0 3 377.941 3.387 10 0 GGAEHN C[C@@H](NCCOc1cc(Cl)cc(Cl)c1)c1ccc(S(N)(=O)=O)cc1 ZINC000182854362 566227258 /nfs/dbraw/zinc/22/72/58/566227258.db2.gz MIKMQBHKAMIHJQ-LLVKDONJSA-N 0 3 389.304 3.370 10 0 GGAEHN CN1CC[C@@H](NCc2cnc(C3OCCO3)s2)[C@@H]1c1ccc(Cl)cc1 ZINC000368031501 566227310 /nfs/dbraw/zinc/22/73/10/566227310.db2.gz UJWQUDQEDIKNIA-CVEARBPZSA-N 0 3 379.913 3.377 10 0 GGAEHN CN1CC[C@@H](NCC(=O)Nc2cccnc2Cl)[C@H]1c1ccc(Cl)cc1 ZINC000368064166 566228599 /nfs/dbraw/zinc/22/85/99/566228599.db2.gz OWOIRDPZZXWSEN-RHSMWYFYSA-N 0 3 379.291 3.362 10 0 GGAEHN CC(C)(O)CN1CCc2c(cccc2NC(=O)c2coc(Br)c2)C1 ZINC000368257053 566234690 /nfs/dbraw/zinc/23/46/90/566234690.db2.gz NEXYUXRJUGGNNG-UHFFFAOYSA-N 0 3 393.281 3.423 10 0 GGAEHN O=C(CCN1CCC(c2ncc[nH]2)CC1)Nc1ccc(Br)cc1 ZINC000265457523 566237892 /nfs/dbraw/zinc/23/78/92/566237892.db2.gz DQNKRFYTKMZSKA-UHFFFAOYSA-N 0 3 377.286 3.380 10 0 GGAEHN OC[C@@H](CN[C@@H]1CCCOc2ccc(Br)cc21)c1cccnc1 ZINC000368577421 566242300 /nfs/dbraw/zinc/24/23/00/566242300.db2.gz WIBNSYRTKHGZRR-RHSMWYFYSA-N 0 3 377.282 3.424 10 0 GGAEHN NS(=O)(=O)c1ccc(CNC[C@@H]2CCCCC2(F)F)cc1Br ZINC000419741196 566243409 /nfs/dbraw/zinc/24/34/09/566243409.db2.gz CBGKCQHSSZSUIA-NSHDSACASA-N 0 3 397.285 3.012 10 0 GGAEHN CCN1CC[C@H](CNC(=O)[C@H](C)CC(=O)c2cccc(Br)c2)C1 ZINC000265942784 566244002 /nfs/dbraw/zinc/24/40/02/566244002.db2.gz JRQZBGUJBYHXFS-ZIAGYGMSSA-N 0 3 381.314 3.116 10 0 GGAEHN CCN1CC[C@@H](CNC(=O)[C@H](C)CC(=O)c2cccc(Br)c2)C1 ZINC000265942781 566244069 /nfs/dbraw/zinc/24/40/69/566244069.db2.gz JRQZBGUJBYHXFS-KGLIPLIRSA-N 0 3 381.314 3.116 10 0 GGAEHN O[C@@H](COc1ccc(Cl)cc1Br)CN1CCC12CCOCC2 ZINC000368898235 566246967 /nfs/dbraw/zinc/24/69/67/566246967.db2.gz YDMCORPZMJKITN-CYBMUJFWSA-N 0 3 390.705 3.097 10 0 GGAEHN O[C@H](COc1ccc(Cl)cc1Br)CN1CCC12CCOCC2 ZINC000368898236 566247104 /nfs/dbraw/zinc/24/71/04/566247104.db2.gz YDMCORPZMJKITN-ZDUSSCGKSA-N 0 3 390.705 3.097 10 0 GGAEHN CN(C)C(=O)[C@@H]1CC[C@H](CN[C@@H](c2ccc(Br)cc2)C2CC2)O1 ZINC000183458283 566247386 /nfs/dbraw/zinc/24/73/86/566247386.db2.gz IHEADJAEFOTVQA-IXDOHACOSA-N 0 3 381.314 3.126 10 0 GGAEHN CCC[C@H](O)[C@@H](CO)NCc1cnc(-c2ccc(Br)cc2)s1 ZINC000419820960 566250411 /nfs/dbraw/zinc/25/04/11/566250411.db2.gz MZQCGQUHZLRYQN-CABCVRRESA-N 0 3 385.327 3.184 10 0 GGAEHN CCC[C@@H](O)[C@H](CO)NCc1cnc(-c2ccc(Br)cc2)s1 ZINC000419820967 566250536 /nfs/dbraw/zinc/25/05/36/566250536.db2.gz MZQCGQUHZLRYQN-LSDHHAIUSA-N 0 3 385.327 3.184 10 0 GGAEHN O[C@@H]([C@@H]1CCCN(CCCc2nc(-c3cccs3)no2)C1)C(F)(F)F ZINC000444733021 566250843 /nfs/dbraw/zinc/25/08/43/566250843.db2.gz QBRCZGIOBUNBTO-RISCZKNCSA-N 0 3 375.416 3.366 10 0 GGAEHN Cc1ccccc1[C@@H](CC(F)(F)F)NC[C@@H]1CCCN(S(C)(=O)=O)C1 ZINC000444784782 566251974 /nfs/dbraw/zinc/25/19/74/566251974.db2.gz OULNECMEDCQHCI-GOEBONIOSA-N 0 3 378.460 3.250 10 0 GGAEHN CCOC(=O)C[C@@H](O)CN(C)[C@H]1CCSc2ccc(Br)cc21 ZINC000599287131 566252032 /nfs/dbraw/zinc/25/20/32/566252032.db2.gz QWMURSHKPIQKHL-OCCSQVGLSA-N 0 3 388.327 3.232 10 0 GGAEHN NC(C(=O)N1CCC(OCc2ccc(Cl)c(Cl)c2)CC1)C(F)(F)F ZINC000575121184 566252965 /nfs/dbraw/zinc/25/29/65/566252965.db2.gz CBSDPLIIEYSAFL-CYBMUJFWSA-N 0 3 385.213 3.391 10 0 GGAEHN CCOC(=O)C[C@@H](O)CN1CCC(OCc2ccc(Cl)c(Cl)c2)CC1 ZINC000599311535 566252979 /nfs/dbraw/zinc/25/29/79/566252979.db2.gz JOOIJCYUIXEBKD-CQSZACIVSA-N 0 3 390.307 3.289 10 0 GGAEHN CN1CC[C@H](NC(=O)COc2ccc(Br)cc2)[C@H]1c1ccccc1 ZINC000534756649 566253325 /nfs/dbraw/zinc/25/33/25/566253325.db2.gz XPHICRXUYLLOLZ-PKOBYXMFSA-N 0 3 389.293 3.390 10 0 GGAEHN COC(=O)c1cnc(CNC(C)(C)Cc2ccc(Br)cc2)cn1 ZINC000599328363 566255022 /nfs/dbraw/zinc/25/50/22/566255022.db2.gz YHBJXDPWNXXOGD-UHFFFAOYSA-N 0 3 378.270 3.137 10 0 GGAEHN C[C@@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)N1CCC(C)CC1 ZINC000599360140 566256936 /nfs/dbraw/zinc/25/69/36/566256936.db2.gz CKQYYKQBRODQRB-LBPRGKRZSA-N 0 3 379.302 3.176 10 0 GGAEHN CN(C(=O)c1cc(Br)ccc1OC(F)F)[C@@H]1CCN(C2CC2)C1 ZINC000648284800 566256980 /nfs/dbraw/zinc/25/69/80/566256980.db2.gz NNLJYQLSFHJTPW-GFCCVEGCSA-N 0 3 389.240 3.359 10 0 GGAEHN CN(C(=O)c1cc(Br)ccc1OC(F)F)[C@H]1CCN(C2CC2)C1 ZINC000648284801 566257314 /nfs/dbraw/zinc/25/73/14/566257314.db2.gz NNLJYQLSFHJTPW-LBPRGKRZSA-N 0 3 389.240 3.359 10 0 GGAEHN CCOCCOc1ccc(Br)cc1CN1CC[C@H]2COC[C@H]2C1 ZINC000668706252 566257410 /nfs/dbraw/zinc/25/74/10/566257410.db2.gz REWORSKVBBDEAO-GOEBONIOSA-N 0 3 384.314 3.333 10 0 GGAEHN Brc1cncc(Br)c1CN1CC[C@H]2COC[C@H]2C1 ZINC000668704665 566257942 /nfs/dbraw/zinc/25/79/42/566257942.db2.gz BWXZIUACVRONRJ-VHSXEESVSA-N 0 3 376.092 3.075 10 0 GGAEHN CCN(CC[N-]S(=O)(=O)c1c(Cl)cccc1Br)C(C)C ZINC000509234785 566281024 /nfs/dbraw/zinc/28/10/24/566281024.db2.gz AORSAXVXRPUIGC-UHFFFAOYSA-N 0 3 383.739 3.111 10 0 GGAEHN CC[N@H+](CC[N-]S(=O)(=O)c1c(Cl)cccc1Br)C(C)C ZINC000509234785 566281032 /nfs/dbraw/zinc/28/10/32/566281032.db2.gz AORSAXVXRPUIGC-UHFFFAOYSA-N 0 3 383.739 3.111 10 0 GGAEHN CC[N@@H+](CC[N-]S(=O)(=O)c1c(Cl)cccc1Br)C(C)C ZINC000509234785 566281035 /nfs/dbraw/zinc/28/10/35/566281035.db2.gz AORSAXVXRPUIGC-UHFFFAOYSA-N 0 3 383.739 3.111 10 0 GGAEHN CCOC(=O)C[C@@H](O)CN[C@H](CC1CC1)c1cc(F)cc(Br)c1 ZINC000599377055 566258593 /nfs/dbraw/zinc/25/85/93/566258593.db2.gz GSNCBXDLHWSIHT-HZPDHXFCSA-N 0 3 388.277 3.333 10 0 GGAEHN C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)c1cc2c(cncc2Br)s1 ZINC000648299219 566258661 /nfs/dbraw/zinc/25/86/61/566258661.db2.gz HWNPAQOZNQLULZ-GWCFXTLKSA-N 0 3 382.327 3.471 10 0 GGAEHN CN(C)CC[C@@](C)(O)CNC(=O)c1cc(Br)cc2ccccc21 ZINC000420028679 566261354 /nfs/dbraw/zinc/26/13/54/566261354.db2.gz COZFNIIFYNHHAS-GOSISDBHSA-N 0 3 379.298 3.035 10 0 GGAEHN CC1(C)CN(c2ccc3nnc(-c4cc(Cl)cc(Cl)c4)n3n2)CCN1 ZINC000420264384 566271590 /nfs/dbraw/zinc/27/15/90/566271590.db2.gz AWLUJUFMXBJZFF-UHFFFAOYSA-N 0 3 377.279 3.286 10 0 GGAEHN C[C@@H]([N-]S(=O)(=O)c1c(Cl)cccc1Br)C(C)(C)C[NH+](C)C ZINC000509189346 566272795 /nfs/dbraw/zinc/27/27/95/566272795.db2.gz YWMHJZPLLVCYMW-SNVBAGLBSA-N 0 3 397.766 3.357 10 0 GGAEHN CCC(F)(F)C(C)(C)CS(=O)(=O)N1CC[C@H]2[C@@H](CCCN2C2CC2)C1 ZINC000625082060 566274125 /nfs/dbraw/zinc/27/41/25/566274125.db2.gz YMYKAEZDGQRVBK-HOCLYGCPSA-N 0 3 378.529 3.336 10 0 GGAEHN CCC(F)(F)C(C)(C)CS(=O)(=O)N1CC[C@H]2[C@H](CCCN2C2CC2)C1 ZINC000625082061 566274304 /nfs/dbraw/zinc/27/43/04/566274304.db2.gz YMYKAEZDGQRVBK-ZBFHGGJFSA-N 0 3 378.529 3.336 10 0 GGAEHN COc1cc(Br)ccc1CNC1CCC(CS(C)(=O)=O)CC1 ZINC000556179382 566274990 /nfs/dbraw/zinc/27/49/90/566274990.db2.gz RTAGEETXPHINSM-UHFFFAOYSA-N 0 3 390.343 3.151 10 0 GGAEHN CCN(CC)[C@@H](CN[C@H](C)Cn1cc(Br)ccc1=O)c1ccco1 ZINC000556233885 566276077 /nfs/dbraw/zinc/27/60/77/566276077.db2.gz LTNRTGSZOGBJLU-ZBFHGGJFSA-N 0 3 396.329 3.265 10 0 GGAEHN O=C(NC[C@@H](c1cccs1)N1CCCC1)c1cc[nH]c(=O)c1Br ZINC000445250977 566276755 /nfs/dbraw/zinc/27/67/55/566276755.db2.gz PHWRZMZUNVHEQT-LBPRGKRZSA-N 0 3 396.310 3.178 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NCc1ccc2c(n1)CCCC2 ZINC000556243638 566278689 /nfs/dbraw/zinc/27/86/89/566278689.db2.gz HBXQBFFYBBPBOR-ZDUSSCGKSA-N 0 3 376.298 3.063 10 0 GGAEHN COc1cc2c(cc1F)CC[C@@H]2N[C@@H](C)Cn1cc(Br)ccc1=O ZINC000556260594 566279986 /nfs/dbraw/zinc/27/99/86/566279986.db2.gz MAAKLCNKBRJLQE-ZBEGNZNMSA-N 0 3 395.272 3.424 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(OC)c(Cl)c2Cl)[C@H](C)C1 ZINC000462310474 566280038 /nfs/dbraw/zinc/28/00/38/566280038.db2.gz CSMBGMZHOJSUCK-VXGBXAGGSA-N 0 3 395.352 3.353 10 0 GGAEHN COC(=O)c1cc(Cl)cc(Cl)c1NC(=O)CN[C@@H]1[C@H](C)O[C@H](C)[C@H]1C ZINC000599625217 566280269 /nfs/dbraw/zinc/28/02/69/566280269.db2.gz HTDHGWANZUEGBQ-BYYOYISRSA-N 0 3 389.279 3.120 10 0 GGAEHN COCCCN1CCC(NC(=O)c2cc(C)cc(Br)c2F)CC1 ZINC000625133948 566281934 /nfs/dbraw/zinc/28/19/34/566281934.db2.gz NWXWOXFUSRUTLY-UHFFFAOYSA-N 0 3 387.293 3.127 10 0 GGAEHN COC(=O)c1cnc(CN2C[C@@H](c3ccc(Br)cc3)C[C@H]2C)cn1 ZINC000599651921 566282865 /nfs/dbraw/zinc/28/28/65/566282865.db2.gz IIGDQJCSVXXJGZ-OCCSQVGLSA-N 0 3 390.281 3.404 10 0 GGAEHN OCCn1ncc2c1CCC[C@@H]2N[C@H]1CCc2c1ccc(F)c2Br ZINC000648434165 566284775 /nfs/dbraw/zinc/28/47/75/566284775.db2.gz VARYXAYJBMMYEF-HOTGVXAUSA-N 0 3 394.288 3.432 10 0 GGAEHN CSC1(CNC(=O)c2cnn(-c3cccc(Cl)c3)c2)CCN(C)CC1 ZINC000575793108 566285341 /nfs/dbraw/zinc/28/53/41/566285341.db2.gz HUUNUQSRTKGTJM-UHFFFAOYSA-N 0 3 378.929 3.083 10 0 GGAEHN COc1cc(Br)c(CNCCc2cnc(C3CC3)nc2)cc1OC ZINC000535193656 566285688 /nfs/dbraw/zinc/28/56/88/566285688.db2.gz ZHSIGVXRICEBBG-UHFFFAOYSA-N 0 3 392.297 3.466 10 0 GGAEHN O[C@@H](CNC[C@H](O)COc1c(Cl)cccc1Cl)Cc1cccc(F)c1 ZINC000575803349 566286226 /nfs/dbraw/zinc/28/62/26/566286226.db2.gz KHPQLAFSWHVCOO-CABCVRRESA-N 0 3 388.266 3.065 10 0 GGAEHN C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000669118319 566286957 /nfs/dbraw/zinc/28/69/57/566286957.db2.gz LJVAQTOUEAOZAM-KSSFIOAISA-N 0 3 394.357 3.462 10 0 GGAEHN CCN1CC[C@@H](N(C)C(=O)c2nn(C(C)(C)C)cc2Br)[C@H](C)C1 ZINC000669126237 566287084 /nfs/dbraw/zinc/28/70/84/566287084.db2.gz VGAWDLVDJANINC-TZMCWYRMSA-N 0 3 385.350 3.203 10 0 GGAEHN O[C@H](CNC[C@H](O)Cc1cccc(F)c1)COc1c(Cl)cccc1Cl ZINC000575803351 566287430 /nfs/dbraw/zinc/28/74/30/566287430.db2.gz KHPQLAFSWHVCOO-HUUCEWRRSA-N 0 3 388.266 3.065 10 0 GGAEHN COC(=O)[C@@H]1C[C@@H](C)N(C[C@H](O)COc2ccc(Cl)c(Cl)c2)[C@@H](C)C1 ZINC000599703533 566287751 /nfs/dbraw/zinc/28/77/51/566287751.db2.gz CLVZCSZLLZXWMA-CRWXNKLISA-N 0 3 390.307 3.395 10 0 GGAEHN C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000482173249 566289187 /nfs/dbraw/zinc/28/91/87/566289187.db2.gz DTFUOOZIKGFQHM-WFASDCNBSA-N 0 3 383.305 3.462 10 0 GGAEHN COc1ccc(-c2nnc(N3C[C@H](SC)[C@@H](N4CCCC4)C3)s2)cc1 ZINC000420609079 566289494 /nfs/dbraw/zinc/28/94/94/566289494.db2.gz GKZAFBARKAEPKJ-HOTGVXAUSA-N 0 3 376.551 3.230 10 0 GGAEHN Cc1cc(Br)cc(C)c1S(=O)(=O)N(C)[C@H]1CCN(C)C[C@H]1C ZINC000462354543 566289570 /nfs/dbraw/zinc/28/95/70/566289570.db2.gz DKXLWYCEHSMSJH-HIFRSBDPSA-N 0 3 389.359 3.027 10 0 GGAEHN CN(C(=O)Cc1c[nH]c2cc(Br)ccc12)[C@H]1CCN(C2CC2)C1 ZINC000482181258 566290519 /nfs/dbraw/zinc/29/05/19/566290519.db2.gz QGTYDAKWSCUODO-HNNXBMFYSA-N 0 3 376.298 3.168 10 0 GGAEHN CCN(CC)[C@H]1CCN(S(=O)(=O)c2cccc(Br)c2Cl)C1 ZINC000556376030 566292305 /nfs/dbraw/zinc/29/23/05/566292305.db2.gz NUKKPKKWRSEIIB-NSHDSACASA-N 0 3 395.750 3.207 10 0 GGAEHN COc1cc(C(=O)N2C[C@H](SC)[C@@H](N3CCCC3)C2)ccc1Br ZINC000599759825 566293343 /nfs/dbraw/zinc/29/33/43/566293343.db2.gz DNHOQYKQMNWORN-HOCLYGCPSA-N 0 3 399.354 3.110 10 0 GGAEHN CC[NH+]1CCC(CC[N-]S(=O)(=O)c2cc(Cl)c(OC)cc2Cl)CC1 ZINC000462395422 566294561 /nfs/dbraw/zinc/29/45/61/566294561.db2.gz HMEBWVDGJUWIBV-UHFFFAOYSA-N 0 3 395.352 3.402 10 0 GGAEHN Cc1c(Br)cc(CN[C@H](C)Cn2cncn2)cc1Br ZINC000556384850 566294775 /nfs/dbraw/zinc/29/47/75/566294775.db2.gz ARMYVINGTXVAQA-SECBINFHSA-N 0 3 388.107 3.290 10 0 GGAEHN CC[NH+]1CCC(CC[N-]S(=O)(=O)c2csc(-c3ccccc3)n2)CC1 ZINC000462402779 566295570 /nfs/dbraw/zinc/29/55/70/566295570.db2.gz PCWRVWXIDJDAKY-UHFFFAOYSA-N 0 3 379.551 3.210 10 0 GGAEHN COCCN1CCC[C@@H]1CN[C@@H]1CCCOc2cc(Br)ccc21 ZINC000482236236 566295646 /nfs/dbraw/zinc/29/56/46/566295646.db2.gz GOKXTAXMAPAGLC-NVXWUHKLSA-N 0 3 383.330 3.363 10 0 GGAEHN COCCN1CCC[C@@H]1CN[C@@H]1CCCOc2ccc(Br)cc21 ZINC000482247088 566296423 /nfs/dbraw/zinc/29/64/23/566296423.db2.gz RIEHRKBHRZXAIF-NVXWUHKLSA-N 0 3 383.330 3.363 10 0 GGAEHN O=C(Nc1nncs1)C1CCN(Cc2cc3cc(Cl)cnc3o2)CC1 ZINC000648585372 566296833 /nfs/dbraw/zinc/29/68/33/566296833.db2.gz LBCLPRSHSRJBOC-UHFFFAOYSA-N 0 3 377.857 3.183 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000625259719 566300227 /nfs/dbraw/zinc/30/02/27/566300227.db2.gz WFEFSUPYMXUJLU-CGTJXYLNSA-N 0 3 377.326 3.135 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1c(C)cc(C)c(Br)c1C ZINC000625266960 566300411 /nfs/dbraw/zinc/30/04/11/566300411.db2.gz JLQRBCGZHJWNJG-HNNXBMFYSA-N 0 3 383.330 3.215 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000625259718 566300419 /nfs/dbraw/zinc/30/04/19/566300419.db2.gz WFEFSUPYMXUJLU-BPQIPLTHSA-N 0 3 377.326 3.135 10 0 GGAEHN Cc1ccc(O[C@H](C)C(=O)N(C)[C@@H]2CCN(C3CC3)C2)c(Br)c1 ZINC000599868020 566300746 /nfs/dbraw/zinc/30/07/46/566300746.db2.gz YLFOULHYXMTZKR-UKRRQHHQSA-N 0 3 381.314 3.220 10 0 GGAEHN CC(C)(CNC(=O)N1CCN2CCC1CC2)c1ccccc1Br ZINC000556441368 566301041 /nfs/dbraw/zinc/30/10/41/566301041.db2.gz KOZACKQMFPQDQE-UHFFFAOYSA-N 0 3 380.330 3.216 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)[C@@H]1COc2ccc(Br)cc21 ZINC000535389155 566301311 /nfs/dbraw/zinc/30/13/11/566301311.db2.gz KUPJNDRVYOLBCM-DVOMOZLQSA-N 0 3 381.314 3.304 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)[C@H]1COc2ccc(Br)cc21 ZINC000535389156 566301906 /nfs/dbraw/zinc/30/19/06/566301906.db2.gz KUPJNDRVYOLBCM-IOASZLSFSA-N 0 3 381.314 3.304 10 0 GGAEHN COc1cccc(Cl)c1CC(=O)NCC1(N2CCSCC2)CCCC1 ZINC000462445172 566304388 /nfs/dbraw/zinc/30/43/88/566304388.db2.gz MJXWLNIBEOWHAX-UHFFFAOYSA-N 0 3 382.957 3.369 10 0 GGAEHN Brc1cnccc1CN1CCC(CCCN2CCOCC2)CC1 ZINC000625309144 566305416 /nfs/dbraw/zinc/30/54/16/566305416.db2.gz SEMOURICMUYZON-UHFFFAOYSA-N 0 3 382.346 3.169 10 0 GGAEHN C[C@@H]1CN(C)[C@@H](C)CN1CCCOc1cccc(I)c1 ZINC000509462899 566307324 /nfs/dbraw/zinc/30/73/24/566307324.db2.gz KNJWDSPQEMGTAY-UONOGXRCSA-N 0 3 388.293 3.085 10 0 GGAEHN CCNC(=O)C[C@@H]1CCCCN1C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000556522365 566310210 /nfs/dbraw/zinc/31/02/10/566310210.db2.gz ZRRVRGHNIHZPFH-GJZGRUSLSA-N 0 3 389.323 3.114 10 0 GGAEHN C[C@H]1CCC[C@H](C)[NH+]1CCNC(=O)NCc1ccc([O-])c(Br)c1 ZINC000482478335 566311529 /nfs/dbraw/zinc/31/15/29/566311529.db2.gz OCMZIYNYMLGQGK-STQMWFEESA-N 0 3 384.318 3.217 10 0 GGAEHN O[C@H](CN[C@@H](c1cccnc1)C1CC1)COc1ccc(Br)cc1 ZINC000445766361 566311639 /nfs/dbraw/zinc/31/16/39/566311639.db2.gz IWZISIULQWVFLJ-SJLPKXTDSA-N 0 3 377.282 3.325 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)NCC1(N(C)C)CCC1)CC2 ZINC000445862496 566315516 /nfs/dbraw/zinc/31/55/16/566315516.db2.gz QUEQZXDDYRCTOF-UHFFFAOYSA-N 0 3 380.330 3.310 10 0 GGAEHN O=C(N[C@@H]1CCN(CC2CC2)C1)N[C@H]1CCOc2c(Br)cccc21 ZINC000669649752 566318065 /nfs/dbraw/zinc/31/80/65/566318065.db2.gz YQNFQVUVESVLKN-CJNGLKHVSA-N 0 3 394.313 3.056 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)c1[nH]nc2ccc(Br)cc21 ZINC000600200638 566322717 /nfs/dbraw/zinc/32/27/17/566322717.db2.gz WFSLNWPUGAZUFX-VXGBXAGGSA-N 0 3 379.302 3.318 10 0 GGAEHN CC[C@H](CN1CCCC1)NC(=O)Cc1c(F)ccc(Br)c1F ZINC000669705298 566322863 /nfs/dbraw/zinc/32/28/63/566322863.db2.gz CXDZNGZKVRPCNB-LLVKDONJSA-N 0 3 375.257 3.260 10 0 GGAEHN COC(=O)Cc1ccc(CNCc2ccc(OC)c(Br)c2)cc1 ZINC000600187727 566323261 /nfs/dbraw/zinc/32/32/61/566323261.db2.gz PSSCDQQJYLELIR-UHFFFAOYSA-N 0 3 378.266 3.463 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)N1CCc2c(Cl)cc(Cl)cc2C1 ZINC000482623923 566323802 /nfs/dbraw/zinc/32/38/02/566323802.db2.gz RSHFITBVGCQSHJ-HNNXBMFYSA-N 0 3 386.323 3.172 10 0 GGAEHN Cc1nn(-c2ccc(Cl)cc2)cc1CNCCC1CCS(=O)(=O)CC1 ZINC000535785114 566325565 /nfs/dbraw/zinc/32/55/65/566325565.db2.gz ZKFQJPFSCGAODT-UHFFFAOYSA-N 0 3 381.929 3.139 10 0 GGAEHN CNC(=O)CCOC1CCN(C[C@H](C)c2cccc(Br)c2)CC1 ZINC000535801422 566327723 /nfs/dbraw/zinc/32/77/23/566327723.db2.gz MNASARXPXSECBI-AWEZNQCLSA-N 0 3 383.330 3.170 10 0 GGAEHN CN1CCC[C@]2(CCN(C(=O)[C@H]3CCc4cc(Br)ccc43)C2)C1 ZINC000648914749 566329174 /nfs/dbraw/zinc/32/91/74/566329174.db2.gz UJJDDIRMIYVVQK-HKUYNNGSSA-N 0 3 377.326 3.423 10 0 GGAEHN CN(C(=O)NCCSCC(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1 ZINC000535823287 566330345 /nfs/dbraw/zinc/33/03/45/566330345.db2.gz RMRMCNAJQKQSKE-HNNXBMFYSA-N 0 3 375.460 3.198 10 0 GGAEHN COc1ccc(Br)cc1C1(NC(=O)CC2CCN(C)CC2)CC1 ZINC000648957807 566334415 /nfs/dbraw/zinc/33/44/15/566334415.db2.gz NGSPFFCFZVXHFL-UHFFFAOYSA-N 0 3 381.314 3.295 10 0 GGAEHN CCCN(C(=O)Cc1c(F)ccc(Br)c1F)[C@H]1CCN(C)C1 ZINC000648996201 566337511 /nfs/dbraw/zinc/33/75/11/566337511.db2.gz OEVSUVHHDWFMRD-NSHDSACASA-N 0 3 375.257 3.213 10 0 GGAEHN CC1(C)NC(=O)CC[C@H]1NCc1ccc(Br)c(Br)c1 ZINC000669998682 566341299 /nfs/dbraw/zinc/34/12/99/566341299.db2.gz LOPXNHOXTODLQH-GFCCVEGCSA-N 0 3 390.119 3.358 10 0 GGAEHN Ic1cnc(CNC[C@@H]2CC23CCSCC3)s1 ZINC000421369025 566368855 /nfs/dbraw/zinc/36/88/55/566368855.db2.gz CHEMJLUGOPKHPL-VIFPVBQESA-N 0 3 380.320 3.371 10 0 GGAEHN CN(C(=O)c1cc2c(cc(Br)cc2F)[nH]1)[C@H]1CN2CCC1CC2 ZINC000600516913 566342737 /nfs/dbraw/zinc/34/27/37/566342737.db2.gz SONROLJCWPTMGU-INIZCTEOSA-N 0 3 380.261 3.236 10 0 GGAEHN CN(C(=O)c1cc(-c2ccc(Br)cc2)[nH]n1)[C@H]1CN2CCC1CC2 ZINC000600512911 566343082 /nfs/dbraw/zinc/34/30/82/566343082.db2.gz SGIKWGWDWVGJOF-KRWDZBQOSA-N 0 3 389.297 3.005 10 0 GGAEHN CN(C(=O)c1cc(-c2ccc(Br)cc2)[nH]n1)[C@@H]1CN2CCC1CC2 ZINC000600512912 566343145 /nfs/dbraw/zinc/34/31/45/566343145.db2.gz SGIKWGWDWVGJOF-QGZVFWFLSA-N 0 3 389.297 3.005 10 0 GGAEHN CN(C(=O)CCCOc1cccc(Br)c1)[C@H]1CN2CCC1CC2 ZINC000600514511 566343537 /nfs/dbraw/zinc/34/35/37/566343537.db2.gz DZXVDSRQNUNICT-KRWDZBQOSA-N 0 3 381.314 3.161 10 0 GGAEHN Cc1cc(Br)oc1C(=O)NC[C@@H]1CN(C)C[C@H]1c1ccccc1 ZINC000649101357 566343733 /nfs/dbraw/zinc/34/37/33/566343733.db2.gz WHIQQVRAQYPCQY-CABCVRRESA-N 0 3 377.282 3.426 10 0 GGAEHN C[C@@H](N[C@@H](C)Cc1ccc(Br)cc1F)C1(S(C)(=O)=O)CC1 ZINC000556921448 566344245 /nfs/dbraw/zinc/34/42/45/566344245.db2.gz VZHNPHTWHFYLLU-WDEREUQCSA-N 0 3 378.307 3.075 10 0 GGAEHN C[C@H](Cc1ccc(Br)c(F)c1)N[C@H](C)C1(S(C)(=O)=O)CC1 ZINC000556924402 566346158 /nfs/dbraw/zinc/34/61/58/566346158.db2.gz SHKOVDIYMVPCFL-GHMZBOCLSA-N 0 3 378.307 3.075 10 0 GGAEHN Cc1cc(C(=O)N2CC[C@H](OCCN3CCCCC3)C2)ccc1Br ZINC000536047295 566346719 /nfs/dbraw/zinc/34/67/19/566346719.db2.gz IANDPIIBMZHLLB-KRWDZBQOSA-N 0 3 395.341 3.475 10 0 GGAEHN C[C@H](Cc1ccc(Br)c(F)c1)N[C@@H](C)C1(S(C)(=O)=O)CC1 ZINC000556924403 566346810 /nfs/dbraw/zinc/34/68/10/566346810.db2.gz SHKOVDIYMVPCFL-MNOVXSKESA-N 0 3 378.307 3.075 10 0 GGAEHN C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CCOC2(CCN(C)CC2)C1 ZINC000649132593 566346953 /nfs/dbraw/zinc/34/69/53/566346953.db2.gz GSYVIXLVQWTROS-CYBMUJFWSA-N 0 3 387.307 3.084 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)c1cc3cc(Br)ccc3o1)CCO2 ZINC000649134071 566347675 /nfs/dbraw/zinc/34/76/75/566347675.db2.gz KXKQMQJUVCMTAL-UHFFFAOYSA-N 0 3 393.281 3.132 10 0 GGAEHN Cc1ccc(C(=O)N2CCOC3(CCN(C)CC3)C2)c(C)c1Br ZINC000649130492 566347799 /nfs/dbraw/zinc/34/77/99/566347799.db2.gz IWXSNMGRIODCQC-UHFFFAOYSA-N 0 3 381.314 3.003 10 0 GGAEHN Cc1cc(CCC(=O)N2CCOC3(CCN(C)CC3)C2)ccc1Br ZINC000649131952 566347817 /nfs/dbraw/zinc/34/78/17/566347817.db2.gz HFLIBRPBRVFXRR-UHFFFAOYSA-N 0 3 395.341 3.013 10 0 GGAEHN C[C@@H](CC(=O)N1CCOC2(CCN(C)CC2)C1)c1ccc(Br)cc1 ZINC000649131312 566347907 /nfs/dbraw/zinc/34/79/07/566347907.db2.gz GVWQKAHRHVRPEE-HNNXBMFYSA-N 0 3 395.341 3.266 10 0 GGAEHN CN(C(=O)c1cc2c(cc(Br)cc2F)[nH]1)[C@@H]1CCN(C2CC2)C1 ZINC000600572429 566348010 /nfs/dbraw/zinc/34/80/10/566348010.db2.gz RMRSCZCSCHWKSM-GFCCVEGCSA-N 0 3 380.261 3.378 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)CCOc1cccc(Cl)c1Cl)CCO2 ZINC000649134117 566347992 /nfs/dbraw/zinc/34/79/92/566347992.db2.gz MXZYRYIWDYDXTH-UHFFFAOYSA-N 0 3 387.307 3.086 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)C(C)(C)c1ccccc1Br)CCO2 ZINC000649129772 566348125 /nfs/dbraw/zinc/34/81/25/566348125.db2.gz KDNAXSWFOVYZRT-UHFFFAOYSA-N 0 3 395.341 3.050 10 0 GGAEHN COC(=O)[C@H](NC[C@@H]1CCN1C1CCCC1)c1cccc(Br)c1 ZINC000600612975 566350611 /nfs/dbraw/zinc/35/06/11/566350611.db2.gz DGMMBWSINCVYBZ-DLBZAZTESA-N 0 3 381.314 3.270 10 0 GGAEHN COC(=O)CCCN1CCC(N[C@H]2COc3c2ccc(Cl)c3Cl)CC1 ZINC000462774454 566350615 /nfs/dbraw/zinc/35/06/15/566350615.db2.gz CMJFLSUDHCNEGG-HNNXBMFYSA-N 0 3 387.307 3.434 10 0 GGAEHN O=C([C@@H]1CN2CCN1CCC2)N1CCC(c2cccc(Cl)c2Cl)CC1 ZINC000462771555 566351608 /nfs/dbraw/zinc/35/16/08/566351608.db2.gz FWACELFVLFQEET-KRWDZBQOSA-N 0 3 382.335 3.089 10 0 GGAEHN O=C(COc1ccccc1)N1CC[C@H](NCc2ccc(Br)cc2)C1 ZINC000509962622 566351973 /nfs/dbraw/zinc/35/19/73/566351973.db2.gz GGDHZVFMKMFXOW-KRWDZBQOSA-N 0 3 389.293 3.219 10 0 GGAEHN CN(C)C[C@@H](NC(=O)CN(C)c1ccc(Cl)cn1)c1ccc(Cl)cc1 ZINC000670173174 566352221 /nfs/dbraw/zinc/35/22/21/566352221.db2.gz IQMXQGYEYJDZPU-MRXNPFEDSA-N 0 3 381.307 3.244 10 0 GGAEHN CCCC[C@](C)(NC[C@H](O)CN1CCOCC1)c1cccc(Br)c1 ZINC000483064714 566357438 /nfs/dbraw/zinc/35/74/38/566357438.db2.gz YZILBTOIBIOGEP-OALUTQOASA-N 0 3 399.373 3.137 10 0 GGAEHN COc1cc(C)nc(CN[C@]2(CO)CCc3cc(Br)ccc3C2)c1 ZINC000625795944 566358707 /nfs/dbraw/zinc/35/87/07/566358707.db2.gz CIJGDOVRIKEJON-LJQANCHMSA-N 0 3 391.309 3.171 10 0 GGAEHN COc1cc(C)nc(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)c1 ZINC000625795943 566359376 /nfs/dbraw/zinc/35/93/76/566359376.db2.gz CIJGDOVRIKEJON-IBGZPJMESA-N 0 3 391.309 3.171 10 0 GGAEHN CCc1nc(C)c(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)o1 ZINC000625796096 566359629 /nfs/dbraw/zinc/35/96/29/566359629.db2.gz FEVBDXDIONXNDV-SFHVURJKSA-N 0 3 379.298 3.318 10 0 GGAEHN COc1cc(Br)ccc1[C@@H]1CCCN1C[C@@H](O)CN(C)C1CC1 ZINC000625794391 566359984 /nfs/dbraw/zinc/35/99/84/566359984.db2.gz JJCMKUZSPSNYMJ-RDJZCZTQSA-N 0 3 383.330 3.050 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)CCN1C ZINC000625803125 566360623 /nfs/dbraw/zinc/36/06/23/566360623.db2.gz GBSVRBJMGKNHBG-FGYYNUPOSA-N 0 3 377.326 3.276 10 0 GGAEHN O=C([C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12)N1CCNC2(CCCCC2)C1 ZINC000625811840 566360647 /nfs/dbraw/zinc/36/06/47/566360647.db2.gz MUFPTPYDCQEOCJ-CGTJXYLNSA-N 0 3 389.337 3.470 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)CCN1C ZINC000625803129 566361061 /nfs/dbraw/zinc/36/10/61/566361061.db2.gz GBSVRBJMGKNHBG-NIIBRFEOSA-N 0 3 377.326 3.276 10 0 GGAEHN COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)CN1CC[C@H](C)C1 ZINC000576595847 566361603 /nfs/dbraw/zinc/36/16/03/566361603.db2.gz PZSBDDYPPIBNET-BBRMVZONSA-N 0 3 381.314 3.463 10 0 GGAEHN Cc1cccc2cc(S(=O)(=O)[N-]CCC[NH2+]Cc3cccnc3)sc21 ZINC000649421840 566364676 /nfs/dbraw/zinc/36/46/76/566364676.db2.gz CZTYEBPFLVUYNC-UHFFFAOYSA-N 0 3 375.519 3.063 10 0 GGAEHN O=C(Cc1ccc(Br)s1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000510138645 566366712 /nfs/dbraw/zinc/36/67/12/566366712.db2.gz FYESLAWACDCPTN-AWEZNQCLSA-N 0 3 379.323 3.444 10 0 GGAEHN CN(C)[C@]1(CNC(=O)NC2CC(F)(c3cccc(Cl)c3)C2)CCSC1 ZINC000483247161 566368168 /nfs/dbraw/zinc/36/81/68/566368168.db2.gz WJXBLSJZHXJMAD-NXYGQSRBSA-N 0 3 385.936 3.404 10 0 GGAEHN NC[C@H](NC(=O)NCC/C=C\c1ccc(Br)cc1)C(F)(F)F ZINC000625899543 566368216 /nfs/dbraw/zinc/36/82/16/566368216.db2.gz WKWWZJIXOCOIDL-AZEYQONTSA-N 0 3 380.208 3.041 10 0 GGAEHN CC[C@@H]1C[C@@H](NCc2cc(Br)ccc2O[C@@H](C)C(=O)NC)CCO1 ZINC000421373850 566368428 /nfs/dbraw/zinc/36/84/28/566368428.db2.gz DZNAUNIWFNLHOI-VBNZEHGJSA-N 0 3 399.329 3.010 10 0 GGAEHN CN(CC(=O)N1CCC[C@@H]1c1ccccc1I)C1CCC1 ZINC000600817787 566368727 /nfs/dbraw/zinc/36/87/27/566368727.db2.gz SXICDXBSODYJCB-MRXNPFEDSA-N 0 3 398.288 3.439 10 0 GGAEHN C[C@@H]1C[C@H](c2ccc(Br)cc2)CN1C(=O)N[C@@H](CN)C(F)(F)F ZINC000625898884 566368916 /nfs/dbraw/zinc/36/89/16/566368916.db2.gz FMYIXGALESOWFZ-CDMKHQONSA-N 0 3 394.235 3.226 10 0 GGAEHN C[C@H](N[C@@H]1CN(C2CC2)C[C@@H]1C)c1ccc(Br)cc1OCCCO ZINC000462951979 566370881 /nfs/dbraw/zinc/37/08/81/566370881.db2.gz HOIPLXUXUQMBAJ-SUNYJGFJSA-N 0 3 397.357 3.344 10 0 GGAEHN CCCC[N@H+](C)CC[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000510220644 566371106 /nfs/dbraw/zinc/37/11/06/566371106.db2.gz BVDJCGIWYRSFHY-UHFFFAOYSA-N 0 3 383.739 3.113 10 0 GGAEHN CCCC[N@@H+](C)CC[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000510220644 566371116 /nfs/dbraw/zinc/37/11/16/566371116.db2.gz BVDJCGIWYRSFHY-UHFFFAOYSA-N 0 3 383.739 3.113 10 0 GGAEHN CN(C)C[C@@H](NCCc1nnn(C(C)(C)C)n1)c1ccc(Cl)c(Cl)c1 ZINC000625982649 566372608 /nfs/dbraw/zinc/37/26/08/566372608.db2.gz KQFQIMTYTYGKEA-OAHLLOKOSA-N 0 3 385.343 3.170 10 0 GGAEHN Cc1cc(Br)ccc1[C@@H]1CCCN1C[C@H](O)COC[C@H]1CCCO1 ZINC000626009183 566373902 /nfs/dbraw/zinc/37/39/02/566373902.db2.gz ANDLJYOCQYIGTQ-SCTDSRPQSA-N 0 3 398.341 3.451 10 0 GGAEHN Cc1cc(Br)ccc1[C@@H]1CCCN1C[C@H](O)COC[C@@H]1CCCO1 ZINC000626009182 566374959 /nfs/dbraw/zinc/37/49/59/566374959.db2.gz ANDLJYOCQYIGTQ-LNLFQRSKSA-N 0 3 398.341 3.451 10 0 GGAEHN Cc1cc(Br)ccc1[C@@H]1CCCN1CCC(=O)N1CCOCC1 ZINC000626009498 566374993 /nfs/dbraw/zinc/37/49/93/566374993.db2.gz KJFNPQODGOSVSG-KRWDZBQOSA-N 0 3 381.314 3.143 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)cc2C)[C@H](C)C1 ZINC000510338849 566376122 /nfs/dbraw/zinc/37/61/22/566376122.db2.gz GBHUXGWZILALPU-UKRRQHHQSA-N 0 3 378.460 3.365 10 0 GGAEHN CN(C)S(=O)(=O)c1ccc(CN[C@H]2CCC[C@H]2Cc2ccccc2)s1 ZINC000557257870 566376234 /nfs/dbraw/zinc/37/62/34/566376234.db2.gz GLUARRCLJKPYFT-WMZOPIPTSA-N 0 3 378.563 3.499 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)cc2C)[C@H](C)C1 ZINC000510338847 566376382 /nfs/dbraw/zinc/37/63/82/566376382.db2.gz GBHUXGWZILALPU-HIFRSBDPSA-N 0 3 378.460 3.365 10 0 GGAEHN CN(C)CCN(CC(=O)OC(C)(C)C)C(=O)c1cc2cc(Cl)sc2[nH]1 ZINC000576753864 566376785 /nfs/dbraw/zinc/37/67/85/566376785.db2.gz XRUIYUVYXCRMEE-UHFFFAOYSA-N 0 3 385.917 3.228 10 0 GGAEHN CCN(Cc1cc(Br)cc(Br)c1N)[C@@H]1CCOC1 ZINC000463022666 566377086 /nfs/dbraw/zinc/37/70/86/566377086.db2.gz FPOWUNRWQMKEDY-LLVKDONJSA-N 0 3 378.108 3.405 10 0 GGAEHN C[C@@H]1C[C@H](c2ccc(Br)cc2)CN1Cc1cc(=O)n2nccc2[nH]1 ZINC000626040728 566378523 /nfs/dbraw/zinc/37/85/23/566378523.db2.gz KVLCFIYLSAWGGT-OCCSQVGLSA-N 0 3 387.281 3.163 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cccc(C)c2Br)C[C@@H]1N1CCCC1 ZINC000483400139 566378800 /nfs/dbraw/zinc/37/88/00/566378800.db2.gz CSJJGPNBQADFMI-LSDHHAIUSA-N 0 3 383.355 3.409 10 0 GGAEHN CS[C@@H]1CN(C(=O)Cc2ccc(Br)cc2C)C[C@H]1N1CCCC1 ZINC000483389009 566379278 /nfs/dbraw/zinc/37/92/78/566379278.db2.gz BTGFHLLNCJXFNT-IAGOWNOFSA-N 0 3 397.382 3.338 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2F)C[C@H]1N1CCCC1 ZINC000483392374 566379311 /nfs/dbraw/zinc/37/93/11/566379311.db2.gz GBOGCLXNZOGRFW-HUUCEWRRSA-N 0 3 376.419 3.496 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cc(C)sc2Br)C[C@H]1N1CCCC1 ZINC000483391003 566379377 /nfs/dbraw/zinc/37/93/77/566379377.db2.gz FHJZWVVXNMSOSY-OLZOCXBDSA-N 0 3 389.384 3.471 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2ccc(F)cc2C(F)(F)F)C[C@@H]1N1CCCC1 ZINC000483387598 566379658 /nfs/dbraw/zinc/37/96/58/566379658.db2.gz CBRCNOXIIJGBLF-LSDHHAIUSA-N 0 3 376.419 3.496 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)CN1C1CC1 ZINC000626042000 566380180 /nfs/dbraw/zinc/38/01/80/566380180.db2.gz OPGGCGCGUOCGMO-DPKAMZSRSA-N 0 3 375.310 3.076 10 0 GGAEHN CNC(=O)C[C@H](NCCOc1ccc(Br)cc1)c1ccccc1 ZINC000483421935 566382321 /nfs/dbraw/zinc/38/23/21/566382321.db2.gz PEWWKCQEBVPMAR-KRWDZBQOSA-N 0 3 377.282 3.295 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000510478193 566385851 /nfs/dbraw/zinc/38/58/51/566385851.db2.gz GCTHFUSRHHUGQM-ZIAGYGMSSA-N 0 3 380.330 3.330 10 0 GGAEHN COC1(C[C@H](C)N[C@H]2CCN(c3cccc(Br)c3)C2=O)CCC1 ZINC000447095848 566386054 /nfs/dbraw/zinc/38/60/54/566386054.db2.gz ZYNVBDVPTKTMMN-BBRMVZONSA-N 0 3 381.314 3.492 10 0 GGAEHN C[C@H]1C[C@H](N2CCCC2)CN1S(=O)(=O)Cc1ccc(Cl)cc1Cl ZINC000510483480 566386246 /nfs/dbraw/zinc/38/62/46/566386246.db2.gz AIPVQWNJBYJHMJ-WFASDCNBSA-N 0 3 377.337 3.382 10 0 GGAEHN O=C(CCN1CCC2(CC1)C(F)(F)C2(F)F)N1CCc2sccc2C1 ZINC000649710700 566387571 /nfs/dbraw/zinc/38/75/71/566387571.db2.gz KBHHCYUUEJYOPZ-UHFFFAOYSA-N 0 3 376.419 3.389 10 0 GGAEHN C[C@H](NC(=O)C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1)c1cc(Cl)ccc1Cl ZINC000670925273 566388519 /nfs/dbraw/zinc/38/85/19/566388519.db2.gz NWJZYEZWEUTNCA-SGMGOOAPSA-N 0 3 386.323 3.112 10 0 GGAEHN CNS(=O)(=O)C[C@@H]1CCCN(C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000626166593 566389138 /nfs/dbraw/zinc/38/91/38/566389138.db2.gz ARCFCFGMXFPXHV-ZIAGYGMSSA-N 0 3 378.460 3.070 10 0 GGAEHN CN(C(=O)[C@@H]1CCOc2ccc(Br)cc21)[C@H]1CCN(C2CC2)C1 ZINC000649723350 566389332 /nfs/dbraw/zinc/38/93/32/566389332.db2.gz IJBTXHANJIIMGA-LSDHHAIUSA-N 0 3 379.298 3.010 10 0 GGAEHN CNS(=O)(=O)C[C@@H]1CCCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1 ZINC000626165943 566389354 /nfs/dbraw/zinc/38/93/54/566389354.db2.gz JXHGHYZTKNTKPI-DZGCQCFKSA-N 0 3 378.460 3.114 10 0 GGAEHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1nscc1Br ZINC000649725772 566389443 /nfs/dbraw/zinc/38/94/43/566389443.db2.gz BTJNRQYSBPOUAU-UHFFFAOYSA-N 0 3 386.290 3.249 10 0 GGAEHN Cc1ccccc1[C@H]([C@H](C)NC(=O)c1cc[nH]c(=O)c1Br)N(C)C ZINC000510514543 566389967 /nfs/dbraw/zinc/38/99/67/566389967.db2.gz UYLRDWGCQUEZFR-LRDDRELGSA-N 0 3 392.297 3.279 10 0 GGAEHN Cc1noc([C@@H]2OCC[C@@H]2NCCC(=O)Nc2cc(Cl)ccc2Cl)n1 ZINC000626145027 566390198 /nfs/dbraw/zinc/39/01/98/566390198.db2.gz ZZPWKSYSSWWKLJ-SWLSCSKDSA-N 0 3 385.251 3.133 10 0 GGAEHN Cc1noc([C@@H]2OCC[C@@H]2NCc2cc(Br)cc3cccnc32)n1 ZINC000626145252 566390254 /nfs/dbraw/zinc/39/02/54/566390254.db2.gz KEQZRYFGSSPGCN-GOEBONIOSA-N 0 3 389.253 3.309 10 0 GGAEHN C[C@H](CCNCc1cc(Br)cc(Br)c1N)[S@@](C)=O ZINC000463239087 566394229 /nfs/dbraw/zinc/39/42/29/566394229.db2.gz UIPLDKAGTXJSSZ-NTCNTBNZSA-N 0 3 398.164 3.041 10 0 GGAEHN C[C@@H](CCNCc1cc(Br)cc(Br)c1N)[S@@](C)=O ZINC000463239086 566394769 /nfs/dbraw/zinc/39/47/69/566394769.db2.gz UIPLDKAGTXJSSZ-DCXZOGHSSA-N 0 3 398.164 3.041 10 0 GGAEHN C[C@H](Cc1cccc(Br)c1)NC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000601281126 566398561 /nfs/dbraw/zinc/39/85/61/566398561.db2.gz ZKAGXCWFQQVFOH-DYVFJYSZSA-N 0 3 380.330 3.258 10 0 GGAEHN CN1CC[C@@H]2[C@H](CCCN2C(=O)[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000649849031 566399414 /nfs/dbraw/zinc/39/94/14/566399414.db2.gz KVFHDAPJKCFRQT-FRFSOERESA-N 0 3 393.325 3.258 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)NCCOc1cccc(Cl)c1Cl ZINC000577058628 566400996 /nfs/dbraw/zinc/40/09/96/566400996.db2.gz SCYJBYJCMLPAII-PZDGAKPMSA-N 0 3 387.307 3.021 10 0 GGAEHN CN(CCC(=O)N[C@@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccncc1 ZINC000557598820 566401508 /nfs/dbraw/zinc/40/15/08/566401508.db2.gz BYTDCORHRDUCPJ-KRWDZBQOSA-N 0 3 382.291 3.455 10 0 GGAEHN CN1CCC2(CCCN2C(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)CC1 ZINC000626332439 566402320 /nfs/dbraw/zinc/40/23/20/566402320.db2.gz RKZDDSALDYPASQ-BPQIPLTHSA-N 0 3 389.337 3.422 10 0 GGAEHN Cc1cnn(CCN[C@H](C)c2ccc(Br)cc2OCCCO)c1 ZINC000463363892 566403671 /nfs/dbraw/zinc/40/36/71/566403671.db2.gz BATMNEBOBOBERG-CQSZACIVSA-N 0 3 382.302 3.066 10 0 GGAEHN CCN1CCN(c2cccc(NC(=O)c3nscc3Br)c2)CC1 ZINC000649933957 566406743 /nfs/dbraw/zinc/40/67/43/566406743.db2.gz SUNHNESNFRVYBQ-UHFFFAOYSA-N 0 3 395.326 3.300 10 0 GGAEHN COc1cccc(CN(CCN(C)C)C(=O)c2nscc2Br)c1 ZINC000649957968 566409799 /nfs/dbraw/zinc/40/97/99/566409799.db2.gz RXIYJOPEAKVVAJ-UHFFFAOYSA-N 0 3 398.326 3.118 10 0 GGAEHN CN(C)S(=O)(=O)c1ccc(CN(C)[C@H]2CCCC[C@H]2C(F)(F)F)cc1 ZINC000463432048 566410291 /nfs/dbraw/zinc/41/02/91/566410291.db2.gz FGVQYYWLUZMJKH-CVEARBPZSA-N 0 3 378.460 3.490 10 0 GGAEHN C[C@H](NC(=O)CSCc1cc(-c2cccs2)on1)C1=CCN(C)CC1 ZINC000510742168 566410411 /nfs/dbraw/zinc/41/04/11/566410411.db2.gz XRIHKTVMRMYWMS-ZDUSSCGKSA-N 0 3 377.535 3.403 10 0 GGAEHN C[C@H](CNC(=O)N(C)[C@@H]1CCN(C2CC2)C1)Oc1ccccc1Br ZINC000484009247 566411573 /nfs/dbraw/zinc/41/15/73/566411573.db2.gz PCBJGSTVJHXEHU-UKRRQHHQSA-N 0 3 396.329 3.095 10 0 GGAEHN CC[C@@H]1C[C@H](N[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)CCO1 ZINC000421849468 566411682 /nfs/dbraw/zinc/41/16/82/566411682.db2.gz BUNLZNCDHNUQHE-HBNTYKKESA-N 0 3 381.325 3.249 10 0 GGAEHN CN(Cc1ccccc1)C[C@H](O)CN1CCc2ccc(Br)cc2C1 ZINC000671245005 566411730 /nfs/dbraw/zinc/41/17/30/566411730.db2.gz CYVNGBQEPOHNQG-FQEVSTJZSA-N 0 3 389.337 3.300 10 0 GGAEHN CCN(CC)CCN(C(=O)c1coc(C)n1)c1ccc(Br)cn1 ZINC000649988601 566412072 /nfs/dbraw/zinc/41/20/72/566412072.db2.gz CFNVHBHCCSSRJB-UHFFFAOYSA-N 0 3 381.274 3.129 10 0 GGAEHN COCCOc1c(Cl)cc(NC(=O)NC[C@@H]2CCCN2C)cc1Cl ZINC000536921525 566412553 /nfs/dbraw/zinc/41/25/53/566412553.db2.gz QKQWPHAYUSTJJM-LBPRGKRZSA-N 0 3 376.284 3.234 10 0 GGAEHN CCO[C@@H]1C[C@H](NC[C@H](O)COc2c(Cl)cccc2Cl)[C@]12CCCO2 ZINC000577172761 566412702 /nfs/dbraw/zinc/41/27/02/566412702.db2.gz CQFBEXQZSMUBGQ-BWUSGFMJSA-N 0 3 390.307 3.049 10 0 GGAEHN C[C@@H](NC(=O)CN1CCCCC[C@@H]1CCO)c1ccc(Br)cc1 ZINC000671248369 566412845 /nfs/dbraw/zinc/41/28/45/566412845.db2.gz RKLQMUOKHVXCBX-RHSMWYFYSA-N 0 3 383.330 3.253 10 0 GGAEHN CCN(CC)CCN(C(=O)CCn1cccc1)c1ccc(Br)cn1 ZINC000649988658 566412820 /nfs/dbraw/zinc/41/28/20/566412820.db2.gz FSVYCVRTMQXDND-UHFFFAOYSA-N 0 3 393.329 3.411 10 0 GGAEHN C[C@@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CC[C@]2(C1)CCCOC2 ZINC000671254313 566413041 /nfs/dbraw/zinc/41/30/41/566413041.db2.gz BMSGNNADCWDKIQ-KXBFYZLASA-N 0 3 395.341 3.299 10 0 GGAEHN CN1CCN([C@H]2CC[C@@H](NC(=O)c3ccsc3C(F)(F)F)CC2)CC1 ZINC000626457873 566413413 /nfs/dbraw/zinc/41/34/13/566413413.db2.gz GDOSJOVEXVUMMX-BETUJISGSA-N 0 3 375.460 3.055 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1cc(F)ccc1I ZINC000510844280 566416608 /nfs/dbraw/zinc/41/66/08/566416608.db2.gz PWNDPYYGSMFUAW-NSHDSACASA-N 0 3 390.240 3.035 10 0 GGAEHN CCOc1cc(C[NH2+]CCC(=O)NC2CCCCC2)cc(Br)c1[O-] ZINC000510878427 566416740 /nfs/dbraw/zinc/41/67/40/566416740.db2.gz GCMNDSWASWTWJP-UHFFFAOYSA-N 0 3 399.329 3.482 10 0 GGAEHN C[C@H](NCCOCC(F)(F)C(F)F)c1ccc(-n2cncn2)cc1Cl ZINC000447602364 566417607 /nfs/dbraw/zinc/41/76/07/566417607.db2.gz UJZRRRWJYSREFN-JTQLQIEISA-N 0 3 380.773 3.488 10 0 GGAEHN CN(CCCN(C)C(=O)Cc1sccc1Br)Cc1ccncc1 ZINC000577286411 566420951 /nfs/dbraw/zinc/42/09/51/566420951.db2.gz MTRONFPCURGCLV-UHFFFAOYSA-N 0 3 396.354 3.429 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)Nc1cnc(-c2ccc(Br)s2)nc1 ZINC000626596555 566427722 /nfs/dbraw/zinc/42/77/22/566427722.db2.gz QZKHRQROHBXPEI-NSHDSACASA-N 0 3 396.314 3.183 10 0 GGAEHN C[C@@H](NCCc1nnnn1-c1ccccc1)c1ccc(Br)cc1F ZINC000511015210 566428150 /nfs/dbraw/zinc/42/81/50/566428150.db2.gz KWTMLEVNHKTBNE-GFCCVEGCSA-N 0 3 390.260 3.457 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2cc(Cl)c(F)cc2Cl)CC1 ZINC000511013497 566428534 /nfs/dbraw/zinc/42/85/34/566428534.db2.gz LNFQNPIJSZNPCI-UHFFFAOYSA-N 0 3 384.238 3.499 10 0 GGAEHN COC(=O)c1ccc(OCCN[C@@H](CO)c2ccc(Cl)cc2)c(Cl)c1 ZINC000557910214 566433141 /nfs/dbraw/zinc/43/31/41/566433141.db2.gz PLJGULDQDCHGGQ-INIZCTEOSA-N 0 3 384.259 3.482 10 0 GGAEHN CCCN1CCC(CNS(=O)(=O)c2ccc(C(F)(F)F)c(F)c2)CC1 ZINC000447823393 566434954 /nfs/dbraw/zinc/43/49/54/566434954.db2.gz UOJWKZQKDUXQLM-UHFFFAOYSA-N 0 3 382.423 3.245 10 0 GGAEHN CN(C[C@@H]1CCCN1C)C(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000422163864 566437591 /nfs/dbraw/zinc/43/75/91/566437591.db2.gz UQICKODUQYYCPA-DZGCQCFKSA-N 0 3 382.302 3.008 10 0 GGAEHN C[C@H](CN1CCC[C@H](S(=O)(=O)N(C)C)C1)c1ccc(C(F)(F)F)cc1 ZINC000511127268 566438846 /nfs/dbraw/zinc/43/88/46/566438846.db2.gz SNSHGIORLMWUHI-CJNGLKHVSA-N 0 3 378.460 3.165 10 0 GGAEHN CS[C@@H]1CN([C@H](C)C(=O)Nc2ccc(F)cc2Cl)C[C@H]1N1CCCC1 ZINC000484609904 566439891 /nfs/dbraw/zinc/43/98/91/566439891.db2.gz BAMMWMAETIDDHZ-CSMYWGQOSA-N 0 3 385.936 3.318 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)c(F)c2)[C@H](C)C1 ZINC000447874375 566441999 /nfs/dbraw/zinc/44/19/99/566441999.db2.gz LFQYQQVLNWQANN-ABAIWWIYSA-N 0 3 382.423 3.195 10 0 GGAEHN CS[C@@H]1CN([C@H](C)C(=O)Nc2cc(Cl)ccc2F)C[C@H]1N1CCCC1 ZINC000484631199 566442039 /nfs/dbraw/zinc/44/20/39/566442039.db2.gz HZEWAECZTPFLMO-CSMYWGQOSA-N 0 3 385.936 3.318 10 0 GGAEHN Cc1cc(Br)c(F)c(C(=O)N=c2ccn(C3CCN(C)CC3)[nH]2)c1 ZINC000626697287 566443729 /nfs/dbraw/zinc/44/37/29/566443729.db2.gz LPFKPMYDVGOFPS-UHFFFAOYSA-N 0 3 395.276 3.034 10 0 GGAEHN CN1CCC(n2ccc(=NC(=O)c3sc4ncccc4c3Cl)[nH]2)CC1 ZINC000626695830 566443919 /nfs/dbraw/zinc/44/39/19/566443919.db2.gz IVNIRGXZCDSMON-UHFFFAOYSA-N 0 3 375.885 3.087 10 0 GGAEHN O=C(c1ccc(C(F)(F)F)s1)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000671772972 566449389 /nfs/dbraw/zinc/44/93/89/566449389.db2.gz PAWJSTLYQRFCAP-ZDUSSCGKSA-N 0 3 376.444 3.484 10 0 GGAEHN Cc1nc([C@H](C)NC[C@@H]2CCN(S(=O)(=O)c3cccs3)C2)c(C)s1 ZINC000671765131 566449587 /nfs/dbraw/zinc/44/95/87/566449587.db2.gz UPHZZPFVBQLFKW-FZMZJTMJSA-N 0 3 385.580 3.183 10 0 GGAEHN Cc1nc([C@H](C)NC[C@H]2CCN(S(=O)(=O)c3cccs3)C2)c(C)s1 ZINC000671765133 566449614 /nfs/dbraw/zinc/44/96/14/566449614.db2.gz UPHZZPFVBQLFKW-SMDDNHRTSA-N 0 3 385.580 3.183 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)NC[C@@](C)(O)C(=O)OC(C)(C)C ZINC000484733950 566449651 /nfs/dbraw/zinc/44/96/51/566449651.db2.gz CCZYOSMGLBXNPG-PIGZYNQJSA-N 0 3 390.293 3.202 10 0 GGAEHN CCCOc1c(Cl)cc(C(=O)N[C@@H]2CNCCC2(F)F)cc1OCC ZINC000577632630 566452366 /nfs/dbraw/zinc/45/23/66/566452366.db2.gz VQUTYMRCKIZHOR-CQSZACIVSA-N 0 3 376.831 3.255 10 0 GGAEHN CN1CCN([C@H]2CC[C@@H](NC(=O)c3ccc(C(F)(F)F)s3)CC2)CC1 ZINC000671796076 566452536 /nfs/dbraw/zinc/45/25/36/566452536.db2.gz AHYHMDPCJJFADH-BETUJISGSA-N 0 3 375.460 3.055 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000511364108 566458034 /nfs/dbraw/zinc/45/80/34/566458034.db2.gz TYEUYMMUARRDBV-CYBMUJFWSA-N 0 3 390.325 3.479 10 0 GGAEHN N[C@H](CNC(=O)N1CCc2cc(F)cc(Br)c2C1)c1ccccc1 ZINC000627078274 566463484 /nfs/dbraw/zinc/46/34/84/566463484.db2.gz MQTOXCFSLHYHFO-QGZVFWFLSA-N 0 3 392.272 3.356 10 0 GGAEHN C[C@@H](NC[C@H]1CCN(c2cccc(Br)c2)C1)c1cnccc1N ZINC000422902200 566464643 /nfs/dbraw/zinc/46/46/43/566464643.db2.gz UADYYMBPFWEIBF-ZIAGYGMSSA-N 0 3 375.314 3.434 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1ccc2cc(Br)ccc2c1 ZINC000448246719 566465615 /nfs/dbraw/zinc/46/56/15/566465615.db2.gz FPRQUYUMNDOVQF-GOSISDBHSA-N 0 3 391.309 3.443 10 0 GGAEHN Cc1ccc(Br)cc1NC(=O)CCN[C@H](C)c1cnccc1N ZINC000422955650 566467641 /nfs/dbraw/zinc/46/76/41/566467641.db2.gz MTZXDJVOBAAKCP-GFCCVEGCSA-N 0 3 377.286 3.244 10 0 GGAEHN CN(C)CCOCCNC(=O)N1CCC(c2cccc(Cl)c2Cl)CC1 ZINC000464344291 566467746 /nfs/dbraw/zinc/46/77/46/566467746.db2.gz UDMQSHWOLRLEER-UHFFFAOYSA-N 0 3 388.339 3.461 10 0 GGAEHN Cc1nc(CN)ccc1[C@H](C)N[C@@H](CCO)c1ccccc1Br ZINC000423026159 566468563 /nfs/dbraw/zinc/46/85/63/566468563.db2.gz ARZPODZQAPBEDE-UGSOOPFHSA-N 0 3 378.314 3.386 10 0 GGAEHN FC(F)(F)c1cc(Br)ccc1CN[C@@H](C1CC1)[C@H]1CNCCO1 ZINC000423020659 566468618 /nfs/dbraw/zinc/46/86/18/566468618.db2.gz CMWHWLLVDVIQRX-CABCVRRESA-N 0 3 393.247 3.325 10 0 GGAEHN C[C@@H]1CC[C@H](C)N1[C@@H]1CCCN(C(=O)C(=O)c2ccc(Br)cc2)C1 ZINC000511543624 566469903 /nfs/dbraw/zinc/46/99/03/566469903.db2.gz YBWZDLAFCKRRTI-JKIFEVAISA-N 0 3 393.325 3.496 10 0 GGAEHN CN(C)[C@]1(CNC(=O)N2CC[C@@H](C(F)(F)F)C3(CCC3)C2)CCSC1 ZINC000511534361 566470124 /nfs/dbraw/zinc/47/01/24/566470124.db2.gz YKWGDCKHYKLSPI-CJNGLKHVSA-N 0 3 379.492 3.188 10 0 GGAEHN CCS(=O)(=O)N1CCC([C@H](C)N(C)Cc2cnc(CC(C)C)s2)CC1 ZINC000558424726 566470383 /nfs/dbraw/zinc/47/03/83/566470383.db2.gz BCWGLKJEPSQKHU-HNNXBMFYSA-N 0 3 387.615 3.224 10 0 GGAEHN Cc1ccc(S(=O)(=O)C[C@H](C)NC[C@H]2CSc3ccccc3O2)cc1 ZINC000577849854 566470897 /nfs/dbraw/zinc/47/08/97/566470897.db2.gz JQIUGIXIJGSGSG-HOTGVXAUSA-N 0 3 377.531 3.300 10 0 GGAEHN COc1ccccc1OCCN[C@](C)(CO)c1ccc(Br)cc1 ZINC000511565492 566471533 /nfs/dbraw/zinc/47/15/33/566471533.db2.gz SSWMEXKOQUQDNA-GOSISDBHSA-N 0 3 380.282 3.334 10 0 GGAEHN COc1cnc(NC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)s1 ZINC000558439221 566472566 /nfs/dbraw/zinc/47/25/66/566472566.db2.gz MKXUBHPHNXBRJJ-UHFFFAOYSA-N 0 3 378.420 3.079 10 0 GGAEHN CCN1CCCN(c2nnc(-c3ccc(Br)cc3Cl)n2C)CC1 ZINC000558444160 566472640 /nfs/dbraw/zinc/47/26/40/566472640.db2.gz FHRUFDXORUMRPD-UHFFFAOYSA-N 0 3 398.736 3.430 10 0 GGAEHN C[C@H](NC(=O)[C@@H]1CCCCN1C1CCCC1)c1ncc(Br)cn1 ZINC000558457837 566474737 /nfs/dbraw/zinc/47/47/37/566474737.db2.gz CFNOBIOTUAPSAU-WFASDCNBSA-N 0 3 381.318 3.213 10 0 GGAEHN COc1cccc(OCCN[C@](C)(CO)c2ccc(Br)cc2)c1 ZINC000511588956 566474892 /nfs/dbraw/zinc/47/48/92/566474892.db2.gz UBTHBJFECPOZNF-GOSISDBHSA-N 0 3 380.282 3.334 10 0 GGAEHN COc1cccc(OCCN[C@@](C)(CO)c2ccc(Br)cc2)c1 ZINC000511588957 566475115 /nfs/dbraw/zinc/47/51/15/566475115.db2.gz UBTHBJFECPOZNF-SFHVURJKSA-N 0 3 380.282 3.334 10 0 GGAEHN NCc1cccc2c1N(C(=O)c1csc(I)c1)CCC2 ZINC000602539729 566475230 /nfs/dbraw/zinc/47/52/30/566475230.db2.gz JNSZLDPOSXAWND-UHFFFAOYSA-N 0 3 398.269 3.404 10 0 GGAEHN C[C@](CO)(NC[C@@H](O)CCc1ccccc1)c1ccc(Br)cc1 ZINC000511589135 566475701 /nfs/dbraw/zinc/47/57/01/566475701.db2.gz VSFQDOXCVSBPSH-RBUKOAKNSA-N 0 3 378.310 3.240 10 0 GGAEHN COC(=O)C[C@@](C)(NCCc1ccncc1)c1ccc(Br)cc1 ZINC000558466704 566475969 /nfs/dbraw/zinc/47/59/69/566475969.db2.gz PMXNJDDELQUOSV-GOSISDBHSA-N 0 3 377.282 3.455 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)c(C)c2)[C@H](C)C1 ZINC000558470933 566476341 /nfs/dbraw/zinc/47/63/41/566476341.db2.gz KOSNBRQTXMYYPR-CZUORRHYSA-N 0 3 378.460 3.365 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)c(C)c2)[C@@H](C)C1 ZINC000558470935 566476382 /nfs/dbraw/zinc/47/63/82/566476382.db2.gz KOSNBRQTXMYYPR-XJKSGUPXSA-N 0 3 378.460 3.365 10 0 GGAEHN CC1(C)CCCN[C@@H]1C(=O)N1CCO[C@@H](c2cccc(Br)c2)C1 ZINC000423112971 566476858 /nfs/dbraw/zinc/47/68/58/566476858.db2.gz XUSSHGRUOPFVEU-HZPDHXFCSA-N 0 3 381.314 3.127 10 0 GGAEHN CCN1CC[C@H](CNC(=O)CCCC(=O)c2ccc(Br)cc2)C1 ZINC000485119377 566476975 /nfs/dbraw/zinc/47/69/75/566476975.db2.gz NFXYRDNODMLHPS-CQSZACIVSA-N 0 3 381.314 3.260 10 0 GGAEHN C[C@](CO)(NCC[S@](=O)c1ccccc1)c1ccc(Br)cc1 ZINC000511612793 566477501 /nfs/dbraw/zinc/47/75/01/566477501.db2.gz VQQOVTWDFXJBGB-VGSWGCGISA-N 0 3 382.323 3.054 10 0 GGAEHN C[C@@H](N[C@@H](C)c1cnccc1N)c1ccc(Br)cc1OCCCO ZINC000423122772 566477523 /nfs/dbraw/zinc/47/75/23/566477523.db2.gz CWYIGXHOOXHQJV-OLZOCXBDSA-N 0 3 394.313 3.430 10 0 GGAEHN Cc1ccc(C[C@H](CO)CN[C@@H](C)c2cnccc2N)cc1Br ZINC000423161648 566480504 /nfs/dbraw/zinc/48/05/04/566480504.db2.gz NYBKYQCQIMTFQJ-ZFWWWQNUSA-N 0 3 378.314 3.067 10 0 GGAEHN O=C(Cc1sccc1Br)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000448608263 566481736 /nfs/dbraw/zinc/48/17/36/566481736.db2.gz RMYZXVMXPBDTJU-CQSZACIVSA-N 0 3 379.323 3.444 10 0 GGAEHN CC[C@@H](NCCNS(=O)(=O)c1cc(C)sc1C)c1cccc(OC)c1 ZINC000537954938 566481839 /nfs/dbraw/zinc/48/18/39/566481839.db2.gz ZYDYLVHGDNDXTM-QGZVFWFLSA-N 0 3 382.551 3.393 10 0 GGAEHN COc1ccc([C@@H](C)Nc2ccc(N3CCNCC3)cn2)c(Br)c1 ZINC000423233731 566483061 /nfs/dbraw/zinc/48/30/61/566483061.db2.gz ONGHJEQURQZIAU-CYBMUJFWSA-N 0 3 391.313 3.435 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)c2c(F)ccc(C(F)(F)F)c2Br)C1 ZINC000627487826 566483295 /nfs/dbraw/zinc/48/32/95/566483295.db2.gz LKSIHIUDGMVIAE-KWQFWETISA-N 0 3 395.194 3.383 10 0 GGAEHN Fc1ccc2c(c1Br)CC[C@H]2Nc1ccc(N2CCNCC2)cn1 ZINC000423242093 566484141 /nfs/dbraw/zinc/48/41/41/566484141.db2.gz YKNZPFRQZWWDLC-MRXNPFEDSA-N 0 3 391.288 3.492 10 0 GGAEHN COCCNCCN[C@@H](C)c1ccc(Br)cc1Br ZINC000423333278 566486910 /nfs/dbraw/zinc/48/69/10/566486910.db2.gz VSMKMEXXLAVBDS-JTQLQIEISA-N 0 3 380.124 3.098 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NCc1ccc2c(c1)CCCN2 ZINC000423444319 566488907 /nfs/dbraw/zinc/48/89/07/566488907.db2.gz LPUGNTXLJBHQQC-CYBMUJFWSA-N 0 3 376.298 3.147 10 0 GGAEHN CN1CCC[C@@H](NC(=O)NCC2(c3ccc(Br)s3)CCC2)C1 ZINC000672454388 566491597 /nfs/dbraw/zinc/49/15/97/566491597.db2.gz JRUCXRUZBWRDOT-GFCCVEGCSA-N 0 3 386.359 3.326 10 0 GGAEHN CN(CCN1CCCCC1)C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000651081127 566495083 /nfs/dbraw/zinc/49/50/83/566495083.db2.gz YUBVNXXFAFESMJ-INIZCTEOSA-N 0 3 396.329 3.400 10 0 GGAEHN O=C(NCCN1CCCCCC1)[C@H]1CCOc2ccc(Br)cc21 ZINC000651089623 566495239 /nfs/dbraw/zinc/49/52/39/566495239.db2.gz LMCARYXVPMEASE-HNNXBMFYSA-N 0 3 381.314 3.307 10 0 GGAEHN C[C@@H]1CCCN(CCNC(=O)[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000651108815 566496821 /nfs/dbraw/zinc/49/68/21/566496821.db2.gz XNLGSVSSUAWJKJ-HIFRSBDPSA-N 0 3 381.314 3.163 10 0 GGAEHN CCC(=O)Nc1cccc(CN[C@H](C)Cn2cc(Br)ccc2=O)c1 ZINC000578165370 566496918 /nfs/dbraw/zinc/49/69/18/566496918.db2.gz PBLJWFDIUFUORM-CYBMUJFWSA-N 0 3 392.297 3.138 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000651108675 566497218 /nfs/dbraw/zinc/49/72/18/566497218.db2.gz UMWLFOMMBUFMAV-ZFWWWQNUSA-N 0 3 381.314 3.306 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000651180177 566501419 /nfs/dbraw/zinc/50/14/19/566501419.db2.gz IEFRBLRWGVXCBZ-GJZGRUSLSA-N 0 3 383.330 3.408 10 0 GGAEHN Cc1ccc(Br)c(C)c1C(=O)N1CCC(N2CCCOCC2)CC1 ZINC000627742106 566502381 /nfs/dbraw/zinc/50/23/81/566502381.db2.gz IXSAHPKTNWPPSI-UHFFFAOYSA-N 0 3 395.341 3.393 10 0 GGAEHN O=C(c1cc(Cl)c(F)cc1Cl)N1CCC(N2CCCOCC2)CC1 ZINC000627742201 566502465 /nfs/dbraw/zinc/50/24/65/566502465.db2.gz MQZCCBCKPPPAFF-UHFFFAOYSA-N 0 3 375.271 3.459 10 0 GGAEHN O=C([C@@H]1CCOc2ccc(Br)cc21)N1CCC[C@@H]1CN1CCCC1 ZINC000651204417 566502548 /nfs/dbraw/zinc/50/25/48/566502548.db2.gz PHNWQKCMSAYEEI-HZPDHXFCSA-N 0 3 393.325 3.402 10 0 GGAEHN CN(Cc1ccc(Br)cc1)C[C@@H](O)COc1ccc2c(c1)OCO2 ZINC000511993448 566502831 /nfs/dbraw/zinc/50/28/31/566502831.db2.gz XGUDMMHIAVCXAO-OAHLLOKOSA-N 0 3 394.265 3.050 10 0 GGAEHN O=C(c1cc(F)c(Cl)cc1Cl)N1CCC(N2CCCOCC2)CC1 ZINC000627738322 566503604 /nfs/dbraw/zinc/50/36/04/566503604.db2.gz NGDGKXBXKOSTPH-UHFFFAOYSA-N 0 3 375.271 3.459 10 0 GGAEHN CC(C)N1CCCN(C(=O)[C@@H]2CCOc3ccc(Br)cc32)CC1 ZINC000651240982 566503961 /nfs/dbraw/zinc/50/39/61/566503961.db2.gz ROIOVAZFKKTSEO-OAHLLOKOSA-N 0 3 381.314 3.258 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)[C@H](NC(=O)c1ccc(Cl)s1)C(C)C ZINC000558759338 566504761 /nfs/dbraw/zinc/50/47/61/566504761.db2.gz ZDLUBPIHFGIWQW-XJKSGUPXSA-N 0 3 387.977 3.248 10 0 GGAEHN CN(C)C[C@@H]1CCCCN1C(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651256981 566505863 /nfs/dbraw/zinc/50/58/63/566505863.db2.gz STZHFXIWQHDXNY-LSDHHAIUSA-N 0 3 381.314 3.258 10 0 GGAEHN O=C(CCN1CCC[C@@H]2COCC[C@H]21)Nc1ccc(Br)cc1F ZINC000464859893 566508521 /nfs/dbraw/zinc/50/85/21/566508521.db2.gz RJCDJVPREYMXCP-MLGOLLRUSA-N 0 3 385.277 3.418 10 0 GGAEHN CC(C)(O)CN1CCN(c2ncc(Br)c3ccc(F)cc32)CC1 ZINC000651304990 566508655 /nfs/dbraw/zinc/50/86/55/566508655.db2.gz ZCMVXBFLOOUIKK-UHFFFAOYSA-N 0 3 382.277 3.029 10 0 GGAEHN O[C@@H]1CCC[C@H]1N1CCN(c2ncc(Br)c3ccc(F)cc32)CC1 ZINC000651306146 566508910 /nfs/dbraw/zinc/50/89/10/566508910.db2.gz UFIJMRFAGXSVAL-IAGOWNOFSA-N 0 3 394.288 3.172 10 0 GGAEHN CCN1CCCC[C@@H]1CNC(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000651305606 566509235 /nfs/dbraw/zinc/50/92/35/566509235.db2.gz PVGNATCGWCHVBE-CABCVRRESA-N 0 3 381.314 3.306 10 0 GGAEHN O[C@@H]1CCC[C@@H]1N1CCN(c2ncc(Br)c3ccc(F)cc32)CC1 ZINC000651306145 566509375 /nfs/dbraw/zinc/50/93/75/566509375.db2.gz UFIJMRFAGXSVAL-DLBZAZTESA-N 0 3 394.288 3.172 10 0 GGAEHN CC(C)(CO)N1CCN(c2ncc(Br)c3ccc(F)cc32)CC1 ZINC000651316544 566510078 /nfs/dbraw/zinc/51/00/78/566510078.db2.gz RKRNCXDNJGVPLQ-UHFFFAOYSA-N 0 3 382.277 3.029 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)c1ccc(I)cc1Cl ZINC000464922662 566510376 /nfs/dbraw/zinc/51/03/76/566510376.db2.gz SFYIVPHNUHQJKS-NSHDSACASA-N 0 3 392.668 3.111 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1cc(Cl)c(Br)cc1F ZINC000448906121 566510341 /nfs/dbraw/zinc/51/03/41/566510341.db2.gz CIEUXHKCUQBHKD-SNVBAGLBSA-N 0 3 393.684 3.082 10 0 GGAEHN Cc1sc2ncnc(SCCC(=O)N3CCC[C@@H]3CN(C)C)c2c1C ZINC000464927261 566510339 /nfs/dbraw/zinc/51/03/39/566510339.db2.gz RORWHNMVHYKXMZ-CQSZACIVSA-N 0 3 378.567 3.343 10 0 GGAEHN CC(C)N1CC[C@H](NC[C@@H](C)CS(C)(=O)=O)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000558829547 566510331 /nfs/dbraw/zinc/51/03/31/566510331.db2.gz SCMHRHJXHILJAT-BVGQSLNGSA-N 0 3 390.952 3.273 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)CCOc1ccc(Cl)cc1Br ZINC000464933283 566510509 /nfs/dbraw/zinc/51/05/09/566510509.db2.gz GLRQDYCZZVHNCK-ZDUSSCGKSA-N 0 3 389.721 3.424 10 0 GGAEHN CC(=O)Nc1cccc(CNC[C@@H](O)COc2c(Cl)cccc2Cl)c1 ZINC000578316179 566511135 /nfs/dbraw/zinc/51/11/35/566511135.db2.gz QABAQBPXDSVFJB-OAHLLOKOSA-N 0 3 383.275 3.481 10 0 GGAEHN Cc1ccc(CC(=O)N(CCN(C)C)Cc2ccccn2)c(Br)c1 ZINC000448929115 566512055 /nfs/dbraw/zinc/51/20/55/566512055.db2.gz PXLBPSKSHOXLGU-UHFFFAOYSA-N 0 3 390.325 3.285 10 0 GGAEHN CCn1c(-c2ccccc2Br)nnc1N1CCN(CC2CC2)CC1 ZINC000558857766 566512230 /nfs/dbraw/zinc/51/22/30/566512230.db2.gz YSXSZMUGWJNFAP-UHFFFAOYSA-N 0 3 390.329 3.260 10 0 GGAEHN COC1CCN(C(C)(C)CNC(=O)Cc2ccc(C)cc2Br)CC1 ZINC000448933524 566513456 /nfs/dbraw/zinc/51/34/56/566513456.db2.gz APNADSYKXPJMPG-UHFFFAOYSA-N 0 3 397.357 3.306 10 0 GGAEHN CN(C(=O)c1cc2c(ccc(F)c2Br)[nH]1)[C@H]1CN2CCC1CC2 ZINC000448956587 566515119 /nfs/dbraw/zinc/51/51/19/566515119.db2.gz QROBHPSWPDIAMB-HNNXBMFYSA-N 0 3 380.261 3.236 10 0 GGAEHN CCN1CCN(c2ccc(CNCc3cscc3Br)cn2)CC1 ZINC000512133224 566515848 /nfs/dbraw/zinc/51/58/48/566515848.db2.gz URIZQVGJQDJSCI-UHFFFAOYSA-N 0 3 395.370 3.337 10 0 GGAEHN COc1ccc(C[C@H](CO)CNCc2cncn2C(C)C)cc1Br ZINC000424166044 566516328 /nfs/dbraw/zinc/51/63/28/566516328.db2.gz CARPZSHYHRTZBH-HNNXBMFYSA-N 0 3 396.329 3.176 10 0 GGAEHN CC(C)n1cncc1CNCCCNC(=O)c1cccc(Br)c1 ZINC000424155666 566516418 /nfs/dbraw/zinc/51/64/18/566516418.db2.gz NKSBOLQXWJDXID-UHFFFAOYSA-N 0 3 379.302 3.136 10 0 GGAEHN CC(C)n1cncc1CNC[C@@H](CO)Cc1cc(Br)ccc1F ZINC000424170469 566516533 /nfs/dbraw/zinc/51/65/33/566516533.db2.gz ICOZHGJRSKEISA-ZDUSSCGKSA-N 0 3 384.293 3.306 10 0 GGAEHN CC[C@H](CN1CCCC1)NC(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651349202 566516996 /nfs/dbraw/zinc/51/69/96/566516996.db2.gz WNIMWIPKRDDZIR-HUUCEWRRSA-N 0 3 381.314 3.306 10 0 GGAEHN CN1CC[C@@H](CNCc2cccc(Br)c2OC(F)F)CC1=O ZINC000424193951 566517511 /nfs/dbraw/zinc/51/75/11/566517511.db2.gz WSHFZGPXQLKQEM-SNVBAGLBSA-N 0 3 377.229 3.009 10 0 GGAEHN C[C@@H]1CN(c2ncc(Br)c3ccc(F)cc32)[C@@H](C)CN1CCO ZINC000651357806 566518166 /nfs/dbraw/zinc/51/81/66/566518166.db2.gz HVNWAOWBTNUMAY-NEPJUHHUSA-N 0 3 382.277 3.028 10 0 GGAEHN CCCN(C(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)[C@@H]1CCN(C)C1 ZINC000627914517 566519003 /nfs/dbraw/zinc/51/90/03/566519003.db2.gz YIBVSIHEWIUAPO-ZYRRHWMLSA-N 0 3 377.326 3.278 10 0 GGAEHN O=C(CCCC(=O)c1ccc(Cl)c(Cl)c1)NCCNc1ccncc1 ZINC000485708858 566519543 /nfs/dbraw/zinc/51/95/43/566519543.db2.gz NKUWZHQUKIZRQC-UHFFFAOYSA-N 0 3 380.275 3.392 10 0 GGAEHN CC(C)C[C@H](N[C@@H](C)c1ccccc1Br)C(=O)NCCN(C)C ZINC000538545928 566520317 /nfs/dbraw/zinc/52/03/17/566520317.db2.gz BSFFQVBFEYHWHM-YOEHRIQHSA-N 0 3 384.362 3.192 10 0 GGAEHN Cc1cc(C)c(C(=O)N2CCOC3(CCN(C)CC3)C2)c(C)c1Br ZINC000627965933 566520788 /nfs/dbraw/zinc/52/07/88/566520788.db2.gz ISOYIUMCNKCDII-UHFFFAOYSA-N 0 3 395.341 3.311 10 0 GGAEHN O=C(NC[C@H]1CCCCN1CCO)N[C@H]1CCSc2ccc(Cl)cc21 ZINC000578417626 566520909 /nfs/dbraw/zinc/52/09/09/566520909.db2.gz LFQMEFXSXGTGRZ-ZBFHGGJFSA-N 0 3 383.945 3.023 10 0 GGAEHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ncsc1Br ZINC000512247743 566521690 /nfs/dbraw/zinc/52/16/90/566521690.db2.gz AKWIQOYQDHAKNW-UHFFFAOYSA-N 0 3 386.290 3.249 10 0 GGAEHN O[C@H](CNCc1ccc(I)cc1Cl)CC(F)(F)F ZINC000578436324 566522415 /nfs/dbraw/zinc/52/24/15/566522415.db2.gz MEOURKGHSUGGIK-VIFPVBQESA-N 0 3 393.574 3.348 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)[C@H]2CCOc3ccc(Br)cc32)CN1C1CC1 ZINC000651467188 566524834 /nfs/dbraw/zinc/52/48/34/566524834.db2.gz YAARTJYJTMIHDX-ZLDLUXBVSA-N 0 3 379.298 3.057 10 0 GGAEHN C[C@@H]1C[C@@H](NC(=O)[C@@H]2CCOc3ccc(Br)cc32)CN1C1CC1 ZINC000651467187 566525152 /nfs/dbraw/zinc/52/51/52/566525152.db2.gz YAARTJYJTMIHDX-UXIGCNINSA-N 0 3 379.298 3.057 10 0 GGAEHN O=C1C[C@H]([C@@H]2CCCCN2Cc2ccnc3c(Br)cccc23)CN1 ZINC000449040156 566525209 /nfs/dbraw/zinc/52/52/09/566525209.db2.gz GUXFJAKZXOEZGP-YOEHRIQHSA-N 0 3 388.309 3.488 10 0 GGAEHN O=C(CNC1CC(c2ccc(Br)cc2F)C1)NCc1ccco1 ZINC000449070579 566525376 /nfs/dbraw/zinc/52/53/76/566525376.db2.gz DHFVVLIKWBXUNQ-UHFFFAOYSA-N 0 3 381.245 3.333 10 0 GGAEHN CS(=O)(=O)CCCCN[C@@H]1CCCOc2ccc(Br)cc21 ZINC000424308777 566526890 /nfs/dbraw/zinc/52/68/90/566526890.db2.gz PDDJIXFUNLYRIQ-CQSZACIVSA-N 0 3 376.316 3.077 10 0 GGAEHN CNC(=O)[C@H](C)Oc1ccc(Br)cc1CNCCc1ccsc1 ZINC000449076252 566527316 /nfs/dbraw/zinc/52/73/16/566527316.db2.gz XBOOJBRHTWLZCV-LBPRGKRZSA-N 0 3 397.338 3.356 10 0 GGAEHN CCN(C(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)[C@H]1CCN(CC)C1 ZINC000628066654 566527229 /nfs/dbraw/zinc/52/72/29/566527229.db2.gz IKYCAZRXBMMQHU-LGRHPFTQSA-N 0 3 377.326 3.278 10 0 GGAEHN CC[C@H](Cn1cncn1)NCc1cc(Cl)cc(I)c1 ZINC000424292419 566527467 /nfs/dbraw/zinc/52/74/67/566527467.db2.gz MPRZZOFXURVVQU-CYBMUJFWSA-N 0 3 390.656 3.105 10 0 GGAEHN CNC(=O)[C@@H](C)Oc1ccc(Br)cc1CNCCc1ccsc1 ZINC000449076251 566527696 /nfs/dbraw/zinc/52/76/96/566527696.db2.gz XBOOJBRHTWLZCV-GFCCVEGCSA-N 0 3 397.338 3.356 10 0 GGAEHN C[C@@H](NCc1ccc(S(=O)(=O)N(C)C)cc1)c1ccc2ncsc2c1 ZINC000485823294 566529261 /nfs/dbraw/zinc/52/92/61/566529261.db2.gz PBQCAZJKJWSWAZ-CYBMUJFWSA-N 0 3 375.519 3.397 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNS(=O)(=O)Cc1ccccc1C(F)(F)F ZINC000603504273 566531091 /nfs/dbraw/zinc/53/10/91/566531091.db2.gz ZBKQVMRISZJFRR-ZIAGYGMSSA-N 0 3 378.460 3.388 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNS(=O)(=O)Cc1ccccc1C(F)(F)F ZINC000603504271 566531247 /nfs/dbraw/zinc/53/12/47/566531247.db2.gz ZBKQVMRISZJFRR-KBPBESRZSA-N 0 3 378.460 3.388 10 0 GGAEHN Cc1cc(CN)cc(NC(=O)N(CCO)Cc2cc(Br)cs2)c1 ZINC000424428215 566534209 /nfs/dbraw/zinc/53/42/09/566534209.db2.gz SAOXQEINLZNVPX-UHFFFAOYSA-N 0 3 398.326 3.304 10 0 GGAEHN CCOc1ccc(Br)cc1CN(C(=O)N[C@@H](C)CN(C)C)C1CC1 ZINC000512425796 566534319 /nfs/dbraw/zinc/53/43/19/566534319.db2.gz CFFQGJOBZWFNJU-ZDUSSCGKSA-N 0 3 398.345 3.472 10 0 GGAEHN CC[C@@H]1CN(C(=O)c2scc(Br)c2Br)C[C@H](C)N1 ZINC000628157337 566536122 /nfs/dbraw/zinc/53/61/22/566536122.db2.gz DJFJYMBSFOLHNC-JGVFFNPUSA-N 0 3 396.148 3.486 10 0 GGAEHN CN1CCC[C@@H](CNC(=O)NCCOCC(F)(F)F)[C@H]1c1cccs1 ZINC000465551977 566536251 /nfs/dbraw/zinc/53/62/51/566536251.db2.gz TZOSTEQTBHWTPS-JSGCOSHPSA-N 0 3 379.448 3.009 10 0 GGAEHN CC[C@@](C)(COc1ncccc1Cl)NCc1cccc(S(C)(=O)=O)c1 ZINC000449198156 566537129 /nfs/dbraw/zinc/53/71/29/566537129.db2.gz ACRZUWPMIXYHMV-SFHVURJKSA-N 0 3 382.913 3.476 10 0 GGAEHN C[C@H]1C[C@H](NC(=O)C(=O)Nc2cc(Cl)c(Cl)c(Cl)c2)CCN1C ZINC000651588168 566538541 /nfs/dbraw/zinc/53/85/41/566538541.db2.gz JUEUJZQBJQKVOS-DTWKUNHWSA-N 0 3 378.687 3.184 10 0 GGAEHN CN1CC[C@@H]2[C@@H](CCCN2S(=O)(=O)Cc2cc(Cl)sc2Cl)C1 ZINC000651607161 566540876 /nfs/dbraw/zinc/54/08/76/566540876.db2.gz FUHGVAXREVVCFW-CMPLNLGQSA-N 0 3 383.366 3.301 10 0 GGAEHN Cc1cc(CN(C)C2CCN(c3cnccn3)CC2)ncc1Br ZINC000628254935 566541005 /nfs/dbraw/zinc/54/10/05/566541005.db2.gz VINWWIAZOXZPOW-UHFFFAOYSA-N 0 3 376.302 3.043 10 0 GGAEHN CN1CCC[C@H]2CN(S(=O)(=O)Cc3cc(Cl)sc3Cl)CC[C@@H]21 ZINC000651604233 566541135 /nfs/dbraw/zinc/54/11/35/566541135.db2.gz UVACKHIAFXLSCK-JQWIXIFHSA-N 0 3 383.366 3.301 10 0 GGAEHN CCN1CC[C@H]2OCCN(Cc3ccc(Br)cc3SC)[C@H]2C1 ZINC000578660694 566542692 /nfs/dbraw/zinc/54/26/92/566542692.db2.gz RCXIFIFGJPIDQB-JKSUJKDBSA-N 0 3 385.371 3.466 10 0 GGAEHN C[C@@H]([NH2+]CC[N-]S(=O)(=O)c1cccc(Cl)c1Cl)C1CC(F)(F)C1 ZINC000628271743 566543129 /nfs/dbraw/zinc/54/31/29/566543129.db2.gz ONCWRUSVSVDBIZ-SECBINFHSA-N 0 3 387.279 3.295 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000465758073 566545316 /nfs/dbraw/zinc/54/53/16/566545316.db2.gz OXUDMYXDPQOIBZ-DZGCQCFKSA-N 0 3 382.302 3.056 10 0 GGAEHN O[C@H](CN[C@H]1CCOc2ccc(Br)cc21)COCc1ccccc1 ZINC000603948905 566546756 /nfs/dbraw/zinc/54/67/56/566546756.db2.gz ZMJDYVWOAUZCLO-AEFFLSMTSA-N 0 3 392.293 3.440 10 0 GGAEHN C[C@@H](CNC(=O)Cc1noc2ccc(Br)cc21)N1CCC(C)CC1 ZINC000424616711 566546981 /nfs/dbraw/zinc/54/69/81/566546981.db2.gz MUZYPCOJIHENCY-ZDUSSCGKSA-N 0 3 394.313 3.369 10 0 GGAEHN Brc1ccc(-c2n[nH]cc2CN2CC[C@H](Cn3ccnn3)C2)s1 ZINC000628336608 566549373 /nfs/dbraw/zinc/54/93/73/566549373.db2.gz LAHYKAIBCSKDEF-NSHDSACASA-N 0 3 393.314 3.014 10 0 GGAEHN CCN1CCC(N(C)C(=O)Cc2noc3ccc(Br)cc32)CC1 ZINC000424636330 566550255 /nfs/dbraw/zinc/55/02/55/566550255.db2.gz DATDQNJEIJKGDB-UHFFFAOYSA-N 0 3 380.286 3.076 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)NCCc1nc(C(F)(F)F)cs1 ZINC000465907528 566551885 /nfs/dbraw/zinc/55/18/85/566551885.db2.gz SUVFLVURYPRUJY-RYUDHWBXSA-N 0 3 378.464 3.267 10 0 GGAEHN C[C@@H](NC(=O)[C@@H]1CCOc2ccc(Br)cc21)C1=CCN(C)CC1 ZINC000651696287 566552965 /nfs/dbraw/zinc/55/29/65/566552965.db2.gz MJNWFPHZEVKNIX-IUODEOHRSA-N 0 3 379.298 3.082 10 0 GGAEHN O=S1(=O)C[C@@H](CNCc2ccc(Br)c(F)c2)c2ccccc21 ZINC000449355645 566553004 /nfs/dbraw/zinc/55/30/04/566553004.db2.gz BUDBYZCQXKGTMV-GFCCVEGCSA-N 0 3 384.270 3.249 10 0 GGAEHN C[C@H](NC(=O)[C@H]1CCOc2ccc(Br)cc21)C1=CCN(C)CC1 ZINC000651696289 566553185 /nfs/dbraw/zinc/55/31/85/566553185.db2.gz MJNWFPHZEVKNIX-WFASDCNBSA-N 0 3 379.298 3.082 10 0 GGAEHN C[C@H]1C[C@H](N2CCCC2)CN1S(=O)(=O)Cc1cc(Cl)sc1Cl ZINC000651701975 566553226 /nfs/dbraw/zinc/55/32/26/566553226.db2.gz GZPIIBFUMIAYJM-JQWIXIFHSA-N 0 3 383.366 3.443 10 0 GGAEHN COc1ncc(C(=O)Nc2ccc(C)cc2CN(C)C)cc1Br ZINC000424660952 566553552 /nfs/dbraw/zinc/55/35/52/566553552.db2.gz DOJHKUMYNPEPLO-UHFFFAOYSA-N 0 3 378.270 3.475 10 0 GGAEHN C[C@@H]1[C@H](N2CCCC2)CCN1S(=O)(=O)Cc1cc(Cl)sc1Cl ZINC000651705030 566553763 /nfs/dbraw/zinc/55/37/63/566553763.db2.gz DTBRPXSSNRORAU-ZYHUDNBSSA-N 0 3 383.366 3.443 10 0 GGAEHN CN(C)CCN(C(=O)Cc1noc2ccc(Br)cc21)C1CCCC1 ZINC000424652768 566553878 /nfs/dbraw/zinc/55/38/78/566553878.db2.gz FWYZUTFAHHCUOG-UHFFFAOYSA-N 0 3 394.313 3.466 10 0 GGAEHN COc1c(Br)ccc(C)c1C(=O)N1CCC[C@H](N2CCCC2)C1 ZINC000424658404 566554020 /nfs/dbraw/zinc/55/40/20/566554020.db2.gz GITDVJRAPYXPLX-AWEZNQCLSA-N 0 3 381.314 3.467 10 0 GGAEHN OC[C@]1(NCc2cnc(C3CC3)o2)CCc2cc(Br)ccc2C1 ZINC000628423805 566554803 /nfs/dbraw/zinc/55/48/03/566554803.db2.gz LFDXJCLGDGJWSG-SFHVURJKSA-N 0 3 377.282 3.324 10 0 GGAEHN O=C(Cc1noc2ccc(Br)cc21)N1CC[C@@H](N2CCCCC2)C1 ZINC000424666393 566555589 /nfs/dbraw/zinc/55/55/89/566555589.db2.gz SLGMBYXTHDCNLX-CQSZACIVSA-N 0 3 392.297 3.220 10 0 GGAEHN COC[C@@](C)(O)CCNCc1cc(Br)cc(Br)c1 ZINC000449383503 566555831 /nfs/dbraw/zinc/55/58/31/566555831.db2.gz HTPSQVFRJCGGQO-ZDUSSCGKSA-N 0 3 381.108 3.089 10 0 GGAEHN Cc1nccc(CN2CC[C@H](Cc3cccc(I)c3)C2)n1 ZINC000449390172 566556359 /nfs/dbraw/zinc/55/63/59/566556359.db2.gz FZAKUAFVNWNPTG-OAHLLOKOSA-N 0 3 393.272 3.454 10 0 GGAEHN COCCCN(C)CCNC(=O)N1CCC[C@@H]1c1ccc(Br)cc1 ZINC000466078459 566556757 /nfs/dbraw/zinc/55/67/57/566556757.db2.gz UHFSBSPMIAEGTR-QGZVFWFLSA-N 0 3 398.345 3.264 10 0 GGAEHN Cn1cncc1CN1CC[C@H](Cc2cccc(I)c2)C1 ZINC000449392580 566556743 /nfs/dbraw/zinc/55/67/43/566556743.db2.gz KLEHVEYRZFSVPG-CQSZACIVSA-N 0 3 381.261 3.089 10 0 GGAEHN OC[C@H](NC1CCC(O)(C(F)(F)F)CC1)c1ccc(Br)cc1 ZINC000539044380 566556711 /nfs/dbraw/zinc/55/67/11/566556711.db2.gz YIMUXAHLOXHXIO-MOKVOYLWSA-N 0 3 382.220 3.308 10 0 GGAEHN OC[C@]12CCC[C@H]1CN(Cc1cnn(-c3ccc(Br)cc3)c1)C2 ZINC000628460911 566556825 /nfs/dbraw/zinc/55/68/25/566556825.db2.gz ADWCRRVZUGPFCL-MAUKXSAKSA-N 0 3 376.298 3.229 10 0 GGAEHN CCC1(N2CCOCC2)CCN(Cc2c(F)cncc2Br)CC1 ZINC000628476548 566557363 /nfs/dbraw/zinc/55/73/63/566557363.db2.gz XTXKRDRXLXHLSX-UHFFFAOYSA-N 0 3 386.309 3.060 10 0 GGAEHN Nc1c(Br)cc(Br)cc1CNCC1=CCOCC1 ZINC000449403307 566558008 /nfs/dbraw/zinc/55/80/08/566558008.db2.gz PMMDBZKXUAZASA-UHFFFAOYSA-N 0 3 376.092 3.230 10 0 GGAEHN O[C@@H](CNC[C@H]1COc2ccccc2O1)COc1ccc(Cl)cc1Cl ZINC000559581207 566559185 /nfs/dbraw/zinc/55/91/85/566559185.db2.gz FVMKQVZYDVCMMQ-KBPBESRZSA-N 0 3 384.259 3.163 10 0 GGAEHN O[C@H](CNC[C@H]1COc2ccccc2O1)COc1ccc(Cl)cc1Cl ZINC000559581210 566559684 /nfs/dbraw/zinc/55/96/84/566559684.db2.gz FVMKQVZYDVCMMQ-KGLIPLIRSA-N 0 3 384.259 3.163 10 0 GGAEHN CN1C[C@@H](c2ccccc2)[C@H](CNS(=O)(=O)Cc2ccc(Cl)cc2)C1 ZINC000651755447 566559850 /nfs/dbraw/zinc/55/98/50/566559850.db2.gz OIDCMDCHCXJWMY-MJGOQNOKSA-N 0 3 378.925 3.105 10 0 GGAEHN CN(C)C[C@H](CNS(=O)(=O)C[C@@H]1CCCC1(F)F)c1ccc(Cl)cc1 ZINC000651764837 566560135 /nfs/dbraw/zinc/56/01/35/566560135.db2.gz QIHAOZCAWNOYEM-GJZGRUSLSA-N 0 3 394.915 3.340 10 0 GGAEHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1noc2ccc(Br)cc21 ZINC000424702088 566560246 /nfs/dbraw/zinc/56/02/46/566560246.db2.gz FJIQMVGPGRBTPC-KGLIPLIRSA-N 0 3 392.297 3.218 10 0 GGAEHN CC[C@H](N[C@@H](C)CC(=O)Nc1ccc(Br)cc1)[C@H](O)C(F)F ZINC000449427200 566560414 /nfs/dbraw/zinc/56/04/14/566560414.db2.gz WLLZUVIWNRJLFM-WFBYXXMGSA-N 0 3 379.245 3.160 10 0 GGAEHN CC[C@H](N[C@H](C)CC(=O)Nc1ccc(Br)cc1)[C@@H](O)C(F)F ZINC000449427198 566560580 /nfs/dbraw/zinc/56/05/80/566560580.db2.gz WLLZUVIWNRJLFM-LJWDBELGSA-N 0 3 379.245 3.160 10 0 GGAEHN CC[C@@H](NCc1cn(-c2ccc(Br)cc2)nc1C)[C@H](O)C(F)F ZINC000449421864 566560733 /nfs/dbraw/zinc/56/07/33/566560733.db2.gz JPEFBTUWPDWJAV-CABCVRRESA-N 0 3 388.256 3.437 10 0 GGAEHN COC(=O)[C@@H]1CCCCC[C@@H]1NCc1cn2ccc(Br)cc2n1 ZINC000449414072 566560967 /nfs/dbraw/zinc/56/09/67/566560967.db2.gz JJDAHWRRVAZFCU-CABCVRRESA-N 0 3 380.286 3.308 10 0 GGAEHN CC1(C)OCC[C@@H]1NCc1cc(Br)cc(Br)c1N ZINC000449415983 566561255 /nfs/dbraw/zinc/56/12/55/566561255.db2.gz QSJKFKFHQNGDJY-NSHDSACASA-N 0 3 378.108 3.451 10 0 GGAEHN CC[C@@H](NCc1cc(Br)c2c(c1)OCCCO2)[C@@H](O)C(F)F ZINC000449429448 566561910 /nfs/dbraw/zinc/56/19/10/566561910.db2.gz ZZZUHACFMFKTIZ-DGCLKSJQSA-N 0 3 380.229 3.105 10 0 GGAEHN O[C@@H]1C[C@H]([C@@H]2CCCOC2)N(CC2=Cc3cc(Br)ccc3OC2)C1 ZINC000449434739 566562480 /nfs/dbraw/zinc/56/24/80/566562480.db2.gz SHVFQELOUORYGK-ZTFGCOKTSA-N 0 3 394.309 3.087 10 0 GGAEHN CC[C@@H](NCc1cc(Br)c2c(c1)OCCCO2)[C@H](O)C(F)F ZINC000449429453 566562524 /nfs/dbraw/zinc/56/25/24/566562524.db2.gz ZZZUHACFMFKTIZ-YPMHNXCESA-N 0 3 380.229 3.105 10 0 GGAEHN CCOc1c(Br)cc(CN[C@@H](CC)[C@@H](O)C(F)F)cc1OC ZINC000449428407 566562910 /nfs/dbraw/zinc/56/29/10/566562910.db2.gz YIDGATVTOCMFGJ-WCQYABFASA-N 0 3 382.245 3.351 10 0 GGAEHN CN(C)CCn1cc(NC(=O)N[C@H]2COc3c2ccc(Cl)c3Cl)cn1 ZINC000673871045 566563844 /nfs/dbraw/zinc/56/38/44/566563844.db2.gz JKDPOAJLGHPBFX-ZDUSSCGKSA-N 0 3 384.267 3.007 10 0 GGAEHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2noc3ccc(Br)cc32)C1 ZINC000424737957 566564690 /nfs/dbraw/zinc/56/46/90/566564690.db2.gz LZBFAIZVVNINIP-BLLLJJGKSA-N 0 3 392.297 3.076 10 0 GGAEHN CS(=O)(=O)N[C@H]1CCCC[C@@H]1CNCc1csc(-c2ccccc2)n1 ZINC000512904670 566567468 /nfs/dbraw/zinc/56/74/68/566567468.db2.gz ZXPPHKCPKKDGOY-WBVHZDCISA-N 0 3 379.551 3.008 10 0 GGAEHN C[C@H]1OCC[C@@H]1N(CCO)Cc1ccc(Br)c(Br)c1 ZINC000449676931 566589459 /nfs/dbraw/zinc/58/94/59/566589459.db2.gz KLKHDOSCXRLMRP-YGRLFVJLSA-N 0 3 393.119 3.183 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)N[C@@H]1CCN(C)[C@H](C)C1)CC2 ZINC000539227826 566568716 /nfs/dbraw/zinc/56/87/16/566568716.db2.gz ZIACMAHRVSRNDW-CZUORRHYSA-N 0 3 380.330 3.308 10 0 GGAEHN Cn1cc(N2CCC[C@@H](N[C@@H]3CCc4sc(Br)cc43)C2)cn1 ZINC000559767259 566568667 /nfs/dbraw/zinc/56/86/67/566568667.db2.gz QMFZRJWLAOKCPR-BXUZGUMPSA-N 0 3 381.343 3.490 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cc(Br)c(C)s2)C[C@@H]1N1CCCC1 ZINC000424773895 566569449 /nfs/dbraw/zinc/56/94/49/566569449.db2.gz GSMOZNKLKDLCNA-GXTWGEPZSA-N 0 3 389.384 3.471 10 0 GGAEHN COc1ncc(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1Br ZINC000424785952 566569529 /nfs/dbraw/zinc/56/95/29/566569529.db2.gz SPAYLEUMGPKNKB-BLLLJJGKSA-N 0 3 392.297 3.274 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)N[C@H]1CCN(C)[C@@H](C)C1)CC2 ZINC000539227824 566569492 /nfs/dbraw/zinc/56/94/92/566569492.db2.gz ZIACMAHRVSRNDW-BBRMVZONSA-N 0 3 380.330 3.308 10 0 GGAEHN C[C@@H]1C[C@H](NCc2nn(C)cc2Br)CN(Cc2ccccc2)C1 ZINC000449483040 566569764 /nfs/dbraw/zinc/56/97/64/566569764.db2.gz FWEDJJRSWXJKJN-ZBFHGGJFSA-N 0 3 377.330 3.183 10 0 GGAEHN Cc1cccnc1CCNCc1ccc(Br)cc1N1CCOCC1 ZINC000449491061 566570127 /nfs/dbraw/zinc/57/01/27/566570127.db2.gz FAQOHRWAOVQEHW-UHFFFAOYSA-N 0 3 390.325 3.321 10 0 GGAEHN C[C@H](CNC(=O)N(C)[C@@H]1CCN(C2CC2)C1)Oc1ccc(Br)cc1 ZINC000466376882 566570440 /nfs/dbraw/zinc/57/04/40/566570440.db2.gz PGDRROAGCKWEGH-CZUORRHYSA-N 0 3 396.329 3.095 10 0 GGAEHN FC(F)(F)COc1cccc(CNCCn2cc(Br)cn2)c1 ZINC000512965737 566570515 /nfs/dbraw/zinc/57/05/15/566570515.db2.gz DCEWTYUTFOEWFA-UHFFFAOYSA-N 0 3 378.192 3.377 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@H]1CNCc1ccc(-c2ccccc2F)s1 ZINC000512976834 566570980 /nfs/dbraw/zinc/57/09/80/566570980.db2.gz BAZPJEGJXLEDES-AWEZNQCLSA-N 0 3 382.526 3.458 10 0 GGAEHN COc1ncc(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1Br ZINC000424785960 566571073 /nfs/dbraw/zinc/57/10/73/566571073.db2.gz SPAYLEUMGPKNKB-WBMJQRKESA-N 0 3 392.297 3.274 10 0 GGAEHN COc1ncc(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1Br ZINC000424785957 566571124 /nfs/dbraw/zinc/57/11/24/566571124.db2.gz SPAYLEUMGPKNKB-MLGOLLRUSA-N 0 3 392.297 3.274 10 0 GGAEHN CN(C[C@@H]1CCCN(C)C1)C(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000604644244 566571735 /nfs/dbraw/zinc/57/17/35/566571735.db2.gz ADDWLOQKSSQHBX-CJNGLKHVSA-N 0 3 396.329 3.256 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@@H]1CNCc1ccc(Br)c(Cl)c1 ZINC000512988005 566572017 /nfs/dbraw/zinc/57/20/17/566572017.db2.gz FLHAJNRIAJAMBR-GFCCVEGCSA-N 0 3 395.750 3.006 10 0 GGAEHN CN(C[C@H]1CCCN(C)C1)C(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000604644243 566572811 /nfs/dbraw/zinc/57/28/11/566572811.db2.gz ADDWLOQKSSQHBX-BBRMVZONSA-N 0 3 396.329 3.256 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@@H]1CNCc1cnc(-c2ccc(Cl)cc2)s1 ZINC000512995319 566573056 /nfs/dbraw/zinc/57/30/56/566573056.db2.gz ABNUDRCKHOWMGL-OAHLLOKOSA-N 0 3 399.969 3.367 10 0 GGAEHN COc1cc(Br)ccc1[C@H]1CCCN1C(=O)C1CCN(C)CC1 ZINC000628675542 566574206 /nfs/dbraw/zinc/57/42/06/566574206.db2.gz DACZFBRGQIMXSN-MRXNPFEDSA-N 0 3 381.314 3.463 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@H]1CNCc1ccc(-c2ccc(F)cc2)s1 ZINC000513033652 566574669 /nfs/dbraw/zinc/57/46/69/566574669.db2.gz XNCXVJGLSAKBNV-INIZCTEOSA-N 0 3 382.526 3.458 10 0 GGAEHN Cc1ccc(-c2ncc(CNC[C@H]3CCCCN3S(C)(=O)=O)s2)cc1 ZINC000513007138 566574849 /nfs/dbraw/zinc/57/48/49/566574849.db2.gz JSTURQHPTGOJMA-MRXNPFEDSA-N 0 3 379.551 3.022 10 0 GGAEHN C/C(=C/c1ccc(Cl)cc1)CNCCS(=O)(=O)NCc1ccccc1 ZINC000513019497 566574946 /nfs/dbraw/zinc/57/49/46/566574946.db2.gz DKHBYAUTYVSCNH-SSZFMOIBSA-N 0 3 378.925 3.453 10 0 GGAEHN C[C@@H]1CN(Cc2c(Br)cnn2C)CCN(Cc2ccccc2)C1 ZINC000449552610 566575486 /nfs/dbraw/zinc/57/54/86/566575486.db2.gz JWXKWONAQUOVHO-HNNXBMFYSA-N 0 3 377.330 3.137 10 0 GGAEHN O=C(c1cc(Cl)c[nH]1)N1CCC(NCc2cncc(Br)c2)CC1 ZINC000513041425 566576177 /nfs/dbraw/zinc/57/61/77/566576177.db2.gz PUUUDNPJKPMGKW-UHFFFAOYSA-N 0 3 397.704 3.220 10 0 GGAEHN CCCN(CCN1CCCC1)C(=O)Cc1noc2ccc(Br)cc21 ZINC000424832446 566576761 /nfs/dbraw/zinc/57/67/61/566576761.db2.gz IZKUHIRZGNZIOT-UHFFFAOYSA-N 0 3 394.313 3.467 10 0 GGAEHN COc1cc(Br)ccc1[C@@H]1CCCN1C(=O)CN1CC[C@H](C)C1 ZINC000628679237 566577412 /nfs/dbraw/zinc/57/74/12/566577412.db2.gz FEQOQWCKOUTVAN-BBRMVZONSA-N 0 3 381.314 3.463 10 0 GGAEHN CCCn1cc(CNC[C@H](CO)Cc2ccc(OC)c(Br)c2)cn1 ZINC000449596293 566578439 /nfs/dbraw/zinc/57/84/39/566578439.db2.gz AOFAKBYTCXGSLP-OAHLLOKOSA-N 0 3 396.329 3.005 10 0 GGAEHN CCCn1cc(CNC[C@@H](CO)Cc2ccc(OC)c(Br)c2)cn1 ZINC000449596292 566578828 /nfs/dbraw/zinc/57/88/28/566578828.db2.gz AOFAKBYTCXGSLP-HNNXBMFYSA-N 0 3 396.329 3.005 10 0 GGAEHN COc1c(Br)ccc(C)c1C(=O)N1CCN(C2CC2)C[C@@H](C)C1 ZINC000424852644 566579914 /nfs/dbraw/zinc/57/99/14/566579914.db2.gz OKMQJOFQHSLWRX-GFCCVEGCSA-N 0 3 381.314 3.322 10 0 GGAEHN COC(=O)C[C@@](C)(NCCN1CCCCC1)c1ccc(Br)cc1 ZINC000513116326 566580941 /nfs/dbraw/zinc/58/09/41/566580941.db2.gz CQYBLNBAMOATJL-GOSISDBHSA-N 0 3 383.330 3.303 10 0 GGAEHN CC(C)(C)C[C@@H]1C[C@H]1NCc1ccc(S(N)(=O)=O)c(Br)c1 ZINC000651979172 566580990 /nfs/dbraw/zinc/58/09/90/566580990.db2.gz AHGIDQLPCRSLFK-WCQYABFASA-N 0 3 375.332 3.011 10 0 GGAEHN COC(=O)C[C@@](C)(NCCn1nc(C)cc1C)c1ccc(Br)cc1 ZINC000513144763 566582666 /nfs/dbraw/zinc/58/26/66/566582666.db2.gz NINMUUNILKTBJH-GOSISDBHSA-N 0 3 394.313 3.331 10 0 GGAEHN COC(=O)C[C@](C)(NCCc1cccnc1)c1ccc(Br)cc1 ZINC000513133544 566582812 /nfs/dbraw/zinc/58/28/12/566582812.db2.gz KEZXPVYDDGOCRM-SFHVURJKSA-N 0 3 377.282 3.455 10 0 GGAEHN COC(=O)C[C@@](C)(NCCn1cc(C)cn1)c1ccc(Br)cc1 ZINC000513139276 566583794 /nfs/dbraw/zinc/58/37/94/566583794.db2.gz OUTTZTKMRQOWNF-QGZVFWFLSA-N 0 3 380.286 3.022 10 0 GGAEHN COc1ccc(CN2CCN(c3ccncc3OC)CC2)c(Br)c1 ZINC000579163391 566584818 /nfs/dbraw/zinc/58/48/18/566584818.db2.gz JJDGCTJZNYJVCU-UHFFFAOYSA-N 0 3 392.297 3.184 10 0 GGAEHN CN1CCC[C@@H](NC(=O)NCCOc2c(Cl)cc(Cl)cc2Cl)C1 ZINC000674327390 566585301 /nfs/dbraw/zinc/58/53/01/566585301.db2.gz DEOXSNQOSIFDDN-LLVKDONJSA-N 0 3 380.703 3.419 10 0 GGAEHN Cn1c(=O)ccc2c1CCC[C@H]2NCc1cc(Br)cc2c1OCC2 ZINC000652048055 566586094 /nfs/dbraw/zinc/58/60/94/566586094.db2.gz DQNBPVDXMCTTJD-MRXNPFEDSA-N 0 3 389.293 3.250 10 0 GGAEHN CN(c1nnc(CSc2ccc(Cl)cc2)n1C)[C@@H]1CCN(C2CC2)C1 ZINC000579175949 566586918 /nfs/dbraw/zinc/58/69/18/566586918.db2.gz XVGFXBSPYHPCNY-OAHLLOKOSA-N 0 3 377.945 3.434 10 0 GGAEHN COc1c(Br)cccc1CN[C@@H]1CCCc2c1ccc(=O)n2C ZINC000652049378 566587970 /nfs/dbraw/zinc/58/79/70/566587970.db2.gz GKBGCAOYFKXZKC-OAHLLOKOSA-N 0 3 377.282 3.324 10 0 GGAEHN C[C@@H]1OCC[C@@H]1N(CCO)Cc1cc(Br)cc(Br)c1 ZINC000449677123 566588682 /nfs/dbraw/zinc/58/86/82/566588682.db2.gz LQHJFYAHYDBHBU-HZMBPMFUSA-N 0 3 393.119 3.183 10 0 GGAEHN C[C@H]1OCC[C@H]1N(CCO)Cc1cc(Br)cc(Br)c1 ZINC000449677125 566589166 /nfs/dbraw/zinc/58/91/66/566589166.db2.gz LQHJFYAHYDBHBU-QMTHXVAHSA-N 0 3 393.119 3.183 10 0 GGAEHN C[C@H]1OCC[C@@H]1N(CCO)Cc1ccc(OC(F)F)c(Br)c1 ZINC000449677317 566589320 /nfs/dbraw/zinc/58/93/20/566589320.db2.gz MHTKWIKAWBWECF-MFKMUULPSA-N 0 3 380.229 3.022 10 0 GGAEHN C[C@H]1OCC[C@H]1N(CCO)Cc1cc(Br)cc(C(F)(F)F)c1 ZINC000449680971 566590501 /nfs/dbraw/zinc/59/05/01/566590501.db2.gz UZLBTCVRVLETFR-QMTHXVAHSA-N 0 3 382.220 3.440 10 0 GGAEHN C[C@@H]1OCC[C@H]1N(CCO)Cc1cc(Br)cc(C(F)(F)F)c1 ZINC000449680970 566591064 /nfs/dbraw/zinc/59/10/64/566591064.db2.gz UZLBTCVRVLETFR-IINYFYTJSA-N 0 3 382.220 3.440 10 0 GGAEHN Cc1ccc([O-])c(C[NH2+]C[C@H](CO)Cc2cccc(Br)c2C)n1 ZINC000449686981 566592606 /nfs/dbraw/zinc/59/26/06/566592606.db2.gz ZKGWRVPNPUKDHV-CQSZACIVSA-N 0 3 379.298 3.107 10 0 GGAEHN Cc1ccc([O-])c(C[NH2+]C[C@@H](CO)Cc2cccc(Br)c2C)n1 ZINC000449686980 566592682 /nfs/dbraw/zinc/59/26/82/566592682.db2.gz ZKGWRVPNPUKDHV-AWEZNQCLSA-N 0 3 379.298 3.107 10 0 GGAEHN O=C1CC[C@@H](N2CCN(Cc3sc4ccccc4c3Cl)CC2)CCN1 ZINC000449704035 566594083 /nfs/dbraw/zinc/59/40/83/566594083.db2.gz VCBVXUUELMZSJH-CQSZACIVSA-N 0 3 377.941 3.341 10 0 GGAEHN O=C1CC[C@H](N2CCN(Cc3sc4ccccc4c3Cl)CC2)CCN1 ZINC000449704032 566594193 /nfs/dbraw/zinc/59/41/93/566594193.db2.gz VCBVXUUELMZSJH-AWEZNQCLSA-N 0 3 377.941 3.341 10 0 GGAEHN CNC(=O)[C@@H](NCc1cc(Br)c(C)c(Br)c1)C(C)C ZINC000560071014 566595029 /nfs/dbraw/zinc/59/50/29/566595029.db2.gz FHJXZWVIRXUMBE-ZDUSSCGKSA-N 0 3 392.135 3.380 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCC1)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000628964325 566598434 /nfs/dbraw/zinc/59/84/34/566598434.db2.gz BNZPWPIFAHRUOC-PTKHLAPESA-N 0 3 389.337 3.468 10 0 GGAEHN COc1c(Br)ccc(F)c1C(=O)NC[C@@H]1CCN1C1CCCC1 ZINC000628966350 566599031 /nfs/dbraw/zinc/59/90/31/566599031.db2.gz PQJHYDCEYABRDR-LBPRGKRZSA-N 0 3 385.277 3.344 10 0 GGAEHN Cn1nc2cc(Br)ccc2c1C(=O)NC[C@@H]1CCN1C1CCCC1 ZINC000628966383 566599290 /nfs/dbraw/zinc/59/92/90/566599290.db2.gz RRAUHDZJPJZZCW-AWEZNQCLSA-N 0 3 391.313 3.083 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1cc(Cl)c(OC)c(Cl)c1 ZINC000605197547 566600238 /nfs/dbraw/zinc/60/02/38/566600238.db2.gz UILCYJUHGBHBEN-GFCCVEGCSA-N 0 3 376.284 3.234 10 0 GGAEHN C[C@@H](N[C@H]1C[C@@H](C(N)=O)C1)c1ccc(Br)cc1Br ZINC000652256509 566600574 /nfs/dbraw/zinc/60/05/74/566600574.db2.gz YMVINOVVOHCMHK-MRTMQBJTSA-N 0 3 376.092 3.126 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1cc(Cl)c(OC)c(Cl)c1 ZINC000605197548 566600614 /nfs/dbraw/zinc/60/06/14/566600614.db2.gz UILCYJUHGBHBEN-LBPRGKRZSA-N 0 3 376.284 3.234 10 0 GGAEHN CN1C[C@@H]2CCCN(C(=O)c3c(Cl)cc(F)cc3Br)[C@@H]2C1 ZINC000425070916 566601468 /nfs/dbraw/zinc/60/14/68/566601468.db2.gz XPGRXCIVRZIGRB-TVQRCGJNSA-N 0 3 375.669 3.408 10 0 GGAEHN CN1C[C@@H]2CCCN(C(=O)CSCc3cc(-c4cccs4)on3)[C@@H]2C1 ZINC000425060746 566602198 /nfs/dbraw/zinc/60/21/98/566602198.db2.gz WXEBWIIGDUDWQP-DZGCQCFKSA-N 0 3 377.535 3.189 10 0 GGAEHN CCc1ccc(S(=O)(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)s1 ZINC000486602515 566602478 /nfs/dbraw/zinc/60/24/78/566602478.db2.gz YLKVHKVFFPWKDK-NVXWUHKLSA-N 0 3 378.563 3.499 10 0 GGAEHN C[C@H]1COCC[C@@H]1C(=O)Nc1cc(Br)ccc1N(C)CCN(C)C ZINC000425097552 566603635 /nfs/dbraw/zinc/60/36/35/566603635.db2.gz IHHNCXWKPBZNBV-ZFWWWQNUSA-N 0 3 398.345 3.058 10 0 GGAEHN CN1CCC[C@]2(CCN(C(=O)[C@@H]3CCOc4ccc(Br)cc43)C2)C1 ZINC000652362142 566605508 /nfs/dbraw/zinc/60/55/08/566605508.db2.gz ZBGJHAYOICLENF-BEFAXECRSA-N 0 3 393.325 3.260 10 0 GGAEHN COC1CCC(CNCc2cn(-c3ccccc3Br)nn2)CC1 ZINC000579412699 566605828 /nfs/dbraw/zinc/60/58/28/566605828.db2.gz VSCQMXYLFYEDLT-UHFFFAOYSA-N 0 3 379.302 3.325 10 0 GGAEHN CN(C)[C@@H](CNc1cc(Br)cc(F)c1C(N)=O)c1ccsc1 ZINC000539843129 566606484 /nfs/dbraw/zinc/60/64/84/566606484.db2.gz VCYNARKEAGVQLP-ZDUSSCGKSA-N 0 3 386.290 3.463 10 0 GGAEHN CCN1CCN(Cc2ccc(CNC(=O)c3csc(Cl)c3)cc2)CC1 ZINC000466908616 566607440 /nfs/dbraw/zinc/60/74/40/566607440.db2.gz SKNQTJIJOMNRPG-UHFFFAOYSA-N 0 3 377.941 3.469 10 0 GGAEHN O=C1C[C@@H]([C@@H]2CCCCN2Cc2nc3ccc(Br)cc3o2)CN1 ZINC000579421482 566607560 /nfs/dbraw/zinc/60/75/60/566607560.db2.gz JTBWSXMVEREXSF-RISCZKNCSA-N 0 3 378.270 3.081 10 0 GGAEHN CNC(=O)[C@H](C)CN(C)Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000539858879 566608687 /nfs/dbraw/zinc/60/86/87/566608687.db2.gz MPUDZTLNWRWFDF-LLVKDONJSA-N 0 3 382.327 3.387 10 0 GGAEHN CN(C)CCOc1ccc(NC(=O)c2nscc2Br)cc1F ZINC000652435357 566609805 /nfs/dbraw/zinc/60/98/05/566609805.db2.gz CZHMFOZTUJGNSJ-UHFFFAOYSA-N 0 3 388.262 3.237 10 0 GGAEHN CC1(C)CCCN1CCNC(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000652426748 566610471 /nfs/dbraw/zinc/61/04/71/566610471.db2.gz JNVAMXYHTHGSNA-CQSZACIVSA-N 0 3 381.314 3.306 10 0 GGAEHN CC1(C)CCCN1CCNC(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000652426747 566610977 /nfs/dbraw/zinc/61/09/77/566610977.db2.gz JNVAMXYHTHGSNA-AWEZNQCLSA-N 0 3 381.314 3.306 10 0 GGAEHN O=C(NCCCN1CCC(O)CC1)c1cc(Br)cc2ccccc21 ZINC000605542752 566612330 /nfs/dbraw/zinc/61/23/30/566612330.db2.gz DVONHGRXELHIES-UHFFFAOYSA-N 0 3 391.309 3.179 10 0 GGAEHN CN1CCC[C@@H](NC(=O)NCc2cc(Cl)cc(Cl)c2OC(F)F)C1 ZINC000674929364 566618129 /nfs/dbraw/zinc/61/81/29/566618129.db2.gz RFEUUHKWJASTFM-LLVKDONJSA-N 0 3 382.238 3.488 10 0 GGAEHN CC[C@@H](CNC(=O)N[C@@H]1CCCN(C)C1)Cc1cccc(Br)c1 ZINC000605961577 566621717 /nfs/dbraw/zinc/62/17/17/566621717.db2.gz RYEGUHNOLUMTDD-RHSMWYFYSA-N 0 3 382.346 3.411 10 0 GGAEHN CN(C)Cc1ccc(NC(=O)[C@H]2CCCc3[nH]ncc32)cc1Br ZINC000467076643 566624441 /nfs/dbraw/zinc/62/44/41/566624441.db2.gz XAGMZCKCFQEKDG-ZDUSSCGKSA-N 0 3 377.286 3.292 10 0 GGAEHN C[S@@](=O)c1ccc(CN[C@H]2CCO[C@@H]2c2cncc(Br)c2)cc1 ZINC000486822901 566625893 /nfs/dbraw/zinc/62/58/93/566625893.db2.gz CBHJPQIJGZWNAQ-YGKZAACZSA-N 0 3 395.322 3.201 10 0 GGAEHN CC[C@@H](Cc1ccccc1Br)C(=O)NC[C@@H]1CCCN1CCOC ZINC000467097933 566625928 /nfs/dbraw/zinc/62/59/28/566625928.db2.gz TVDRZCKZKPTQEE-RDJZCZTQSA-N 0 3 397.357 3.245 10 0 GGAEHN Cc1ccc(CC(=O)NC2CCN(CCOC(C)C)CC2)c(Br)c1 ZINC000450031653 566626260 /nfs/dbraw/zinc/62/62/60/566626260.db2.gz HTJVKTGAVCLINM-UHFFFAOYSA-N 0 3 397.357 3.306 10 0 GGAEHN CN(C)[C@]1(CNC(=O)CCc2cccc(F)c2Br)CCSC1 ZINC000450039599 566627130 /nfs/dbraw/zinc/62/71/30/566627130.db2.gz FSWBURNPSCLCCA-INIZCTEOSA-N 0 3 389.334 3.074 10 0 GGAEHN CC[C@H](C)N[C@@H](CNC(=O)c1cnc(OC)c(Br)c1)c1ccco1 ZINC000425300268 566629469 /nfs/dbraw/zinc/62/94/69/566629469.db2.gz HASYAAXNWHDEFQ-FZMZJTMJSA-N 0 3 396.285 3.305 10 0 GGAEHN CC[C@H](C)N[C@H](CNC(=O)c1cnc(OC)c(Br)c1)c1ccco1 ZINC000425300271 566629924 /nfs/dbraw/zinc/62/99/24/566629924.db2.gz HASYAAXNWHDEFQ-SMDDNHRTSA-N 0 3 396.285 3.305 10 0 GGAEHN C[C@H](N[C@H](CO)c1ccc(Br)cc1)c1ccc(-n2cncn2)cc1 ZINC000540140927 566631047 /nfs/dbraw/zinc/63/10/47/566631047.db2.gz AXSIUDGISSZXRM-SCLBCKFNSA-N 0 3 387.281 3.414 10 0 GGAEHN CN(C)[C@]1(CNC(=O)c2c(Cl)cc(F)cc2Br)CCSC1 ZINC000450083356 566631670 /nfs/dbraw/zinc/63/16/70/566631670.db2.gz AELBXRGGZWYYSN-AWEZNQCLSA-N 0 3 395.725 3.409 10 0 GGAEHN O=C(c1ccsc1Br)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000450109222 566633663 /nfs/dbraw/zinc/63/36/63/566633663.db2.gz APSNUWNTYLJCRB-CYBMUJFWSA-N 0 3 387.343 3.228 10 0 GGAEHN CS[C@@H]1CC[C@H]1NCc1cccnc1Oc1cccc(S(C)(=O)=O)c1 ZINC000425345690 566633795 /nfs/dbraw/zinc/63/37/95/566633795.db2.gz JVBRRRRCYIPGGE-IAGOWNOFSA-N 0 3 378.519 3.261 10 0 GGAEHN CCNC(=O)N1CC[C@@H](N[C@@H]2CCc3c2cc(Cl)cc3Br)C1 ZINC000540165032 566634536 /nfs/dbraw/zinc/63/45/36/566634536.db2.gz WKRKCRGSEXTFIB-IAQYHMDHSA-N 0 3 386.721 3.483 10 0 GGAEHN CCNC(=O)N1CC[C@H](N[C@H]2CCc3c2cc(Cl)cc3Br)C1 ZINC000540165033 566634595 /nfs/dbraw/zinc/63/45/95/566634595.db2.gz WKRKCRGSEXTFIB-NHYWBVRUSA-N 0 3 386.721 3.483 10 0 GGAEHN CC[C@@H](CNCc1c(Br)cnn1C)N1CCc2ccccc2C1 ZINC000486925396 566636740 /nfs/dbraw/zinc/63/67/40/566636740.db2.gz FYADEMFHOQSACY-INIZCTEOSA-N 0 3 377.330 3.109 10 0 GGAEHN C[C@@H]1CN(CCCCNC(=O)Cc2sccc2Br)C[C@@H](C)O1 ZINC000450121979 566636989 /nfs/dbraw/zinc/63/69/89/566636989.db2.gz LXUMWJXOWHJWRF-CHWSQXEVSA-N 0 3 389.359 3.059 10 0 GGAEHN O[C@@H](CN(Cc1cccc(Br)c1)C1CCOCC1)C(F)(F)F ZINC000467296818 566637767 /nfs/dbraw/zinc/63/77/67/566637767.db2.gz AJEGXTKTMPHKPT-AWEZNQCLSA-N 0 3 382.220 3.353 10 0 GGAEHN CO[C@@H]1CN(C[C@@H](O)COc2ccc(Cl)cc2Br)CC[C@@H]1C ZINC000467294106 566638553 /nfs/dbraw/zinc/63/85/53/566638553.db2.gz TXLFGJBUYWGNAJ-NORZTCDRSA-N 0 3 392.721 3.199 10 0 GGAEHN COc1cccc([C@H](CNCc2c(Br)cnn2C)N2CCCC2)c1 ZINC000486956323 566638447 /nfs/dbraw/zinc/63/84/47/566638447.db2.gz NEPWMLQBBRDIMP-KRWDZBQOSA-N 0 3 393.329 3.118 10 0 GGAEHN CCN1CCN(c2ccc(NCc3c(Br)cnn3C)c(C)c2)CC1 ZINC000486937703 566638564 /nfs/dbraw/zinc/63/85/64/566638564.db2.gz LKZMSSRKKZFRID-UHFFFAOYSA-N 0 3 392.345 3.245 10 0 GGAEHN COC1(C[C@H](C)[NH2+]CC[N-]S(=O)(=O)c2cccc(Cl)c2Cl)CCC1 ZINC000560570402 566639160 /nfs/dbraw/zinc/63/91/60/566639160.db2.gz BSGWADXMBOZNCX-LBPRGKRZSA-N 0 3 395.352 3.209 10 0 GGAEHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1c(Cl)cc(F)cc1Br ZINC000450151280 566639200 /nfs/dbraw/zinc/63/92/00/566639200.db2.gz GGRNDDWEAUAFDP-OQPBUACISA-N 0 3 375.669 3.454 10 0 GGAEHN COc1ccccc1[C@H](CNCc1c(Br)cnn1C)N1CCCC1 ZINC000486968391 566639254 /nfs/dbraw/zinc/63/92/54/566639254.db2.gz JCGWVTKPILMVNH-INIZCTEOSA-N 0 3 393.329 3.118 10 0 GGAEHN O=C(CCOC1CNC1)Nc1cc(C(F)(F)F)ccc1SCC(F)F ZINC000579823526 566641485 /nfs/dbraw/zinc/64/14/85/566641485.db2.gz XCACRIVBPCOQTP-UHFFFAOYSA-N 0 3 384.370 3.380 10 0 GGAEHN CCCN(Cc1ccc(S(=O)(=O)N(C)C)s1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000425418367 566641730 /nfs/dbraw/zinc/64/17/30/566641730.db2.gz LOULXYDAYVOHLZ-DJIMGWMZSA-N 0 3 386.583 3.024 10 0 GGAEHN CCCN(Cc1ccc(S(=O)(=O)N(C)C)s1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000425418368 566641747 /nfs/dbraw/zinc/64/17/47/566641747.db2.gz LOULXYDAYVOHLZ-OIISXLGYSA-N 0 3 386.583 3.024 10 0 GGAEHN C[C@H]1CCN(CC(=O)N2CCC[C@@H]2c2ccc(I)cc2)C1 ZINC000579851485 566645113 /nfs/dbraw/zinc/64/51/13/566645113.db2.gz PBURIBVEKWVBPS-XJKSGUPXSA-N 0 3 398.288 3.297 10 0 GGAEHN Cc1c(Cl)cccc1S(=O)(=O)N1C[C@@H](CN(C)C)Oc2ccccc21 ZINC000675473314 566647663 /nfs/dbraw/zinc/64/76/63/566647663.db2.gz YIYDNIUHXITHCS-CQSZACIVSA-N 0 3 380.897 3.166 10 0 GGAEHN CN1CC[C@@H]2[C@H](CCCN2C(=O)CCc2cccc(F)c2Br)C1 ZINC000450234964 566647744 /nfs/dbraw/zinc/64/77/44/566647744.db2.gz TTWJVTKBQBMJDD-GDBMZVCRSA-N 0 3 383.305 3.464 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2c(C)cccc2Br)C[C@H]1N1CCCC1 ZINC000487092537 566648240 /nfs/dbraw/zinc/64/82/40/566648240.db2.gz AYFAGOVNDIUNPJ-HUUCEWRRSA-N 0 3 383.355 3.409 10 0 GGAEHN CN(C)C[C@H]1CN(C(=O)Cc2ccc(Br)s2)c2ccccc2O1 ZINC000675489696 566648844 /nfs/dbraw/zinc/64/88/44/566648844.db2.gz GSNIZJBKWCGUFQ-LBPRGKRZSA-N 0 3 395.322 3.409 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)NC[C@@H](C)N(C)C1CC1)CC2 ZINC000540383987 566649252 /nfs/dbraw/zinc/64/92/52/566649252.db2.gz PSIKFKOMAJBWGO-CYBMUJFWSA-N 0 3 380.330 3.308 10 0 GGAEHN CS[C@@H]1CN(C(=O)Cc2ccc(Br)s2)C[C@@H]1N1CCCC1 ZINC000487113620 566649367 /nfs/dbraw/zinc/64/93/67/566649367.db2.gz PFIOOOOFWRFEQD-QWHCGFSZSA-N 0 3 389.384 3.091 10 0 GGAEHN CS[C@H]1CN(C(=O)CCc2cccc(F)c2Br)C[C@H]1N(C)C ZINC000450267751 566650761 /nfs/dbraw/zinc/65/07/61/566650761.db2.gz XYXDHIADKSLPLX-KGLIPLIRSA-N 0 3 389.334 3.025 10 0 GGAEHN Cn1ncc(Br)c1CNC[C@@]1(Cc2ccc(F)cc2)CCC[C@@H]1O ZINC000487162274 566652260 /nfs/dbraw/zinc/65/22/60/566652260.db2.gz SEURCHBYNNYJPT-ROUUACIJSA-N 0 3 396.304 3.185 10 0 GGAEHN CCc1cc(NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)no1 ZINC000606958987 566652619 /nfs/dbraw/zinc/65/26/19/566652619.db2.gz LUDKQKFEYIBRRR-UHFFFAOYSA-N 0 3 395.301 3.017 10 0 GGAEHN Cc1ccc(C2(C(=O)NC[C@H]3CNCCO3)CCCCC2)c(Br)c1 ZINC000653163081 566653667 /nfs/dbraw/zinc/65/36/67/566653667.db2.gz GCOIJJDSJYIZFS-OAHLLOKOSA-N 0 3 395.341 3.064 10 0 GGAEHN N[C@@H]1Cc2ccccc2N(C(=O)[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000653165015 566653916 /nfs/dbraw/zinc/65/39/16/566653916.db2.gz CMMLLSYYFOVKBQ-HUUCEWRRSA-N 0 3 387.277 3.232 10 0 GGAEHN CCC1(N2CCOCC2)CCN(C(=O)Cc2ccc(Br)cc2)CC1 ZINC000629420378 566654692 /nfs/dbraw/zinc/65/46/92/566654692.db2.gz USFFAYHULKCUND-UHFFFAOYSA-N 0 3 395.341 3.095 10 0 GGAEHN CCC1(N2CCOCC2)CCN(C(=O)[C@@H]2SCCc3sccc32)CC1 ZINC000629418012 566654748 /nfs/dbraw/zinc/65/47/48/566654748.db2.gz LRYHCRNFYBVKNY-QGZVFWFLSA-N 0 3 380.579 3.182 10 0 GGAEHN COc1c(Br)ccc(C)c1C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21 ZINC000425552801 566654813 /nfs/dbraw/zinc/65/48/13/566654813.db2.gz RATLXQJFFQRYOL-ZFWWWQNUSA-N 0 3 381.314 3.322 10 0 GGAEHN CN(C)CCOc1cc(NC(=O)Cc2cscc2Br)ccn1 ZINC000450301219 566656006 /nfs/dbraw/zinc/65/60/06/566656006.db2.gz UKWJISIHFOSYOJ-UHFFFAOYSA-N 0 3 384.299 3.027 10 0 GGAEHN CCCN1CCC[C@@H]1C(=O)NCc1ccc(I)c(C)c1 ZINC000467637162 566657796 /nfs/dbraw/zinc/65/77/96/566657796.db2.gz BDTINDNRVIQIRV-OAHLLOKOSA-N 0 3 386.277 3.090 10 0 GGAEHN COc1ccc([C@H](C)NCCC2CCS(=O)(=O)CC2)c(Br)c1 ZINC000540607636 566660514 /nfs/dbraw/zinc/66/05/14/566660514.db2.gz VHZPSOVMVUHJCL-LBPRGKRZSA-N 0 3 390.343 3.323 10 0 GGAEHN CCCN1CCC[C@H]1C(=O)N[C@@H]1CCN(c2ccc(Br)cc2)C1 ZINC000487261465 566660825 /nfs/dbraw/zinc/66/08/25/566660825.db2.gz MKEJZZIQRGBUNE-WBVHZDCISA-N 0 3 380.330 3.018 10 0 GGAEHN Cn1ncc(Br)c1CNCC1(N2CCOC(C)(C)C2)CCCCC1 ZINC000487274332 566661082 /nfs/dbraw/zinc/66/10/82/566661082.db2.gz GEMQIYAGDKVWHN-UHFFFAOYSA-N 0 3 399.377 3.086 10 0 GGAEHN COc1ccc([C@@H](C)NCCC2CCS(=O)(=O)CC2)c(Br)c1 ZINC000540607619 566661255 /nfs/dbraw/zinc/66/12/55/566661255.db2.gz VHZPSOVMVUHJCL-GFCCVEGCSA-N 0 3 390.343 3.323 10 0 GGAEHN CC[C@H](CO)N1CCN(c2ccnc3cc(F)c(Br)cc32)CC1 ZINC000450359113 566661474 /nfs/dbraw/zinc/66/14/74/566661474.db2.gz DYYOWKSFPAQXMN-GFCCVEGCSA-N 0 3 382.277 3.029 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N1CCC[C@H]2CN(C)C[C@H]21 ZINC000425650169 566662022 /nfs/dbraw/zinc/66/20/22/566662022.db2.gz IZTASYOGZNCRAS-UKPHBRMFSA-N 0 3 380.330 3.116 10 0 GGAEHN Cn1ncc(Br)c1CNc1ccc(CCN2CCSCC2)cc1 ZINC000487293724 566662093 /nfs/dbraw/zinc/66/20/93/566662093.db2.gz JFNDNUBRXJVPBY-UHFFFAOYSA-N 0 3 395.370 3.386 10 0 GGAEHN COc1cc(CN2CCNC[C@](C)(F)C2)cc(Br)c1OC(F)F ZINC000514673242 566662438 /nfs/dbraw/zinc/66/24/38/566662438.db2.gz GYRVEAAFNIJGPS-HNNXBMFYSA-N 0 3 397.235 3.193 10 0 GGAEHN O=C1N[C@H](c2ccccc2Br)C(=O)N1C[C@@H]1CCN1C1CCCC1 ZINC000629488288 566662378 /nfs/dbraw/zinc/66/23/78/566662378.db2.gz YWYZEVYFXCVHNN-XJKSGUPXSA-N 0 3 392.297 3.059 10 0 GGAEHN COc1ccc(C(C)(C)CNCc2c(Br)cnn2C)cc1OC ZINC000487292129 566662481 /nfs/dbraw/zinc/66/24/81/566662481.db2.gz ADNVCDLVDIAURH-UHFFFAOYSA-N 0 3 382.302 3.267 10 0 GGAEHN Cc1ccc(-c2nsc(NC(=O)[C@]3(N)[C@@H]4CCCO[C@@H]4C3(C)C)n2)s1 ZINC000580071537 566663251 /nfs/dbraw/zinc/66/32/51/566663251.db2.gz WDJUSUHSIRUEMS-YOIRWDDOSA-N 0 3 378.523 3.046 10 0 GGAEHN FC(F)(F)c1cc(Br)cnc1N1CCN(C[C@H]2CCOC2)CC1 ZINC000450369633 566663536 /nfs/dbraw/zinc/66/35/36/566663536.db2.gz QXADSTSIKIBAHL-LLVKDONJSA-N 0 3 394.235 3.021 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)Nc2cnc3c(Br)cccn23)CCN1C ZINC000425669872 566664435 /nfs/dbraw/zinc/66/44/35/566664435.db2.gz DGEHWDYBXQYGHB-VXGBXAGGSA-N 0 3 380.290 3.043 10 0 GGAEHN CCCN(CC(F)(F)F)C(=O)CN1CCNC[C@H]1c1cccc(Cl)c1 ZINC000629531015 566664836 /nfs/dbraw/zinc/66/48/36/566664836.db2.gz XLQIEGCSWAPEBH-HNNXBMFYSA-N 0 3 377.838 3.087 10 0 GGAEHN CCS(=O)(=O)NCCN(C)[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000540675500 566665618 /nfs/dbraw/zinc/66/56/18/566665618.db2.gz KKDWZUVXWNNWCC-CVEARBPZSA-N 0 3 378.460 3.213 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1cc(Cl)ccc1OC(F)F ZINC000425688631 566668660 /nfs/dbraw/zinc/66/86/60/566668660.db2.gz CKQZRSGJXVLXPH-GFCCVEGCSA-N 0 3 377.819 3.174 10 0 GGAEHN CN(CCC(=O)N[C@H](CCO)c1cc(Cl)cc(Cl)c1)c1ccncc1 ZINC000629588378 566669436 /nfs/dbraw/zinc/66/94/36/566669436.db2.gz LHAVHUQHSQMGPB-QGZVFWFLSA-N 0 3 382.291 3.455 10 0 GGAEHN CN(CCC(=O)N[C@@H](CCO)c1cc(Cl)cc(Cl)c1)c1ccncc1 ZINC000629588377 566669454 /nfs/dbraw/zinc/66/94/54/566669454.db2.gz LHAVHUQHSQMGPB-KRWDZBQOSA-N 0 3 382.291 3.455 10 0 GGAEHN O[C@H](CNC[C@H](n1cccn1)C(F)(F)F)COc1ccc(Cl)c(Cl)c1 ZINC000629599095 566670971 /nfs/dbraw/zinc/67/09/71/566670971.db2.gz NBDCTYVDXXEJLB-YGRLFVJLSA-N 0 3 398.212 3.323 10 0 GGAEHN O[C@H](CN[C@@H]1CCCSc2ccc(Br)cc21)Cn1cccn1 ZINC000629593084 566671166 /nfs/dbraw/zinc/67/11/66/566671166.db2.gz DLEZOVZEXJTBNX-UKRRQHHQSA-N 0 3 382.327 3.223 10 0 GGAEHN O[C@H](CNC[C@@H](n1cccn1)C(F)(F)F)COc1c(Cl)cccc1Cl ZINC000629600804 566671287 /nfs/dbraw/zinc/67/12/87/566671287.db2.gz QZMIUXUDZPFQAG-ZWNOBZJWSA-N 0 3 398.212 3.323 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CCC[C@H]2CN(C)C[C@H]21 ZINC000425748315 566674437 /nfs/dbraw/zinc/67/44/37/566674437.db2.gz WCBCTXXHXYMVGE-DVOMOZLQSA-N 0 3 396.329 3.254 10 0 GGAEHN CO[C@@H](CCNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1)C(F)(F)F ZINC000514856609 566674959 /nfs/dbraw/zinc/67/49/59/566674959.db2.gz PRZHOOFHJPEYKK-HNNXBMFYSA-N 0 3 381.460 3.315 10 0 GGAEHN COc1ccccc1COC[C@H](O)CNCc1csc(C(F)(F)F)c1 ZINC000629615632 566675870 /nfs/dbraw/zinc/67/58/70/566675870.db2.gz WTSWQOFJPMPXQB-CQSZACIVSA-N 0 3 375.412 3.443 10 0 GGAEHN CCCN1CCC[C@H]1C(=O)NCCOc1ncc(C(F)(F)F)cc1Cl ZINC000607671937 566677488 /nfs/dbraw/zinc/67/74/88/566677488.db2.gz OGODYOGDAWQTEQ-ZDUSSCGKSA-N 0 3 379.810 3.123 10 0 GGAEHN CCOc1cc(CNCc2ccc(NC(N)=O)cc2)cc(Br)c1O ZINC000514927375 566679606 /nfs/dbraw/zinc/67/96/06/566679606.db2.gz MLVNLDXIVLWBMJ-UHFFFAOYSA-N 0 3 394.269 3.334 10 0 GGAEHN CCN(CC)CCN(C(=O)C[C@H](C)COC)c1ccc(Br)cn1 ZINC000514942144 566681473 /nfs/dbraw/zinc/68/14/73/566681473.db2.gz RZGUWRJTKVUZAO-AWEZNQCLSA-N 0 3 386.334 3.192 10 0 GGAEHN C[C@H](Cc1cccc(Br)c1)NC(=O)CCN(C)c1ccncc1 ZINC000540928393 566681748 /nfs/dbraw/zinc/68/17/48/566681748.db2.gz GHNFJVUANMCNQX-CQSZACIVSA-N 0 3 376.298 3.418 10 0 GGAEHN C[C@@H](Cc1cccc(Br)c1)NC(=O)CCN(C)c1ccncc1 ZINC000540928392 566681822 /nfs/dbraw/zinc/68/18/22/566681822.db2.gz GHNFJVUANMCNQX-AWEZNQCLSA-N 0 3 376.298 3.418 10 0 GGAEHN CN(CCOc1ccc(Br)cc1)C(=O)CCN(C)c1ccncc1 ZINC000540928789 566681924 /nfs/dbraw/zinc/68/19/24/566681924.db2.gz YXSVJAFWNLYVPH-UHFFFAOYSA-N 0 3 392.297 3.208 10 0 GGAEHN COCCN1CCC[C@@H](NC(=O)C[C@@H](C)c2ccc(Br)cc2)C1 ZINC000676275891 566683743 /nfs/dbraw/zinc/68/37/43/566683743.db2.gz USOHLEAIYUAWIB-RHSMWYFYSA-N 0 3 383.330 3.170 10 0 GGAEHN CN(CCC(=O)OC(C)(C)C)C[C@H](O)COc1c(Cl)cccc1Cl ZINC000468137776 566684180 /nfs/dbraw/zinc/68/41/80/566684180.db2.gz ZDVYQNCOSBYXTI-LBPRGKRZSA-N 0 3 378.296 3.397 10 0 GGAEHN CN(C)CCN(Cc1cccs1)C(=O)c1ccc(OCC(F)(F)F)o1 ZINC000653685984 566685700 /nfs/dbraw/zinc/68/57/00/566685700.db2.gz IASAVAISXMBBOQ-UHFFFAOYSA-N 0 3 376.400 3.486 10 0 GGAEHN NC(=O)[C@@H](N[C@H]1CCOC2(CCSCC2)C1)c1ccc(Br)cc1 ZINC000676348545 566686143 /nfs/dbraw/zinc/68/61/43/566686143.db2.gz NRNYJULCGFLOGG-GJZGRUSLSA-N 0 3 399.354 3.010 10 0 GGAEHN C/C(=C\c1cccc(C(F)(F)F)c1)CN[C@H]1CCCN(S(C)(=O)=O)C1 ZINC000580371769 566687554 /nfs/dbraw/zinc/68/75/54/566687554.db2.gz WEIZJHVOWZTFTQ-WQMJKPAKSA-N 0 3 376.444 3.122 10 0 GGAEHN CCCN1CCC(CNc2c(Br)cccc2S(C)(=O)=O)CC1 ZINC000580373408 566687938 /nfs/dbraw/zinc/68/79/38/566687938.db2.gz VECXNRUZAISNAF-UHFFFAOYSA-N 0 3 389.359 3.387 10 0 GGAEHN CC(=O)Nc1ccc(CNC[C@@H](O)COc2c(Cl)cccc2Cl)cc1 ZINC000515054871 566687934 /nfs/dbraw/zinc/68/79/34/566687934.db2.gz PGBQDCJKAJGUCK-OAHLLOKOSA-N 0 3 383.275 3.481 10 0 GGAEHN C/C(=C/c1cccc(C(F)(F)F)c1)CN[C@H]1CCCN(S(C)(=O)=O)C1 ZINC000580371767 566688294 /nfs/dbraw/zinc/68/82/94/566688294.db2.gz WEIZJHVOWZTFTQ-OVHOFWQVSA-N 0 3 376.444 3.122 10 0 GGAEHN OCCCN1CCC[C@@H]1CNc1ncc(Br)cc1C(F)(F)F ZINC000450600382 566688759 /nfs/dbraw/zinc/68/87/59/566688759.db2.gz VRDVESVEZWJNBS-LLVKDONJSA-N 0 3 382.224 3.122 10 0 GGAEHN OCCCN1CCC[C@H]1CNc1ncc(Br)cc1C(F)(F)F ZINC000450600384 566689059 /nfs/dbraw/zinc/68/90/59/566689059.db2.gz VRDVESVEZWJNBS-NSHDSACASA-N 0 3 382.224 3.122 10 0 GGAEHN Cc1nc2ccc(CN(C)[C@H](C)c3ccc(S(N)(=O)=O)cc3)cc2s1 ZINC000426043940 566689530 /nfs/dbraw/zinc/68/95/30/566689530.db2.gz QEOBHNCSTJRZRQ-GFCCVEGCSA-N 0 3 375.519 3.445 10 0 GGAEHN CC[C@@H](Cn1cncn1)NCc1ccc(I)c(Cl)c1 ZINC000561283562 566690266 /nfs/dbraw/zinc/69/02/66/566690266.db2.gz KJHKASBTMPYBFN-NSHDSACASA-N 0 3 390.656 3.105 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)Cc2ccccc2C(F)(F)F)[C@H](C)C1 ZINC000608027602 566692159 /nfs/dbraw/zinc/69/21/59/566692159.db2.gz NLMHJWDAGSVQII-CJNGLKHVSA-N 0 3 378.460 3.197 10 0 GGAEHN FC(F)(F)C1CCN(C2CC(Nc3ccncc3Br)C2)CC1 ZINC000561323904 566695060 /nfs/dbraw/zinc/69/50/60/566695060.db2.gz STGIPKAWWTXABX-UHFFFAOYSA-N 0 3 378.236 3.483 10 0 GGAEHN C[C@H](c1ncc(-c2ccc(Cl)cc2Cl)o1)N1CCN2C[C@H](O)C[C@H]2C1 ZINC000653829209 566695988 /nfs/dbraw/zinc/69/59/88/566695988.db2.gz CYNXCJALBCNLGH-KWCYVHTRSA-N 0 3 382.291 3.460 10 0 GGAEHN CC[C@@H](N[C@@H]1CCCN(S(=O)(=O)N(C)C)C1)c1ccc(Cl)c(Cl)c1 ZINC000561348735 566698771 /nfs/dbraw/zinc/69/87/71/566698771.db2.gz OVEFDONQWGOGSK-CZUORRHYSA-N 0 3 394.368 3.305 10 0 GGAEHN CC[C@H](N[C@@H]1CCCN(S(=O)(=O)N(C)C)C1)c1ccc(Cl)c(Cl)c1 ZINC000561348733 566698804 /nfs/dbraw/zinc/69/88/04/566698804.db2.gz OVEFDONQWGOGSK-CJNGLKHVSA-N 0 3 394.368 3.305 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3ccc(Br)cc3SC)[C@H]2C1 ZINC000653850924 566700126 /nfs/dbraw/zinc/70/01/26/566700126.db2.gz IQDITFXLPWLYBA-LSDHHAIUSA-N 0 3 399.354 3.106 10 0 GGAEHN CC[C@@H](NCCS(=O)(=O)c1ccc(Br)cc1)[C@@H]1CCCCO1 ZINC000653881960 566700715 /nfs/dbraw/zinc/70/07/15/566700715.db2.gz WYZNXBMBOOUMDR-CVEARBPZSA-N 0 3 390.343 3.160 10 0 GGAEHN CO[C@H](CCNC(=O)NC[C@@H](c1cccs1)N1CCCC1)C(F)(F)F ZINC000468428206 566701053 /nfs/dbraw/zinc/70/10/53/566701053.db2.gz PJVZTCZSFRBLHN-GXTWGEPZSA-N 0 3 379.448 3.152 10 0 GGAEHN OC1(CN2CCN(c3cc(Cl)c(Cl)c(Cl)c3)CC2)CCOCC1 ZINC000653882484 566701084 /nfs/dbraw/zinc/70/10/84/566701084.db2.gz IIXKXLRBTWICIL-UHFFFAOYSA-N 0 3 379.715 3.310 10 0 GGAEHN Cc1nc(S(=O)(=O)C(C)C(=O)N(Cc2ccccc2)C(C)C)sc1C ZINC000608098649 566703163 /nfs/dbraw/zinc/70/31/63/566703163.db2.gz FQQKXZFMJRGATQ-HNNXBMFYSA-N 0 3 380.535 3.359 10 0 GGAEHN CN1CC[C@@]2(CCN(C(=O)N[C@@H]3CCc4cc(Br)ccc43)C2)C1 ZINC000488018797 566704719 /nfs/dbraw/zinc/70/47/19/566704719.db2.gz UVZVDPIGPJPHRF-SJLPKXTDSA-N 0 3 378.314 3.174 10 0 GGAEHN C[C@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Br)cc1 ZINC000541230527 566705728 /nfs/dbraw/zinc/70/57/28/566705728.db2.gz XBJYZRYSBYADAG-XJKSGUPXSA-N 0 3 391.313 3.024 10 0 GGAEHN C[C@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Br)cc1 ZINC000541230524 566706724 /nfs/dbraw/zinc/70/67/24/566706724.db2.gz XBJYZRYSBYADAG-BBRMVZONSA-N 0 3 391.313 3.024 10 0 GGAEHN CCC(=O)N[C@H]1CCCN(CCCc2ccc(Br)cc2OC)C1 ZINC000541274437 566709617 /nfs/dbraw/zinc/70/96/17/566709617.db2.gz XMYLFZSDOMCCJN-INIZCTEOSA-N 0 3 383.330 3.381 10 0 GGAEHN CS[C@@H]1CN(C(=O)Cc2sccc2Br)C[C@@H]1N1CCCC1 ZINC000450837332 566710444 /nfs/dbraw/zinc/71/04/44/566710444.db2.gz CDTWMYQTBMTFMU-GXTWGEPZSA-N 0 3 389.384 3.091 10 0 GGAEHN CN(CCNS(=O)(=O)Cc1ccccc1Br)C1CCCCC1 ZINC000561500297 566710506 /nfs/dbraw/zinc/71/05/06/566710506.db2.gz MGZKCRZKEIMFDX-UHFFFAOYSA-N 0 3 389.359 3.133 10 0 GGAEHN CS(=O)(=O)c1ccc(CNC[C@H](O)CC2CCCC2)cc1C(F)(F)F ZINC000515415197 566711328 /nfs/dbraw/zinc/71/13/28/566711328.db2.gz NWFCCVZGLTWCEK-CQSZACIVSA-N 0 3 379.444 3.140 10 0 GGAEHN O[C@@H](CNCc1ccc(Br)cc1N1CCOCC1)CC1CCCC1 ZINC000515414139 566711719 /nfs/dbraw/zinc/71/17/19/566711719.db2.gz CODPUCHTGHNVGE-GOSISDBHSA-N 0 3 397.357 3.317 10 0 GGAEHN C[C@H](c1ccccc1)[C@H](O)CN(CCO)Cc1cc(Br)cs1 ZINC000450846415 566711896 /nfs/dbraw/zinc/71/18/96/566711896.db2.gz MPTOPNSCAALBFK-CXAGYDPISA-N 0 3 384.339 3.470 10 0 GGAEHN O=C(Nc1cnc2c(Br)cccn12)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000654084441 566715264 /nfs/dbraw/zinc/71/52/64/566715264.db2.gz SNYCUTABIPPAGO-KBPBESRZSA-N 0 3 392.301 3.235 10 0 GGAEHN Cc1ccc(Br)cc1CNC[C@H](O)COc1ccc2c(c1)OCO2 ZINC000580770215 566721492 /nfs/dbraw/zinc/72/14/92/566721492.db2.gz UEXLSUQQPICIAH-HNNXBMFYSA-N 0 3 394.265 3.016 10 0 GGAEHN O=C(Cc1noc2ccc(Br)cc12)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000654313610 566727599 /nfs/dbraw/zinc/72/75/99/566727599.db2.gz ATDYAONYIUJHEA-HOCLYGCPSA-N 0 3 392.297 3.266 10 0 GGAEHN O=C(Cc1noc2ccc(Br)cc12)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000654313611 566728098 /nfs/dbraw/zinc/72/80/98/566728098.db2.gz ATDYAONYIUJHEA-ZBFHGGJFSA-N 0 3 392.297 3.266 10 0 GGAEHN O=C(Cc1c(F)ccc(Br)c1F)N[C@H]1CCCN2CCCC[C@H]12 ZINC000654315861 566728110 /nfs/dbraw/zinc/72/81/10/566728110.db2.gz XCBSQGLPXWFRPK-LSDHHAIUSA-N 0 3 387.268 3.403 10 0 GGAEHN CN1CCC(N(Cc2ccccc2Br)C(=O)Cc2ccon2)CC1 ZINC000426783783 566728731 /nfs/dbraw/zinc/72/87/31/566728731.db2.gz NQTREKMJBWRELQ-UHFFFAOYSA-N 0 3 392.297 3.103 10 0 GGAEHN CCC[C@H](NC(=O)N1CCN2C[C@H](O)C[C@H]2C1)c1ccc(Cl)c(Cl)c1 ZINC000654411554 566732877 /nfs/dbraw/zinc/73/28/77/566732877.db2.gz JPBCNPRFOGBILI-VBQJREDUSA-N 0 3 386.323 3.295 10 0 GGAEHN C[C@H]1CCN(CC(=O)N2CCc3[nH]c4ccc(Br)cc4c3C2)C1 ZINC000654467909 566734169 /nfs/dbraw/zinc/73/41/69/566734169.db2.gz IMKPKMLSQMNYMW-LBPRGKRZSA-N 0 3 376.298 3.157 10 0 GGAEHN CCN(CC)CCN(C(=O)Cc1ccon1)c1cccc(Br)c1 ZINC000468827555 566734430 /nfs/dbraw/zinc/73/44/30/566734430.db2.gz FGFNFFYGAKSHMZ-UHFFFAOYSA-N 0 3 380.286 3.355 10 0 GGAEHN O=C(N[C@@H]1CSc2ccc(Br)cc21)N1CC[C@H](N2CC=CC2)C1 ZINC000426842649 566734784 /nfs/dbraw/zinc/73/47/84/566734784.db2.gz ICDUCYWOWJYSBU-DZGCQCFKSA-N 0 3 394.338 3.252 10 0 GGAEHN CN(C(=O)N[C@@H]1CSc2ccc(Br)cc21)[C@H]1CCN(C2CC2)C1 ZINC000426857232 566736246 /nfs/dbraw/zinc/73/62/46/566736246.db2.gz GQJHFVVCKIQJKZ-DZGCQCFKSA-N 0 3 396.354 3.474 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000654536459 566740209 /nfs/dbraw/zinc/74/02/09/566740209.db2.gz SQDMMJSIBXBGAH-HZPDHXFCSA-N 0 3 396.329 3.274 10 0 GGAEHN C[C@@H](C(=O)Nc1ccc(=O)n(CCN(C)C)c1)c1c(Cl)cccc1Cl ZINC000677327123 566741257 /nfs/dbraw/zinc/74/12/57/566741257.db2.gz ACXSDQBVAGJMBI-GFCCVEGCSA-N 0 3 382.291 3.459 10 0 GGAEHN CCN1CCC[C@H](NC(=O)Cn2c(C)c(Br)c3ccccc32)C1 ZINC000515976174 566741424 /nfs/dbraw/zinc/74/14/24/566741424.db2.gz WKAHIKCWVFKOOH-AWEZNQCLSA-N 0 3 378.314 3.313 10 0 GGAEHN CCOc1cc(C[NH2+][C@@H]2CCN(CC(F)(F)F)C2)cc(Br)c1[O-] ZINC000516006120 566742252 /nfs/dbraw/zinc/74/22/52/566742252.db2.gz WISQZDNTXQHVDA-LLVKDONJSA-N 0 3 397.235 3.280 10 0 GGAEHN CN(CCCNC(=O)c1c(F)cncc1Br)Cc1ccccc1 ZINC000630578058 566742302 /nfs/dbraw/zinc/74/23/02/566742302.db2.gz FKVADNIAQMRUAG-UHFFFAOYSA-N 0 3 380.261 3.235 10 0 GGAEHN O=C([C@@H]1[C@@H]2Cc3cc(Br)ccc3[C@@H]21)N1CCN(c2ccncc2)CC1 ZINC000630567500 566742979 /nfs/dbraw/zinc/74/29/79/566742979.db2.gz NOOJWJGPTGCFKJ-CEXWTWQISA-N 0 3 398.304 3.079 10 0 GGAEHN C[C@]1(c2cccc(Br)c2)C[C@H]1C(=O)NC1CCN(C2CC2)CC1 ZINC000630626407 566744516 /nfs/dbraw/zinc/74/45/16/566744516.db2.gz GAPCLWIHMMZPQP-PKOBYXMFSA-N 0 3 377.326 3.470 10 0 GGAEHN C[C@](CO)(NCCOc1cc(F)cc(Br)c1)c1cccc(O)c1 ZINC000581038481 566746022 /nfs/dbraw/zinc/74/60/22/566746022.db2.gz LFVAHVTZENXSBP-QGZVFWFLSA-N 0 3 384.245 3.170 10 0 GGAEHN C[C@H](CNC(=O)CSCc1ccc(Br)cc1F)N(C)C1CC1 ZINC000609025404 566746349 /nfs/dbraw/zinc/74/63/49/566746349.db2.gz HIUAEGRMTXYCFK-LLVKDONJSA-N 0 3 389.334 3.420 10 0 GGAEHN Cc1ccc(C(=O)N[C@@H](C)CN2CCCCC2)cc1I ZINC000609070536 566749282 /nfs/dbraw/zinc/74/92/82/566749282.db2.gz HWMYAFKUBWEOEA-ZDUSSCGKSA-N 0 3 386.277 3.204 10 0 GGAEHN O[C@H](CCNCc1cccc(Br)c1OC(F)F)C(F)(F)F ZINC000561980682 566754134 /nfs/dbraw/zinc/75/41/34/566754134.db2.gz VNGYUSDCNYENPJ-SECBINFHSA-N 0 3 378.135 3.453 10 0 GGAEHN COc1ccc(Br)cc1CN(C)C(=O)CCN(C)c1ccncc1 ZINC000541856503 566756002 /nfs/dbraw/zinc/75/60/02/566756002.db2.gz MVBQNXDPCXAMQY-UHFFFAOYSA-N 0 3 392.297 3.338 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000469047535 566756060 /nfs/dbraw/zinc/75/60/60/566756060.db2.gz RENISFGLGJQLQB-SWLSCSKDSA-N 0 3 396.329 3.397 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)Cc1cc(F)ccc1Br ZINC000516293590 566756893 /nfs/dbraw/zinc/75/68/93/566756893.db2.gz KKGYDKZJIRNVOG-KRWDZBQOSA-N 0 3 377.257 3.215 10 0 GGAEHN C[C@H](N[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1)C(=O)NCc1cccs1 ZINC000562049516 566760376 /nfs/dbraw/zinc/76/03/76/566760376.db2.gz URWABGXYPGMRGM-KKXDTOCCSA-N 0 3 377.941 3.441 10 0 GGAEHN C[C@H](N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1)C(=O)NCc1cccs1 ZINC000562049520 566760961 /nfs/dbraw/zinc/76/09/61/566760961.db2.gz URWABGXYPGMRGM-VHSSKADRSA-N 0 3 377.941 3.441 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)c1ccc(Oc2ccc(Br)cc2)nc1 ZINC000516398318 566761755 /nfs/dbraw/zinc/76/17/55/566761755.db2.gz YOBMEKLVRDUZOV-HNNXBMFYSA-N 0 3 390.281 3.460 10 0 GGAEHN O[C@@H](COc1ccc(Cl)cc1Br)CN1CC[C@H](C(F)F)C1 ZINC000677732226 566762005 /nfs/dbraw/zinc/76/20/05/566762005.db2.gz MRQGXGSSIBQQLW-GXSJLCMTSA-N 0 3 384.648 3.429 10 0 GGAEHN CCNC(=O)C[C@H]1CCCCN1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000581265804 566762293 /nfs/dbraw/zinc/76/22/93/566762293.db2.gz LAOUFKKXPWNUOD-KGLIPLIRSA-N 0 3 389.323 3.114 10 0 GGAEHN C[C@H]1CC[C@]2(CCN(Cc3cc(=O)n4cc(Br)ccc4n3)C2)C1 ZINC000541953844 566763046 /nfs/dbraw/zinc/76/30/46/566763046.db2.gz SUQNBJBSAQMASQ-UGSOOPFHSA-N 0 3 376.298 3.469 10 0 GGAEHN Cc1c(Br)csc1C(=O)NCC1(N2CCCC2)CCOCC1 ZINC000630935655 566764926 /nfs/dbraw/zinc/76/49/26/566764926.db2.gz NQNVASKGRUEMGM-UHFFFAOYSA-N 0 3 387.343 3.194 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)c1ccc(Sc2ccccc2Cl)nn1 ZINC000516569559 566768754 /nfs/dbraw/zinc/76/87/54/566768754.db2.gz SXRVPDPPOKZLAG-ZDUSSCGKSA-N 0 3 384.839 3.008 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@@H]1CCN(C)[C@@H](C)C1 ZINC000469189264 566768710 /nfs/dbraw/zinc/76/87/10/566768710.db2.gz ZQNVNRARPZVDGN-SGMGOOAPSA-N 0 3 384.318 3.301 10 0 GGAEHN Cc1cccc(CN(CCN(C)C)C(=O)c2cc[nH]c(=O)c2Br)c1 ZINC000469184037 566769250 /nfs/dbraw/zinc/76/92/50/566769250.db2.gz MSPPZDVKRLWAKE-UHFFFAOYSA-N 0 3 392.297 3.062 10 0 GGAEHN Cc1ncc(CNCCSCCOc2cccc(Br)c2)cn1 ZINC000609544886 566770637 /nfs/dbraw/zinc/77/06/37/566770637.db2.gz VQUZYLUSGZWPFF-UHFFFAOYSA-N 0 3 382.327 3.449 10 0 GGAEHN O=S(=O)(C1CCC(C(F)(F)F)CC1)N1CCCC[C@H](N2CCCC2)C1 ZINC000451177329 566771980 /nfs/dbraw/zinc/77/19/80/566771980.db2.gz VGKUNCLVDNQBDT-PCKAHOCUSA-N 0 3 382.492 3.388 10 0 GGAEHN Nc1ncccc1CN1CC[C@H](Cc2cccc(I)c2)C1 ZINC000451191116 566774002 /nfs/dbraw/zinc/77/40/02/566774002.db2.gz MDAJJOYPWMSGCD-CQSZACIVSA-N 0 3 393.272 3.333 10 0 GGAEHN COc1cccc(N2CC[C@@H](CNCc3ccncc3Br)C2)c1 ZINC000631061064 566775919 /nfs/dbraw/zinc/77/59/19/566775919.db2.gz GLOVFTCNMGCWCS-AWEZNQCLSA-N 0 3 376.298 3.469 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)N[C@H](C)c1ccc(Br)cc1OC ZINC000469265232 566776303 /nfs/dbraw/zinc/77/63/03/566776303.db2.gz CPFMDFRUDALWQV-TZMCWYRMSA-N 0 3 384.318 3.302 10 0 GGAEHN C[C@H](NCCOc1c(Cl)cccc1Cl)c1cccc(S(N)(=O)=O)c1 ZINC000542134648 566777185 /nfs/dbraw/zinc/77/71/85/566777185.db2.gz OKJLYMOAOSAJEQ-NSHDSACASA-N 0 3 389.304 3.370 10 0 GGAEHN CC[C@H](Cc1ccccc1Br)NCc1cn(C[C@H]2CCOC2)nn1 ZINC000631091562 566777368 /nfs/dbraw/zinc/77/73/68/566777368.db2.gz RWBBAFQWWWAINI-GDBMZVCRSA-N 0 3 393.329 3.188 10 0 GGAEHN O[C@@H](CNCc1ccc(C(F)F)nc1)COc1ccccc1Br ZINC000631092374 566777883 /nfs/dbraw/zinc/77/78/83/566777883.db2.gz XOXHSXYTVDOHQF-LBPRGKRZSA-N 0 3 387.224 3.311 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1cccc(Br)c1Cl ZINC000516744982 566779574 /nfs/dbraw/zinc/77/95/74/566779574.db2.gz MOSQLZILTHXREN-LLVKDONJSA-N 0 3 390.709 3.335 10 0 GGAEHN O=S1(=O)CCC(CCNCc2cccc(Br)c2Cl)CC1 ZINC000631103045 566779868 /nfs/dbraw/zinc/77/98/68/566779868.db2.gz CXZGGQDEMBXTNN-UHFFFAOYSA-N 0 3 380.735 3.407 10 0 GGAEHN COC(=O)[C@@H]1CCCCC[C@@H]1N[C@@H](C)C(=O)Nc1ccccc1Br ZINC000451234939 566780002 /nfs/dbraw/zinc/78/00/02/566780002.db2.gz MPTBMEXSHZNFCA-GUTXKFCHSA-N 0 3 397.313 3.488 10 0 GGAEHN CN(C)CCOc1cc(CNCc2ncc(Br)cc2Cl)ccn1 ZINC000631102352 566779935 /nfs/dbraw/zinc/77/99/35/566779935.db2.gz RKBAPCINYIQBDX-UHFFFAOYSA-N 0 3 399.720 3.123 10 0 GGAEHN Cc1nc2ccc(S(=O)(=O)N3CCCC[C@H](N4CCCC4)C3)cc2s1 ZINC000562333432 566781177 /nfs/dbraw/zinc/78/11/77/566781177.db2.gz DNKRSXUUUSWYRA-HNNXBMFYSA-N 0 3 379.551 3.244 10 0 GGAEHN C[NH+](C)[C@@H]1CCC[C@@H]([N-]S(=O)(=O)c2cccc(Br)c2Cl)C1 ZINC000516792249 566783931 /nfs/dbraw/zinc/78/39/31/566783931.db2.gz QQPZTBYNDWEONU-GHMZBOCLSA-N 0 3 395.750 3.254 10 0 GGAEHN COc1ccc(-c2nc(CNCCC3CCS(=O)(=O)CC3)cs2)cc1 ZINC000678156748 566785794 /nfs/dbraw/zinc/78/57/94/566785794.db2.gz JKWCWIIJFIVMPS-UHFFFAOYSA-N 0 3 380.535 3.123 10 0 GGAEHN O[C@H](COc1ccc(Br)cc1)CN1CCC(c2cccnc2)CC1 ZINC000678166927 566787615 /nfs/dbraw/zinc/78/76/15/566787615.db2.gz FDVPDNICXKUXAW-SFHVURJKSA-N 0 3 391.309 3.463 10 0 GGAEHN CC[C@H](Cc1ccc(Br)cc1)NCc1cn(C[C@@H]2CCOC2)nn1 ZINC000631176846 566787763 /nfs/dbraw/zinc/78/77/63/566787763.db2.gz HWXBCHPPDSUQKN-DOTOQJQBSA-N 0 3 393.329 3.188 10 0 GGAEHN C[C@@H](NC[C@@H]1CSc2ccccc2O1)c1cccc(NS(C)(=O)=O)c1 ZINC000516866572 566788167 /nfs/dbraw/zinc/78/81/67/566788167.db2.gz FENAYCZDSNFGSE-CZUORRHYSA-N 0 3 378.519 3.262 10 0 GGAEHN C[C@H](NC[C@@H]1CSc2ccccc2O1)c1cccc(NS(C)(=O)=O)c1 ZINC000516866573 566788322 /nfs/dbraw/zinc/78/83/22/566788322.db2.gz FENAYCZDSNFGSE-XJKSGUPXSA-N 0 3 378.519 3.262 10 0 GGAEHN C[C@H](NC[C@H]1CSc2ccccc2O1)c1cccc(NS(C)(=O)=O)c1 ZINC000516866570 566788549 /nfs/dbraw/zinc/78/85/49/566788549.db2.gz FENAYCZDSNFGSE-BBRMVZONSA-N 0 3 378.519 3.262 10 0 GGAEHN NS(=O)(=O)c1cc(CN[C@@H]2[C@H]3Cc4cc(Cl)ccc4[C@@H]23)ccc1Cl ZINC000631180889 566788976 /nfs/dbraw/zinc/78/89/76/566788976.db2.gz JNZSWXIXCCHWJJ-IAOVAPTHSA-N 0 3 383.300 3.069 10 0 GGAEHN CC[C@@H](Cc1ccc(Br)cc1)NCc1cn(C[C@H]2CCOC2)nn1 ZINC000631176853 566789243 /nfs/dbraw/zinc/78/92/43/566789243.db2.gz HWXBCHPPDSUQKN-WBVHZDCISA-N 0 3 393.329 3.188 10 0 GGAEHN CCC(C)(C)N1CCN(C(=O)c2cc(Br)cc3nc[nH]c32)CC1 ZINC000655270804 566790977 /nfs/dbraw/zinc/79/09/77/566790977.db2.gz KJJCYGZIZJJCIP-UHFFFAOYSA-N 0 3 379.302 3.272 10 0 GGAEHN C[C@@H](CC(=O)c1cccc(Br)c1)C(=O)NC[C@H]1C[C@@H](N(C)C)C1 ZINC000655247156 566791107 /nfs/dbraw/zinc/79/11/07/566791107.db2.gz UYCBBTFSHNPKEV-HEHGZKQESA-N 0 3 381.314 3.114 10 0 GGAEHN CCC(C)(C)N1CCN(C(=O)Cc2noc3ccc(Br)cc32)CC1 ZINC000655268987 566791173 /nfs/dbraw/zinc/79/11/73/566791173.db2.gz GORKUXQBTDMPIJ-UHFFFAOYSA-N 0 3 394.313 3.466 10 0 GGAEHN CCN(CC)CCN(CCC(F)(F)F)S(=O)(=O)C[C@@H]1CCCC1(F)F ZINC000451304668 566791942 /nfs/dbraw/zinc/79/19/42/566791942.db2.gz PCJWVPBPNUIVAF-ZDUSSCGKSA-N 0 3 394.450 3.348 10 0 GGAEHN COc1ccc(CNc2cnn(C3CC[NH+](C)CC3)c2)c(Br)c1[O-] ZINC000631226551 566792526 /nfs/dbraw/zinc/79/25/26/566792526.db2.gz WFCRWWDHMOYVCS-UHFFFAOYSA-N 0 3 395.301 3.239 10 0 GGAEHN Brc1cccc2c1C[C@@H]([NH2+]Cc1nnc(C3CCOCC3)[n-]1)CC2 ZINC000631214775 566793055 /nfs/dbraw/zinc/79/30/55/566793055.db2.gz YKQIQSBAKNHLAW-AWEZNQCLSA-N 0 3 391.313 3.108 10 0 GGAEHN Brc1cccc2c1C[C@@H](NCc1nnc(C3CCOCC3)[nH]1)CC2 ZINC000631214775 566793062 /nfs/dbraw/zinc/79/30/62/566793062.db2.gz YKQIQSBAKNHLAW-AWEZNQCLSA-N 0 3 391.313 3.108 10 0 GGAEHN C[C@H](CNC(=O)c1c(F)cncc1Br)N(C)Cc1ccccc1 ZINC000631221903 566793122 /nfs/dbraw/zinc/79/31/22/566793122.db2.gz MMKQNVSJRLFGHN-GFCCVEGCSA-N 0 3 380.261 3.234 10 0 GGAEHN CN1CCC(n2cc(NCc3cnc4ccc(Br)cn34)cn2)CC1 ZINC000631224944 566793743 /nfs/dbraw/zinc/79/37/43/566793743.db2.gz DBRRFUZVPXDXKB-UHFFFAOYSA-N 0 3 389.301 3.172 10 0 GGAEHN CCN(CC)CCN(C(=O)C[C@@H]1CCCO1)c1ccc(Br)cn1 ZINC000562451198 566793824 /nfs/dbraw/zinc/79/38/24/566793824.db2.gz BSCIQFZVMWBIKN-HNNXBMFYSA-N 0 3 384.318 3.088 10 0 GGAEHN CN(CCC(=O)N1CCOc2cccc(Br)c2C1)c1ccncc1 ZINC000655319305 566794073 /nfs/dbraw/zinc/79/40/73/566794073.db2.gz GVHPVZRFMABOCM-UHFFFAOYSA-N 0 3 390.281 3.092 10 0 GGAEHN O=C(N[C@@H]1CCCN2CCCC[C@@H]12)c1[nH]nc2ccc(Br)cc21 ZINC000655349299 566797221 /nfs/dbraw/zinc/79/72/21/566797221.db2.gz FRABAWRHCVWOKJ-CABCVRRESA-N 0 3 377.286 3.072 10 0 GGAEHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1c(F)cncc1Br ZINC000631314070 566798752 /nfs/dbraw/zinc/79/87/52/566798752.db2.gz WXQRNERTRRTWIW-CQSZACIVSA-N 0 3 392.272 3.378 10 0 GGAEHN CCCN1CCC(NS(=O)(=O)Cc2cccc(Br)c2C)CC1 ZINC000655467279 566801777 /nfs/dbraw/zinc/80/17/77/566801777.db2.gz MWMYQXBPGWVTEI-UHFFFAOYSA-N 0 3 389.359 3.051 10 0 GGAEHN Cc1cc(C(=O)N[C@@H](CN)C(F)(F)F)nn1-c1ccc(Cl)cc1Cl ZINC000655515041 566806138 /nfs/dbraw/zinc/80/61/38/566806138.db2.gz KCQDROZBGLBCOH-LBPRGKRZSA-N 0 3 381.185 3.107 10 0 GGAEHN NC[C@H](NC(=O)c1cnc(-c2ccc(C(F)(F)F)cc2)s1)C(F)(F)F ZINC000655512360 566806421 /nfs/dbraw/zinc/80/64/21/566806421.db2.gz FCTWJEZKCNYAKE-JTQLQIEISA-N 0 3 383.317 3.448 10 0 GGAEHN NC[C@H](NC(=O)c1cc(COc2c(Cl)cccc2Cl)on1)C(F)(F)F ZINC000655513129 566806641 /nfs/dbraw/zinc/80/66/41/566806641.db2.gz QBTLJYRHKMQASE-NSHDSACASA-N 0 3 398.168 3.180 10 0 GGAEHN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N[C@H](CN)C(F)(F)F ZINC000655515073 566806999 /nfs/dbraw/zinc/80/69/99/566806999.db2.gz WPGBQFNLHASFBY-LLVKDONJSA-N 0 3 393.818 3.303 10 0 GGAEHN O=C1[C@@H](N[C@H]2CCCc3ccc(Br)cc32)CCN1C1CCOCC1 ZINC000678595664 566806983 /nfs/dbraw/zinc/80/69/83/566806983.db2.gz WYYQRGUABHNGSA-ROUUACIJSA-N 0 3 393.325 3.196 10 0 GGAEHN O=C1[C@H](N[C@H]2CCCc3ccc(Br)cc32)CCN1C1CCOCC1 ZINC000678595665 566807883 /nfs/dbraw/zinc/80/78/83/566807883.db2.gz WYYQRGUABHNGSA-ZWKOTPCHSA-N 0 3 393.325 3.196 10 0 GGAEHN Cc1c(Br)cccc1CS(=O)(=O)N(C)[C@H]1CCN(C)[C@H](C)C1 ZINC000655524134 566808607 /nfs/dbraw/zinc/80/86/07/566808607.db2.gz UFNFOOYHIXGPAK-DOMZBBRYSA-N 0 3 389.359 3.002 10 0 GGAEHN CC(C)(C)[C@@H]1CCN(C[C@H](O)COc2cc(Cl)ccc2Cl)C[C@@H]1O ZINC000542547034 566810194 /nfs/dbraw/zinc/81/01/94/566810194.db2.gz SYOVKYNZYMLWPH-LZWOXQAQSA-N 0 3 376.324 3.462 10 0 GGAEHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1[C@@H]2c3ccc(Br)cc3C[C@H]12 ZINC000631676571 566814643 /nfs/dbraw/zinc/81/46/43/566814643.db2.gz AEKZKKNPKWZFRJ-UWAKZDDMSA-N 0 3 389.337 3.420 10 0 GGAEHN COc1cc(C[NH2+][C@H]2COc3ccc(F)cc3C2)cc(Br)c1[O-] ZINC000517259825 566815866 /nfs/dbraw/zinc/81/58/66/566815866.db2.gz RXWOGIDRTZWKPX-CYBMUJFWSA-N 0 3 382.229 3.396 10 0 GGAEHN CN(C)CCn1cc(NC(=O)Nc2cc(F)c(Br)c(F)c2)cn1 ZINC000678766928 566817470 /nfs/dbraw/zinc/81/74/70/566817470.db2.gz XNDQJHTXYARXRD-UHFFFAOYSA-N 0 3 388.216 3.129 10 0 GGAEHN CSCC[C@H](N[C@@H](C)Cc1ccc(Br)cc1F)C(=O)N(C)C ZINC000489910768 566817882 /nfs/dbraw/zinc/81/78/82/566817882.db2.gz XYKVWNNMYSWIGI-NHYWBVRUSA-N 0 3 391.350 3.319 10 0 GGAEHN O=S1(=O)CC[C@@H](N[C@H]2CCOC3(CCSCC3)C2)c2cc(F)ccc21 ZINC000678807264 566819387 /nfs/dbraw/zinc/81/93/87/566819387.db2.gz FPMLUCUIJXNMDG-GOEBONIOSA-N 0 3 385.526 3.079 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@H](C)c1ccc2[nH]c(=O)oc2c1 ZINC000631736959 566821460 /nfs/dbraw/zinc/82/14/60/566821460.db2.gz CNKPVDCKPQJGMR-GHMZBOCLSA-N 0 3 392.253 3.197 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)COc1ccc(Br)cc1F ZINC000517397393 566824368 /nfs/dbraw/zinc/82/43/68/566824368.db2.gz BQPQASNHHABALK-STQMWFEESA-N 0 3 387.293 3.346 10 0 GGAEHN Brc1ccn2cc(CNC3CCN(c4ccccn4)CC3)nc2c1 ZINC000582031994 566824457 /nfs/dbraw/zinc/82/44/57/566824457.db2.gz MACYOZVSZNETJC-UHFFFAOYSA-N 0 3 386.297 3.250 10 0 GGAEHN COCc1cc(CN[C@H](C)Cn2cc(Br)ccc2=O)ccc1F ZINC000428214785 566824841 /nfs/dbraw/zinc/82/48/41/566824841.db2.gz FYEYTDBDAOZZIO-GFCCVEGCSA-N 0 3 383.261 3.075 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@@H](CCCO)c1ccccc1 ZINC000428215993 566825886 /nfs/dbraw/zinc/82/58/86/566825886.db2.gz BBNJXIUULNMLGD-PBHICJAKSA-N 0 3 379.298 3.103 10 0 GGAEHN O=C(NC1CCN([C@@H]2CCOC2)CC1)c1oc2ccccc2c1Br ZINC000631801955 566826700 /nfs/dbraw/zinc/82/67/00/566826700.db2.gz XVCXWFNDVNYBGP-CYBMUJFWSA-N 0 3 393.281 3.178 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1cc(F)ccc1Br ZINC000517460112 566827656 /nfs/dbraw/zinc/82/76/56/566827656.db2.gz COFURZBHGZTXNX-OAHLLOKOSA-N 0 3 379.273 3.491 10 0 GGAEHN C[C@H](CC(=O)Nc1cccc(Br)c1)N[C@@H]1CCCn2nccc21 ZINC000631809533 566828388 /nfs/dbraw/zinc/82/83/88/566828388.db2.gz QHAFHCCMRFYLBB-IUODEOHRSA-N 0 3 377.286 3.487 10 0 GGAEHN CCN1CCC(NC(=O)C(=O)Nc2cc(Cl)c(Cl)c(Cl)c2)CC1 ZINC000582066468 566828429 /nfs/dbraw/zinc/82/84/29/566828429.db2.gz DSBOAIWYKBMMPT-UHFFFAOYSA-N 0 3 378.687 3.186 10 0 GGAEHN C[C@@H](CC(=O)Nc1cccc(Br)c1)N[C@@H]1CCCn2nccc21 ZINC000631809534 566828768 /nfs/dbraw/zinc/82/87/68/566828768.db2.gz QHAFHCCMRFYLBB-SWLSCSKDSA-N 0 3 377.286 3.487 10 0 GGAEHN O=C([C@@H]1SCCc2sccc21)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000469943744 566829073 /nfs/dbraw/zinc/82/90/73/566829073.db2.gz ITOSTPUUVULWEZ-CRAIPNDOSA-N 0 3 380.579 3.182 10 0 GGAEHN O=C([C@H]1SCCc2sccc21)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000469943746 566829101 /nfs/dbraw/zinc/82/91/01/566829101.db2.gz ITOSTPUUVULWEZ-QAPCUYQASA-N 0 3 380.579 3.182 10 0 GGAEHN C[C@H](CC(=O)Nc1ccc(Br)cc1)N[C@@H]1CCCn2nccc21 ZINC000631809310 566829405 /nfs/dbraw/zinc/82/94/05/566829405.db2.gz NLPSLWARSBEUJP-IUODEOHRSA-N 0 3 377.286 3.487 10 0 GGAEHN CC[C@H](C)N(C)CCNS(=O)(=O)c1c(C)cc(Br)cc1C ZINC000517528294 566830725 /nfs/dbraw/zinc/83/07/25/566830725.db2.gz XZCSQOUUMBEVSI-ZDUSSCGKSA-N 0 3 377.348 3.075 10 0 GGAEHN O=S(=O)(CCc1cccs1)NCc1ccccc1CN1CCCCC1 ZINC000428330269 566832588 /nfs/dbraw/zinc/83/25/88/566832588.db2.gz MRFWQYIRNNQSFB-UHFFFAOYSA-N 0 3 378.563 3.396 10 0 GGAEHN Brc1ccc2c(c1)[C@H](NC1CCN([C@H]3CCOC3)CC1)CCO2 ZINC000655701370 566835783 /nfs/dbraw/zinc/83/57/83/566835783.db2.gz TVUAKVLIXLNQMX-DOTOQJQBSA-N 0 3 381.314 3.116 10 0 GGAEHN Brc1ccc2c(c1)[C@@H](NC1CCN([C@@H]3CCOC3)CC1)CCO2 ZINC000655701573 566836336 /nfs/dbraw/zinc/83/63/36/566836336.db2.gz TVUAKVLIXLNQMX-WBVHZDCISA-N 0 3 381.314 3.116 10 0 GGAEHN CN(C)Cc1cccc(C(=O)Nc2cc(I)ccc2O)c1 ZINC000610491109 566836902 /nfs/dbraw/zinc/83/69/02/566836902.db2.gz SCNHTCVBATVMLW-UHFFFAOYSA-N 0 3 396.228 3.311 10 0 GGAEHN C[C@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)N1CCC[C@@H](C)C1 ZINC000517643361 566837369 /nfs/dbraw/zinc/83/73/69/566837369.db2.gz WXBZEPXPCSBTFQ-VXGBXAGGSA-N 0 3 379.302 3.176 10 0 GGAEHN CN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2csc(CCC(F)(F)F)n2)C1 ZINC000631951220 566837370 /nfs/dbraw/zinc/83/73/70/566837370.db2.gz ZOFVLYPPPKJCCL-JSGCOSHPSA-N 0 3 375.460 3.123 10 0 GGAEHN CC(C)(C)OC(=O)[C@H]1CCN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000610538598 566840560 /nfs/dbraw/zinc/84/05/60/566840560.db2.gz GGGXSQKMVITKJZ-QWHCGFSZSA-N 0 3 390.307 3.397 10 0 GGAEHN CN1CCN(CCNC(=O)N[C@H]2CCCc3sc(Cl)cc32)CC1(C)C ZINC000490323184 566844032 /nfs/dbraw/zinc/84/40/32/566844032.db2.gz RGJUOKMGFWJUJO-AWEZNQCLSA-N 0 3 384.977 3.104 10 0 GGAEHN CSC1(CNC(=O)[C@H]2CCc3cc(Br)ccc32)CCN(C)CC1 ZINC000582242745 566844510 /nfs/dbraw/zinc/84/45/10/566844510.db2.gz PJLJTGANTXIBPW-INIZCTEOSA-N 0 3 397.382 3.423 10 0 GGAEHN COC(=O)[C@@H]1CCCC[C@@H]1NCC(=O)Nc1ccc(Br)cc1C ZINC000451589200 566845263 /nfs/dbraw/zinc/84/52/63/566845263.db2.gz UTTHMERDWZKHAA-HIFRSBDPSA-N 0 3 383.286 3.017 10 0 GGAEHN C[C@H](N[C@@H]([C@@H](CO)C1CC1)C1CC1)C(=O)Nc1ccccc1Br ZINC000451585362 566845612 /nfs/dbraw/zinc/84/56/12/566845612.db2.gz DFCDAUGWQIAHPJ-PZSREKOKSA-N 0 3 381.314 3.163 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NCCOc1ccccc1Cl ZINC000428447524 566845718 /nfs/dbraw/zinc/84/57/18/566845718.db2.gz MJUQXLTWXVYGJI-GFCCVEGCSA-N 0 3 385.689 3.321 10 0 GGAEHN C[C@@H]1CC[C@H]([NH2+]CC[N-]S(=O)(=O)c2cccc(Cl)c2Cl)CS1 ZINC000655766271 566845740 /nfs/dbraw/zinc/84/57/40/566845740.db2.gz CCEOGSMKWVMVPP-MNOVXSKESA-N 0 3 383.366 3.145 10 0 GGAEHN COC(=O)[C@@H]1CCCC[C@@H]1NCCS(=O)(=O)c1cc(Cl)ccc1Cl ZINC000451590685 566846378 /nfs/dbraw/zinc/84/63/78/566846378.db2.gz CIWJLIWGZKVSGP-OCCSQVGLSA-N 0 3 394.320 3.089 10 0 GGAEHN COC(=O)[C@@H]1CCCC[C@@H]1N[C@H](C)C(=O)Nc1cccc(Br)c1 ZINC000451590529 566846851 /nfs/dbraw/zinc/84/68/51/566846851.db2.gz YQEOJKWUCAIVSB-DFBGVHRSSA-N 0 3 383.286 3.098 10 0 GGAEHN CC[C@@H](NCc1cn(-c2cccc(Br)c2)nc1C)[C@@H](O)C(F)F ZINC000655778201 566847528 /nfs/dbraw/zinc/84/75/28/566847528.db2.gz FAYBAWOTLUJDMP-HUUCEWRRSA-N 0 3 388.256 3.437 10 0 GGAEHN O=C1CCCN1CCCN[C@@H](c1ccc(Br)cc1)[C@H]1CCCO1 ZINC000679330093 566847641 /nfs/dbraw/zinc/84/76/41/566847641.db2.gz YDHFSGGQSXBARV-AEFFLSMTSA-N 0 3 381.314 3.271 10 0 GGAEHN COCC[C@H](COC)NCc1cn(-c2cccc(Br)c2)nc1C ZINC000655777418 566848134 /nfs/dbraw/zinc/84/81/34/566848134.db2.gz UNAFMPAADCCCIY-MRXNPFEDSA-N 0 3 382.302 3.084 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@H]1CCO[C@H](C)C1)c1ccc(Br)cn1 ZINC000517804249 566849427 /nfs/dbraw/zinc/84/94/27/566849427.db2.gz LDNCUWSUYLNIHN-CABCVRRESA-N 0 3 398.345 3.334 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1F)[NH2+]Cc1nnc([C@@H]2CCCO2)[n-]1 ZINC000655795853 566849498 /nfs/dbraw/zinc/84/94/98/566849498.db2.gz DFKMMHIYCCAAQR-HZMBPMFUSA-N 0 3 383.265 3.279 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1F)NCc1nc([C@@H]2CCCO2)n[nH]1 ZINC000655795853 566849502 /nfs/dbraw/zinc/84/95/02/566849502.db2.gz DFKMMHIYCCAAQR-HZMBPMFUSA-N 0 3 383.265 3.279 10 0 GGAEHN CC(C)N(CCn1nc2ccccn2c1=O)Cc1ccc(Br)cc1 ZINC000517860383 566850781 /nfs/dbraw/zinc/85/07/81/566850781.db2.gz ZRKRBJRNFSJXSZ-UHFFFAOYSA-N 0 3 389.297 3.169 10 0 GGAEHN COc1sc(CNC[C@H](C)N2C[C@@H](C)O[C@@H](C)C2)cc1Br ZINC000655823789 566851158 /nfs/dbraw/zinc/85/11/58/566851158.db2.gz MPONXIULCZPXCJ-SDDRHHMPSA-N 0 3 377.348 3.107 10 0 GGAEHN CCNC(=O)N1CC[C@H](N[C@@H](c2ccc(Br)cc2)[C@H]2CCCO2)C1 ZINC000679353515 566851348 /nfs/dbraw/zinc/85/13/48/566851348.db2.gz DUCCEASSZIDLSS-BBWFWOEESA-N 0 3 396.329 3.063 10 0 GGAEHN COc1ccc(OC)c(CNC[C@H](CO)Cc2ccccc2Br)c1 ZINC000428536476 566852746 /nfs/dbraw/zinc/85/27/46/566852746.db2.gz LSINICQQKRCIQV-CQSZACIVSA-N 0 3 394.309 3.407 10 0 GGAEHN COc1ccc(OC)c(CNC[C@@H](CO)Cc2ccccc2Br)c1 ZINC000428536473 566853096 /nfs/dbraw/zinc/85/30/96/566853096.db2.gz LSINICQQKRCIQV-AWEZNQCLSA-N 0 3 394.309 3.407 10 0 GGAEHN CN1CCC[C@@H](NC(=O)Nc2cc(I)ccc2Cl)C1 ZINC000610713575 566856810 /nfs/dbraw/zinc/85/68/10/566856810.db2.gz PZGMQMCLLURZBU-SNVBAGLBSA-N 0 3 393.656 3.160 10 0 GGAEHN O=C(Cc1ccc(Br)s1)Nc1cccc(CN2CC[C@H](O)C2)c1 ZINC000428551157 566856779 /nfs/dbraw/zinc/85/67/79/566856779.db2.gz JXWIFCMOYQMUIP-AWEZNQCLSA-N 0 3 395.322 3.258 10 0 GGAEHN O=C(Cc1ccc(Br)s1)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000428551160 566857025 /nfs/dbraw/zinc/85/70/25/566857025.db2.gz JXWIFCMOYQMUIP-CQSZACIVSA-N 0 3 395.322 3.258 10 0 GGAEHN NC[C@H](NC(=O)N(Cc1cc(Br)ccc1F)C1CC1)C(F)(F)F ZINC000655915525 566858618 /nfs/dbraw/zinc/85/86/18/566858618.db2.gz OEMWJAABSKJNJH-LBPRGKRZSA-N 0 3 398.198 3.152 10 0 GGAEHN CC[C@@H](NC(=O)N[C@H](CN)C(F)(F)F)c1cc(F)cc(Br)c1 ZINC000655923637 566858714 /nfs/dbraw/zinc/85/87/14/566858714.db2.gz ATDXGBCWSVWMCU-GHMZBOCLSA-N 0 3 386.187 3.228 10 0 GGAEHN NC[C@@H](NC(=O)NCC1(c2cccc(Br)c2)CCC1)C(F)(F)F ZINC000655913244 566858896 /nfs/dbraw/zinc/85/88/96/566858896.db2.gz FJJKNRLEODELKG-GFCCVEGCSA-N 0 3 394.235 3.060 10 0 GGAEHN NC[C@H](NC(=O)N1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1)C(F)(F)F ZINC000655921645 566858962 /nfs/dbraw/zinc/85/89/62/566858962.db2.gz PQSWECKVFAFAFD-CABZTGNLSA-N 0 3 386.201 3.046 10 0 GGAEHN NC[C@@H](NC(=O)N(Cc1cccc(Br)c1)C1CC1)C(F)(F)F ZINC000655912564 566859041 /nfs/dbraw/zinc/85/90/41/566859041.db2.gz ACPUDEZZHXVFMM-GFCCVEGCSA-N 0 3 380.208 3.013 10 0 GGAEHN NC[C@H](NC(=O)N1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1)C(F)(F)F ZINC000655921649 566859086 /nfs/dbraw/zinc/85/90/86/566859086.db2.gz PQSWECKVFAFAFD-SKDRFNHKSA-N 0 3 386.201 3.046 10 0 GGAEHN NC[C@H](NC(=O)N[C@H](c1cc(F)cc(Br)c1)C1CC1)C(F)(F)F ZINC000655924250 566859095 /nfs/dbraw/zinc/85/90/95/566859095.db2.gz IYPYAWKUKZKMKO-RYUDHWBXSA-N 0 3 398.198 3.228 10 0 GGAEHN NC[C@@H](NC(=O)N1CCC[C@H]1c1ccccc1Br)C(F)(F)F ZINC000655921708 566859217 /nfs/dbraw/zinc/85/92/17/566859217.db2.gz PBMFJTRQHCWOEC-NWDGAFQWSA-N 0 3 380.208 3.185 10 0 GGAEHN NC[C@H](NC(=O)N[C@@H](c1ccc(Br)cc1)C1CCC1)C(F)(F)F ZINC000655910749 566859744 /nfs/dbraw/zinc/85/97/44/566859744.db2.gz BMGVKQOEBYKOOD-QWHCGFSZSA-N 0 3 394.235 3.479 10 0 GGAEHN NC[C@@H](NC(=O)N1CCC[C@@H]1c1cccc(Br)c1)C(F)(F)F ZINC000655912563 566859817 /nfs/dbraw/zinc/85/98/17/566859817.db2.gz VXKGRTVMBGTYJV-VXGBXAGGSA-N 0 3 380.208 3.185 10 0 GGAEHN CCOc1cc(C[NH2+]CC2(O)Cc3ccccc3C2)cc(Br)c1[O-] ZINC000582406221 566860361 /nfs/dbraw/zinc/86/03/61/566860361.db2.gz ZOKRPZRCEPOBNA-UHFFFAOYSA-N 0 3 392.293 3.173 10 0 GGAEHN COCC[C@@H](NC(=O)N[C@@H](CN)C(F)(F)F)c1ccc(Cl)c(Cl)c1 ZINC000655930309 566860760 /nfs/dbraw/zinc/86/07/60/566860760.db2.gz MTJYNOJDFWCMLO-NEPJUHHUSA-N 0 3 388.217 3.260 10 0 GGAEHN CC[C@@H](Cc1ccccc1Br)N(C)C(=O)N[C@@H](CN)C(F)(F)F ZINC000655924610 566860782 /nfs/dbraw/zinc/86/07/82/566860782.db2.gz MUMKVARQBFKARW-AAEUAGOBSA-N 0 3 396.251 3.301 10 0 GGAEHN NC[C@@H](NC(=O)N1CCC[C@H]1c1cc(F)cc(Br)c1)C(F)(F)F ZINC000655924823 566860897 /nfs/dbraw/zinc/86/08/97/566860897.db2.gz QZRQLHDOICKEBP-NWDGAFQWSA-N 0 3 398.198 3.324 10 0 GGAEHN NC[C@H](NC(=O)N1CCC(c2ccccc2Br)CC1)C(F)(F)F ZINC000655929313 566861023 /nfs/dbraw/zinc/86/10/23/566861023.db2.gz SBBCJELUWXOLGG-ZDUSSCGKSA-N 0 3 394.235 3.228 10 0 GGAEHN CC[C@H]1Cc2c(Br)cccc2CN1C(=O)N[C@@H](CN)C(F)(F)F ZINC000655926013 566861194 /nfs/dbraw/zinc/86/11/94/566861194.db2.gz CGXQZJGWAPQGCM-GWCFXTLKSA-N 0 3 394.235 3.185 10 0 GGAEHN NC[C@H](NC(=O)NCC1(c2ccccc2Br)CCC1)C(F)(F)F ZINC000655927599 566861259 /nfs/dbraw/zinc/86/12/59/566861259.db2.gz PHVTXRWKXSYAKQ-LBPRGKRZSA-N 0 3 394.235 3.060 10 0 GGAEHN C[C@@H](CN(C)C(=O)N[C@H](CN)C(F)(F)F)Oc1ccc(Cl)c(Cl)c1 ZINC000655927956 566861274 /nfs/dbraw/zinc/86/12/74/566861274.db2.gz JVWFXHNITTWUTE-QPUJVOFHSA-N 0 3 388.217 3.292 10 0 GGAEHN NC[C@H](NC(=O)N1CCC[C@@H]1c1ccc(Br)c(F)c1)C(F)(F)F ZINC000655928541 566861368 /nfs/dbraw/zinc/86/13/68/566861368.db2.gz OILZLYDQPVIUAR-NEPJUHHUSA-N 0 3 398.198 3.324 10 0 GGAEHN NC[C@H](NC(=O)N1CCC[C@@H]1c1cc(F)cc(Br)c1)C(F)(F)F ZINC000655924822 566861604 /nfs/dbraw/zinc/86/16/04/566861604.db2.gz QZRQLHDOICKEBP-NEPJUHHUSA-N 0 3 398.198 3.324 10 0 GGAEHN Cc1cc([C@@H]2CCCN2C(=O)N[C@H](CN)C(F)(F)F)ccc1Br ZINC000655928483 566861630 /nfs/dbraw/zinc/86/16/30/566861630.db2.gz MVRAKNBNDDZFBH-QWHCGFSZSA-N 0 3 394.235 3.494 10 0 GGAEHN COCCC[C@@H](CNC(=O)N[C@@H](CN)C(F)(F)F)c1ccc(Cl)cc1 ZINC000655927774 566861746 /nfs/dbraw/zinc/86/17/46/566861746.db2.gz INTQBUSCSHBLQL-JSGCOSHPSA-N 0 3 381.826 3.039 10 0 GGAEHN CC[C@H]1Cc2c(Br)cccc2CN1C(=O)N[C@H](CN)C(F)(F)F ZINC000655926014 566861830 /nfs/dbraw/zinc/86/18/30/566861830.db2.gz CGXQZJGWAPQGCM-GXFFZTMASA-N 0 3 394.235 3.185 10 0 GGAEHN CCN(CC)CCN(C(=O)c1ccn(CC)n1)c1ccc(Br)cn1 ZINC000563218927 566864774 /nfs/dbraw/zinc/86/47/74/566864774.db2.gz WDMQZDBGWNHPSH-UHFFFAOYSA-N 0 3 394.317 3.049 10 0 GGAEHN CN1CCC[C@@H](N[C@@H]2CCCOc3ccc(I)cc32)C1 ZINC000610804148 566865537 /nfs/dbraw/zinc/86/55/37/566865537.db2.gz BGADAFGGPXHOEV-UKRRQHHQSA-N 0 3 386.277 3.189 10 0 GGAEHN Cc1nc(CSc2ccccc2C(=O)N[C@H]2CNCCC2(F)F)cs1 ZINC000563205945 566865758 /nfs/dbraw/zinc/86/57/58/566865758.db2.gz DTHXNMDXAHZOOK-HNNXBMFYSA-N 0 3 383.489 3.471 10 0 GGAEHN COc1cc(Br)ccc1CN1CCCN(C[C@H]2CCCO2)CC1 ZINC000679770801 566873240 /nfs/dbraw/zinc/87/32/40/566873240.db2.gz QAGPCDQQDCZTEF-QGZVFWFLSA-N 0 3 383.330 3.144 10 0 GGAEHN CCCOc1ccc(Br)cc1CNC[C@H]1CCCN1CCOC ZINC000518279315 566873420 /nfs/dbraw/zinc/87/34/20/566873420.db2.gz NPESXUZUCDQJAI-QGZVFWFLSA-N 0 3 385.346 3.438 10 0 GGAEHN C[C@H]1COCCN1C1CCN(Cc2nc3cc(Br)ccc3[nH]2)CC1 ZINC000563362547 566878239 /nfs/dbraw/zinc/87/82/39/566878239.db2.gz BOPCXSOOZVZHGH-ZDUSSCGKSA-N 0 3 393.329 3.011 10 0 GGAEHN C[C@H]1COCCN1C1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000563362547 566878242 /nfs/dbraw/zinc/87/82/42/566878242.db2.gz BOPCXSOOZVZHGH-ZDUSSCGKSA-N 0 3 393.329 3.011 10 0 GGAEHN COc1ccc(CCC(=O)N(C)[C@@H]2CCN(C3CC3)C2)cc1Br ZINC000518364437 566878670 /nfs/dbraw/zinc/87/86/70/566878670.db2.gz AYVROVFXHCLQPS-OAHLLOKOSA-N 0 3 381.314 3.085 10 0 GGAEHN CC(C)OCCN1CCC(NC(=O)N2CCc3sc(Cl)cc3C2)CC1 ZINC000518369087 566879012 /nfs/dbraw/zinc/87/90/12/566879012.db2.gz ZKONGVLRSLFDRP-UHFFFAOYSA-N 0 3 385.961 3.359 10 0 GGAEHN CC[C@H]1CCC[C@H](CNCc2ccc(S(=O)(=O)N3CCOCC3)s2)C1 ZINC000543413260 566879304 /nfs/dbraw/zinc/87/93/04/566879304.db2.gz CHSIILDNWQSQSP-HOTGVXAUSA-N 0 3 386.583 3.075 10 0 GGAEHN CC[C@H]1CCC[C@@H](CNCc2ccc(S(=O)(=O)N3CCOCC3)s2)C1 ZINC000543413262 566879417 /nfs/dbraw/zinc/87/94/17/566879417.db2.gz CHSIILDNWQSQSP-JKSUJKDBSA-N 0 3 386.583 3.075 10 0 GGAEHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ncsc1Br ZINC000563381708 566879473 /nfs/dbraw/zinc/87/94/73/566879473.db2.gz XFQLBOQJSBKICT-UHFFFAOYSA-N 0 3 396.310 3.115 10 0 GGAEHN Cc1ccnc([C@H]2CCN(C[C@@H](O)COc3ccc(Br)cc3)C2)c1 ZINC000563365901 566879611 /nfs/dbraw/zinc/87/96/11/566879611.db2.gz FMPFARQUZHDUPX-DOTOQJQBSA-N 0 3 391.309 3.382 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1F)NC[C@@H]1CCCCS1(=O)=O ZINC000543427321 566880012 /nfs/dbraw/zinc/88/00/12/566880012.db2.gz YGCBSRDRNWXMGE-FZMZJTMJSA-N 0 3 378.307 3.076 10 0 GGAEHN COc1ccc(Br)c2[nH]c(C(=O)N(C)[C@@H]3CCN(C4CC4)C3)cc21 ZINC000518428813 566882737 /nfs/dbraw/zinc/88/27/37/566882737.db2.gz XYOQLGZFHCNTTG-GFCCVEGCSA-N 0 3 392.297 3.248 10 0 GGAEHN Brc1ccc(OCCNCc2cnnn2Cc2ccccc2)cc1 ZINC000490890388 566884816 /nfs/dbraw/zinc/88/48/16/566884816.db2.gz YBLREBQHAWSXEM-UHFFFAOYSA-N 0 3 387.281 3.258 10 0 GGAEHN O[C@H](CNCCSCCOc1cccc(Br)c1)C(F)(F)F ZINC000518519148 566888623 /nfs/dbraw/zinc/88/86/23/566888623.db2.gz NNBOSDHWOWETDK-GFCCVEGCSA-N 0 3 388.249 3.074 10 0 GGAEHN CN(C)CCN(Cc1cccs1)C(=O)NC1CCC(OC(F)F)CC1 ZINC000656239681 566888680 /nfs/dbraw/zinc/88/86/80/566888680.db2.gz MYCIJZAOQHNNHF-UHFFFAOYSA-N 0 3 375.485 3.372 10 0 GGAEHN C[C@@H](NC(=O)N1CCc2ccccc2[C@H]1CN)c1ccc(Br)cn1 ZINC000582723987 566889558 /nfs/dbraw/zinc/88/95/58/566889558.db2.gz XBQHNVBYAZRPMR-SJKOYZFVSA-N 0 3 389.297 3.173 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1CCCC[C@@H]1CC(N)=O ZINC000656251098 566890566 /nfs/dbraw/zinc/89/05/66/566890566.db2.gz GVYOXCAMKLUEHS-OAHLLOKOSA-N 0 3 391.313 3.173 10 0 GGAEHN C[C@@H](NC(=O)c1c(F)cncc1Br)[C@@H](c1ccccc1)N(C)C ZINC000632517329 566892104 /nfs/dbraw/zinc/89/21/04/566892104.db2.gz IDWRIAFNMKPTPP-BZNIZROVSA-N 0 3 380.261 3.404 10 0 GGAEHN CCN(CC)CCN(C(=O)c1cc(C)on1)c1ccc(Br)cn1 ZINC000563539618 566892517 /nfs/dbraw/zinc/89/25/17/566892517.db2.gz UFEGAYZMXXDCQO-UHFFFAOYSA-N 0 3 381.274 3.129 10 0 GGAEHN C[C@@](CO)(NCCN1CCc2ccccc21)c1ccc(Br)cc1 ZINC000428973308 566892689 /nfs/dbraw/zinc/89/26/89/566892689.db2.gz CVDIFXYAVFIWIP-IBGZPJMESA-N 0 3 375.310 3.309 10 0 GGAEHN COCC1(CCNCc2c(F)ccc(I)c2F)CC1 ZINC000582784842 566892708 /nfs/dbraw/zinc/89/27/08/566892708.db2.gz KVZVHWMELVIQGU-UHFFFAOYSA-N 0 3 381.204 3.476 10 0 GGAEHN C[C@](CO)(NCCN1CCc2ccccc21)c1ccc(Br)cc1 ZINC000428973311 566892917 /nfs/dbraw/zinc/89/29/17/566892917.db2.gz CVDIFXYAVFIWIP-LJQANCHMSA-N 0 3 375.310 3.309 10 0 GGAEHN O=C(NCc1cc(F)cc(Br)c1)N1CC[C@@H](N2CCCCC2)C1 ZINC000518591336 566893189 /nfs/dbraw/zinc/89/31/89/566893189.db2.gz DMYSLPCFGQJTPE-MRXNPFEDSA-N 0 3 384.293 3.358 10 0 GGAEHN COc1cc(S(=O)(=O)N[C@H](C)[C@H]2CCCN(C3CCC3)C2)ccc1Cl ZINC000563539930 566893200 /nfs/dbraw/zinc/89/32/00/566893200.db2.gz DWNLYWMQUKIKBI-KGLIPLIRSA-N 0 3 386.945 3.280 10 0 GGAEHN CCN(CC)CCN(C(=O)Cc1cccnc1)c1ccc(Br)cn1 ZINC000563538897 566893234 /nfs/dbraw/zinc/89/32/34/566893234.db2.gz KWBQDTQECZOPMC-UHFFFAOYSA-N 0 3 391.313 3.157 10 0 GGAEHN C[C@H](NCc1cc(Cl)cc(S(N)(=O)=O)c1)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000563539780 566893867 /nfs/dbraw/zinc/89/38/67/566893867.db2.gz WSUPNFREJCPKMW-OAVHHTNSSA-N 0 3 380.897 3.030 10 0 GGAEHN Cc1cc(Br)cc(C)c1CNC(=O)N[C@H]1C[C@H](C)N(C2CC2)C1 ZINC000428969420 566893850 /nfs/dbraw/zinc/89/38/50/566893850.db2.gz RKJHAOCOOWXASG-ZFWWWQNUSA-N 0 3 380.330 3.490 10 0 GGAEHN COCC1(N(C)CCCOc2cccc(I)c2)CC1 ZINC000611178498 566896559 /nfs/dbraw/zinc/89/65/59/566896559.db2.gz DVLYYSRTRYHEDD-UHFFFAOYSA-N 0 3 375.250 3.171 10 0 GGAEHN C[C@H]1CN(CCC(=O)Nc2cccc(Cl)c2)CCN(CC(F)(F)F)C1 ZINC000451870047 566899548 /nfs/dbraw/zinc/89/95/48/566899548.db2.gz HMEZCAWTODGNKO-ZDUSSCGKSA-N 0 3 377.838 3.485 10 0 GGAEHN Cc1nc(S(=O)(=O)[N-]Cc2ccccc2C[NH+]2CCCCC2)sc1C ZINC000470759274 566901339 /nfs/dbraw/zinc/90/13/39/566901339.db2.gz CVMRWMWJGFQEID-UHFFFAOYSA-N 0 3 379.551 3.224 10 0 GGAEHN CN(C)CCOc1ccccc1C(=O)NCc1cc(F)cc(Br)c1 ZINC000518812018 566904185 /nfs/dbraw/zinc/90/41/85/566904185.db2.gz AXERLQHXNZMZMZ-UHFFFAOYSA-N 0 3 395.272 3.459 10 0 GGAEHN COc1cc(NC(=O)NC[C@H](C)N2CCC(C)CC2)ncc1Br ZINC000680369027 566904467 /nfs/dbraw/zinc/90/44/67/566904467.db2.gz YFIHTYZTLJLFPI-LBPRGKRZSA-N 0 3 385.306 3.095 10 0 GGAEHN C[C@@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CCC[C@@]2(CCOC2)C1 ZINC000451902671 566904738 /nfs/dbraw/zinc/90/47/38/566904738.db2.gz OPEYTWZBTLMFPH-HNAYVOBHSA-N 0 3 395.341 3.299 10 0 GGAEHN Cc1cc(I)ccc1NC(=O)CCN(C)c1ccncc1 ZINC000543715433 566905607 /nfs/dbraw/zinc/90/56/07/566905607.db2.gz LHLHQUHWRWGREK-UHFFFAOYSA-N 0 3 395.244 3.460 10 0 GGAEHN O=C(CCN1CC[C@H]([C@H](O)C(F)(F)F)C1)Nc1ccc(Br)cc1 ZINC000451915410 566906423 /nfs/dbraw/zinc/90/64/23/566906423.db2.gz VKYDOGOXCXUDGH-HZMBPMFUSA-N 0 3 395.219 3.023 10 0 GGAEHN CC[C@H](c1ccc(Br)cc1)N1CCN([C@@H]2CCNC(=O)CC2)CC1 ZINC000451919630 566907506 /nfs/dbraw/zinc/90/75/06/566907506.db2.gz SOYASTSIDXRLOC-ZWKOTPCHSA-N 0 3 394.357 3.187 10 0 GGAEHN CS(=O)(=O)N1CCC[C@H](CN2CC[C@@H](Sc3cccc(Cl)c3)C2)C1 ZINC000429126978 566909074 /nfs/dbraw/zinc/90/90/74/566909074.db2.gz ATVPZZZVEQUZER-RHSMWYFYSA-N 0 3 388.986 3.178 10 0 GGAEHN CS(=O)(=O)N1CCC[C@H](CN2CC[C@H](Sc3cccc(Cl)c3)C2)C1 ZINC000429126976 566909861 /nfs/dbraw/zinc/90/98/61/566909861.db2.gz ATVPZZZVEQUZER-PBHICJAKSA-N 0 3 388.986 3.178 10 0 GGAEHN CCCCOc1c(Cl)cc(C(=O)N[C@H]2CNCCC2(F)F)cc1OC ZINC000563713315 566911574 /nfs/dbraw/zinc/91/15/74/566911574.db2.gz MARQPNKLMCCGIC-AWEZNQCLSA-N 0 3 376.831 3.255 10 0 GGAEHN CC(C(=O)N[C@H]1CCOc2ccccc21)S(=O)(=O)Cc1ccsc1Cl ZINC000656533161 566912407 /nfs/dbraw/zinc/91/24/07/566912407.db2.gz PLWITMQZDBUPSU-FZMZJTMJSA-N 0 3 399.921 3.345 10 0 GGAEHN COc1ccccc1CNC(=O)C(C)S(=O)(=O)Cc1ccsc1Cl ZINC000656532576 566912549 /nfs/dbraw/zinc/91/25/49/566912549.db2.gz AATMCACFFQNPEY-NSHDSACASA-N 0 3 387.910 3.030 10 0 GGAEHN OC[C@@H](NCCCOc1cccc(I)c1)c1ccccc1 ZINC000543812613 566912821 /nfs/dbraw/zinc/91/28/21/566912821.db2.gz NITGVQNDUMHZCE-QGZVFWFLSA-N 0 3 397.256 3.383 10 0 GGAEHN CN1CC[C@]2(CCN(C(=O)c3cc(F)c(Br)cc3Cl)C2)C1 ZINC000583016258 566913771 /nfs/dbraw/zinc/91/37/71/566913771.db2.gz RPYTYNPEBSLUPL-HNNXBMFYSA-N 0 3 375.669 3.409 10 0 GGAEHN CC(C(=O)NCCc1cccs1)S(=O)(=O)Cc1ccsc1Cl ZINC000656534460 566913912 /nfs/dbraw/zinc/91/39/12/566913912.db2.gz RLDWFWNFMFREKL-JTQLQIEISA-N 0 3 377.940 3.125 10 0 GGAEHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)NCc1ccc(Cl)cc1Cl ZINC000491765004 566914502 /nfs/dbraw/zinc/91/45/02/566914502.db2.gz VIAOCQXSYLHQHV-CYBMUJFWSA-N 0 3 386.323 3.388 10 0 GGAEHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)NCc1ccc(Cl)cc1Cl ZINC000491765007 566914646 /nfs/dbraw/zinc/91/46/46/566914646.db2.gz VIAOCQXSYLHQHV-ZDUSSCGKSA-N 0 3 386.323 3.388 10 0 GGAEHN C[C@@H]1[C@H](C(F)(F)F)CCN1CCC(=O)Nc1ccc(C(N)=O)c(Cl)c1 ZINC000470938927 566915839 /nfs/dbraw/zinc/91/58/39/566915839.db2.gz AORMPROHTSRQKR-BXKDBHETSA-N 0 3 377.794 3.040 10 0 GGAEHN C[C@H]1[C@@H](C(F)(F)F)CCN1CCC(=O)Nc1ccc(C(N)=O)c(Cl)c1 ZINC000470938928 566916581 /nfs/dbraw/zinc/91/65/81/566916581.db2.gz AORMPROHTSRQKR-CABZTGNLSA-N 0 3 377.794 3.040 10 0 GGAEHN CN1CC[C@H](Cn2nnnc2Sc2cnc3cc(Cl)c(Cl)cc3n2)C1 ZINC000543901054 566921427 /nfs/dbraw/zinc/92/14/27/566921427.db2.gz CCPMGORZRBRQAV-VIFPVBQESA-N 0 3 396.307 3.026 10 0 GGAEHN CN1CCC[C@@H](N2CCN(c3nnc(-c4ccccc4Cl)s3)CC2)C1 ZINC000680622686 566922717 /nfs/dbraw/zinc/92/27/17/566922717.db2.gz QTLFDXWESHMGJV-CQSZACIVSA-N 0 3 377.945 3.075 10 0 GGAEHN CC[C@H](Cc1ccccc1Br)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000471077429 566926288 /nfs/dbraw/zinc/92/62/88/566926288.db2.gz DRJZGVDQSSJFKX-SJORKVTESA-N 0 3 392.341 3.426 10 0 GGAEHN CC1CCN(S(=O)(=O)Cc2ccccc2CN[C@H]2CCCSC2)CC1 ZINC000544002171 566928284 /nfs/dbraw/zinc/92/82/84/566928284.db2.gz HBYVUVINSWCQKM-IBGZPJMESA-N 0 3 382.595 3.234 10 0 GGAEHN CC(C)(CN1CCCC1)NCc1nc(-c2cccc(Br)c2)no1 ZINC000452080663 566931493 /nfs/dbraw/zinc/93/14/93/566931493.db2.gz CJACTNIFZFUNQI-UHFFFAOYSA-N 0 3 379.302 3.463 10 0 GGAEHN COC[C@H](N[C@@H](C)C(=O)Nc1ccc(Br)c(C)c1)C1CCOCC1 ZINC000656677901 566931522 /nfs/dbraw/zinc/93/15/22/566931522.db2.gz IGLPXHGIKVPWKG-GUYCJALGSA-N 0 3 399.329 3.116 10 0 GGAEHN COC[C@@H]1CCCN(CC(=O)N(C)Cc2ccccc2Br)CC1 ZINC000452089960 566933002 /nfs/dbraw/zinc/93/30/02/566933002.db2.gz QJCBNYZPNYSFOA-OAHLLOKOSA-N 0 3 383.330 3.156 10 0 GGAEHN CC[C@H](c1ccc(Br)cc1)N1CCN(C[C@]2(O)CCCOC2)CC1 ZINC000656696690 566933117 /nfs/dbraw/zinc/93/31/17/566933117.db2.gz JRKDSKOJQKWCGP-RTBURBONSA-N 0 3 397.357 3.059 10 0 GGAEHN COC[C@@H]1CCCN(CC(=O)N[C@H](C)c2ccc(Br)cc2)CC1 ZINC000452088709 566933049 /nfs/dbraw/zinc/93/30/49/566933049.db2.gz OZKFQRDAJRELSH-HUUCEWRRSA-N 0 3 383.330 3.375 10 0 GGAEHN COC[C@@H](N[C@H](C)C(=O)Nc1cccc(Cl)c1Cl)C1CCOCC1 ZINC000656680671 566933501 /nfs/dbraw/zinc/93/35/01/566933501.db2.gz SHLVIONHGISLNV-IAQYHMDHSA-N 0 3 375.296 3.352 10 0 GGAEHN CC1(C)CCCN[C@@H]1C(=O)NC[C@@H]1CCN(c2ccc(Br)cc2)C1 ZINC000563959245 566933950 /nfs/dbraw/zinc/93/39/50/566933950.db2.gz FCEWUKQSUCKSMR-WMLDXEAASA-N 0 3 394.357 3.170 10 0 GGAEHN COC[C@H](N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)C1CCOCC1 ZINC000656680622 566934031 /nfs/dbraw/zinc/93/40/31/566934031.db2.gz YXZZFTMHEFTZCK-CVEARBPZSA-N 0 3 387.307 3.130 10 0 GGAEHN COc1ccc(CCC(=O)N2CC[C@H]3CC[C@@H](C2)N3C)c(Br)c1 ZINC000611732791 566935449 /nfs/dbraw/zinc/93/54/49/566935449.db2.gz LJNLRVDIRIUZTN-CABCVRRESA-N 0 3 381.314 3.085 10 0 GGAEHN CN1CCN([C@H]2CC[C@@H](NC(=O)CSc3ccccc3Cl)CC2)CC1 ZINC000680841948 566935478 /nfs/dbraw/zinc/93/54/78/566935478.db2.gz RJEMSEFPYYNPST-IYBDPMFKSA-N 0 3 381.973 3.107 10 0 GGAEHN O=S(=O)([N-]CC[NH2+][C@H]1CC[C@@H]1C1CCC1)c1cccc(Cl)c1Cl ZINC000583278767 566936127 /nfs/dbraw/zinc/93/61/27/566936127.db2.gz BXDVXTOJMSMJKD-OCCSQVGLSA-N 0 3 377.337 3.440 10 0 GGAEHN CC(C)(CNCCS(=O)(=O)c1cccc(Br)c1)C(F)(F)F ZINC000519389063 566937990 /nfs/dbraw/zinc/93/79/90/566937990.db2.gz XPTUZPWYGPJWGP-UHFFFAOYSA-N 0 3 388.249 3.401 10 0 GGAEHN CO[C@@H]1CCC[C@H](N[C@@H]2CCN(c3ccc(Br)c(C)c3)C2=O)C1 ZINC000680882088 566938292 /nfs/dbraw/zinc/93/82/92/566938292.db2.gz MYWJIEXZRFFWOE-YSVLISHTSA-N 0 3 381.314 3.410 10 0 GGAEHN O[C@@H](COc1ccc(Br)cc1)CN1CC[C@@H](Cc2ccncc2)C1 ZINC000680888935 566940486 /nfs/dbraw/zinc/94/04/86/566940486.db2.gz MCMFURXNXYPIQS-FUHWJXTLSA-N 0 3 391.309 3.148 10 0 GGAEHN O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1cc(F)cc(Br)c1 ZINC000519465080 566940841 /nfs/dbraw/zinc/94/08/41/566940841.db2.gz MGFKNADOBUMLNO-CQSZACIVSA-N 0 3 399.216 3.026 10 0 GGAEHN Cc1nc(-c2ccc(C(=O)N3CCOC[C@H]3[C@H]3CCCN3C)s2)cs1 ZINC000633195442 566941797 /nfs/dbraw/zinc/94/17/97/566941797.db2.gz GJFSHPRAXXDZQZ-CABCVRRESA-N 0 3 377.535 3.115 10 0 GGAEHN Cc1nc(-c2ccc(C(=O)N3CCOC[C@@H]3[C@@H]3CCCN3C)s2)cs1 ZINC000633195445 566942151 /nfs/dbraw/zinc/94/21/51/566942151.db2.gz GJFSHPRAXXDZQZ-LSDHHAIUSA-N 0 3 377.535 3.115 10 0 GGAEHN CN1CCC[C@]2(CCN(C(=O)Cc3csc(CCC(F)(F)F)n3)C2)C1 ZINC000633207676 566943353 /nfs/dbraw/zinc/94/33/53/566943353.db2.gz UTISTLHZBSHBRZ-INIZCTEOSA-N 0 3 375.460 3.125 10 0 GGAEHN CC1(C)CCC[C@@H](NCc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1 ZINC000564100116 566944546 /nfs/dbraw/zinc/94/45/46/566944546.db2.gz AQSGHMDDIDVTBD-OAHLLOKOSA-N 0 3 386.583 3.218 10 0 GGAEHN C[C@@H](NC(=O)CN1CCCC[C@H]1C1(O)CC1)c1ccc(Br)cc1 ZINC000519525157 566945347 /nfs/dbraw/zinc/94/53/47/566945347.db2.gz JPZLEAFHTFITER-CJNGLKHVSA-N 0 3 381.314 3.006 10 0 GGAEHN C[C@H](NC(=O)CN1CCCC[C@@H]1C1(O)CC1)c1ccc(Br)cc1 ZINC000519525161 566945423 /nfs/dbraw/zinc/94/54/23/566945423.db2.gz JPZLEAFHTFITER-XJKSGUPXSA-N 0 3 381.314 3.006 10 0 GGAEHN CN1CCC(N(Cc2ccccc2Br)C(=O)C2CC(C)(O)C2)CC1 ZINC000452151037 566945394 /nfs/dbraw/zinc/94/53/94/566945394.db2.gz NCFPGEMXTJWPKO-UHFFFAOYSA-N 0 3 395.341 3.033 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CCN(C3CC3)C[C@@H](C)C2)c1 ZINC000452177957 566948300 /nfs/dbraw/zinc/94/83/00/566948300.db2.gz YAEXUQZMAMIYDV-CYBMUJFWSA-N 0 3 398.288 3.156 10 0 GGAEHN COc1ccc(CN2CCC[C@@H](C3CC[NH2+]CC3)C2)c(Br)c1[O-] ZINC000656783374 566950042 /nfs/dbraw/zinc/95/00/42/566950042.db2.gz QKIHPUXBXYXBIG-CQSZACIVSA-N 0 3 383.330 3.375 10 0 GGAEHN Brc1ccc2ncc(CNc3ccc([C@H]4CNCCO4)cc3)n2c1 ZINC000656792028 566950645 /nfs/dbraw/zinc/95/06/45/566950645.db2.gz IHLAEOGHRUGIHV-QGZVFWFLSA-N 0 3 387.281 3.370 10 0 GGAEHN COc1ccc(CNc2ccc([C@H]3CNCCO3)cc2)c(Br)c1O ZINC000656792914 566950742 /nfs/dbraw/zinc/95/07/42/566950742.db2.gz OXWNRAVTGBOLOQ-MRXNPFEDSA-N 0 3 393.281 3.436 10 0 GGAEHN Brc1cc(CNc2ccc([C@H]3CNCCO3)cc2)cc2c1OCO2 ZINC000656792122 566950842 /nfs/dbraw/zinc/95/08/42/566950842.db2.gz NSTOXWZPPNOONK-QGZVFWFLSA-N 0 3 391.265 3.451 10 0 GGAEHN COc1cc(Br)c(CNc2ccc([C@@H]3CNCCO3)cc2)cc1O ZINC000656794397 566950914 /nfs/dbraw/zinc/95/09/14/566950914.db2.gz ZRJSZJOTZKQCPE-SFHVURJKSA-N 0 3 393.281 3.436 10 0 GGAEHN Brc1cc(CNc2ccc([C@@H]3CNCCO3)cc2)cc2c1OCO2 ZINC000656792121 566950956 /nfs/dbraw/zinc/95/09/56/566950956.db2.gz NSTOXWZPPNOONK-KRWDZBQOSA-N 0 3 391.265 3.451 10 0 GGAEHN COc1cc(CN(C)C)ccc1NC(=O)c1cncc(Br)c1C ZINC000633378381 566954473 /nfs/dbraw/zinc/95/44/73/566954473.db2.gz JZMIPSWSOCBOOO-UHFFFAOYSA-N 0 3 378.270 3.475 10 0 GGAEHN CN(C)CCN1CCN(C(=O)c2csc(-c3ccc(Cl)cc3)c2)CC1 ZINC000429849605 566958399 /nfs/dbraw/zinc/95/83/99/566958399.db2.gz UOMUBWFBPXSDRN-UHFFFAOYSA-N 0 3 377.941 3.388 10 0 GGAEHN CC[C@@H](NC[C@@H](O)COc1cccc(Br)c1)c1c(C)nn(C)c1C ZINC000564297977 566961864 /nfs/dbraw/zinc/96/18/64/566961864.db2.gz LXNBHFHAXKFTDN-NVXWUHKLSA-N 0 3 396.329 3.280 10 0 GGAEHN CC[C@@H](NC[C@H](O)COc1cccc(Br)c1)c1c(C)nn(C)c1C ZINC000564297976 566961900 /nfs/dbraw/zinc/96/19/00/566961900.db2.gz LXNBHFHAXKFTDN-DOTOQJQBSA-N 0 3 396.329 3.280 10 0 GGAEHN Cc1ccccc1C[C@@H](CO)NC[C@H](O)COc1c(Cl)cccc1Cl ZINC000583565092 566963168 /nfs/dbraw/zinc/96/31/68/566963168.db2.gz QBXRXOAYKBLULV-HOTGVXAUSA-N 0 3 384.303 3.235 10 0 GGAEHN COc1ccc(N(C)C(=O)C(C[C@@H]2COCCO2)C(F)(F)F)cc1Cl ZINC000612301563 566963580 /nfs/dbraw/zinc/96/35/80/566963580.db2.gz RWNLFVIVFYNZFZ-VXGBXAGGSA-N 0 3 381.778 3.295 10 0 GGAEHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000612305596 566963792 /nfs/dbraw/zinc/96/37/92/566963792.db2.gz ZQAFFNZHVKMULQ-UGSOOPFHSA-N 0 3 392.341 3.262 10 0 GGAEHN CNS(=O)(=O)CCCN[C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 ZINC000544469362 566965874 /nfs/dbraw/zinc/96/58/74/566965874.db2.gz MYMHBUITQOKHPO-NSHDSACASA-N 0 3 387.958 3.362 10 0 GGAEHN O=C(NC[C@H]1CCCN1CCCO)c1cc(Br)cc2ccccc21 ZINC000452354263 566966185 /nfs/dbraw/zinc/96/61/85/566966185.db2.gz VJNHTKZBYMPUSZ-MRXNPFEDSA-N 0 3 391.309 3.179 10 0 GGAEHN Cc1nc2ccc(CNCCNS(=O)(=O)c3cccc(Cl)c3)cc2s1 ZINC000494000389 566967619 /nfs/dbraw/zinc/96/76/19/566967619.db2.gz QQVQVLZEHBQXPN-UHFFFAOYSA-N 0 3 395.937 3.326 10 0 GGAEHN CS(=O)(=O)N1CC[C@H](CN[C@H](c2c(Cl)cccc2Cl)C2CC2)C1 ZINC000564379026 566968416 /nfs/dbraw/zinc/96/84/16/566968416.db2.gz MDFOOTKPPZWKJV-BZNIZROVSA-N 0 3 377.337 3.316 10 0 GGAEHN Cc1cc(Br)cc2c(C(=O)NC[C@@H]3CCCN3CCCO)coc21 ZINC000452368262 566969907 /nfs/dbraw/zinc/96/99/07/566969907.db2.gz QTIHGLFRUHBSRO-AWEZNQCLSA-N 0 3 395.297 3.080 10 0 GGAEHN Cc1cc(Br)cc2c(C(=O)NC[C@@H]3CCCCN3CCO)coc21 ZINC000452369376 566970003 /nfs/dbraw/zinc/97/00/03/566970003.db2.gz DPOYTWKXBBTDMS-AWEZNQCLSA-N 0 3 395.297 3.080 10 0 GGAEHN CN1CCN(CCCCNC(=O)N[C@@H]2CCCc3sc(Cl)cc32)CC1 ZINC000519799351 566971449 /nfs/dbraw/zinc/97/14/49/566971449.db2.gz JSKVBFUEUJFPSN-OAHLLOKOSA-N 0 3 384.977 3.106 10 0 GGAEHN C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000471676846 566971662 /nfs/dbraw/zinc/97/16/62/566971662.db2.gz NCLRAUUJBPCUIE-ZIAGYGMSSA-N 0 3 379.492 3.330 10 0 GGAEHN C[C@@H](CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccncc1 ZINC000681391408 566972004 /nfs/dbraw/zinc/97/20/04/566972004.db2.gz FWVQFGLONNIOIO-LRDDRELGSA-N 0 3 395.322 3.456 10 0 GGAEHN C[C@@H](CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccncc1 ZINC000681391407 566972127 /nfs/dbraw/zinc/97/21/27/566972127.db2.gz FWVQFGLONNIOIO-BLLLJJGKSA-N 0 3 395.322 3.456 10 0 GGAEHN CC(C)N1C(=O)C[C@@H](NCCOCC(F)F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000494217007 566977255 /nfs/dbraw/zinc/97/72/55/566977255.db2.gz SHLFSNMPYMQBER-PBHICJAKSA-N 0 3 378.822 3.401 10 0 GGAEHN Cn1c(CCN(CCO)Cc2cc(Br)cs2)nc2ccccc21 ZINC000494248893 566978158 /nfs/dbraw/zinc/97/81/58/566978158.db2.gz VWCAYLLDUZMZMX-UHFFFAOYSA-N 0 3 394.338 3.434 10 0 GGAEHN O=C(CCN(CCO)Cc1cc(Br)cs1)Nc1ccccc1 ZINC000494246390 566979208 /nfs/dbraw/zinc/97/92/08/566979208.db2.gz APLIMXQHNRDEQK-UHFFFAOYSA-N 0 3 383.311 3.334 10 0 GGAEHN CCC[C@H](C)[C@H](CO)NCC(=O)Nc1c(F)cc(F)cc1Br ZINC000583755975 566980353 /nfs/dbraw/zinc/98/03/53/566980353.db2.gz LIDSMQHFSBXCHU-ZANVPECISA-N 0 3 379.245 3.053 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1cc(Br)cc(OC(C)C)c1 ZINC000471858592 566981286 /nfs/dbraw/zinc/98/12/86/566981286.db2.gz HIQCANJEEVJAQQ-MRXNPFEDSA-N 0 3 399.329 3.077 10 0 GGAEHN Cc1cccc2c1OCC[C@H]2N[C@H](C)Cn1cc(Br)ccc1=O ZINC000583767813 566982028 /nfs/dbraw/zinc/98/20/28/566982028.db2.gz WQJQGDUMHBTRDF-CZUORRHYSA-N 0 3 377.282 3.421 10 0 GGAEHN CN(C(=O)CCN(CCO)Cc1cc(Br)cs1)c1ccccc1 ZINC000494280211 566983475 /nfs/dbraw/zinc/98/34/75/566983475.db2.gz SIDCAXULAVZQBF-UHFFFAOYSA-N 0 3 397.338 3.358 10 0 GGAEHN Cc1cc(Br)cn2cc(CCNCc3cnn4ccccc34)nc12 ZINC000544706300 566983694 /nfs/dbraw/zinc/98/36/94/566983694.db2.gz PTZFSZTUPLEORZ-UHFFFAOYSA-N 0 3 384.281 3.385 10 0 GGAEHN CC(C)(C)c1ccc(CCNC[C@H](O)CS(=O)(=O)c2cccs2)cc1 ZINC000564529930 566984245 /nfs/dbraw/zinc/98/42/45/566984245.db2.gz WHJGGWXKBUQLMY-KRWDZBQOSA-N 0 3 381.563 3.013 10 0 GGAEHN CN(CCNS(=O)(=O)c1cccc(OC(F)(F)F)c1)C1CCCCC1 ZINC000520124121 566986154 /nfs/dbraw/zinc/98/61/54/566986154.db2.gz ZEPIKYZJFNFXRW-UHFFFAOYSA-N 0 3 380.432 3.128 10 0 GGAEHN C[C@H](CC(F)(F)F)CS(=O)(=O)NC[C@H]1CCN(Cc2ccccc2)C1 ZINC000656976212 566988140 /nfs/dbraw/zinc/98/81/40/566988140.db2.gz IBPZZGKHDFPXBY-GDBMZVCRSA-N 0 3 378.460 3.016 10 0 GGAEHN CSCc1cc(F)ccc1CNC(=O)NCC1(SC)CCN(C)CC1 ZINC000564582749 566989315 /nfs/dbraw/zinc/98/93/15/566989315.db2.gz WWMDZRRCUSBHTN-UHFFFAOYSA-N 0 3 385.574 3.315 10 0 GGAEHN Cc1nnc([C@H](C)NC(=O)NC[C@H]2CCCN(C)[C@H]2c2cccs2)s1 ZINC000544761622 566990167 /nfs/dbraw/zinc/99/01/67/566990167.db2.gz BJAUAWRDHSGXJZ-NJZAAPMLSA-N 0 3 379.555 3.351 10 0 GGAEHN C[C@H](C(=O)N[C@@H](C)c1ccc(Cl)cc1Cl)N1CCNC[C@](C)(F)C1 ZINC000583872616 566990958 /nfs/dbraw/zinc/99/09/58/566990958.db2.gz VZKAOLOCJHPVOB-JKDFXYPNSA-N 0 3 376.303 3.193 10 0 GGAEHN CCN(CC)CCN(C(=O)c1ccsn1)c1ccc(Br)cn1 ZINC000520234691 566991533 /nfs/dbraw/zinc/99/15/33/566991533.db2.gz AAZICLYSSMTQFR-UHFFFAOYSA-N 0 3 383.315 3.289 10 0 GGAEHN CN(C(=O)CCCOc1cccc(Br)c1)[C@H]1CCN(C2CC2)C1 ZINC000520317753 566997634 /nfs/dbraw/zinc/99/76/34/566997634.db2.gz LLUNARUDXAIDFF-INIZCTEOSA-N 0 3 381.314 3.303 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)c1c[nH]c2ncc(Br)cc12 ZINC000472089567 567000189 /nfs/dbraw/zinc/00/01/89/567000189.db2.gz GXBLGJUTDAJFAU-VXGBXAGGSA-N 0 3 379.302 3.318 10 0 GGAEHN COc1cc(Br)ccc1CNC1CCN(c2cnccn2)CC1 ZINC000681742552 567003036 /nfs/dbraw/zinc/00/30/36/567003036.db2.gz ITRWOLRSHIZUMA-UHFFFAOYSA-N 0 3 377.286 3.006 10 0 GGAEHN CC[C@H](Cc1cccc(Br)c1)C(=O)N[C@H]1CNCCC1(F)F ZINC000564798248 567009422 /nfs/dbraw/zinc/00/94/22/567009422.db2.gz QSZUEYCNCUDIQG-OCCSQVGLSA-N 0 3 375.257 3.131 10 0 GGAEHN O=C(Nc1ccc2c(c1F)CCNC2)[C@H]1COc2ccc(Br)cc21 ZINC000584107744 567012133 /nfs/dbraw/zinc/01/21/33/567012133.db2.gz ILASVJGPVSZEST-AWEZNQCLSA-N 0 3 391.240 3.349 10 0 GGAEHN O=C(C[C@@H]1CSCCN1)NCc1ccc(Br)cc1C(F)(F)F ZINC000564838538 567012764 /nfs/dbraw/zinc/01/27/64/567012764.db2.gz OTWHSNIDDJNOEM-LLVKDONJSA-N 0 3 397.260 3.179 10 0 GGAEHN CN1CCC(n2cc(NC(=O)Cc3ccc(Br)s3)cn2)CC1 ZINC000634090323 567016258 /nfs/dbraw/zinc/01/62/58/567016258.db2.gz XNBMQVJPIQQIGM-UHFFFAOYSA-N 0 3 383.315 3.155 10 0 GGAEHN Cc1ccsc1[C@@H](CO)NC[C@@H](O)COc1ccccc1C(F)(F)F ZINC000494673000 567016571 /nfs/dbraw/zinc/01/65/71/567016571.db2.gz OMLSKAASMDKYAG-TZMCWYRMSA-N 0 3 375.412 3.138 10 0 GGAEHN CN1CCC(n2cc(NC(=O)c3ccc(F)cc3Br)cn2)CC1 ZINC000634084944 567016779 /nfs/dbraw/zinc/01/67/79/567016779.db2.gz WUQLWUFJLTWNPF-UHFFFAOYSA-N 0 3 381.249 3.304 10 0 GGAEHN CN1CCC(n2cc(NC(=O)c3c(F)cccc3Br)cn2)CC1 ZINC000634092212 567016830 /nfs/dbraw/zinc/01/68/30/567016830.db2.gz RCFRIFPEFJMUQD-UHFFFAOYSA-N 0 3 381.249 3.304 10 0 GGAEHN C[C@@H]1CN(C2CC2)C[C@H]1Nc1ncnc2cccc(I)c21 ZINC000545164835 567024253 /nfs/dbraw/zinc/02/42/53/567024253.db2.gz YSIGKAIFLOHPOP-QMTHXVAHSA-N 0 3 394.260 3.129 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)N[C@@H]1C[C@@H]1c1cccc(Br)c1 ZINC000520781023 567025275 /nfs/dbraw/zinc/02/52/75/567025275.db2.gz JHGQPYZNNSUADH-KBRIMQKVSA-N 0 3 380.330 3.479 10 0 GGAEHN [NH3+]C[C@H]1CC[C@H](C[N-]S(=O)(=O)c2cccc(Br)c2Cl)CC1 ZINC000564967212 567026261 /nfs/dbraw/zinc/02/62/61/567026261.db2.gz URKNIBDOIJNMOT-XYPYZODXSA-N 0 3 395.750 3.146 10 0 GGAEHN C[C@@H](CC(F)(F)F)NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472447012 567026674 /nfs/dbraw/zinc/02/66/74/567026674.db2.gz LKTAMTKYKYSWRS-GCVQQVDUSA-N 0 3 375.357 3.432 10 0 GGAEHN COc1ccc(Br)c(CC(=O)N2CCc3ccccc3[C@@H]2CN)c1 ZINC000565005378 567029054 /nfs/dbraw/zinc/02/90/54/567029054.db2.gz SKRHWDUQKCZZSG-SFHVURJKSA-N 0 3 389.293 3.085 10 0 GGAEHN C[C@H](N[C@H]1CCCC(F)(F)C1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430695312 567029743 /nfs/dbraw/zinc/02/97/43/567029743.db2.gz MTYZOTSJLKRKDO-ONGXEEELSA-N 0 3 397.285 3.325 10 0 GGAEHN C[C@@H](N[C@@H]1CCCC(F)(F)C1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430695311 567029804 /nfs/dbraw/zinc/02/98/04/567029804.db2.gz MTYZOTSJLKRKDO-MWLCHTKSSA-N 0 3 397.285 3.325 10 0 GGAEHN NC(=O)c1ncc(Br)cc1NC[C@@H](c1ccccc1)N1CCCC1 ZINC000472500688 567031493 /nfs/dbraw/zinc/03/14/93/567031493.db2.gz NBIDSUZHIYCJBD-INIZCTEOSA-N 0 3 389.297 3.192 10 0 GGAEHN C[C@H](NC[C@H]1CCCCS1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430740810 567032081 /nfs/dbraw/zinc/03/20/81/567032081.db2.gz CQFUWOYATRLUCM-CMPLNLGQSA-N 0 3 393.372 3.033 10 0 GGAEHN C[C@H](NC[C@@H]1CCCCS1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430740811 567032110 /nfs/dbraw/zinc/03/21/10/567032110.db2.gz CQFUWOYATRLUCM-JQWIXIFHSA-N 0 3 393.372 3.033 10 0 GGAEHN CN(C(=O)NCc1cc2cc(Br)ccc2[nH]1)[C@@H]1CCN(C2CC2)C1 ZINC000545242083 567033319 /nfs/dbraw/zinc/03/33/19/567033319.db2.gz TZZHOQCVQFCZGU-MRXNPFEDSA-N 0 3 391.313 3.309 10 0 GGAEHN C[C@H](NC(=O)c1cc(Br)cc(N2CCCC2)c1)C1=CCN(C)CC1 ZINC000613374381 567033759 /nfs/dbraw/zinc/03/37/59/567033759.db2.gz FFQXVPAJWWIQAD-AWEZNQCLSA-N 0 3 392.341 3.430 10 0 GGAEHN C[C@@H]1CN(Cc2ccccc2)[C@@H](C)CN1Cc1c(Br)cnn1C ZINC000494998245 567038138 /nfs/dbraw/zinc/03/81/38/567038138.db2.gz RCUBCYSUUPTHIP-LSDHHAIUSA-N 0 3 377.330 3.277 10 0 GGAEHN C[C@@H]1CN(Cc2ccccc2)[C@H](C)CN1Cc1c(Br)cnn1C ZINC000494998244 567038748 /nfs/dbraw/zinc/03/87/48/567038748.db2.gz RCUBCYSUUPTHIP-HUUCEWRRSA-N 0 3 377.330 3.277 10 0 GGAEHN CC(C)(C)OC(=O)[C@H]1CCN(C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000495067788 567044140 /nfs/dbraw/zinc/04/41/40/567044140.db2.gz OTIUHVFNWPLNBH-JSGCOSHPSA-N 0 3 390.307 3.397 10 0 GGAEHN CC(C)(C)OC(=O)[C@H]1CCN(C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000495067787 567043937 /nfs/dbraw/zinc/04/39/37/567043937.db2.gz OTIUHVFNWPLNBH-GXTWGEPZSA-N 0 3 390.307 3.397 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000613543278 567044227 /nfs/dbraw/zinc/04/42/27/567044227.db2.gz AUTXFPZYBYURQF-ACJLOTCBSA-N 0 3 388.309 3.403 10 0 GGAEHN Cn1ncc(C(F)(F)F)c1CNCCc1cc(Cl)c2c(c1)OCCO2 ZINC000657295482 567044358 /nfs/dbraw/zinc/04/43/58/567044358.db2.gz QAWZVSLTYDBCQU-UHFFFAOYSA-N 0 3 375.778 3.196 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000613543279 567044562 /nfs/dbraw/zinc/04/45/62/567044562.db2.gz AUTXFPZYBYURQF-FZKQIMNGSA-N 0 3 388.309 3.403 10 0 GGAEHN COc1ccc(CCC(=O)NCCN2CC=C(C)CC2)c(Br)c1 ZINC000613523351 567044643 /nfs/dbraw/zinc/04/46/43/567044643.db2.gz SFFPDAGIYZGXJV-UHFFFAOYSA-N 0 3 381.314 3.159 10 0 GGAEHN Cc1c(Br)cncc1CNCc1ccc(CN2CCOCC2)cc1 ZINC000657293297 567045046 /nfs/dbraw/zinc/04/50/46/567045046.db2.gz LHUGBTSVUXTHQO-UHFFFAOYSA-N 0 3 390.325 3.275 10 0 GGAEHN C[C@@H]1CCN(CC(=O)N(Cc2cccc(Br)c2)C2CCOCC2)C1 ZINC000565191422 567045632 /nfs/dbraw/zinc/04/56/32/567045632.db2.gz JXQBAPWUMDPCAT-OAHLLOKOSA-N 0 3 395.341 3.299 10 0 GGAEHN CN1CCN(Cc2ccc(NCc3c(F)cncc3Br)cc2)CC1 ZINC000657320269 567046361 /nfs/dbraw/zinc/04/63/61/567046361.db2.gz BSVGNCOKJBKAEN-UHFFFAOYSA-N 0 3 393.304 3.343 10 0 GGAEHN Fc1cncc(Br)c1CNC1CCN(Cc2ccccn2)CC1 ZINC000657314376 567047110 /nfs/dbraw/zinc/04/71/10/567047110.db2.gz TZTFLHBPRDGAHK-UHFFFAOYSA-N 0 3 379.277 3.132 10 0 GGAEHN Fc1cncc(Br)c1CNC1CCN(Cc2ccncc2)CC1 ZINC000657319084 567047617 /nfs/dbraw/zinc/04/76/17/567047617.db2.gz RBXJBBDRTRJUJY-UHFFFAOYSA-N 0 3 379.277 3.132 10 0 GGAEHN CN(Cc1c(Br)cnn1C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000495137330 567048023 /nfs/dbraw/zinc/04/80/23/567048023.db2.gz GNOHXHXBVAWXIP-MRXNPFEDSA-N 0 3 377.330 3.279 10 0 GGAEHN Brc1ccc(N2CC[C@H](NCc3ccnn3-c3ccncc3)C2)cc1 ZINC000657351325 567050157 /nfs/dbraw/zinc/05/01/57/567050157.db2.gz CJVCWBOCMJYFOX-INIZCTEOSA-N 0 3 398.308 3.398 10 0 GGAEHN CC[C@@H]1C[C@@H](NCC(C)(C)S(=O)(=O)c2ccc(Br)cc2)CO1 ZINC000657365286 567050788 /nfs/dbraw/zinc/05/07/88/567050788.db2.gz ZLKACVXRSWXCLJ-ZIAGYGMSSA-N 0 3 390.343 3.159 10 0 GGAEHN Brc1ccc(C2(NCc3cnn4c3CCC4)CCOCC2)cc1 ZINC000657376591 567050914 /nfs/dbraw/zinc/05/09/14/567050914.db2.gz SIWMUWZHNNAFDX-UHFFFAOYSA-N 0 3 376.298 3.387 10 0 GGAEHN Cc1ccc(Br)cc1NC(=O)CCNCc1cnn2c1CCC2 ZINC000657360649 567051621 /nfs/dbraw/zinc/05/16/21/567051621.db2.gz ODLDHWJIACQJLG-UHFFFAOYSA-N 0 3 377.286 3.019 10 0 GGAEHN Brc1ccc(C2(NCc3cnc4n3CCC4)CCOCC2)cc1 ZINC000657377111 567051768 /nfs/dbraw/zinc/05/17/68/567051768.db2.gz YMJPHGGZXWWIEH-UHFFFAOYSA-N 0 3 376.298 3.387 10 0 GGAEHN O=S(=O)(C[C@H](O)CNCc1cccc(C2CCCC2)c1)c1cccs1 ZINC000657415814 567054794 /nfs/dbraw/zinc/05/47/94/567054794.db2.gz NSEVKJRTULYFEC-GOSISDBHSA-N 0 3 379.547 3.330 10 0 GGAEHN Cc1c(Br)cncc1CN[C@H](C)Cn1ncc2ccccc2c1=O ZINC000657421908 567054885 /nfs/dbraw/zinc/05/48/85/567054885.db2.gz RQNSTERADCIWJV-GFCCVEGCSA-N 0 3 387.281 3.041 10 0 GGAEHN O=S(=O)(C[C@@H](O)CNCc1cccc(C2CCCC2)c1)c1cccs1 ZINC000657415815 567054934 /nfs/dbraw/zinc/05/49/34/567054934.db2.gz NSEVKJRTULYFEC-SFHVURJKSA-N 0 3 379.547 3.330 10 0 GGAEHN CCCOC[C@H](Cc1cccc(Br)c1)NC[C@H](O)C(F)(F)F ZINC000565300374 567055937 /nfs/dbraw/zinc/05/59/37/567055937.db2.gz WRALGTYAMSYOKS-KBPBESRZSA-N 0 3 384.236 3.300 10 0 GGAEHN CCN(CC)CCN(C(=O)COC(C)(C)C)c1ccc(Br)cn1 ZINC000565308025 567056998 /nfs/dbraw/zinc/05/69/98/567056998.db2.gz RTHGEGJFYCWBPT-UHFFFAOYSA-N 0 3 386.334 3.334 10 0 GGAEHN O=C(Nc1cc(Cl)ccc1N1CCSCC1)N[C@@H]1CNCCC1(F)F ZINC000521406176 567058353 /nfs/dbraw/zinc/05/83/53/567058353.db2.gz PJWRZRMSCIHEEB-CQSZACIVSA-N 0 3 390.887 3.012 10 0 GGAEHN Cc1c(Br)cncc1CN[C@H]1CC(=O)N(Cc2ccccc2)[C@@H]1C ZINC000657458707 567058566 /nfs/dbraw/zinc/05/85/66/567058566.db2.gz OBSLOQZXWVOVRE-KDOFPFPSSA-N 0 3 388.309 3.432 10 0 GGAEHN Cc1c(Br)cncc1CN[C@@H]1CC(=O)N(Cc2ccccc2)[C@@H]1C ZINC000657458709 567058578 /nfs/dbraw/zinc/05/85/78/567058578.db2.gz OBSLOQZXWVOVRE-RDTXWAMCSA-N 0 3 388.309 3.432 10 0 GGAEHN Cc1ncsc1-c1ccc(CNC[C@H]2CCCCN2S(C)(=O)=O)cc1 ZINC000657463100 567058910 /nfs/dbraw/zinc/05/89/10/567058910.db2.gz IIONTPKPNPDMOT-QGZVFWFLSA-N 0 3 379.551 3.022 10 0 GGAEHN O=C(NC[C@@H]1CCCN(Cc2cccs2)C1)N[C@H](CO)c1ccsc1 ZINC000472962484 567059027 /nfs/dbraw/zinc/05/90/27/567059027.db2.gz WHYMJVXYZWHUIT-WMLDXEAASA-N 0 3 379.551 3.054 10 0 GGAEHN Cc1cnn(CCN[C@@H](CO)c2ccc(Br)cc2C(F)(F)F)c1 ZINC000565378247 567061645 /nfs/dbraw/zinc/06/16/45/567061645.db2.gz YXXCMEIBWQWGGY-AWEZNQCLSA-N 0 3 392.219 3.296 10 0 GGAEHN Cc1cnn(CCN[C@H](CO)c2ccc(Br)cc2C(F)(F)F)c1 ZINC000565378258 567062302 /nfs/dbraw/zinc/06/23/02/567062302.db2.gz YXXCMEIBWQWGGY-CQSZACIVSA-N 0 3 392.219 3.296 10 0 GGAEHN CCOC(=O)c1nn(C)cc1CNCC(C)(C)c1ccccc1Br ZINC000473116039 567063467 /nfs/dbraw/zinc/06/34/67/567063467.db2.gz DGXYSUXHUVGDAX-UHFFFAOYSA-N 0 3 394.313 3.427 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2c[nH]c3cccc(Br)c23)C[C@H]1N(C)C ZINC000495695603 567064302 /nfs/dbraw/zinc/06/43/02/567064302.db2.gz FBINCPOYKDJDPD-ZIAGYGMSSA-N 0 3 382.327 3.048 10 0 GGAEHN CN(C)c1ccc(-c2noc(CC3CCN(C)CC3)n2)cc1Br ZINC000453224768 567065463 /nfs/dbraw/zinc/06/54/63/567065463.db2.gz WYTUUEDCGPOGDV-UHFFFAOYSA-N 0 3 379.302 3.449 10 0 GGAEHN CO[C@@H](CNCc1ccc(OC(F)F)c(Br)c1)[C@H]1CCOC1 ZINC000657541967 567066635 /nfs/dbraw/zinc/06/66/35/567066635.db2.gz MDGKCQNTUATQLO-FZMZJTMJSA-N 0 3 380.229 3.192 10 0 GGAEHN C[C@H]1CCN(CC(=O)N2CCO[C@H](c3cc(F)c(Cl)cc3Cl)C2)C1 ZINC000565439114 567066560 /nfs/dbraw/zinc/06/65/60/567066560.db2.gz CYZNRDJHJVNSIN-ZBEGNZNMSA-N 0 3 375.271 3.374 10 0 GGAEHN CO[C@H](CNCc1cc(OC(F)F)ccc1Br)[C@@H]1CCOC1 ZINC000657543198 567066825 /nfs/dbraw/zinc/06/68/25/567066825.db2.gz RVTAUFIIKJOZKH-QMTHXVAHSA-N 0 3 380.229 3.192 10 0 GGAEHN CC(=O)NCc1ccc(CNCc2cc3c(c(Br)c2)OCO3)cc1 ZINC000657541476 567067020 /nfs/dbraw/zinc/06/70/20/567067020.db2.gz PJPOKBMGAFWOOH-UHFFFAOYSA-N 0 3 391.265 3.104 10 0 GGAEHN Cc1ccc2c(c1)[C@@H](NCCn1cc(Br)ccc1=O)CCCO2 ZINC000453245515 567067654 /nfs/dbraw/zinc/06/76/54/567067654.db2.gz IAJWYXGWJLDIKX-INIZCTEOSA-N 0 3 377.282 3.423 10 0 GGAEHN C[C@@H]1CCN(CC(=O)N2CCO[C@H](c3cc(F)c(Cl)cc3Cl)C2)C1 ZINC000565439112 567067706 /nfs/dbraw/zinc/06/77/06/567067706.db2.gz CYZNRDJHJVNSIN-BZNIZROVSA-N 0 3 375.271 3.374 10 0 GGAEHN CO[C@@H](CNCc1ccc(OC(F)F)c(Br)c1)[C@@H]1CCOC1 ZINC000657541969 567067799 /nfs/dbraw/zinc/06/77/99/567067799.db2.gz MDGKCQNTUATQLO-RISCZKNCSA-N 0 3 380.229 3.192 10 0 GGAEHN CO[C@@H](CNCc1cn(-c2ccccc2Br)nc1C)[C@H]1CCOC1 ZINC000657542326 567067855 /nfs/dbraw/zinc/06/78/55/567067855.db2.gz XFDRZYICLAIPTM-KSSFIOAISA-N 0 3 394.313 3.084 10 0 GGAEHN CO[C@H](CNCc1cn(-c2ccccc2Br)nc1C)[C@@H]1CCOC1 ZINC000657542329 567067994 /nfs/dbraw/zinc/06/79/94/567067994.db2.gz XFDRZYICLAIPTM-RDTXWAMCSA-N 0 3 394.313 3.084 10 0 GGAEHN OCCN1CCCC[C@@H]1CN[C@H]1CCCOc2c(Br)cccc21 ZINC000453255286 567068553 /nfs/dbraw/zinc/06/85/53/567068553.db2.gz FKFKNHGAFYJRJT-PBHICJAKSA-N 0 3 383.330 3.099 10 0 GGAEHN Cc1ccc(NC(=O)CN2CCc3ccccc3[C@H]2CN)c(Br)c1 ZINC000521624527 567068673 /nfs/dbraw/zinc/06/86/73/567068673.db2.gz KJMLJNNWGUNMHC-GOSISDBHSA-N 0 3 388.309 3.254 10 0 GGAEHN COc1cc(CN[C@H](CO)C2CCC2)cc(Br)c1OC(F)F ZINC000657557744 567068944 /nfs/dbraw/zinc/06/89/44/567068944.db2.gz AKHXLAVEMHBEPR-GFCCVEGCSA-N 0 3 380.229 3.310 10 0 GGAEHN COC[C@H](CCNCc1c(C)nn(-c2ccc(Br)cc2)c1C)OC ZINC000657552273 567069105 /nfs/dbraw/zinc/06/91/05/567069105.db2.gz CZNIPZVTGQIVQV-KRWDZBQOSA-N 0 3 396.329 3.393 10 0 GGAEHN CN(C)c1cc(Cl)cc(Cl)c1CNCCC1(CS(C)(=O)=O)CC1 ZINC000657546789 567069586 /nfs/dbraw/zinc/06/95/86/567069586.db2.gz CUAMIVXUUDIBMY-UHFFFAOYSA-N 0 3 379.353 3.364 10 0 GGAEHN Cc1nn(-c2ccc(Cl)cc2)cc1CNCCC1(CS(C)(=O)=O)CC1 ZINC000657547033 567069657 /nfs/dbraw/zinc/06/96/57/567069657.db2.gz AFTYROPQTMZRSL-UHFFFAOYSA-N 0 3 381.929 3.139 10 0 GGAEHN O=S1(=O)CC[C@@H](CCN(Cc2cccc(Br)c2)CC2CC2)C1 ZINC000682776891 567070300 /nfs/dbraw/zinc/07/03/00/567070300.db2.gz ADVDRMVONNDSEJ-OAHLLOKOSA-N 0 3 386.355 3.486 10 0 GGAEHN OCCN1CCCC[C@H]1CN[C@H]1CCCOc2ccc(Br)cc21 ZINC000453270779 567071237 /nfs/dbraw/zinc/07/12/37/567071237.db2.gz SPEVSIAIPCVHHM-RDJZCZTQSA-N 0 3 383.330 3.099 10 0 GGAEHN OCCN1CCCC[C@@H]1CN[C@@H]1CCCOc2ccc(Br)cc21 ZINC000453270776 567071272 /nfs/dbraw/zinc/07/12/72/567071272.db2.gz SPEVSIAIPCVHHM-NVXWUHKLSA-N 0 3 383.330 3.099 10 0 GGAEHN COC[C@@H](NCc1nc(-c2cccc(Br)c2)c[nH]1)C1CCOCC1 ZINC000657566088 567071338 /nfs/dbraw/zinc/07/13/38/567071338.db2.gz ZWESKCZJRIZPHX-QGZVFWFLSA-N 0 3 394.313 3.370 10 0 GGAEHN CC[C@H](N[C@H](C)c1ccc(F)c(I)c1)[C@H](O)C(F)F ZINC000453268001 567071431 /nfs/dbraw/zinc/07/14/31/567071431.db2.gz JDRRSYWUYHDKQL-MKCWBWRRSA-N 0 3 387.183 3.486 10 0 GGAEHN COC[C@H](NCc1nc(-c2cccc(Br)c2)c[nH]1)C1CCOCC1 ZINC000657566086 567071520 /nfs/dbraw/zinc/07/15/20/567071520.db2.gz ZWESKCZJRIZPHX-KRWDZBQOSA-N 0 3 394.313 3.370 10 0 GGAEHN COc1sc(CN[C@H](CO)[C@@H]2CCC[C@@H](OC)C2)cc1Br ZINC000657576225 567072664 /nfs/dbraw/zinc/07/26/64/567072664.db2.gz ITNQCXLNQUHKGR-JTNHKYCSSA-N 0 3 378.332 3.175 10 0 GGAEHN C[C@H](NCCOc1ccc(Cl)c(Cl)c1)c1ccc(S(N)(=O)=O)cc1 ZINC000453298141 567072984 /nfs/dbraw/zinc/07/29/84/567072984.db2.gz UHVFTURJTYHFGD-NSHDSACASA-N 0 3 389.304 3.370 10 0 GGAEHN COc1sc(CN[C@H](CO)[C@H]2CCC[C@@H](OC)C2)cc1Br ZINC000657576226 567073052 /nfs/dbraw/zinc/07/30/52/567073052.db2.gz ITNQCXLNQUHKGR-MISXGVKJSA-N 0 3 378.332 3.175 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)c1csc(I)c1 ZINC000521671416 567073927 /nfs/dbraw/zinc/07/39/27/567073927.db2.gz FUDSCFNKOATZMY-QWRGUYRKSA-N 0 3 392.306 3.345 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)c1cc(Br)c2c(c1)OCCO2 ZINC000521683521 567074088 /nfs/dbraw/zinc/07/40/88/567074088.db2.gz HGIPLMXYFPGOGP-STQMWFEESA-N 0 3 397.313 3.213 10 0 GGAEHN O[C@@H]1CCN(Cc2ccc(CNCc3csc(Br)c3)cc2)C1 ZINC000657594298 567074339 /nfs/dbraw/zinc/07/43/39/567074339.db2.gz IDVIMIVMLZYLFT-MRXNPFEDSA-N 0 3 381.339 3.367 10 0 GGAEHN O[C@H]1CCN(Cc2ccc(CNCc3csc(Br)c3)cc2)C1 ZINC000657594296 567075108 /nfs/dbraw/zinc/07/51/08/567075108.db2.gz IDVIMIVMLZYLFT-INIZCTEOSA-N 0 3 381.339 3.367 10 0 GGAEHN Cc1c(Br)cncc1CNCc1ccc(CN2CC[C@@H](O)C2)cc1 ZINC000657594492 567075153 /nfs/dbraw/zinc/07/51/53/567075153.db2.gz AUEDBLXHJRXEOP-GOSISDBHSA-N 0 3 390.325 3.009 10 0 GGAEHN O[C@@H]1CCN(Cc2ccc(CNCc3sccc3Br)cc2)C1 ZINC000657594849 567075400 /nfs/dbraw/zinc/07/54/00/567075400.db2.gz DICOFROCIUOMKM-OAHLLOKOSA-N 0 3 381.339 3.367 10 0 GGAEHN O[C@@H]1CCN(Cc2ccc(CNCc3ccccc3Br)cc2)C1 ZINC000657596740 567075501 /nfs/dbraw/zinc/07/55/01/567075501.db2.gz YJTLZGRUMIQYFB-GOSISDBHSA-N 0 3 375.310 3.306 10 0 GGAEHN Cc1cc(NC(=O)Cc2cscc2Br)n(C2CCN(C)CC2)n1 ZINC000584854715 567075996 /nfs/dbraw/zinc/07/59/96/567075996.db2.gz ZGWCMGLMVFHGOD-UHFFFAOYSA-N 0 3 397.342 3.463 10 0 GGAEHN FC1(F)C[C@@H]1OCCNCc1cc(Br)c2c(c1)OCCCO2 ZINC000657617830 567076832 /nfs/dbraw/zinc/07/68/32/567076832.db2.gz FMIXKZFOFYUXRH-ZDUSSCGKSA-N 0 3 378.213 3.124 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CNCCO[C@H]1CC1(F)F ZINC000657619833 567077208 /nfs/dbraw/zinc/07/72/08/567077208.db2.gz VBLRICXXKUNDRB-HNNXBMFYSA-N 0 3 386.240 3.457 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CNCCO[C@@H]1CC1(F)F ZINC000657619025 567077292 /nfs/dbraw/zinc/07/72/92/567077292.db2.gz KCIUCRSMPOIRNQ-OAHLLOKOSA-N 0 3 386.240 3.457 10 0 GGAEHN CCN(C)C(=O)CCN1CCC[C@@H]1c1ccccc1I ZINC000431383719 567078090 /nfs/dbraw/zinc/07/80/90/567078090.db2.gz FNSLDUJKTZOVMQ-OAHLLOKOSA-N 0 3 386.277 3.297 10 0 GGAEHN CCN(C)C(=O)CCN1CCC[C@H]1c1ccccc1I ZINC000431383718 567078113 /nfs/dbraw/zinc/07/81/13/567078113.db2.gz FNSLDUJKTZOVMQ-HNNXBMFYSA-N 0 3 386.277 3.297 10 0 GGAEHN C[C@H]1CC[C@H](NCc2ccnc3c(Br)cccc23)CS1(=O)=O ZINC000657637457 567078752 /nfs/dbraw/zinc/07/87/52/567078752.db2.gz IVHAATIKNYVWEF-AAEUAGOBSA-N 0 3 383.311 3.053 10 0 GGAEHN C[C@H](Cc1ccc(F)cc1Br)N[C@@H]1CC[C@H](C)S(=O)(=O)C1 ZINC000657640236 567080084 /nfs/dbraw/zinc/08/00/84/567080084.db2.gz WRKQGQIHLXSGRW-UHIISALHSA-N 0 3 378.307 3.075 10 0 GGAEHN CN(C)C[C@]1(O)CCCN(C(=O)c2sc3ccccc3c2Br)C1 ZINC000614064327 567080376 /nfs/dbraw/zinc/08/03/76/567080376.db2.gz NWLUSXPUDCIDMQ-QGZVFWFLSA-N 0 3 397.338 3.193 10 0 GGAEHN Cc1ccc(C(=O)N2CCC(OCCN(C)C)CC2)c(C)c1Br ZINC000682899934 567080988 /nfs/dbraw/zinc/08/09/88/567080988.db2.gz SFGRXPVWKNDUEG-UHFFFAOYSA-N 0 3 383.330 3.249 10 0 GGAEHN Cc1cc2c(o1)c(C(=O)N1CCC[C@@](O)(CN(C)C)C1)ccc2Br ZINC000614065123 567081125 /nfs/dbraw/zinc/08/11/25/567081125.db2.gz KYXJTEOLHNMMMW-GOSISDBHSA-N 0 3 395.297 3.032 10 0 GGAEHN CN(C)C[C@]1(O)CCCN(C(=O)c2cccc3cccc(Br)c32)C1 ZINC000614063925 567081190 /nfs/dbraw/zinc/08/11/90/567081190.db2.gz JLEIWOQSPMKUEP-LJQANCHMSA-N 0 3 391.309 3.131 10 0 GGAEHN Cc1ccc(C(=O)NC2CCN([C@H]3CCOC3)CC2)c(C)c1Br ZINC000682917979 567082921 /nfs/dbraw/zinc/08/29/21/567082921.db2.gz GPKRONOFERIIJA-HNNXBMFYSA-N 0 3 381.314 3.049 10 0 GGAEHN CC(C)(C)O[C@@H]1C[C@H](NCc2ccc(S(N)(=O)=O)c(Cl)c2)C12CCC2 ZINC000657703139 567085782 /nfs/dbraw/zinc/08/57/82/567085782.db2.gz UTDMJUBTMKRSQF-JKSUJKDBSA-N 0 3 386.945 3.203 10 0 GGAEHN Cn1cc(C[C@@H]2CCC[C@H]2NCc2cc3c(cc2Br)OCO3)cn1 ZINC000657689907 567086447 /nfs/dbraw/zinc/08/64/47/567086447.db2.gz ZMURWBGBEZWDNX-XJKSGUPXSA-N 0 3 392.297 3.412 10 0 GGAEHN CCOc1cc(CNCCc2cncc(C)n2)cc(Br)c1OC ZINC000657709907 567088289 /nfs/dbraw/zinc/08/82/89/567088289.db2.gz JAQZUMJKMUXLLR-UHFFFAOYSA-N 0 3 380.286 3.287 10 0 GGAEHN CCC(=O)N1CCC(NCc2nc3cc(Br)ccc3n2CC)CC1 ZINC000683001535 567090732 /nfs/dbraw/zinc/09/07/32/567090732.db2.gz STRSXSBVLVUBOY-UHFFFAOYSA-N 0 3 393.329 3.309 10 0 GGAEHN COc1ccc(Br)c(CN[C@@H]2C[C@@H](N3CCOCC3)C23CCC3)c1 ZINC000657746583 567091596 /nfs/dbraw/zinc/09/15/96/567091596.db2.gz GOWUQMLUYJJTJC-QZTJIDSGSA-N 0 3 395.341 3.191 10 0 GGAEHN Fc1c(Br)cccc1CN[C@@H]1C[C@@H](N2CCOCC2)C12CCC2 ZINC000657749679 567092872 /nfs/dbraw/zinc/09/28/72/567092872.db2.gz ZYERFUKOTURRRN-HZPDHXFCSA-N 0 3 383.305 3.321 10 0 GGAEHN CCS(=O)(=O)C1(CNCc2ccnc3c(Br)cccc23)CC1 ZINC000657758356 567093265 /nfs/dbraw/zinc/09/32/65/567093265.db2.gz HVPPCNFMBUWDCY-UHFFFAOYSA-N 0 3 383.311 3.054 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)NC1(CN(C)C)CCC1 ZINC000545991697 567094076 /nfs/dbraw/zinc/09/40/76/567094076.db2.gz BDNXJZJYWZWGSL-UHFFFAOYSA-N 0 3 378.314 3.313 10 0 GGAEHN NC(=O)[C@H](N[C@@H]1CCC[C@@H]([C@H]2CCOC2)C1)c1cccc(Br)c1 ZINC000545983433 567094315 /nfs/dbraw/zinc/09/43/15/567094315.db2.gz IIDCENIDXUNYCO-JWZBEHFJSA-N 0 3 381.314 3.160 10 0 GGAEHN Cc1c(Br)cncc1C(=O)NC[C@H]1CCN(Cc2ccccc2)C1 ZINC000614238139 567096322 /nfs/dbraw/zinc/09/63/22/567096322.db2.gz RKLHYORHLBXFLU-MRXNPFEDSA-N 0 3 388.309 3.404 10 0 GGAEHN COCCN(CCN(C)C)C(=O)c1coc2c1cc(Br)cc2C ZINC000473717651 567097787 /nfs/dbraw/zinc/09/77/87/567097787.db2.gz MONWNSKYPSKTFU-UHFFFAOYSA-N 0 3 383.286 3.154 10 0 GGAEHN Cc1nc2ccc(CNCc3ccc(N(C)S(C)(=O)=O)cc3)cc2s1 ZINC000683145986 567098166 /nfs/dbraw/zinc/09/81/66/567098166.db2.gz TZRPCZNKFHKXQQ-UHFFFAOYSA-N 0 3 375.519 3.290 10 0 GGAEHN CN(CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[C@H]1CCN(C2CC2)C1 ZINC000522068443 567098603 /nfs/dbraw/zinc/09/86/03/567098603.db2.gz RBOKQTRSMXJWLB-ZDUSSCGKSA-N 0 3 375.822 3.466 10 0 GGAEHN Cc1cc(NC(=O)Nc2cnn(CCN(C)C)c2)cc(C)c1Br ZINC000683155822 567099105 /nfs/dbraw/zinc/09/91/05/567099105.db2.gz OPSZBSQDXWBGGJ-UHFFFAOYSA-N 0 3 380.290 3.468 10 0 GGAEHN CC(C)(C)n1cc(Br)c(C(=O)NC2CC(N3CCCCC3)C2)n1 ZINC000614278227 567099439 /nfs/dbraw/zinc/09/94/39/567099439.db2.gz JFCHXXBZPNPQPD-UHFFFAOYSA-N 0 3 383.334 3.147 10 0 GGAEHN COC[C@H](CC1CCOCC1)NCc1cc2c(c(Br)c1)OCO2 ZINC000657848853 567099878 /nfs/dbraw/zinc/09/98/78/567099878.db2.gz BTGMEVAKCUVIIF-AWEZNQCLSA-N 0 3 386.286 3.099 10 0 GGAEHN OC[C@H](CNCc1cn2cccc(F)c2n1)Cc1ccccc1Br ZINC000683206028 567105569 /nfs/dbraw/zinc/10/55/69/567105569.db2.gz LUWIZKWIQYXFCS-ZDUSSCGKSA-N 0 3 392.272 3.177 10 0 GGAEHN CCN(CC)CCN(CC(C)C)C(=O)C(=O)c1ccc(Br)cc1 ZINC000522253050 567108282 /nfs/dbraw/zinc/10/82/82/567108282.db2.gz WQGQRMXQPZZBQH-UHFFFAOYSA-N 0 3 383.330 3.458 10 0 GGAEHN COC[C@H](CC1CCOCC1)NCc1cn2cc(Br)cc(C)c2n1 ZINC000657974380 567110052 /nfs/dbraw/zinc/11/00/52/567110052.db2.gz OOUWLRXAANSSGE-INIZCTEOSA-N 0 3 396.329 3.327 10 0 GGAEHN CN(CCN(C)C1CC1)C(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000473902919 567112497 /nfs/dbraw/zinc/11/24/97/567112497.db2.gz DNOZNCUMLRRMSR-HNNXBMFYSA-N 0 3 382.302 3.008 10 0 GGAEHN CC(C)[C@H](NC[C@H](O)COc1c(Cl)cccc1Cl)[C@H](O)C(F)(F)F ZINC000565950561 567113209 /nfs/dbraw/zinc/11/32/09/567113209.db2.gz IIJLDBXTHTYSJA-WFBYXXMGSA-N 0 3 390.229 3.271 10 0 GGAEHN CS[C@@H]1CN(C(=O)Nc2cccc(OCC(F)(F)F)c2)C[C@@H]1N(C)C ZINC000497655149 567114148 /nfs/dbraw/zinc/11/41/48/567114148.db2.gz BMSJHFRGBXKXER-UONOGXRCSA-N 0 3 377.432 3.137 10 0 GGAEHN CS[C@@H]1CN(C(=O)Nc2cccc(OCC(F)(F)F)c2)C[C@H]1N(C)C ZINC000497655150 567114939 /nfs/dbraw/zinc/11/49/39/567114939.db2.gz BMSJHFRGBXKXER-ZIAGYGMSSA-N 0 3 377.432 3.137 10 0 GGAEHN Cc1c(C(=O)NC[C@H](CN(C)C)c2ccc(Cl)cc2)sc2nccn12 ZINC000565976480 567115625 /nfs/dbraw/zinc/11/56/25/567115625.db2.gz KGVODFAWQAMHPT-CQSZACIVSA-N 0 3 376.913 3.433 10 0 GGAEHN Cc1ccc(C(=O)NCCCN2CCCO[C@H](C)C2)c(C)c1Br ZINC000683347578 567116892 /nfs/dbraw/zinc/11/68/92/567116892.db2.gz UCCKUJPSCQKBHE-CQSZACIVSA-N 0 3 383.330 3.297 10 0 GGAEHN COC[C@H](CC1CCOCC1)NCc1cc(OC)c(O)cc1Br ZINC000658042279 567116896 /nfs/dbraw/zinc/11/68/96/567116896.db2.gz BZKZGRRONXBNAL-AWEZNQCLSA-N 0 3 388.302 3.085 10 0 GGAEHN Cc1ccc(C(=O)NCCCN2CCCO[C@@H](C)C2)c(C)c1Br ZINC000683347577 567117625 /nfs/dbraw/zinc/11/76/25/567117625.db2.gz UCCKUJPSCQKBHE-AWEZNQCLSA-N 0 3 383.330 3.297 10 0 GGAEHN CCS(=O)(=O)c1cc(Cl)cc(CN[C@@H](COC)CC2CCOCC2)c1 ZINC000658034289 567117536 /nfs/dbraw/zinc/11/75/36/567117536.db2.gz KLAARRPAFCMHSG-QGZVFWFLSA-N 0 3 389.945 3.055 10 0 GGAEHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)NCCc2ccccc2Br)C1 ZINC000497691506 567118100 /nfs/dbraw/zinc/11/81/00/567118100.db2.gz PCXNEUXEVVACGP-DOTOQJQBSA-N 0 3 380.330 3.117 10 0 GGAEHN COC1CC(CCN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)C1 ZINC000658057833 567118825 /nfs/dbraw/zinc/11/88/25/567118825.db2.gz ZKWXEXBZJWWRES-ABIUDSBCSA-N 0 3 388.327 3.072 10 0 GGAEHN C[C@H](NC[C@H]1CCN1C(C)(C)C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000658060183 567119119 /nfs/dbraw/zinc/11/91/19/567119119.db2.gz KGVZBSUNOKEYBM-WDEREUQCSA-N 0 3 394.368 3.164 10 0 GGAEHN C[C@@H](NCCC1(CS(C)(=O)=O)CC1)c1cc(Br)ccc1F ZINC000658078138 567120511 /nfs/dbraw/zinc/12/05/11/567120511.db2.gz OJEVNJHZIACKHP-LLVKDONJSA-N 0 3 378.307 3.454 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1c(C)cc(C)cc1Br ZINC000431994283 567120910 /nfs/dbraw/zinc/12/09/10/567120910.db2.gz VTALXFUVHFRHCD-CQSZACIVSA-N 0 3 384.318 3.298 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1c(C)cc(C)cc1Br ZINC000431994282 567121334 /nfs/dbraw/zinc/12/13/34/567121334.db2.gz VTALXFUVHFRHCD-AWEZNQCLSA-N 0 3 384.318 3.298 10 0 GGAEHN COC(=O)CC1CCN(C[C@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000497732815 567121295 /nfs/dbraw/zinc/12/12/95/567121295.db2.gz RFCVMMGVYJBHEN-ZDUSSCGKSA-N 0 3 376.280 3.008 10 0 GGAEHN C[C@H]1CCCC[N@@H+]1CCCCNC(=O)Cc1ccc(Br)cc1[O-] ZINC000431992774 567121881 /nfs/dbraw/zinc/12/18/81/567121881.db2.gz GQPDDKDXUHXQHA-AWEZNQCLSA-N 0 3 383.330 3.468 10 0 GGAEHN C[C@H]1CCCC[N@H+]1CCCCNC(=O)Cc1ccc(Br)cc1[O-] ZINC000431992774 567121884 /nfs/dbraw/zinc/12/18/84/567121884.db2.gz GQPDDKDXUHXQHA-AWEZNQCLSA-N 0 3 383.330 3.468 10 0 GGAEHN CN(C)CCn1cc(NC(=O)c2ccc(Br)c(Cl)c2F)cn1 ZINC000683442588 567123939 /nfs/dbraw/zinc/12/39/39/567123939.db2.gz BUFNIRCJHRTEIQ-UHFFFAOYSA-N 0 3 389.656 3.252 10 0 GGAEHN C[C@H](NCc1ccc(CN2CC[C@H](O)C2)cc1)c1ncc(Br)s1 ZINC000658136795 567124265 /nfs/dbraw/zinc/12/42/65/567124265.db2.gz IIUNHDLYOPEBOF-WFASDCNBSA-N 0 3 396.354 3.323 10 0 GGAEHN C[C@@H](NC[C@]1(OCCO)CCOC1)c1cc2cc(Br)ccc2o1 ZINC000658148321 567126156 /nfs/dbraw/zinc/12/61/56/567126156.db2.gz LCFFQOKRJXNUBU-SJKOYZFVSA-N 0 3 384.270 3.014 10 0 GGAEHN COc1ccc([C@H](CN(C)C)NC(=O)c2cncc(Br)c2C)cc1 ZINC000614612147 567126596 /nfs/dbraw/zinc/12/65/96/567126596.db2.gz TWOQRVPUCCEKPT-KRWDZBQOSA-N 0 3 392.297 3.194 10 0 GGAEHN C[N@@H+]1CCCC[C@H]1CCC(=O)Nc1cc(I)ccc1[O-] ZINC000588351917 567128626 /nfs/dbraw/zinc/12/86/26/567128626.db2.gz NZKJIQSLOXNLOU-LBPRGKRZSA-N 0 3 388.249 3.200 10 0 GGAEHN C[N@H+]1CCCC[C@H]1CCC(=O)Nc1cc(I)ccc1[O-] ZINC000588351917 567128629 /nfs/dbraw/zinc/12/86/29/567128629.db2.gz NZKJIQSLOXNLOU-LBPRGKRZSA-N 0 3 388.249 3.200 10 0 GGAEHN CCCN1CCC(CNS(=O)(=O)c2cccc(Br)c2C)CC1 ZINC000474079834 567130728 /nfs/dbraw/zinc/13/07/28/567130728.db2.gz LBXAQIFMQZAYFP-UHFFFAOYSA-N 0 3 389.359 3.158 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N1CC[C@H](Cc2ccc(Br)cc2)C1 ZINC000432099587 567132396 /nfs/dbraw/zinc/13/23/96/567132396.db2.gz RFNLWZWLTMXWPK-WBVHZDCISA-N 0 3 380.330 3.117 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)N1CCc2c(Br)cccc2C1 ZINC000522846939 567133260 /nfs/dbraw/zinc/13/32/60/567133260.db2.gz WCQLIGRGZCCRIP-HNNXBMFYSA-N 0 3 382.346 3.493 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)NCc1ccsc1Br ZINC000566192907 567134888 /nfs/dbraw/zinc/13/48/88/567134888.db2.gz FLBSGTYQIUHOBI-AWEZNQCLSA-N 0 3 380.311 3.278 10 0 GGAEHN O=C1N(CCN[C@H]2CCc3c2cc(Br)cc3F)C[C@H]2CCCCN12 ZINC000658305605 567136320 /nfs/dbraw/zinc/13/63/20/567136320.db2.gz AVTVZEXNNWKFSR-DYVFJYSZSA-N 0 3 396.304 3.455 10 0 GGAEHN O=C1N(CCN[C@H]2CCc3c2cc(Br)cc3F)C[C@@H]2CCCCN12 ZINC000658305606 567136414 /nfs/dbraw/zinc/13/64/14/567136414.db2.gz AVTVZEXNNWKFSR-GUYCJALGSA-N 0 3 396.304 3.455 10 0 GGAEHN COc1ccc([C@@H](C)NCCN2C[C@H]3CCCCN3C2=O)cc1Br ZINC000658309179 567136515 /nfs/dbraw/zinc/13/65/15/567136515.db2.gz NQSVUUUGZRMFMB-UKRRQHHQSA-N 0 3 396.329 3.398 10 0 GGAEHN O=C1N(CCN[C@@H]2CCc3ccc(Br)cc32)C[C@@H]2CCCCN12 ZINC000658304963 567136531 /nfs/dbraw/zinc/13/65/31/567136531.db2.gz IDMAGYYQJRPBOT-DOTOQJQBSA-N 0 3 378.314 3.316 10 0 GGAEHN CN(Cc1ccc(F)cc1Br)C(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C ZINC000566195898 567137632 /nfs/dbraw/zinc/13/76/32/567137632.db2.gz SJFNMFASXAGDDO-JCKWVBRZSA-N 0 3 399.304 3.079 10 0 GGAEHN CCc1ccc(S(=O)(=O)NC2CCN(CCc3ccccc3)CC2)s1 ZINC000614792479 567139225 /nfs/dbraw/zinc/13/92/25/567139225.db2.gz ONQIRIJVDVQELI-UHFFFAOYSA-N 0 3 378.563 3.296 10 0 GGAEHN C[C@@H](NC[C@@H]1CSc2ccccc2O1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000566220670 567139174 /nfs/dbraw/zinc/13/91/74/567139174.db2.gz LAJSBBDECOITLU-TZMCWYRMSA-N 0 3 381.494 3.433 10 0 GGAEHN O=C(CN1CCNC[C@@H]1C(F)F)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000566243539 567142457 /nfs/dbraw/zinc/14/24/57/567142457.db2.gz WUWCYJWTROOVJL-HUUCEWRRSA-N 0 3 392.277 3.196 10 0 GGAEHN CSc1ccc(S(=O)(=O)N2CC[C@H](c3ccc(F)cc3)[C@@H](N)C2)cc1 ZINC000658405846 567142816 /nfs/dbraw/zinc/14/28/16/567142816.db2.gz YOWRJXZJBQSLHX-MSOLQXFVSA-N 0 3 380.510 3.053 10 0 GGAEHN COCC[C@H]1CCCCN(Cc2cc(=O)n3cc(Br)ccc3n2)C1 ZINC000546642694 567145909 /nfs/dbraw/zinc/14/59/09/567145909.db2.gz WKMLSSGOCGMGHU-CQSZACIVSA-N 0 3 394.313 3.096 10 0 GGAEHN CN(CCC(=O)NCc1cc2cc(Br)ccc2[nH]1)c1ccncc1 ZINC000546663748 567147800 /nfs/dbraw/zinc/14/78/00/567147800.db2.gz PPPCRZYNJBVHMC-UHFFFAOYSA-N 0 3 387.281 3.468 10 0 GGAEHN CCN1CCC[C@@H](CNS(=O)(=O)c2c(C)cc(Br)cc2C)C1 ZINC000546731573 567152442 /nfs/dbraw/zinc/15/24/42/567152442.db2.gz DOZCOGUPCQUNHF-AWEZNQCLSA-N 0 3 389.359 3.076 10 0 GGAEHN CCN1CCC[C@H](CNS(=O)(=O)c2c(C)cc(Br)cc2C)C1 ZINC000546731574 567152464 /nfs/dbraw/zinc/15/24/64/567152464.db2.gz DOZCOGUPCQUNHF-CQSZACIVSA-N 0 3 389.359 3.076 10 0 GGAEHN Cc1nc(N[C@H](CO)c2ccsc2)cc(N[C@H](CO)c2ccsc2)n1 ZINC000546732522 567152890 /nfs/dbraw/zinc/15/28/90/567152890.db2.gz INBVQYIEQVLRCG-HUUCEWRRSA-N 0 3 376.507 3.199 10 0 GGAEHN Cc1nc(N[C@@H](CO)c2ccsc2)cc(N[C@@H](CO)c2ccsc2)n1 ZINC000546732521 567153143 /nfs/dbraw/zinc/15/31/43/567153143.db2.gz INBVQYIEQVLRCG-GJZGRUSLSA-N 0 3 376.507 3.199 10 0 GGAEHN Cc1ccccc1CN1CCCN(Cc2c(Br)cnn2C)CC1 ZINC000683825451 567157537 /nfs/dbraw/zinc/15/75/37/567157537.db2.gz IMBCQEUVEZGMHQ-UHFFFAOYSA-N 0 3 377.330 3.199 10 0 GGAEHN C[C@@H]1CCC[C@](CNC(=O)Cc2ccc(Br)cc2[O-])([NH+](C)C)C1 ZINC000432408607 567158158 /nfs/dbraw/zinc/15/81/58/567158158.db2.gz CLKJWTQKNZPDGT-ACJLOTCBSA-N 0 3 383.330 3.324 10 0 GGAEHN CN(C)C[C@]1(O)CCCN(C(=O)c2csc(-c3ccc(Cl)s3)n2)C1 ZINC000683913599 567160232 /nfs/dbraw/zinc/16/02/32/567160232.db2.gz YURSKIVLNFPRDV-MRXNPFEDSA-N 0 3 385.942 3.054 10 0 GGAEHN CN(C)C[C@@]1(O)CCCN(C(=O)CCCc2cc(Cl)sc2Cl)C1 ZINC000683910808 567160288 /nfs/dbraw/zinc/16/02/88/567160288.db2.gz WDHZJMGTMHSWPT-INIZCTEOSA-N 0 3 379.353 3.293 10 0 GGAEHN C[C@H](NC(=O)NCCN1[C@@H](C)CCC[C@@H]1C)c1ccc(Br)cn1 ZINC000474334074 567160813 /nfs/dbraw/zinc/16/08/13/567160813.db2.gz TZGULLJGNRJRCK-IHRRRGAJSA-N 0 3 383.334 3.467 10 0 GGAEHN CN(Cc1nc(-c2cccc(Br)c2)no1)[C@@H]1CCN(C2CC2)C1 ZINC000523583011 567163888 /nfs/dbraw/zinc/16/38/88/567163888.db2.gz PZISYTKXTCGAES-OAHLLOKOSA-N 0 3 377.286 3.168 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)COc1ccc(Br)cc1Cl ZINC000498322795 567167208 /nfs/dbraw/zinc/16/72/08/567167208.db2.gz MHLLPOWFOZXBSG-GFCCVEGCSA-N 0 3 389.721 3.472 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)COc1ccc(Br)cc1Cl ZINC000498322796 567167798 /nfs/dbraw/zinc/16/77/98/567167798.db2.gz MHLLPOWFOZXBSG-LBPRGKRZSA-N 0 3 389.721 3.472 10 0 GGAEHN Cc1cc(Br)oc1C(=O)N1CC[C@H](c2cccc(F)c2)[C@H](N)C1 ZINC000658948040 567171070 /nfs/dbraw/zinc/17/10/70/567171070.db2.gz RUVFYRXZTNCHPG-ZIAGYGMSSA-N 0 3 381.245 3.447 10 0 GGAEHN N[C@@H]1CN(C(=O)Cc2ccccc2Br)CC[C@@H]1c1cccc(F)c1 ZINC000658947067 567171481 /nfs/dbraw/zinc/17/14/81/567171481.db2.gz IBCPVOGGWNZKPD-SJLPKXTDSA-N 0 3 391.284 3.474 10 0 GGAEHN CN(C(=O)NCC1(c2cccc(Br)c2)CC1)[C@@H]1CCN(C2CC2)C1 ZINC000523808563 567172545 /nfs/dbraw/zinc/17/25/45/567172545.db2.gz NJFYBFHZLBUKIC-QGZVFWFLSA-N 0 3 392.341 3.359 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)CCCc1cccc(Br)c1 ZINC000615265994 567172755 /nfs/dbraw/zinc/17/27/55/567172755.db2.gz QXJDRSIZMYFSRG-MSOLQXFVSA-N 0 3 395.341 3.093 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N1CCOC[C@@H]1[C@H]1CCCN1C ZINC000615266674 567173809 /nfs/dbraw/zinc/17/38/09/567173809.db2.gz ONJSDNQFVCYHLB-APHBMKBZSA-N 0 3 387.307 3.082 10 0 GGAEHN Cc1cc(Br)cc(C(=O)N2CCOC[C@H]2[C@@H]2CCCN2C)c1C ZINC000615274493 567174459 /nfs/dbraw/zinc/17/44/59/567174459.db2.gz JICPGWHTPPAYFF-IRXDYDNUSA-N 0 3 381.314 3.001 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)CCCc1ccccc1Br ZINC000615268761 567175210 /nfs/dbraw/zinc/17/52/10/567175210.db2.gz IFGGNLOLHGZKHV-ROUUACIJSA-N 0 3 395.341 3.093 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000615271760 567175617 /nfs/dbraw/zinc/17/56/17/567175617.db2.gz YIHSJROWKYAHKR-GJZGRUSLSA-N 0 3 376.806 3.294 10 0 GGAEHN Cc1cc(C)c(Br)c(C(=O)N2CCOC[C@H]2[C@@H]2CCCN2C)c1 ZINC000615268494 567175642 /nfs/dbraw/zinc/17/56/42/567175642.db2.gz HNWVWHSDYDWWOI-HOTGVXAUSA-N 0 3 381.314 3.001 10 0 GGAEHN Cc1cc(C)c(Br)c(C(=O)N2CCOC[C@@H]2[C@H]2CCCN2C)c1 ZINC000615268495 567175728 /nfs/dbraw/zinc/17/57/28/567175728.db2.gz HNWVWHSDYDWWOI-HZPDHXFCSA-N 0 3 381.314 3.001 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N1CCOC[C@H]1[C@@H]1CCCN1C ZINC000615266678 567175888 /nfs/dbraw/zinc/17/58/88/567175888.db2.gz ONJSDNQFVCYHLB-RCBQFDQVSA-N 0 3 387.307 3.082 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)Cc1cscc1Br ZINC000432647876 567177527 /nfs/dbraw/zinc/17/75/27/567177527.db2.gz WHODFJMCYFQZMP-HNNXBMFYSA-N 0 3 381.339 3.342 10 0 GGAEHN O=C(NCc1ccsc1Br)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659046660 567179092 /nfs/dbraw/zinc/17/90/92/567179092.db2.gz NZLIDCUTLNQYHN-AWEZNQCLSA-N 0 3 396.310 3.493 10 0 GGAEHN O=C(NCc1sccc1Br)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659033862 567179660 /nfs/dbraw/zinc/17/96/60/567179660.db2.gz YSOKCRJTLLKBGW-CQSZACIVSA-N 0 3 396.310 3.493 10 0 GGAEHN COc1ccc(CCC(=O)N2CC[C@]3(C2)CCCN(C)C3)c(Br)c1 ZINC000615354962 567180574 /nfs/dbraw/zinc/18/05/74/567180574.db2.gz BINNCRDJCCPSJT-LJQANCHMSA-N 0 3 395.341 3.335 10 0 GGAEHN CN(CCN(C)C1CC1)C(=O)CSCc1ccc(Br)cc1F ZINC000474586303 567180811 /nfs/dbraw/zinc/18/08/11/567180811.db2.gz VIBFYKSRXCPZIQ-UHFFFAOYSA-N 0 3 389.334 3.374 10 0 GGAEHN Cc1cc2cc(C(=O)N3CCC[C@@](O)(CN(C)C)C3)oc2c(Br)c1 ZINC000684174701 567184512 /nfs/dbraw/zinc/18/45/12/567184512.db2.gz LRMPLPQKRVQGPT-GOSISDBHSA-N 0 3 395.297 3.032 10 0 GGAEHN CC(C)[C@@H](O)CN(C)Cc1cccc(Br)c1OC[C@@H]1CCCO1 ZINC000432793849 567192314 /nfs/dbraw/zinc/19/23/14/567192314.db2.gz QUCCRYKIXWNOLI-RDJZCZTQSA-N 0 3 386.330 3.456 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)c1ccc(Br)cc1C(F)(F)F ZINC000566796172 567192966 /nfs/dbraw/zinc/19/29/66/567192966.db2.gz MVISXAOKBXUTHX-SNVBAGLBSA-N 0 3 387.146 3.195 10 0 GGAEHN COc1ccc(CNC(=O)C[C@H]2NCc3ccccc32)cc1Br ZINC000659264165 567196568 /nfs/dbraw/zinc/19/65/68/567196568.db2.gz WKMMNHGQRTUTIG-MRXNPFEDSA-N 0 3 375.266 3.309 10 0 GGAEHN CC(C)[C@@H](O)CN1CCC(Oc2ccccc2I)CC1 ZINC000432833067 567196760 /nfs/dbraw/zinc/19/67/60/567196760.db2.gz BCSMNVFQZYQZQB-HNNXBMFYSA-N 0 3 389.277 3.151 10 0 GGAEHN O=C(NCc1ccc(Cl)cc1Cl)[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000524395153 567197175 /nfs/dbraw/zinc/19/71/75/567197175.db2.gz FBDAMCMTVKUZMP-LJQANCHMSA-N 0 3 379.287 3.247 10 0 GGAEHN C[C@H]1CN(CCCNc2ccc3cccc(Br)c3n2)CCCO1 ZINC000432851272 567198142 /nfs/dbraw/zinc/19/81/42/567198142.db2.gz AQESWBQKTFWYAK-AWEZNQCLSA-N 0 3 378.314 3.332 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2ccc(Br)c(C)c2F)C[C@@H]1N(C)C ZINC000566894997 567199218 /nfs/dbraw/zinc/19/92/18/567199218.db2.gz CUFONXJPRLGIOD-QWHCGFSZSA-N 0 3 375.307 3.014 10 0 GGAEHN C[C@H](CNC(=O)c1sc2c(c1Br)CNC2)N1CCCC[C@H]1C ZINC000659292349 567199713 /nfs/dbraw/zinc/19/97/13/567199713.db2.gz OSDWOQLKBLYYNN-GHMZBOCLSA-N 0 3 386.359 3.107 10 0 GGAEHN C[C@H](CNC(=O)c1sc2c(c1Br)CNC2)N1CCCC[C@@H]1C ZINC000659292357 567200087 /nfs/dbraw/zinc/20/00/87/567200087.db2.gz OSDWOQLKBLYYNN-WDEREUQCSA-N 0 3 386.359 3.107 10 0 GGAEHN CN(CCC(=O)N1CCOc2c(Br)cccc2C1)c1ccncc1 ZINC000684331417 567200860 /nfs/dbraw/zinc/20/08/60/567200860.db2.gz ATPXLHXATVYZLH-UHFFFAOYSA-N 0 3 390.281 3.092 10 0 GGAEHN O=C(Nc1cscc1Br)C(C[C@H]1COCCO1)C(F)(F)F ZINC000615734816 567202638 /nfs/dbraw/zinc/20/26/38/567202638.db2.gz ZCEQVQCXUDZONY-JGVFFNPUSA-N 0 3 388.205 3.433 10 0 GGAEHN CN(CCCCc1ccc(Cl)c(Cl)c1)CCN1CCCS1(=O)=O ZINC000684362913 567203808 /nfs/dbraw/zinc/20/38/08/567203808.db2.gz XUZPYXDMFJBUIT-UHFFFAOYSA-N 0 3 379.353 3.283 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)[C@@H]2CCc3cc(Br)ccc32)CCSC1 ZINC000566974817 567207422 /nfs/dbraw/zinc/20/74/22/567207422.db2.gz KHZNIWPOYVBIBS-NVXWUHKLSA-N 0 3 383.355 3.032 10 0 GGAEHN O=C(N[C@@H]1CCN(CC2CC2)C1)c1cc(F)c(Br)cc1Cl ZINC000684436788 567207491 /nfs/dbraw/zinc/20/74/91/567207491.db2.gz KWVQGMDMNCWYJF-SNVBAGLBSA-N 0 3 375.669 3.456 10 0 GGAEHN N[C@@H](Cc1ccccc1)C(=O)NCC1(Cc2ccc(Br)cc2)CC1 ZINC000659359027 567207649 /nfs/dbraw/zinc/20/76/49/567207649.db2.gz NRSFWBCHWXKXDZ-SFHVURJKSA-N 0 3 387.321 3.458 10 0 GGAEHN O=C(Cc1ccc(Br)c(F)c1)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659366434 567209179 /nfs/dbraw/zinc/20/91/79/567209179.db2.gz JWRBGUHQDTWMIH-KRWDZBQOSA-N 0 3 393.256 3.430 10 0 GGAEHN O=C(CCOC1CNC1)N1CCc2sccc2[C@@H]1c1ccc(Cl)cc1 ZINC000659373836 567209511 /nfs/dbraw/zinc/20/95/11/567209511.db2.gz WYWWPDWMCRBYLK-IBGZPJMESA-N 0 3 376.909 3.254 10 0 GGAEHN O=C(Cc1ccccc1Br)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659373022 567209803 /nfs/dbraw/zinc/20/98/03/567209803.db2.gz PBNOKJOCLAJWKC-KRWDZBQOSA-N 0 3 375.266 3.291 10 0 GGAEHN O=C(COc1ccc(Br)cc1)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659371727 567209918 /nfs/dbraw/zinc/20/99/18/567209918.db2.gz VZOLYIPCFUSCIN-QGZVFWFLSA-N 0 3 391.265 3.128 10 0 GGAEHN O=C(Cc1cc(F)ccc1Br)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659364053 567210270 /nfs/dbraw/zinc/21/02/70/567210270.db2.gz GLGYWMCMBGDIKI-QGZVFWFLSA-N 0 3 393.256 3.430 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)CCCOc1cccc(Cl)c1Cl ZINC000590117257 567210393 /nfs/dbraw/zinc/21/03/93/567210393.db2.gz LHIDFMSZEDYWGY-AWEZNQCLSA-N 0 3 389.323 3.379 10 0 GGAEHN O=C(c1ccc2c(c1)CNC2)N1CCOC[C@H]1c1cccc(Br)c1 ZINC000659367161 567210435 /nfs/dbraw/zinc/21/04/35/567210435.db2.gz JREBXZMWOVLSPN-SFHVURJKSA-N 0 3 387.277 3.266 10 0 GGAEHN COc1cc(Br)ccc1C(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659371697 567210443 /nfs/dbraw/zinc/21/04/43/567210443.db2.gz VMAOSRGYOAEPNO-QGZVFWFLSA-N 0 3 391.265 3.371 10 0 GGAEHN O=C(Cc1ccc(Br)cc1)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659371082 567210500 /nfs/dbraw/zinc/21/05/00/567210500.db2.gz UZRCUUCZJLQPEX-QGZVFWFLSA-N 0 3 375.266 3.291 10 0 GGAEHN COc1ccc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)c(Br)c1 ZINC000659372008 567210526 /nfs/dbraw/zinc/21/05/26/567210526.db2.gz XPNKDUCJADWPHM-QGZVFWFLSA-N 0 3 391.265 3.371 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)N[C@@H]2[C@H]3Cc4cc(Br)ccc4[C@@H]23)CCN1C ZINC000637650968 567211145 /nfs/dbraw/zinc/21/11/45/567211145.db2.gz RQFFLQMQHWMGRE-QMUUJGJKSA-N 0 3 392.341 3.211 10 0 GGAEHN Cc1ncc(Br)cc1NC(=O)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000615855034 567211199 /nfs/dbraw/zinc/21/11/99/567211199.db2.gz OAYQBMCNZIUWJW-MNOVXSKESA-N 0 3 397.191 3.075 10 0 GGAEHN N[C@@H]1CN(C(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)CC[C@H]1F ZINC000659388801 567211353 /nfs/dbraw/zinc/21/13/53/567211353.db2.gz MWBCMPUIXHEIAY-CHWSQXEVSA-N 0 3 381.860 3.165 10 0 GGAEHN COc1ccccc1[C@H]1[C@@H](N)CCCN1C(=O)c1cncc(Br)c1 ZINC000567022481 567211373 /nfs/dbraw/zinc/21/13/73/567211373.db2.gz QTKOVUQTIKQODX-RDJZCZTQSA-N 0 3 390.281 3.157 10 0 GGAEHN N[C@@H]1CN(C(=O)c2ccc(Oc3ccc(Br)cc3)nc2)CC[C@H]1F ZINC000659389086 567211810 /nfs/dbraw/zinc/21/18/10/567211810.db2.gz HZMYSHPHODCCGK-HUUCEWRRSA-N 0 3 394.244 3.148 10 0 GGAEHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)N[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]12 ZINC000637651163 567211927 /nfs/dbraw/zinc/21/19/27/567211927.db2.gz UHYLHEDPINDIAV-JDHAIZTISA-N 0 3 392.341 3.069 10 0 GGAEHN N[C@@H]1CN(C(=O)c2ccc(COc3ccc(Br)cc3)o2)CC[C@H]1F ZINC000659388825 567211993 /nfs/dbraw/zinc/21/19/93/567211993.db2.gz FFEBLTMCZZOERI-HUUCEWRRSA-N 0 3 397.244 3.132 10 0 GGAEHN O=C(C[C@@H]1CSCCN1)N[C@H]1CCCCc2cc(Br)ccc21 ZINC000659386494 567212211 /nfs/dbraw/zinc/21/22/11/567212211.db2.gz OUSVAZNNDOVKRN-ZBFHGGJFSA-N 0 3 383.355 3.428 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@@H]1CCCOCC1)c1ccc(Br)cn1 ZINC000567053282 567214245 /nfs/dbraw/zinc/21/42/45/567214245.db2.gz YBLQTSHTCTUXRL-OAHLLOKOSA-N 0 3 398.345 3.336 10 0 GGAEHN C[C@H](CNC(=O)N1CC[C@@H](F)[C@H](N)C1)Sc1ccc(Br)cc1 ZINC000659452206 567214594 /nfs/dbraw/zinc/21/45/94/567214594.db2.gz NRGOZFJIZCQWKN-LERXQTSPSA-N 0 3 390.322 3.010 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)N[C@H]2C[C@@H]2c2cccc(Br)c2)CCN1C ZINC000524787405 567215010 /nfs/dbraw/zinc/21/50/10/567215010.db2.gz QKJRVULWHSNNHN-YYQUZTFQSA-N 0 3 380.330 3.429 10 0 GGAEHN N[C@@H]1CN(C(=O)N[C@@H](c2ccc(Br)cc2)C2CCC2)CC[C@H]1F ZINC000659440637 567215401 /nfs/dbraw/zinc/21/54/01/567215401.db2.gz TTWYTBXOBFFDBG-BZUAXINKSA-N 0 3 384.293 3.371 10 0 GGAEHN CC[C@@H](NCCc1nnnn1C)c1ccc(Br)cc1C(F)(F)F ZINC000684552901 567216287 /nfs/dbraw/zinc/21/62/87/567216287.db2.gz QGMAMRWYZAUZBC-GFCCVEGCSA-N 0 3 392.223 3.275 10 0 GGAEHN CN(C[C@H](O)Cc1ccccc1)C[C@H](O)COc1c(Cl)cccc1Cl ZINC000433039166 567217510 /nfs/dbraw/zinc/21/75/10/567217510.db2.gz KOMWMTPXTGHZDO-CVEARBPZSA-N 0 3 384.303 3.269 10 0 GGAEHN CN(C[C@@H](O)COc1c(Cl)cccc1Cl)C[C@@H](O)Cc1ccccc1 ZINC000433039169 567217701 /nfs/dbraw/zinc/21/77/01/567217701.db2.gz KOMWMTPXTGHZDO-JKSUJKDBSA-N 0 3 384.303 3.269 10 0 GGAEHN CC(C)(C)n1cc(Br)c(C(=O)NC2CCN(C3CCC3)CC2)n1 ZINC000616002839 567218603 /nfs/dbraw/zinc/21/86/03/567218603.db2.gz AKDMQBCEHDYHMO-UHFFFAOYSA-N 0 3 383.334 3.147 10 0 GGAEHN CC1(C)Cc2c(cccc2Br)[C@H]1NC(=O)N1CC[C@@H](F)[C@H](N)C1 ZINC000659494974 567218861 /nfs/dbraw/zinc/21/88/61/567218861.db2.gz HQFSTGVOAIMDSR-RBSFLKMASA-N 0 3 384.293 3.153 10 0 GGAEHN CC(C)C[C@@H](CN1CCCC1)NC(=O)N[C@@H](C)c1ncc(Br)cn1 ZINC000454996331 567220786 /nfs/dbraw/zinc/22/07/86/567220786.db2.gz JUAPTAIJKGJYKS-ZFWWWQNUSA-N 0 3 398.349 3.110 10 0 GGAEHN CN(CCCCOc1cccc(C(F)(F)F)c1)C[C@@H]1CCS(=O)(=O)C1 ZINC000524892336 567220927 /nfs/dbraw/zinc/22/09/27/567220927.db2.gz ACZJQKBYTAGHEX-AWEZNQCLSA-N 0 3 379.444 3.231 10 0 GGAEHN CC(C)(NCC(=O)N1CCO[C@@H]2CCCC[C@@H]21)c1ccc(Br)cc1 ZINC000616010878 567221224 /nfs/dbraw/zinc/22/12/24/567221224.db2.gz QUQFENSZPXVTMO-DLBZAZTESA-N 0 3 395.341 3.444 10 0 GGAEHN Cc1cc(=O)[nH]c(C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)c1 ZINC000433104977 567222760 /nfs/dbraw/zinc/22/27/60/567222760.db2.gz NTSZQKLMXRAIJP-UHFFFAOYSA-N 0 3 392.297 3.062 10 0 GGAEHN O=C(NC[C@H]1CCCCN1CCO)Nc1ccc(Br)c(Cl)c1 ZINC000455015003 567223345 /nfs/dbraw/zinc/22/33/45/567223345.db2.gz ZUPSKCSTWGBJQL-GFCCVEGCSA-N 0 3 390.709 3.071 10 0 GGAEHN CN1CCC[C@H](NC(=O)N[C@H]2C[C@H](c3ccc(F)c(Br)c3)C2)C1 ZINC000684656095 567225091 /nfs/dbraw/zinc/22/50/91/567225091.db2.gz WNTVBOSXUZICME-IHRRRGAJSA-N 0 3 384.293 3.228 10 0 GGAEHN CCN(CCCN[C@@H](CO)c1cccc(Br)c1)CC(F)(F)F ZINC000475130399 567227633 /nfs/dbraw/zinc/22/76/33/567227633.db2.gz NSRKBHFVRACSFK-AWEZNQCLSA-N 0 3 383.252 3.346 10 0 GGAEHN CN1CCC[C@@H](NC(=O)Nc2ccc(-c3ccc(Br)s3)nn2)C1 ZINC000684698119 567228158 /nfs/dbraw/zinc/22/81/58/567228158.db2.gz GNJXBKYGJOGAMT-SNVBAGLBSA-N 0 3 396.314 3.183 10 0 GGAEHN Cc1ccc([O-])c(CN(CC[NH+](C)C)Cc2ccc(Br)cc2)n1 ZINC000567225421 567228537 /nfs/dbraw/zinc/22/85/37/567228537.db2.gz JUALLHLJEVJQLC-UHFFFAOYSA-N 0 3 378.314 3.422 10 0 GGAEHN COc1ccc(Br)c2[nH]c(C(=O)N(C)[C@@H]3CCN(C)[C@H](C)C3)cc21 ZINC000525106716 567229521 /nfs/dbraw/zinc/22/95/21/567229521.db2.gz YJWFMVBQRNQUME-VXGBXAGGSA-N 0 3 394.313 3.494 10 0 GGAEHN COc1ccc(CCC(=O)N(C)[C@@H]2CCN(C(C)C)C2)c(Br)c1 ZINC000616155407 567229651 /nfs/dbraw/zinc/22/96/51/567229651.db2.gz KATQTQLHGAUPFJ-OAHLLOKOSA-N 0 3 383.330 3.331 10 0 GGAEHN CN1CC[C@@H](NCC(=O)NCc2cccs2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000567283547 567232733 /nfs/dbraw/zinc/23/27/33/567232733.db2.gz LEYNDYZWWCCSHZ-AEFFLSMTSA-N 0 3 381.904 3.192 10 0 GGAEHN CCC[C@@H](C)[C@@H](CO)NCC(=O)Nc1ccc(Br)cc1Cl ZINC000567276894 567233534 /nfs/dbraw/zinc/23/35/34/567233534.db2.gz ZMOQSMKJTNKSPS-QMTHXVAHSA-N 0 3 377.710 3.428 10 0 GGAEHN CN1CC[C@@H](NCC(=O)NCc2cccs2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000567283549 567233577 /nfs/dbraw/zinc/23/35/77/567233577.db2.gz LEYNDYZWWCCSHZ-SJLPKXTDSA-N 0 3 381.904 3.192 10 0 GGAEHN Cc1nn(C)c(CNCC2CCN(c3ccccc3)CC2)c1Br ZINC000475280715 567237573 /nfs/dbraw/zinc/23/75/73/567237573.db2.gz AAGAVCVJODNWFC-UHFFFAOYSA-N 0 3 377.330 3.497 10 0 GGAEHN O=C1[C@H](N2CCC[C@@H]([C@@H]3CCOC3)C2)CCN1c1cccc(Br)c1 ZINC000433270228 567238048 /nfs/dbraw/zinc/23/80/48/567238048.db2.gz KAIXXXQNXRQYPH-IIDMSEBBSA-N 0 3 393.325 3.303 10 0 GGAEHN Cn1ncc(Br)c1CNC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000475336473 567240902 /nfs/dbraw/zinc/24/09/02/567240902.db2.gz SJMWRZUUTZXJQO-UHFFFAOYSA-N 0 3 395.267 3.078 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)NCCN1CC[C@@H](C)C1 ZINC000525292361 567242185 /nfs/dbraw/zinc/24/21/85/567242185.db2.gz XHPWWELYNKCEAL-CYBMUJFWSA-N 0 3 378.314 3.170 10 0 GGAEHN CO[C@H](CN1CCN([C@@H](C)c2ccc(Br)cc2)CC1)[C@H]1CCOC1 ZINC000659957889 567242699 /nfs/dbraw/zinc/24/26/99/567242699.db2.gz YPAJBCMFIUYVGA-VDZJLULYSA-N 0 3 397.357 3.179 10 0 GGAEHN COC(=O)c1ccc(CNCc2cccc(I)c2)cc1 ZINC000567399666 567242829 /nfs/dbraw/zinc/24/28/29/567242829.db2.gz NUKUPFPISCFYRV-UHFFFAOYSA-N 0 3 381.213 3.368 10 0 GGAEHN CN(C[C@@H]1CCCN1C)C(=O)c1c(F)c(F)c(Br)c(F)c1F ZINC000616384377 567243310 /nfs/dbraw/zinc/24/33/10/567243310.db2.gz QSJYMPGAIWNEMF-ZETCQYMHSA-N 0 3 383.183 3.172 10 0 GGAEHN Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)NCCN1[C@H](C)CCC[C@H]1C ZINC000567404696 567242966 /nfs/dbraw/zinc/24/29/66/567242966.db2.gz JFOYBILQJZWHPE-GHMZBOCLSA-N 0 3 380.842 3.243 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])NC1CC[NH+](C2CCCC2)CC1 ZINC000547749341 567243263 /nfs/dbraw/zinc/24/32/63/567243263.db2.gz GEFQQOHGWPAVND-UHFFFAOYSA-N 0 3 381.314 3.220 10 0 GGAEHN Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)NCCN1[C@H](C)CCC[C@@H]1C ZINC000567404697 567243374 /nfs/dbraw/zinc/24/33/74/567243374.db2.gz JFOYBILQJZWHPE-PHIMTYICSA-N 0 3 380.842 3.243 10 0 GGAEHN CCOc1c(Cl)cc(NC(=O)NC[C@@H]2CCCCN2CCO)cc1Cl ZINC000455190852 567244428 /nfs/dbraw/zinc/24/44/28/567244428.db2.gz OQXUWKJRZVAITA-ZDUSSCGKSA-N 0 3 390.311 3.360 10 0 GGAEHN CN(C)CCN(C)c1ccc(Br)cc1NC(=O)[C@H]1C[C@H]2C[C@H]2C1 ZINC000616422744 567244716 /nfs/dbraw/zinc/24/47/16/567244716.db2.gz DDZPHQLQZBCEFY-WDNDVIMCSA-N 0 3 380.330 3.432 10 0 GGAEHN COCc1cc(Cl)ccc1NC(=O)C(C[C@H]1COCCO1)C(F)(F)F ZINC000616425488 567244782 /nfs/dbraw/zinc/24/47/82/567244782.db2.gz VCXZQZVWVHBAMW-QWHCGFSZSA-N 0 3 381.778 3.409 10 0 GGAEHN COCc1cc(Cl)ccc1NC(=O)C(C[C@H]1COCCO1)C(F)(F)F ZINC000616425489 567244791 /nfs/dbraw/zinc/24/47/91/567244791.db2.gz VCXZQZVWVHBAMW-STQMWFEESA-N 0 3 381.778 3.409 10 0 GGAEHN COC(=O)CC1(NCC(=O)Nc2ccc(Br)cc2C)CCCC1 ZINC000547771229 567245842 /nfs/dbraw/zinc/24/58/42/567245842.db2.gz FBTLEDNDODIBSE-UHFFFAOYSA-N 0 3 383.286 3.162 10 0 GGAEHN COc1ccc(C[C@@H](C)N[C@@H](C(N)=O)c2cccc(Br)c2)cc1 ZINC000475438205 567247978 /nfs/dbraw/zinc/24/79/78/567247978.db2.gz FPTLDYYSCRGQHH-SJKOYZFVSA-N 0 3 377.282 3.205 10 0 GGAEHN CC(C)(O)CN(Cc1nc2cc(Br)ccc2[nH]1)C1CCOCC1 ZINC000547830590 567250466 /nfs/dbraw/zinc/25/04/66/567250466.db2.gz VMNHMVXVTCWNAL-UHFFFAOYSA-N 0 3 382.302 3.077 10 0 GGAEHN CC(C)(O)CN(Cc1nc2ccc(Br)cc2[nH]1)C1CCOCC1 ZINC000547830590 567250470 /nfs/dbraw/zinc/25/04/70/567250470.db2.gz VMNHMVXVTCWNAL-UHFFFAOYSA-N 0 3 382.302 3.077 10 0 GGAEHN CN(C(=O)NCC1(c2ccccc2Br)CC1)[C@@H]1CCN(C2CC2)C1 ZINC000525514424 567251834 /nfs/dbraw/zinc/25/18/34/567251834.db2.gz UOSYQDAHIJTTHO-OAHLLOKOSA-N 0 3 392.341 3.359 10 0 GGAEHN CS[C@H]1CN(C(=O)c2csc(Br)c2)C[C@H]1N1CCCC1 ZINC000547860619 567252360 /nfs/dbraw/zinc/25/23/60/567252360.db2.gz SYCWMDWVXREXNV-NEPJUHHUSA-N 0 3 375.357 3.162 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)C2=Cc3cc(Br)ccc3OC2)CCN1C ZINC000525540959 567252957 /nfs/dbraw/zinc/25/29/57/567252957.db2.gz STVGBPXLRSVSAX-MLGOLLRUSA-N 0 3 379.298 3.166 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)C2=Cc3cc(Br)ccc3OC2)CCN1C ZINC000525540957 567253664 /nfs/dbraw/zinc/25/36/64/567253664.db2.gz STVGBPXLRSVSAX-BLLLJJGKSA-N 0 3 379.298 3.166 10 0 GGAEHN CN1CC[C@@H](NCC(=O)NC2CCCC2)C[C@@H]1c1ccc(Br)cc1 ZINC000638527063 567253958 /nfs/dbraw/zinc/25/39/58/567253958.db2.gz JKFZILDDGVWEOF-QZTJIDSGSA-N 0 3 394.357 3.233 10 0 GGAEHN C[C@@H]1C[C@@H](NC(=O)CSCc2ccc(Br)cc2F)CCN1C ZINC000525617494 567255676 /nfs/dbraw/zinc/25/56/76/567255676.db2.gz ODFNUBVHOFIQMN-RISCZKNCSA-N 0 3 389.334 3.420 10 0 GGAEHN C[C@H](C(=O)N[C@](C)(CO)c1ccc(Br)cc1)N1CCCCCC1 ZINC000616832159 567260447 /nfs/dbraw/zinc/26/04/47/567260447.db2.gz RFPAEVOBZNTRGE-RDTXWAMCSA-N 0 3 383.330 3.037 10 0 GGAEHN C[C@H](C(=O)N[C@@](C)(CO)c1ccc(Br)cc1)N1CCCCCC1 ZINC000616832157 567261389 /nfs/dbraw/zinc/26/13/89/567261389.db2.gz RFPAEVOBZNTRGE-KDOFPFPSSA-N 0 3 383.330 3.037 10 0 GGAEHN COc1sc(CN2CCN(c3ccncc3OC)CC2)cc1Br ZINC000475618001 567261956 /nfs/dbraw/zinc/26/19/56/567261956.db2.gz AGGAOTRMGQBEBX-UHFFFAOYSA-N 0 3 398.326 3.245 10 0 GGAEHN N[C@H](C(=O)Nc1nnc(-c2c(Cl)cccc2Cl)s1)C1CCOCC1 ZINC000638654202 567262134 /nfs/dbraw/zinc/26/21/34/567262134.db2.gz KNBLNECRMGGIHB-LBPRGKRZSA-N 0 3 387.292 3.204 10 0 GGAEHN COc1cnccc1N1CCN(Cc2cc(F)ccc2Br)CC1 ZINC000475621740 567262628 /nfs/dbraw/zinc/26/26/28/567262628.db2.gz HHRGAMWGSZYBRX-UHFFFAOYSA-N 0 3 380.261 3.314 10 0 GGAEHN CC(C)N1CC[C@H](N[C@H]2CCN(C)[C@H](c3ccc(Br)cc3)C2)C1=O ZINC000638639587 567262766 /nfs/dbraw/zinc/26/27/66/567262766.db2.gz TVZUCEXFCYQFDX-BZSNNMDCSA-N 0 3 394.357 3.183 10 0 GGAEHN COc1cnccc1N1CCN(Cc2ccc(Br)c(F)c2)CC1 ZINC000475620949 567262767 /nfs/dbraw/zinc/26/27/67/567262767.db2.gz FTBSREVDKRONPE-UHFFFAOYSA-N 0 3 380.261 3.314 10 0 GGAEHN CC(C)OCCN1CCC(Nc2nc(C3CC3)ncc2Br)CC1 ZINC000685272005 567265965 /nfs/dbraw/zinc/26/59/65/567265965.db2.gz JACQYPDSPLKYAW-UHFFFAOYSA-N 0 3 383.334 3.418 10 0 GGAEHN Cc1nccc(NC(=O)NCCCN(C)Cc2ccccc2)c1Br ZINC000525847857 567269489 /nfs/dbraw/zinc/26/94/89/567269489.db2.gz XDRHWIZXIPYHSF-UHFFFAOYSA-N 0 3 391.313 3.218 10 0 GGAEHN Cc1nccc(NC(=O)N2CCN(C3CCC(C)CC3)CC2)c1Br ZINC000525848477 567269814 /nfs/dbraw/zinc/26/98/14/567269814.db2.gz XFGZUNXHBJYUSM-UHFFFAOYSA-N 0 3 395.345 3.303 10 0 GGAEHN Brc1cnc2c(CN[C@H]3CCOC4(CCSCC4)C3)cnn2c1 ZINC000638789550 567269937 /nfs/dbraw/zinc/26/99/37/567269937.db2.gz QIUGTLPDFTZZBM-AWEZNQCLSA-N 0 3 397.342 3.026 10 0 GGAEHN Cc1cc(CN[C@H]2CCN(C)[C@@H](c3ccc(Br)cc3)C2)ncn1 ZINC000638812063 567272047 /nfs/dbraw/zinc/27/20/47/567272047.db2.gz REWMEDRWTPZMTK-FUHWJXTLSA-N 0 3 375.314 3.473 10 0 GGAEHN CO[C@H](CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1)[C@@H]1CCOC1 ZINC000660158409 567272405 /nfs/dbraw/zinc/27/24/05/567272405.db2.gz WVONIENQKXPCBD-VQIMIIECSA-N 0 3 387.351 3.205 10 0 GGAEHN CO[C@H](CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1)[C@H]1CCOC1 ZINC000660158408 567272528 /nfs/dbraw/zinc/27/25/28/567272528.db2.gz WVONIENQKXPCBD-QFBILLFUSA-N 0 3 387.351 3.205 10 0 GGAEHN Cc1cc(CNC[C@@H](O)COc2ccccc2Br)cc(C)c1O ZINC000685425786 567273960 /nfs/dbraw/zinc/27/39/60/567273960.db2.gz GIAPUBMKFZSJRN-OAHLLOKOSA-N 0 3 380.282 3.301 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)c1ccc(-n2cc(Br)cn2)cc1 ZINC000617016798 567274922 /nfs/dbraw/zinc/27/49/22/567274922.db2.gz NDMSYYQMNKBVDF-INIZCTEOSA-N 0 3 391.313 3.237 10 0 GGAEHN C[C@H](Oc1ccc(F)cc1Br)C(=O)NC[C@H]1CCN1C(C)(C)C ZINC000617016670 567275171 /nfs/dbraw/zinc/27/51/71/567275171.db2.gz JZJDLMMMBCWVGT-WCQYABFASA-N 0 3 387.293 3.345 10 0 GGAEHN COc1cc(C(=O)NC[C@H]2CCN2C(C)(C)C)cc(Br)c1OC ZINC000617007301 567275690 /nfs/dbraw/zinc/27/56/90/567275690.db2.gz QDIIOJRXJKEVHW-GFCCVEGCSA-N 0 3 385.302 3.069 10 0 GGAEHN COc1cc(Br)ccc1CN(CCN(C)C)Cc1ccccn1 ZINC000685458088 567275903 /nfs/dbraw/zinc/27/59/03/567275903.db2.gz NLNNAMDDVKQSBB-UHFFFAOYSA-N 0 3 378.314 3.417 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)c1ccn(-c2cccc(Br)c2)n1 ZINC000617013536 567276102 /nfs/dbraw/zinc/27/61/02/567276102.db2.gz WFBNNWGWJGMSRS-OAHLLOKOSA-N 0 3 391.313 3.237 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)c1cnn(-c2cccc(Br)c2)c1 ZINC000617012699 567276148 /nfs/dbraw/zinc/27/61/48/567276148.db2.gz GHHLXWOELWAETH-MRXNPFEDSA-N 0 3 391.313 3.237 10 0 GGAEHN C[C@@H](Oc1ccc(F)cc1Br)C(=O)NC[C@H]1CCN1C(C)(C)C ZINC000617016669 567276210 /nfs/dbraw/zinc/27/62/10/567276210.db2.gz JZJDLMMMBCWVGT-DGCLKSJQSA-N 0 3 387.293 3.345 10 0 GGAEHN Cc1nc2ccc(Br)cn2c1C(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000617008430 567276489 /nfs/dbraw/zinc/27/64/89/567276489.db2.gz GYZKHLDKJOPDBZ-ZDUSSCGKSA-N 0 3 379.302 3.008 10 0 GGAEHN CC(C)[N@H+](C)CC1CCN(C(=O)Cc2ccc(Br)cc2[O-])CC1 ZINC000548073529 567278148 /nfs/dbraw/zinc/27/81/48/567278148.db2.gz GLWZEJIAQGCLPK-UHFFFAOYSA-N 0 3 383.330 3.276 10 0 GGAEHN CC(C)[N@@H+](C)CC1CCN(C(=O)Cc2ccc(Br)cc2[O-])CC1 ZINC000548073529 567278158 /nfs/dbraw/zinc/27/81/58/567278158.db2.gz GLWZEJIAQGCLPK-UHFFFAOYSA-N 0 3 383.330 3.276 10 0 GGAEHN CSCc1cc(F)ccc1CNS(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000433860740 567278391 /nfs/dbraw/zinc/27/83/91/567278391.db2.gz VHNWCVVNPQPKHW-UHFFFAOYSA-N 0 3 382.526 3.229 10 0 GGAEHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cc(Br)c[nH]1 ZINC000525967293 567278508 /nfs/dbraw/zinc/27/85/08/567278508.db2.gz BVQXMTGYWUBMEE-UHFFFAOYSA-N 0 3 394.235 3.312 10 0 GGAEHN COC(=O)c1cc(NC(=O)N[C@H](C)C2=CCN(C)CC2)ccc1Br ZINC000548081899 567278477 /nfs/dbraw/zinc/27/84/77/567278477.db2.gz UHAASVVBKWQICA-LLVKDONJSA-N 0 3 396.285 3.008 10 0 GGAEHN C[C@H](NCC1(O)CCSCC1)c1cc2c(cc1Br)OCCO2 ZINC000660187507 567279145 /nfs/dbraw/zinc/27/91/45/567279145.db2.gz NCUUBLNTSLZVSJ-NSHDSACASA-N 0 3 388.327 3.129 10 0 GGAEHN CCCN1CCC[C@@H]1C(=O)N1CCO[C@@H](c2ccc(F)c(Br)c2)C1 ZINC000475832286 567280217 /nfs/dbraw/zinc/28/02/17/567280217.db2.gz AIKCTSCRBXMIHB-IAGOWNOFSA-N 0 3 399.304 3.363 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)Cc1c(F)ccc(Br)c1F ZINC000499880296 567280285 /nfs/dbraw/zinc/28/02/85/567280285.db2.gz OOOJAIZTONVVHA-YGRLFVJLSA-N 0 3 375.257 3.068 10 0 GGAEHN CCCN1CCC[C@H]1C(=O)N1CCO[C@@H](c2ccc(F)c(Br)c2)C1 ZINC000475832281 567280684 /nfs/dbraw/zinc/28/06/84/567280684.db2.gz AIKCTSCRBXMIHB-DLBZAZTESA-N 0 3 399.304 3.363 10 0 GGAEHN CN1CC[C@@H](NC(=O)Nc2cc(Br)ccn2)[C@H]1c1ccccc1 ZINC000499891801 567280863 /nfs/dbraw/zinc/28/08/63/567280863.db2.gz CVVOWIFIAAVVSC-GDBMZVCRSA-N 0 3 375.270 3.411 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N(CCN(C)C)C[C@@H]1CCCO1 ZINC000499892390 567280893 /nfs/dbraw/zinc/28/08/93/567280893.db2.gz FQJQJZCNQBBADC-ZFWWWQNUSA-N 0 3 389.323 3.330 10 0 GGAEHN CC(C)(C)C(=O)N1CCC[C@H](CN[C@H](CO)c2cccc(Br)c2)C1 ZINC000660237281 567283455 /nfs/dbraw/zinc/28/34/55/567283455.db2.gz CFOUVOPVHAPVRI-RHSMWYFYSA-N 0 3 397.357 3.357 10 0 GGAEHN Cc1cc(Br)ccc1CN(C)C(=O)N[C@H]1CN(C2CC2)C[C@H]1C ZINC000433926105 567284119 /nfs/dbraw/zinc/28/41/19/567284119.db2.gz JIIZJBISODTDSS-DYVFJYSZSA-N 0 3 380.330 3.382 10 0 GGAEHN COCCN1CCC(NC(=O)N(C)Cc2ccc(Br)cc2C)CC1 ZINC000433910772 567284700 /nfs/dbraw/zinc/28/47/00/567284700.db2.gz YCCBSUJHVVLQNA-UHFFFAOYSA-N 0 3 398.345 3.010 10 0 GGAEHN CC[C@H](NC[C@H](O)COc1c(Cl)cccc1Cl)[C@@H](O)C(F)(F)F ZINC000567872482 567285972 /nfs/dbraw/zinc/28/59/72/567285972.db2.gz ADSOYSVNYPGEPA-LJUAHTATSA-N 0 3 376.202 3.025 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)Cc1cc(F)ccc1Br ZINC000433980974 567286413 /nfs/dbraw/zinc/28/64/13/567286413.db2.gz KYDBOAOZZUQVFH-KRWDZBQOSA-N 0 3 393.300 3.420 10 0 GGAEHN CN(C)Cc1ccc(NC(=O)CCN(C)c2ccncc2)cc1Br ZINC000526054794 567286405 /nfs/dbraw/zinc/28/64/05/567286405.db2.gz PDEAAEDMVKTSTL-UHFFFAOYSA-N 0 3 391.313 3.371 10 0 GGAEHN CCC(CC)(NC(=O)[C@@H](N)CCC(=O)OC)c1ccc(Cl)c(Cl)c1 ZINC000567904477 567288733 /nfs/dbraw/zinc/28/87/33/567288733.db2.gz UPFRSPPTEHZUHW-AWEZNQCLSA-N 0 3 375.296 3.405 10 0 GGAEHN Cc1cc(C)c(C(=O)N(C)[C@@H]2CN3CCC2CC3)cc1I ZINC000475934056 567288820 /nfs/dbraw/zinc/28/88/20/567288820.db2.gz QGMGHKSNCIFLAG-MRXNPFEDSA-N 0 3 398.288 3.074 10 0 GGAEHN COc1cc(C[NH2+]C[C@@]2(CO)C[C@@H]2c2ccccc2)cc(Br)c1[O-] ZINC000685627261 567289091 /nfs/dbraw/zinc/28/90/91/567289091.db2.gz UVJBRVONFKAQBA-DNVCBOLYSA-N 0 3 392.293 3.419 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)Cc1ccc(F)c(Br)c1 ZINC000567927138 567289648 /nfs/dbraw/zinc/28/96/48/567289648.db2.gz VOIVIXGABNDOBZ-QGZVFWFLSA-N 0 3 377.257 3.215 10 0 GGAEHN COCCN(CCN(C)C)C(=O)c1c(C)cc(Br)cc1Cl ZINC000567944577 567291626 /nfs/dbraw/zinc/29/16/26/567291626.db2.gz RGZWORAFHXESRL-UHFFFAOYSA-N 0 3 377.710 3.061 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NCCc1nnn(C(C)(C)C)n1 ZINC000660391071 567292088 /nfs/dbraw/zinc/29/20/88/567292088.db2.gz DTEJKCBGRURRPJ-LLVKDONJSA-N 0 3 382.306 3.093 10 0 GGAEHN CC(C)[C@H](N[C@@H](C)C(=O)NC(=O)NCC(F)(F)F)c1ccc(Cl)cc1 ZINC000567933046 567292143 /nfs/dbraw/zinc/29/21/43/567292143.db2.gz GFFZKTAOIJPAER-GWCFXTLKSA-N 0 3 379.810 3.403 10 0 GGAEHN COCCN(Cc1cc(Br)cs1)C[C@H](OC)[C@@H]1CCOC1 ZINC000660411641 567293036 /nfs/dbraw/zinc/29/30/36/567293036.db2.gz SKRCDTJRSHITPC-DOMZBBRYSA-N 0 3 378.332 3.011 10 0 GGAEHN CCc1onc(-c2ccc(Br)cc2)c1C(=O)NC[C@@H]1CCCN1C ZINC000476037938 567293241 /nfs/dbraw/zinc/29/32/41/567293241.db2.gz BWDKTRQLPQPGMP-AWEZNQCLSA-N 0 3 392.297 3.491 10 0 GGAEHN CC(C)(C)N1CC[C@H](NC(=O)Cc2noc3ccc(Br)cc32)C1 ZINC000617341166 567299688 /nfs/dbraw/zinc/29/96/88/567299688.db2.gz MGZSNSIBSCTINW-LBPRGKRZSA-N 0 3 380.286 3.122 10 0 GGAEHN CC(C)(C)N1CC[C@@H](NC(=O)c2cc(=O)[nH]c3ccc(Br)cc32)C1 ZINC000617349923 567300842 /nfs/dbraw/zinc/30/08/42/567300842.db2.gz ZEBDZTQVURGSAV-GFCCVEGCSA-N 0 3 392.297 3.306 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1c(C)ccc(F)c1Br ZINC000455744287 567301281 /nfs/dbraw/zinc/30/12/81/567301281.db2.gz FEJTZNZRSWWINK-GFCCVEGCSA-N 0 3 388.281 3.129 10 0 GGAEHN COc1ncc(Br)cc1CN[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000660490722 567301485 /nfs/dbraw/zinc/30/14/85/567301485.db2.gz YHAWKUJZRXNIOD-SJORKVTESA-N 0 3 376.298 3.388 10 0 GGAEHN CC(=O)N(c1nc(CN(C)CC2CN(C)C2)cs1)c1cccc(Cl)c1 ZINC000639310607 567301975 /nfs/dbraw/zinc/30/19/75/567301975.db2.gz UKUWURCDFQBLHF-UHFFFAOYSA-N 0 3 378.929 3.475 10 0 GGAEHN CC[C@H](NC[C@@H](O)COC[C@@H]1CCCO1)c1cc(F)cc(Br)c1 ZINC000548275284 567304307 /nfs/dbraw/zinc/30/43/07/567304307.db2.gz AFOFNPHOPKKNKM-IKGGRYGDSA-N 0 3 390.293 3.185 10 0 GGAEHN CC[C@H](NC[C@@H](O)COC[C@H]1CCCO1)c1cc(F)cc(Br)c1 ZINC000548275286 567304505 /nfs/dbraw/zinc/30/45/05/567304505.db2.gz AFOFNPHOPKKNKM-ZACQAIPSSA-N 0 3 390.293 3.185 10 0 GGAEHN COc1cc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc(Br)c1OC ZINC000568090603 567304866 /nfs/dbraw/zinc/30/48/66/567304866.db2.gz QHKIYYPMHLKZTD-DGCLKSJQSA-N 0 3 385.302 3.021 10 0 GGAEHN CS[C@H]1CN(c2nc(-c3cc(F)cc(F)c3)ns2)C[C@@H]1N1CCCC1 ZINC000591931948 567305031 /nfs/dbraw/zinc/30/50/31/567305031.db2.gz ICKRXMOOSKVVPN-GJZGRUSLSA-N 0 3 382.505 3.499 10 0 GGAEHN Brc1cnc2c(CNCC3([C@H]4CCCCO4)CCC3)cnn2c1 ZINC000639387590 567305032 /nfs/dbraw/zinc/30/50/32/567305032.db2.gz SVRYXBGQUHFLHE-OAHLLOKOSA-N 0 3 379.302 3.321 10 0 GGAEHN CS(=O)(=O)N1CCC[C@H](CN2CCC(F)(c3ccc(Cl)cc3)CC2)C1 ZINC000500172417 567305075 /nfs/dbraw/zinc/30/50/75/567305075.db2.gz ZSPCNNLTGVMKAK-OAHLLOKOSA-N 0 3 388.936 3.272 10 0 GGAEHN CN(C)CCOc1ccc(CNC(=O)Cc2cscc2Br)cc1 ZINC000568139454 567307502 /nfs/dbraw/zinc/30/75/02/567307502.db2.gz SUDMQCQPRPFCOM-UHFFFAOYSA-N 0 3 397.338 3.310 10 0 GGAEHN Cn1cc([C@@H](NCCOc2cccc(Br)c2)C2(CO)CCC2)cn1 ZINC000660605491 567311264 /nfs/dbraw/zinc/31/12/64/567311264.db2.gz UOJMAWWPJLPJIN-QGZVFWFLSA-N 0 3 394.313 3.055 10 0 GGAEHN C[C@H](NCC(C)(C)[C@@]1(O)CCOC1)c1ccccc1I ZINC000592398112 567335603 /nfs/dbraw/zinc/33/56/03/567335603.db2.gz OQJUNPYYFCKSRA-BLLLJJGKSA-N 0 3 389.277 3.119 10 0 GGAEHN C[NH+](C)CCc1ccc(NC(=O)Cc2ccc(Br)cc2[O-])cc1 ZINC000548402266 567313339 /nfs/dbraw/zinc/31/33/39/567313339.db2.gz NJCMYMMJJGTKMA-UHFFFAOYSA-N 0 3 377.282 3.440 10 0 GGAEHN N#Cc1ccc(OCCNCc2cccc(I)c2)cc1 ZINC000568237282 567313610 /nfs/dbraw/zinc/31/36/10/567313610.db2.gz VYZZPOVVKDASCX-UHFFFAOYSA-N 0 3 378.213 3.331 10 0 GGAEHN O=S1(=O)CCC(CCNCc2c(F)ccc(Br)c2F)CC1 ZINC000500403334 567319388 /nfs/dbraw/zinc/31/93/88/567319388.db2.gz NVLGEYUQIIJGDF-UHFFFAOYSA-N 0 3 382.270 3.032 10 0 GGAEHN CCN(C(=O)c1cn(-c2ccc(Br)cc2)nc1C)[C@H]1CCN(C)C1 ZINC000617551896 567321558 /nfs/dbraw/zinc/32/15/58/567321558.db2.gz AXEWLXQLHXSSJS-INIZCTEOSA-N 0 3 391.313 3.109 10 0 GGAEHN CCN(C(=O)CCNc1ncc(C(F)(F)F)cc1Cl)[C@H]1CCN(C)C1 ZINC000617554992 567322082 /nfs/dbraw/zinc/32/20/82/567322082.db2.gz OADCJELQLIUYFU-LBPRGKRZSA-N 0 3 378.826 3.108 10 0 GGAEHN CCN(C(=O)COc1ccc(Br)cc1Cl)[C@@H]1CCN(C)C1 ZINC000617559893 567322255 /nfs/dbraw/zinc/32/22/55/567322255.db2.gz BPFBEXJEYCDNAB-GFCCVEGCSA-N 0 3 375.694 3.034 10 0 GGAEHN CCN(C(=O)Cc1csc(Cc2cccc(Cl)c2)n1)[C@@H]1CCN(C)C1 ZINC000617551215 567322376 /nfs/dbraw/zinc/32/23/76/567322376.db2.gz NHPDNFFDONOWKQ-QGZVFWFLSA-N 0 3 377.941 3.482 10 0 GGAEHN CCN(C(=O)[C@H](CCOC)Cc1cccc(Br)c1)[C@H]1CCN(C)C1 ZINC000617555037 567322410 /nfs/dbraw/zinc/32/24/10/567322410.db2.gz OYWUGYQGSVULSK-AEFFLSMTSA-N 0 3 397.357 3.197 10 0 GGAEHN COc1ccc(Br)c2sc(NC(=O)[C@@H]3CCN(C)[C@@H]3C)nc21 ZINC000617584818 567323039 /nfs/dbraw/zinc/32/30/39/567323039.db2.gz MKSWMFCHXYLEBJ-RKDXNWHRSA-N 0 3 384.299 3.346 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@H]1N(C)C ZINC000476456831 567324953 /nfs/dbraw/zinc/32/49/53/567324953.db2.gz JCTBFTPRLKYAEU-CHWSQXEVSA-N 0 3 395.725 3.359 10 0 GGAEHN C[C@H]1CN(CCCCNC(=O)c2csc(Br)c2)C[C@H](C)O1 ZINC000434775630 567327579 /nfs/dbraw/zinc/32/75/79/567327579.db2.gz KYKMVDQALAIFCL-RYUDHWBXSA-N 0 3 375.332 3.130 10 0 GGAEHN Brc1ccc(S[C@H]2CCN(C[C@@H]3CCc4ncnn43)C2)cc1 ZINC000639889495 567327679 /nfs/dbraw/zinc/32/76/79/567327679.db2.gz FPCIGEWKKWZQKT-ZFWWWQNUSA-N 0 3 379.327 3.395 10 0 GGAEHN CS[C@H]1CN(C(=O)Nc2cnc(-c3ccc(Cl)s3)nc2)C[C@@H]1N(C)C ZINC000592278248 567328086 /nfs/dbraw/zinc/32/80/86/567328086.db2.gz ONHDQPCCQXGPSL-AAEUAGOBSA-N 0 3 397.957 3.368 10 0 GGAEHN Cc1c(Br)cc(CNC[C@@H](O)[C@H]2CCCO2)cc1Br ZINC000527753498 567371970 /nfs/dbraw/zinc/37/19/70/567371970.db2.gz AVCNZDLDOIJEOI-ZIAGYGMSSA-N 0 3 393.119 3.150 10 0 GGAEHN CS[C@H]1CN(C(=O)Nc2cnc(-c3ccc(Cl)s3)nc2)C[C@H]1N(C)C ZINC000592278251 567328727 /nfs/dbraw/zinc/32/87/27/567328727.db2.gz ONHDQPCCQXGPSL-YPMHNXCESA-N 0 3 397.957 3.368 10 0 GGAEHN OC[C@@H](NC[C@@H](O)Cc1cccc(Cl)c1)c1cccc(Br)c1 ZINC000568427346 567328875 /nfs/dbraw/zinc/32/88/75/567328875.db2.gz QWGYAEBLPOQVFI-DLBZAZTESA-N 0 3 384.701 3.329 10 0 GGAEHN O=C(CCc1cc(Cl)cs1)NCc1ccc(CN2CC[C@@H](O)C2)cc1 ZINC000617700643 567329891 /nfs/dbraw/zinc/32/98/91/567329891.db2.gz IOXCSIOFQDMHGN-QGZVFWFLSA-N 0 3 378.925 3.217 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1cc(Br)cs1 ZINC000617700035 567329945 /nfs/dbraw/zinc/32/99/45/567329945.db2.gz ZDIFGGGFILSPBO-OAHLLOKOSA-N 0 3 395.322 3.007 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1cc(Cl)ccc1Cl ZINC000617696371 567330025 /nfs/dbraw/zinc/33/00/25/567330025.db2.gz HVLINMAEQGZEFY-MRXNPFEDSA-N 0 3 379.287 3.490 10 0 GGAEHN C[C@@H](C(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1)c1ccc(Cl)s1 ZINC000617700767 567330321 /nfs/dbraw/zinc/33/03/21/567330321.db2.gz LASOWAIBXGEGKN-CJNGLKHVSA-N 0 3 378.925 3.388 10 0 GGAEHN O=C(CCNC[C@@H](O)COc1c(Cl)cccc1Cl)Nc1ccccc1 ZINC000568502116 567333239 /nfs/dbraw/zinc/33/32/39/567333239.db2.gz LOTGJOVXFCWEPE-CQSZACIVSA-N 0 3 383.275 3.352 10 0 GGAEHN COc1cc(Br)ccc1CN[C@H](C1CC1)C1(CO)CCOCC1 ZINC000568493967 567333495 /nfs/dbraw/zinc/33/34/95/567333495.db2.gz GACSMTSXAXIRQG-QGZVFWFLSA-N 0 3 384.314 3.115 10 0 GGAEHN CC(C)(C)OC(=O)C1(CNCc2cncc(Br)c2)CCOCC1 ZINC000592373155 567334169 /nfs/dbraw/zinc/33/41/69/567334169.db2.gz SQTJCEQAPOEPQC-UHFFFAOYSA-N 0 3 385.302 3.072 10 0 GGAEHN CC[C@H](NCc1cc(OC)c(O)cc1Br)C1(C(=O)OC)CCC1 ZINC000592399591 567335393 /nfs/dbraw/zinc/33/53/93/567335393.db2.gz NSEIGDFWMOAGBU-HNNXBMFYSA-N 0 3 386.286 3.375 10 0 GGAEHN O=C(CCN1C[C@@H](CO)[C@H](C(F)(F)F)C1)Nc1cc(Cl)ccc1Cl ZINC000640054570 567339711 /nfs/dbraw/zinc/33/97/11/567339711.db2.gz NTOMIPYKPUNNAU-GXSJLCMTSA-N 0 3 385.213 3.425 10 0 GGAEHN CN1CCC[C@@H]1CNC(=O)N1CCO[C@H](c2cc(F)c(Cl)cc2Cl)C1 ZINC000592509709 567342238 /nfs/dbraw/zinc/34/22/38/567342238.db2.gz JPFMAMMFNJMDJH-BZNIZROVSA-N 0 3 390.286 3.310 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000661040894 567343054 /nfs/dbraw/zinc/34/30/54/567343054.db2.gz BIHYACKWYIWKSX-AWEZNQCLSA-N 0 3 384.318 3.130 10 0 GGAEHN CCOC(=O)c1sc2ccsc2c1CNC(=O)[C@@H]1CNCCC1(F)F ZINC000592532052 567343651 /nfs/dbraw/zinc/34/36/51/567343651.db2.gz MDASDBYRCIHNTI-JTQLQIEISA-N 0 3 388.461 3.001 10 0 GGAEHN CCN(C(=O)c1cn(-c2ccc(Br)cc2)cn1)[C@@H]1CCN(CC)C1 ZINC000617926317 567346074 /nfs/dbraw/zinc/34/60/74/567346074.db2.gz BFTBIBPFDJRIMW-MRXNPFEDSA-N 0 3 391.313 3.191 10 0 GGAEHN C[C@@H](NC(=O)N1CCc2ccc(F)c(Br)c2C1)C1=CCN(C)CC1 ZINC000527597075 567346520 /nfs/dbraw/zinc/34/65/20/567346520.db2.gz ZRESYOISEDFTMN-GFCCVEGCSA-N 0 3 396.304 3.306 10 0 GGAEHN CN(C[C@H](O)COc1c(Cl)cccc1Cl)[C@@H](CO)Cc1ccccc1 ZINC000661096767 567346581 /nfs/dbraw/zinc/34/65/81/567346581.db2.gz HAUPICGWBGTMNQ-CVEARBPZSA-N 0 3 384.303 3.269 10 0 GGAEHN CCN(C(=O)[C@@H]1CCOc2ccc(Br)cc21)[C@@H]1CCN(CC)C1 ZINC000617922950 567347189 /nfs/dbraw/zinc/34/71/89/567347189.db2.gz WBCLDPQNCFAARB-HUUCEWRRSA-N 0 3 381.314 3.258 10 0 GGAEHN CCN(C(=O)Cc1c(F)ccc(Br)c1F)[C@@H]1CCN(CC)C1 ZINC000617924171 567347329 /nfs/dbraw/zinc/34/73/29/567347329.db2.gz PEEQKGOKZPRIQH-LLVKDONJSA-N 0 3 375.257 3.213 10 0 GGAEHN CCN(C(=O)c1ccn(-c2cccc(Br)c2)n1)[C@@H]1CCN(CC)C1 ZINC000617929568 567347342 /nfs/dbraw/zinc/34/73/42/567347342.db2.gz MESMBAGLDRJEKQ-MRXNPFEDSA-N 0 3 391.313 3.191 10 0 GGAEHN O=C(Cc1c(F)ccc(Br)c1F)N1CC[C@H](N2CCCCC2)C1 ZINC000500826540 567347824 /nfs/dbraw/zinc/34/78/24/567347824.db2.gz YZZHIGYKCFAYFY-LBPRGKRZSA-N 0 3 387.268 3.357 10 0 GGAEHN C[C@@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cscn1 ZINC000661101884 567348468 /nfs/dbraw/zinc/34/84/68/567348468.db2.gz ZFLVOSVFUUVUHY-QFWMXSHPSA-N 0 3 376.448 3.309 10 0 GGAEHN C[C@H](NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cscn1 ZINC000661101883 567348756 /nfs/dbraw/zinc/34/87/56/567348756.db2.gz ZFLVOSVFUUVUHY-PKSQDBQZSA-N 0 3 376.448 3.309 10 0 GGAEHN NC[C@@H](C(=O)N1CCc2ccc(F)c(Br)c2C1)c1ccc(F)cc1 ZINC000527617863 567350362 /nfs/dbraw/zinc/35/03/62/567350362.db2.gz SCGGWEPIBCZRJL-CQSZACIVSA-N 0 3 395.247 3.355 10 0 GGAEHN O=C([C@@H]1CNCc2ccccc21)N1CCc2ccc(F)c(Br)c2C1 ZINC000527616748 567350749 /nfs/dbraw/zinc/35/07/49/567350749.db2.gz NUXVYXANDZYUOY-OAHLLOKOSA-N 0 3 389.268 3.360 10 0 GGAEHN Brc1ccc(-c2nccc(CN3CC[C@H](Cn4ccnn4)C3)n2)cc1 ZINC000661147356 567352714 /nfs/dbraw/zinc/35/27/14/567352714.db2.gz ZYTIVGVFNMHBPG-AWEZNQCLSA-N 0 3 399.296 3.020 10 0 GGAEHN O=C(CN[C@H](CO)C1CCC1)Nc1ccc(Br)c(C(F)(F)F)c1 ZINC000661158979 567353106 /nfs/dbraw/zinc/35/31/06/567353106.db2.gz SYAJJWDHZULYBY-CYBMUJFWSA-N 0 3 395.219 3.157 10 0 GGAEHN Brc1ccc(-c2nccc(CN3CC[C@@H](Cn4ccnn4)C3)n2)cc1 ZINC000661147359 567353221 /nfs/dbraw/zinc/35/32/21/567353221.db2.gz ZYTIVGVFNMHBPG-CQSZACIVSA-N 0 3 399.296 3.020 10 0 GGAEHN COC[C@@H](NCC(=O)N[C@@H](C)c1ccc(Cl)cc1Cl)C1CCOCC1 ZINC000661160088 567353601 /nfs/dbraw/zinc/35/36/01/567353601.db2.gz XLFGUGFRKPXORZ-YVEFUNNKSA-N 0 3 389.323 3.202 10 0 GGAEHN Clc1ccc(OCCN2CC[C@@H](Cn3ccnn3)C2)c(Br)c1 ZINC000661146091 567353618 /nfs/dbraw/zinc/35/36/18/567353618.db2.gz IIXDGCNOHVPXJQ-GFCCVEGCSA-N 0 3 385.693 3.095 10 0 GGAEHN O=C(CCNC[C@H]1COc2ccccc2O1)Nc1ccc(Br)cc1 ZINC000548832132 567353774 /nfs/dbraw/zinc/35/37/74/567353774.db2.gz HWZFKBIXSZKYHN-HNNXBMFYSA-N 0 3 391.265 3.207 10 0 GGAEHN CCC[C@H](C)[C@@H](CO)N[C@H](CC)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000568758098 567354854 /nfs/dbraw/zinc/35/48/54/567354854.db2.gz PLZRPRFOMKZCKX-APHBMKBZSA-N 0 3 376.950 3.086 10 0 GGAEHN O=C(NCc1cc(Br)ccc1F)NC[C@@H]1CCN1C1CCCC1 ZINC000527660449 567356698 /nfs/dbraw/zinc/35/66/98/567356698.db2.gz QLBHVENOGCXTTK-HNNXBMFYSA-N 0 3 384.293 3.404 10 0 GGAEHN CO[C@@H]1CCC[C@H]([C@H](CO)NCC(=O)Nc2ccc(Cl)c(Cl)c2)C1 ZINC000661218233 567357204 /nfs/dbraw/zinc/35/72/04/567357204.db2.gz KVPGTZGZJLPJBO-GHJWDPDVSA-N 0 3 375.296 3.088 10 0 GGAEHN CO[C@@H]1CCC[C@@H]([C@@H](CO)NCC(=O)Nc2ccc(Cl)c(Cl)c2)C1 ZINC000661218225 567357963 /nfs/dbraw/zinc/35/79/63/567357963.db2.gz KVPGTZGZJLPJBO-AXAPSJFSSA-N 0 3 375.296 3.088 10 0 GGAEHN CO[C@@H]1CCC[C@H]([C@@H](CO)NCC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000661215809 567358080 /nfs/dbraw/zinc/35/80/80/567358080.db2.gz HRCLVGMSVQGQHQ-YWPYICTPSA-N 0 3 375.296 3.088 10 0 GGAEHN CO[C@@H]1CCC[C@H]([C@H](CO)NCC(=O)Nc2cccc(Cl)c2Cl)C1 ZINC000661221322 567359023 /nfs/dbraw/zinc/35/90/23/567359023.db2.gz RHLBCQVGGPJYNB-ZOWXZIJZSA-N 0 3 375.296 3.088 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1cnn(-c2cccc(Br)c2)c1 ZINC000592741380 567359182 /nfs/dbraw/zinc/35/91/82/567359182.db2.gz IWPSPTDWWBEEOW-CQSZACIVSA-N 0 3 391.313 3.239 10 0 GGAEHN O=C(NCc1cc(F)cc(Br)c1)NC[C@H]1CCN1C1CCCC1 ZINC000527672717 567360481 /nfs/dbraw/zinc/36/04/81/567360481.db2.gz GMNQZIFUPIEXCZ-MRXNPFEDSA-N 0 3 384.293 3.404 10 0 GGAEHN Nc1nccc([C@H]2CCCN(CCOc3cc(F)cc(Br)c3)C2)n1 ZINC000548933137 567362095 /nfs/dbraw/zinc/36/20/95/567362095.db2.gz PLOYFYFZXCUXSW-LBPRGKRZSA-N 0 3 395.276 3.049 10 0 GGAEHN CCCN(C(=O)c1ccc(C)c(I)c1)[C@H]1CCN(C)C1 ZINC000592830120 567367759 /nfs/dbraw/zinc/36/77/59/567367759.db2.gz BQNXZWKKBIXAQC-AWEZNQCLSA-N 0 3 386.277 3.156 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N[C@@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000477070622 567368156 /nfs/dbraw/zinc/36/81/56/567368156.db2.gz BGMCUERSJTUADK-JKSUJKDBSA-N 0 3 384.293 3.433 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2c(Cl)cc(F)cc2Cl)[C@@H](C)C1 ZINC000435443446 567369659 /nfs/dbraw/zinc/36/96/59/567369659.db2.gz NZDJSEWEVXQRRR-IINYFYTJSA-N 0 3 383.316 3.483 10 0 GGAEHN Cn1nccc1CCN1CCC[C@@H]1c1ccccc1I ZINC000549041121 567370820 /nfs/dbraw/zinc/37/08/20/567370820.db2.gz XFWZMHPYJVTPLW-MRXNPFEDSA-N 0 3 381.261 3.404 10 0 GGAEHN CS(=O)(=O)NCCN[C@@H](c1cccc(C(F)(F)F)c1)C1CCCCC1 ZINC000549077431 567371896 /nfs/dbraw/zinc/37/18/96/567371896.db2.gz JUNMEOLIKFSTOT-MRXNPFEDSA-N 0 3 378.460 3.466 10 0 GGAEHN COc1ccc(Br)c(CN(C)C(=O)NC[C@H]2CCN2C(C)(C)C)c1 ZINC000661405605 567371971 /nfs/dbraw/zinc/37/19/71/567371971.db2.gz XCJWCLGTFMWHOM-CQSZACIVSA-N 0 3 398.345 3.472 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)N[C@@H](c1cncc(Br)c1)C1CC1 ZINC000661404766 567372023 /nfs/dbraw/zinc/37/20/23/567372023.db2.gz QYBQEXWDXHSIGI-JKSUJKDBSA-N 0 3 395.345 3.467 10 0 GGAEHN Cc1c(Br)cc(CNC[C@H](O)[C@H]2CCCO2)cc1Br ZINC000527753496 567372063 /nfs/dbraw/zinc/37/20/63/567372063.db2.gz AVCNZDLDOIJEOI-UONOGXRCSA-N 0 3 393.119 3.150 10 0 GGAEHN Ic1cnc(CNC[C@H]2CCN2C2CCCCC2)s1 ZINC000527752303 567372138 /nfs/dbraw/zinc/37/21/38/567372138.db2.gz LJHJELNBZUUDJL-GFCCVEGCSA-N 0 3 391.322 3.244 10 0 GGAEHN NC[C@H](C(=O)N1CCOc2ccc(Br)cc2C1)c1ccc(F)cc1 ZINC000568999008 567372516 /nfs/dbraw/zinc/37/25/16/567372516.db2.gz QDXBOFLLOMSXHK-INIZCTEOSA-N 0 3 393.256 3.052 10 0 GGAEHN CS(=O)(=O)c1cc(CNC[C@H](O)CC2CCCC2)cc(C(F)(F)F)c1 ZINC000568993593 567372902 /nfs/dbraw/zinc/37/29/02/567372902.db2.gz RCDBFLTZMUTXMX-OAHLLOKOSA-N 0 3 379.444 3.140 10 0 GGAEHN COc1ccc(CN2CC[C@H]2CNCc2ccc(Br)cn2)cc1 ZINC000527773266 567373705 /nfs/dbraw/zinc/37/37/05/567373705.db2.gz NGUITROIUGBBIB-KRWDZBQOSA-N 0 3 376.298 3.217 10 0 GGAEHN C[C@H]1C[C@@H](NC(=O)NCc2ccc(Br)c(F)c2F)CCN1C ZINC000527807554 567374773 /nfs/dbraw/zinc/37/47/73/567374773.db2.gz LCDRZXWKNLNAKF-ONGXEEELSA-N 0 3 376.245 3.009 10 0 GGAEHN Cc1cc(Br)cn2c(CNC[C@@H]3c4ccccc4C(=O)N3C)cnc12 ZINC000527805455 567374783 /nfs/dbraw/zinc/37/47/83/567374783.db2.gz IXGIONFNOYONIH-QGZVFWFLSA-N 0 3 399.292 3.322 10 0 GGAEHN C[C@H](NC(=O)N[C@H]1CCCN(C)C1)c1cc(F)c(Br)cc1F ZINC000527797901 567374907 /nfs/dbraw/zinc/37/49/07/567374907.db2.gz DNYOFYFCLVQULL-UWVGGRQHSA-N 0 3 376.245 3.182 10 0 GGAEHN COc1ccc(CCNCc2ccc(F)cc2I)cn1 ZINC000527797700 567375044 /nfs/dbraw/zinc/37/50/44/567375044.db2.gz OYGMQSKTCWYQTK-UHFFFAOYSA-N 0 3 386.208 3.166 10 0 GGAEHN COc1cccc(CN(CCN(C)C)C(=O)c2ncsc2Br)c1 ZINC000569042431 567375178 /nfs/dbraw/zinc/37/51/78/567375178.db2.gz ZVKVDKXSZPHHIS-UHFFFAOYSA-N 0 3 398.326 3.118 10 0 GGAEHN C[C@@H](NC(=O)N[C@H]1CCCN(C)C1)c1cc(F)c(Br)cc1F ZINC000527797907 567375690 /nfs/dbraw/zinc/37/56/90/567375690.db2.gz DNYOFYFCLVQULL-ZJUUUORDSA-N 0 3 376.245 3.182 10 0 GGAEHN C[C@H]1C[C@H](NC(=O)NCc2ccc(Br)c(F)c2F)CN1C1CC1 ZINC000527814336 567377428 /nfs/dbraw/zinc/37/74/28/567377428.db2.gz SWAZBYGVLHIFRY-ONGXEEELSA-N 0 3 388.256 3.152 10 0 GGAEHN C[C@@]1(Cc2ccc(OC(F)(F)F)cc2)CCCN1CCCS(C)(=O)=O ZINC000661616407 567384358 /nfs/dbraw/zinc/38/43/58/567384358.db2.gz RVOZQWOCRODGAA-INIZCTEOSA-N 0 3 379.444 3.417 10 0 GGAEHN CNS(=O)(=O)c1cccc([C@H](C)N[C@@H]2[C@H]3Cc4cc(Cl)ccc4[C@@H]23)c1 ZINC000527944080 567386223 /nfs/dbraw/zinc/38/62/23/567386223.db2.gz OHLZFSDUEMRYKI-YWCBWXAZSA-N 0 3 376.909 3.237 10 0 GGAEHN C[C@H](NC(=O)NC[C@H]1CCN1C1CCCCC1)c1ncc(Br)cn1 ZINC000527966950 567386289 /nfs/dbraw/zinc/38/62/89/567386289.db2.gz OMCLTJZIXBUPPV-SWLSCSKDSA-N 0 3 396.333 3.006 10 0 GGAEHN C[C@@H](NCc1cc(F)c(Br)cc1F)C1CCS(=O)(=O)CC1 ZINC000527979365 567387837 /nfs/dbraw/zinc/38/78/37/567387837.db2.gz JHJRKYCPKJIJSS-SECBINFHSA-N 0 3 382.270 3.030 10 0 GGAEHN O=C(Cc1ccc(Br)cc1O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000477314009 567387807 /nfs/dbraw/zinc/38/78/07/567387807.db2.gz BZNXUOGTJDATPH-KRWDZBQOSA-N 0 3 389.293 3.088 10 0 GGAEHN CC1(C)CN(C(=O)CSCc2ccc(Br)cc2F)CCN1 ZINC000477322761 567388268 /nfs/dbraw/zinc/38/82/68/567388268.db2.gz TYASAIWBJQXPDL-UHFFFAOYSA-N 0 3 375.307 3.032 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)COc1ccc(Br)cc1F ZINC000569225367 567388408 /nfs/dbraw/zinc/38/84/08/567388408.db2.gz LXWSYIOYGVRLMD-INIZCTEOSA-N 0 3 393.256 3.052 10 0 GGAEHN COc1ccc([C@H](C)N[C@@H](C)Cn2cc(Br)ccc2=O)c(OC)c1 ZINC000527974564 567388521 /nfs/dbraw/zinc/38/85/21/567388521.db2.gz RSEZRJYEHROQQQ-STQMWFEESA-N 0 3 395.297 3.367 10 0 GGAEHN CN(C)C[C@H](NC1CCN(C(=O)N(C)C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000528011099 567390492 /nfs/dbraw/zinc/39/04/92/567390492.db2.gz OQJCLWRDVIURDV-KRWDZBQOSA-N 0 3 387.355 3.332 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000477370474 567391102 /nfs/dbraw/zinc/39/11/02/567391102.db2.gz CFHCIXWALBAVTB-AWEZNQCLSA-N 0 3 381.314 3.032 10 0 GGAEHN CN1CCC2(CCCN2S(=O)(=O)Cc2ccc(Cl)cc2Cl)CC1 ZINC000501480325 567391589 /nfs/dbraw/zinc/39/15/89/567391589.db2.gz TUYPINWDVVXNGD-UHFFFAOYSA-N 0 3 377.337 3.383 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)c1cc[nH]c(=O)c1Br)c1ccsc1 ZINC000435865669 567392811 /nfs/dbraw/zinc/39/28/11/567392811.db2.gz RBIQSWUJLPIPGP-ZDUSSCGKSA-N 0 3 398.326 3.424 10 0 GGAEHN Cn1cc(C[C@@H]2CCC[C@H]2NCc2cn3cc(Br)ccc3n2)cn1 ZINC000661780282 567392850 /nfs/dbraw/zinc/39/28/50/567392850.db2.gz PTPPLSDRHONING-WMLDXEAASA-N 0 3 388.313 3.331 10 0 GGAEHN O=C(NCC1(Cc2ccc(Br)cc2)CC1)N1CCN2CCC1CC2 ZINC000661798948 567394353 /nfs/dbraw/zinc/39/43/53/567394353.db2.gz RSJKEEVNBXZWJG-UHFFFAOYSA-N 0 3 392.341 3.261 10 0 GGAEHN O[C@@H](CN[C@@H]1CCOc2c(Br)cccc21)COCc1ccco1 ZINC000501517385 567394621 /nfs/dbraw/zinc/39/46/21/567394621.db2.gz GSDJHQHKZDMORK-BLLLJJGKSA-N 0 3 382.254 3.033 10 0 GGAEHN O[C@@H](CN[C@@H]1CCOc2c(Br)cccc21)COc1ccc(F)cc1 ZINC000501549466 567396412 /nfs/dbraw/zinc/39/64/12/567396412.db2.gz HQBBXZQIKMHNJJ-SUMWQHHRSA-N 0 3 396.256 3.441 10 0 GGAEHN NC(=O)CC1(NCc2cnc(-c3ccc(Br)cc3)s2)CCC1 ZINC000477481344 567397724 /nfs/dbraw/zinc/39/77/24/567397724.db2.gz YBSIZMORCAUUDD-UHFFFAOYSA-N 0 3 380.311 3.460 10 0 GGAEHN C[C@H](NC[C@@H]1CSc2ccccc2O1)c1ccc(NS(C)(=O)=O)cc1 ZINC000569339489 567398189 /nfs/dbraw/zinc/39/81/89/567398189.db2.gz IBBANHUATCQUNB-XJKSGUPXSA-N 0 3 378.519 3.262 10 0 GGAEHN CO[C@@H](CCNC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)C(F)(F)F ZINC000549576694 567398826 /nfs/dbraw/zinc/39/88/26/567398826.db2.gz URIGDKXBEDYMIH-KBPBESRZSA-N 0 3 381.826 3.209 10 0 GGAEHN O=C(NC1CCN([C@H]2CCOC2)CC1)N[C@H]1CCCc2sc(Cl)cc21 ZINC000661987297 567403043 /nfs/dbraw/zinc/40/30/43/567403043.db2.gz PIOCWSUJSHJEGK-ZFWWWQNUSA-N 0 3 383.945 3.331 10 0 GGAEHN C[C@H](NCc1nnnn1-c1ccccc1Br)C1CCC(F)CC1 ZINC000662001493 567403190 /nfs/dbraw/zinc/40/31/90/567403190.db2.gz VEPHITWLQRCJMR-HIFPTAJRSA-N 0 3 382.281 3.431 10 0 GGAEHN Cc1ccc([C@@H](CNC(=O)Cc2ccc(Br)cc2O)N(C)C)cc1 ZINC000477609943 567405254 /nfs/dbraw/zinc/40/52/54/567405254.db2.gz HQHGHPSMEBRRDK-QGZVFWFLSA-N 0 3 391.309 3.425 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(Br)c(F)c1 ZINC000501801665 567405553 /nfs/dbraw/zinc/40/55/53/567405553.db2.gz GCLLKNWXDCEBPI-MRXNPFEDSA-N 0 3 393.300 3.420 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)Cc1ccc(Br)c(F)c1 ZINC000501801663 567405848 /nfs/dbraw/zinc/40/58/48/567405848.db2.gz GCLLKNWXDCEBPI-INIZCTEOSA-N 0 3 393.300 3.420 10 0 GGAEHN COc1ccc(CN2CCC(CNC(=O)[C@@H]3C[C@]3(C)Br)CC2)cc1 ZINC000528280761 567406844 /nfs/dbraw/zinc/40/68/44/567406844.db2.gz QSXUXZGESVLSTR-HKUYNNGSSA-N 0 3 395.341 3.197 10 0 GGAEHN CN(C)CCN(Cc1ccc(F)cc1F)C(=O)[C@@H]1C[C@@]1(C)Br ZINC000528278344 567407415 /nfs/dbraw/zinc/40/74/15/567407415.db2.gz HNSRVYRIJGBGIB-XJKSGUPXSA-N 0 3 375.257 3.029 10 0 GGAEHN O=S(=O)(Cc1ccc(Cl)cc1Cl)N1CCC[C@@H]1CN1CCCC1 ZINC000501891671 567411652 /nfs/dbraw/zinc/41/16/52/567411652.db2.gz PEBMTMSHKBNNMS-OAHLLOKOSA-N 0 3 377.337 3.383 10 0 GGAEHN CN1CCC(CC(=O)N2CCOC[C@@H]2c2cccc(Br)c2)CC1 ZINC000618774096 567413098 /nfs/dbraw/zinc/41/30/98/567413098.db2.gz OBNXEEKDOWSFKH-QGZVFWFLSA-N 0 3 381.314 3.081 10 0 GGAEHN C[C@@]1(Br)C[C@@H]1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000528348332 567413841 /nfs/dbraw/zinc/41/38/41/567413841.db2.gz FXAYUMAYVATTSX-IEBWSBKVSA-N 0 3 379.342 3.327 10 0 GGAEHN Fc1c(Br)ccc(CN2CCC(CN3CCOCC3)CC2)c1F ZINC000528353094 567414965 /nfs/dbraw/zinc/41/49/65/567414965.db2.gz GUFHVQVUBDOOAR-UHFFFAOYSA-N 0 3 389.284 3.272 10 0 GGAEHN CC(C)(C)N1CC[C@H](NCCCS(C)(=O)=O)[C@H]1c1ccc(Cl)c(F)c1 ZINC000569573900 567415044 /nfs/dbraw/zinc/41/50/44/567415044.db2.gz HKTFOBAXYOOYIY-DLBZAZTESA-N 0 3 390.952 3.417 10 0 GGAEHN CCN(CC)CCN(C(=O)c1cncc(F)c1)c1ccc(Br)cn1 ZINC000569581223 567415392 /nfs/dbraw/zinc/41/53/92/567415392.db2.gz IOCNFVCSJHWCEC-UHFFFAOYSA-N 0 3 395.276 3.367 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)Cc1csc(-c2cccc(Br)c2)n1 ZINC000502133756 567421464 /nfs/dbraw/zinc/42/14/64/567421464.db2.gz ZZFVFNLLXRTMSR-HNNXBMFYSA-N 0 3 394.338 3.326 10 0 GGAEHN COc1ccc(Br)cc1[C@@H]1CCCN1C[C@H]1CCC2(CNC2)O1 ZINC000662255206 567422624 /nfs/dbraw/zinc/42/26/24/567422624.db2.gz BCPVBNADHVJMPG-ZBFHGGJFSA-N 0 3 381.314 3.116 10 0 GGAEHN COc1ccccc1[C@H]1CNCCN1Cc1cc(Br)cnc1OC ZINC000662272484 567423519 /nfs/dbraw/zinc/42/35/19/567423519.db2.gz NZYZTWPUNAIYAD-MRXNPFEDSA-N 0 3 392.297 3.008 10 0 GGAEHN C[C@H](NC[C@@H]1CNCCO1)c1nc(-c2ccc(Br)cc2)cs1 ZINC000662280154 567424276 /nfs/dbraw/zinc/42/42/76/567424276.db2.gz CXUATVOHQGVONH-FZMZJTMJSA-N 0 3 382.327 3.212 10 0 GGAEHN CCOCCOC[C@@H](O)CN[C@@H](C)c1cc2cc(Br)ccc2o1 ZINC000477930357 567425778 /nfs/dbraw/zinc/42/57/78/567425778.db2.gz KKBMLJCPQKSNNY-WFASDCNBSA-N 0 3 386.286 3.260 10 0 GGAEHN CN(C)CCN(Cc1ccccn1)C(=O)c1ccc(Br)c(F)c1F ZINC000528460978 567426286 /nfs/dbraw/zinc/42/62/86/567426286.db2.gz AEDZQWLACGCXBV-UHFFFAOYSA-N 0 3 398.251 3.326 10 0 GGAEHN CN(CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[C@@H](CN)C(F)(F)F ZINC000662327813 567427400 /nfs/dbraw/zinc/42/74/00/567427400.db2.gz MVZVELOWNGUDLX-JTQLQIEISA-N 0 3 377.716 3.119 10 0 GGAEHN C[C@H](C(=O)N[C@@H](C)c1ccc(Cl)cc1Cl)N(C)[C@H](CN)C(F)(F)F ZINC000662329471 567427404 /nfs/dbraw/zinc/42/74/04/567427404.db2.gz KAWKLLBNJJTDSB-IGJMFERPSA-N 0 3 386.245 3.381 10 0 GGAEHN CN(CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[C@@H](CN)C(F)(F)F ZINC000662327172 567427469 /nfs/dbraw/zinc/42/74/69/567427469.db2.gz DYTUQSSQUDGTNA-JTQLQIEISA-N 0 3 377.716 3.119 10 0 GGAEHN CN(CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[C@H](CN)C(F)(F)F ZINC000662327173 567427478 /nfs/dbraw/zinc/42/74/78/567427478.db2.gz DYTUQSSQUDGTNA-SNVBAGLBSA-N 0 3 377.716 3.119 10 0 GGAEHN C[C@H](C(=O)N[C@@H](C)c1ccc(Cl)cc1Cl)N(C)[C@@H](CN)C(F)(F)F ZINC000662329477 567427493 /nfs/dbraw/zinc/42/74/93/567427493.db2.gz KAWKLLBNJJTDSB-RWEMILLDSA-N 0 3 386.245 3.381 10 0 GGAEHN CN(C)[C@H]1CCOc2c(Nc3ncc(I)cn3)cccc21 ZINC000618983958 567429073 /nfs/dbraw/zinc/42/90/73/567429073.db2.gz HSTPDQWROLENQF-ZDUSSCGKSA-N 0 3 396.232 3.210 10 0 GGAEHN C[C@@H](CN1CCC(C)CC1)NC(=O)Cc1noc2ccc(Br)cc21 ZINC000618994950 567429260 /nfs/dbraw/zinc/42/92/60/567429260.db2.gz DUAUIHWWODDYBA-ZDUSSCGKSA-N 0 3 394.313 3.369 10 0 GGAEHN CN(C)Cc1ccc(NC(=O)c2sc3c(c2Br)CNC3)cc1 ZINC000662374508 567431970 /nfs/dbraw/zinc/43/19/70/567431970.db2.gz IZLQUCJSNGTWOE-UHFFFAOYSA-N 0 3 380.311 3.428 10 0 GGAEHN OC[C@@]1([C@H](NCc2ccc(Br)c(F)c2F)C2CC2)CCCO1 ZINC000528513611 567432202 /nfs/dbraw/zinc/43/22/02/567432202.db2.gz ARDQWBHPYZXPKF-HZPDHXFCSA-N 0 3 376.241 3.137 10 0 GGAEHN Cn1nc2c(c1CNC[C@H](O)COc1ccc(Cl)cc1Cl)CCCC2 ZINC000569804557 567434725 /nfs/dbraw/zinc/43/47/25/567434725.db2.gz GJMXGKKABSZPJC-ZDUSSCGKSA-N 0 3 384.307 3.135 10 0 GGAEHN N[C@@H](CNC(=O)c1cc(Br)cc(N2CCCC2)c1)c1ccccc1 ZINC000662412196 567434810 /nfs/dbraw/zinc/43/48/10/567434810.db2.gz DOKVURPSLDRZSK-SFHVURJKSA-N 0 3 388.309 3.479 10 0 GGAEHN CCN1CC[C@H]2OCCN(Cc3cc(Br)cc4cccnc43)[C@H]2C1 ZINC000550227091 567435748 /nfs/dbraw/zinc/43/57/48/567435748.db2.gz APBIQXBHPJISEJ-ZWKOTPCHSA-N 0 3 390.325 3.292 10 0 GGAEHN Cn1c(=O)ccc2c1CCC[C@H]2NCc1cccc(I)c1 ZINC000593695149 567436265 /nfs/dbraw/zinc/43/62/65/567436265.db2.gz XEXDHOFFRNXFAH-OAHLLOKOSA-N 0 3 394.256 3.157 10 0 GGAEHN Cn1c(=O)ccc2c1CCC[C@@H]2NCc1ccc(I)cc1 ZINC000593695258 567436412 /nfs/dbraw/zinc/43/64/12/567436412.db2.gz ZLODJUDDAPHURH-HNNXBMFYSA-N 0 3 394.256 3.157 10 0 GGAEHN CC[C@H]1CCCCN1CCNC(=O)c1sc2c(c1Br)CNC2 ZINC000662457924 567437610 /nfs/dbraw/zinc/43/76/10/567437610.db2.gz GAOQJXWNCNWIRK-NSHDSACASA-N 0 3 386.359 3.108 10 0 GGAEHN CC(C)N1CC[C@H](N(C)C(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000457079098 567438051 /nfs/dbraw/zinc/43/80/51/567438051.db2.gz BFZCVNOJJIRHHP-NSHDSACASA-N 0 3 375.257 3.211 10 0 GGAEHN O[C@H](CNC[C@H]1COc2ccccc2O1)COc1c(Cl)cccc1Cl ZINC000550328362 567441343 /nfs/dbraw/zinc/44/13/43/567441343.db2.gz RGBPGUUILACYPE-OLZOCXBDSA-N 0 3 384.259 3.163 10 0 GGAEHN CN(C)CCOc1ccc(NC(=O)[C@@H]2C[C@@]2(C)Br)cc1Cl ZINC000528590895 567441525 /nfs/dbraw/zinc/44/15/25/567441525.db2.gz IHNFHIXVFHJPHX-XHDPSFHLSA-N 0 3 375.694 3.392 10 0 GGAEHN O[C@@H](CNC[C@@H]1COc2ccccc2O1)COc1c(Cl)cccc1Cl ZINC000550328363 567441590 /nfs/dbraw/zinc/44/15/90/567441590.db2.gz RGBPGUUILACYPE-QWHCGFSZSA-N 0 3 384.259 3.163 10 0 GGAEHN OC[C@H]1CCC2(CCOCC2)CN1CCOc1cccc(Br)c1 ZINC000528641860 567444245 /nfs/dbraw/zinc/44/42/45/567444245.db2.gz VZYPVZLTYBOBNU-MRXNPFEDSA-N 0 3 384.314 3.081 10 0 GGAEHN COc1cc(C(=O)NCCN2[C@@H](C)CCC[C@@H]2C)cc(OC)c1Br ZINC000593876442 567444724 /nfs/dbraw/zinc/44/47/24/567444724.db2.gz XYNGUOWDEJBOOC-STQMWFEESA-N 0 3 399.329 3.459 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)CNC(=O)c1ccc(Cl)c(Cl)c1 ZINC000593876405 567445045 /nfs/dbraw/zinc/44/50/45/567445045.db2.gz WJBINPUXOSGSST-STQMWFEESA-N 0 3 386.323 3.102 10 0 GGAEHN OC[C@@H]1CCC2(CCOCC2)CN1CCOc1cccc(Br)c1 ZINC000528641859 567445102 /nfs/dbraw/zinc/44/51/02/567445102.db2.gz VZYPVZLTYBOBNU-INIZCTEOSA-N 0 3 384.314 3.081 10 0 GGAEHN C[C@@H]1CCN(CC(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)C1 ZINC000569939016 567445221 /nfs/dbraw/zinc/44/52/21/567445221.db2.gz GZRXVULWXIOPNG-CQSZACIVSA-N 0 3 384.351 3.416 10 0 GGAEHN O=C(N1CCO[C@H](c2ccc(Br)cc2)C1)C1(NC2CC2)CCC1 ZINC000662528373 567446839 /nfs/dbraw/zinc/44/68/39/567446839.db2.gz NROBNQRQPDJKHN-INIZCTEOSA-N 0 3 379.298 3.024 10 0 GGAEHN Cn1cnnc1Sc1ccc(NC(=O)C2(NC3CC3)CCC2)cc1Cl ZINC000662548296 567448306 /nfs/dbraw/zinc/44/83/06/567448306.db2.gz GELFQQYLFDPAOV-UHFFFAOYSA-N 0 3 377.901 3.233 10 0 GGAEHN CCCN1CCC(CNS(=O)(=O)c2ccc(C)cc2Br)CC1 ZINC000502734964 567448965 /nfs/dbraw/zinc/44/89/65/567448965.db2.gz AJUJOGAFYRVNSQ-UHFFFAOYSA-N 0 3 389.359 3.158 10 0 GGAEHN O=C(NCc1ccsc1Br)Nc1ccc2c(c1)OCCNC2 ZINC000528709897 567449096 /nfs/dbraw/zinc/44/90/96/567449096.db2.gz NKXSFWJXOGYQRM-UHFFFAOYSA-N 0 3 382.283 3.314 10 0 GGAEHN CN(C)CC(C)(C)NC(=O)CSCc1ccc(Br)cc1F ZINC000457214489 567449701 /nfs/dbraw/zinc/44/97/01/567449701.db2.gz WRXFYDHCZQDYLS-UHFFFAOYSA-N 0 3 377.323 3.278 10 0 GGAEHN O=C(Nc1cc(Cl)c(Br)cc1F)N[C@@H]1CNCCC1(F)F ZINC000528697630 567449838 /nfs/dbraw/zinc/44/98/38/567449838.db2.gz NZGTTYLMSIXEFN-SNVBAGLBSA-N 0 3 386.599 3.360 10 0 GGAEHN Cc1cc(C(=O)NC(C)(C)CN(C)C)nn1-c1ccc(Br)cc1 ZINC000457215286 567449892 /nfs/dbraw/zinc/44/98/92/567449892.db2.gz YZBDXPIHFKXBJO-UHFFFAOYSA-N 0 3 379.302 3.013 10 0 GGAEHN O=C(NCCc1cccc(Br)c1)Nc1ccc2c(c1)OCCNC2 ZINC000528704290 567449965 /nfs/dbraw/zinc/44/99/65/567449965.db2.gz JSPZGTJHQYLJHH-UHFFFAOYSA-N 0 3 390.281 3.295 10 0 GGAEHN COc1ccc(Br)cc1CN1CCC(C)(N2CCOCC2)CC1 ZINC000528731991 567450813 /nfs/dbraw/zinc/45/08/13/567450813.db2.gz WIRIMGJYSGSDEE-UHFFFAOYSA-N 0 3 383.330 3.144 10 0 GGAEHN CC1(N2CCOCC2)CCN(CCOc2cccc(Br)c2)CC1 ZINC000528729696 567451538 /nfs/dbraw/zinc/45/15/38/567451538.db2.gz ISGKOPFUQSZQTN-UHFFFAOYSA-N 0 3 383.330 3.015 10 0 GGAEHN COc1ccc(Br)c(CN2CCC(C)(N3CCOCC3)CC2)c1 ZINC000528726797 567451565 /nfs/dbraw/zinc/45/15/65/567451565.db2.gz LVFSPYRXYVUSNY-UHFFFAOYSA-N 0 3 383.330 3.144 10 0 GGAEHN CC1(N2CCOCC2)CCN(CCOc2ccccc2Br)CC1 ZINC000528727813 567451597 /nfs/dbraw/zinc/45/15/97/567451597.db2.gz UYWUJBBFTGOWRZ-UHFFFAOYSA-N 0 3 383.330 3.015 10 0 GGAEHN O=C(NCc1ccc(Br)s1)Nc1ccc2c(c1)OCCNC2 ZINC000528714915 567451757 /nfs/dbraw/zinc/45/17/57/567451757.db2.gz NAHAUDYITSHXBT-UHFFFAOYSA-N 0 3 382.283 3.314 10 0 GGAEHN COC(=O)CC1(NCc2cc(Br)c3c(c2)OCCO3)CCCC1 ZINC000619431680 567452107 /nfs/dbraw/zinc/45/21/07/567452107.db2.gz HCGWLGVGPSFRJB-UHFFFAOYSA-N 0 3 384.270 3.186 10 0 GGAEHN C[C@H](N[C@H]1[C@@H](C)[C@H](C)O[C@H]1C)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000528752074 567452933 /nfs/dbraw/zinc/45/29/33/567452933.db2.gz DGULHGURYJQZMH-DEEHTKSCSA-N 0 3 383.330 3.198 10 0 GGAEHN O=S(=O)(c1cccc(Br)c1)N1CCCC[C@H](N2CCCC2)C1 ZINC000594044598 567455429 /nfs/dbraw/zinc/45/54/29/567455429.db2.gz RKKWYFLFNSTZMS-HNNXBMFYSA-N 0 3 387.343 3.088 10 0 GGAEHN CN(C)Cc1cccc(NC(=O)c2sc3c(c2Br)CNC3)c1 ZINC000662683099 567455938 /nfs/dbraw/zinc/45/59/38/567455938.db2.gz NHYLVVHVIOKFPT-UHFFFAOYSA-N 0 3 380.311 3.428 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2cc(F)c(Cl)cc2Cl)CC1 ZINC000478435053 567456315 /nfs/dbraw/zinc/45/63/15/567456315.db2.gz CLADWEMBLCSPOF-UHFFFAOYSA-N 0 3 384.238 3.499 10 0 GGAEHN CCn1cc(Br)cc1C(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000662689937 567457511 /nfs/dbraw/zinc/45/75/11/567457511.db2.gz YPQZHZLFVFGSJX-INIZCTEOSA-N 0 3 378.270 3.184 10 0 GGAEHN O=C(NC[C@@H]1CCN(c2ccc(Br)cc2)C1)C1(NC2CC2)CCC1 ZINC000662691560 567457939 /nfs/dbraw/zinc/45/79/39/567457939.db2.gz JODTWNLFGMYFGG-AWEZNQCLSA-N 0 3 392.341 3.066 10 0 GGAEHN O=C(CCN1CCC[C@H]1c1ccc(=O)[nH]n1)Nc1cccc(Br)c1 ZINC000528797113 567458545 /nfs/dbraw/zinc/45/85/45/567458545.db2.gz VEHZYDXWIVQVNP-HNNXBMFYSA-N 0 3 391.269 3.110 10 0 GGAEHN O[C@@H](CNC[C@H]1COc2ccccc2O1)COc1cc(Cl)ccc1Cl ZINC000550721333 567458861 /nfs/dbraw/zinc/45/88/61/567458861.db2.gz MDZSOHRYSCGVDK-KBPBESRZSA-N 0 3 384.259 3.163 10 0 GGAEHN CCO[C@@H]1C[C@@](N)(C(=O)N2Cc3ccc(C)c(Br)c3C2)C1(C)C ZINC000662737679 567459123 /nfs/dbraw/zinc/45/91/23/567459123.db2.gz APHRYUSHDORMJR-RDTXWAMCSA-N 0 3 381.314 3.132 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2cc(C)ccc2Br)CC1 ZINC000478467811 567459602 /nfs/dbraw/zinc/45/96/02/567459602.db2.gz ZPTYUKADXCDOAA-UHFFFAOYSA-N 0 3 390.281 3.124 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2ccc(C)cc2Br)CC1 ZINC000478459509 567459610 /nfs/dbraw/zinc/45/96/10/567459610.db2.gz WTKSMQICZARUFJ-UHFFFAOYSA-N 0 3 390.281 3.124 10 0 GGAEHN COc1ccccc1[C@H]1[C@@H](N)CCCN1C(=O)c1ccc(Br)o1 ZINC000457363059 567460746 /nfs/dbraw/zinc/46/07/46/567460746.db2.gz NXEPITNMWGLGDU-LRDDRELGSA-N 0 3 379.254 3.355 10 0 GGAEHN N[C@H](CC(=O)N1CCOc2cc(Br)ccc2C1)c1ccccc1 ZINC000662743432 567460941 /nfs/dbraw/zinc/46/09/41/567460941.db2.gz IWMRFLDXWANDKR-MRXNPFEDSA-N 0 3 375.266 3.260 10 0 GGAEHN O=C(c1cc2c(s1)CCNC2)N1CCOc2cc(Br)ccc2C1 ZINC000662743662 567461431 /nfs/dbraw/zinc/46/14/31/567461431.db2.gz KOUWZTNXBGDCLY-UHFFFAOYSA-N 0 3 393.306 3.191 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2cnc(C)c(Cl)c2Cl)CC1 ZINC000478494849 567462284 /nfs/dbraw/zinc/46/22/84/567462284.db2.gz VGACTMRWWFMXDF-UHFFFAOYSA-N 0 3 381.263 3.063 10 0 GGAEHN CN(C)Cc1ccc(NC(=O)c2cccc3c2CCNC3)cc1Br ZINC000662796598 567462361 /nfs/dbraw/zinc/46/23/61/567462361.db2.gz ONCMGJUNANOYCZ-UHFFFAOYSA-N 0 3 388.309 3.409 10 0 GGAEHN CC(C)(C)n1cc(Br)c(C(=O)N2CCc3ccccc3[C@H]2CN)n1 ZINC000662821433 567462904 /nfs/dbraw/zinc/46/29/04/567462904.db2.gz FUOYILGINLZMAR-OAHLLOKOSA-N 0 3 391.313 3.099 10 0 GGAEHN Cc1ccc(I)c(C(=O)N[C@@H]2CCCN3CCCC[C@@H]23)c1 ZINC000594199379 567465149 /nfs/dbraw/zinc/46/51/49/567465149.db2.gz YFDNNWUZNXVMSI-CVEARBPZSA-N 0 3 398.288 3.346 10 0 GGAEHN Cc1ccc(I)c(C(=O)N[C@H]2CCCN3CCCC[C@@H]23)c1 ZINC000594199380 567465300 /nfs/dbraw/zinc/46/53/00/567465300.db2.gz YFDNNWUZNXVMSI-HOTGVXAUSA-N 0 3 398.288 3.346 10 0 GGAEHN Cc1cc(Br)c(Cl)cc1NC(=O)c1cn[n-]c1[C@H]1CC[NH2+]C1 ZINC000662861178 567466243 /nfs/dbraw/zinc/46/62/43/567466243.db2.gz YUYUPYJBIQPELN-VIFPVBQESA-N 0 3 383.677 3.463 10 0 GGAEHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)[C@H]1C[C@]1(C)Br ZINC000528905275 567467097 /nfs/dbraw/zinc/46/70/97/567467097.db2.gz YCHIPZYJPULLQQ-SUMDDJOVSA-N 0 3 395.341 3.379 10 0 GGAEHN NC1(C(=O)N2CCc3[nH]c4ccc(Br)cc4c3C2)CC2(CCC2)C1 ZINC000662862442 567467530 /nfs/dbraw/zinc/46/75/30/567467530.db2.gz PDDKAYBJQNGDSK-UHFFFAOYSA-N 0 3 388.309 3.477 10 0 GGAEHN Cn1cc(CCN2CCC[C@H]2c2ccccc2I)cn1 ZINC000503093343 567468050 /nfs/dbraw/zinc/46/80/50/567468050.db2.gz IIDSVYSSGGRQIF-INIZCTEOSA-N 0 3 381.261 3.404 10 0 GGAEHN CN1CC[C@@H](NC(=O)c2cc(O)cc(Br)c2)[C@@H]1c1ccccc1 ZINC000528912360 567468528 /nfs/dbraw/zinc/46/85/28/567468528.db2.gz GCJUSKMEBSRSSN-SJORKVTESA-N 0 3 375.266 3.330 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)Nc1ccc(F)c(Br)c1F ZINC000662922736 567469273 /nfs/dbraw/zinc/46/92/73/567469273.db2.gz XHVZZKTUFCVBQI-VMVLCRONSA-N 0 3 389.240 3.198 10 0 GGAEHN COc1ccc([C@@H](C)N[C@H](C)Cn2cc(Br)ccc2=O)cc1F ZINC000550940156 567469440 /nfs/dbraw/zinc/46/94/40/567469440.db2.gz SNKZXCFVRNBNOQ-VXGBXAGGSA-N 0 3 383.261 3.498 10 0 GGAEHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@@]2(C)Br)cc1 ZINC000528946438 567471553 /nfs/dbraw/zinc/47/15/53/567471553.db2.gz UIGNTBWTHHUVAO-XYJFISCASA-N 0 3 381.314 3.122 10 0 GGAEHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)c1cc(Br)cc2[nH]cnc21 ZINC000503183374 567472246 /nfs/dbraw/zinc/47/22/46/567472246.db2.gz UXCRHRHDEXWCKM-NEPJUHHUSA-N 0 3 379.302 3.176 10 0 GGAEHN CC(=O)c1ccc(OC[C@H](O)CNCc2cc(F)cc(Br)c2)cc1 ZINC000551008477 567472395 /nfs/dbraw/zinc/47/23/95/567472395.db2.gz ZGIHPFLYXJKYRR-QGZVFWFLSA-N 0 3 396.256 3.320 10 0 GGAEHN O=C(CCN[C@H](CO)c1cccc(Br)c1)N1CCc2ccccc21 ZINC000503200867 567473570 /nfs/dbraw/zinc/47/35/70/567473570.db2.gz WDUMKINODMCENV-QGZVFWFLSA-N 0 3 389.293 3.052 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)COc1ccc(F)cc1Br ZINC000570333426 567476323 /nfs/dbraw/zinc/47/63/23/567476323.db2.gz DFNDTVCHVVFKGN-INIZCTEOSA-N 0 3 393.256 3.052 10 0 GGAEHN O[C@@H](CN[C@@H]1CCOc2ccc(Br)cc21)COCc1ccccc1 ZINC000619742717 567477036 /nfs/dbraw/zinc/47/70/36/567477036.db2.gz ZMJDYVWOAUZCLO-FUHWJXTLSA-N 0 3 392.293 3.440 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)Cc1c(F)ccc(Br)c1F ZINC000503309976 567480526 /nfs/dbraw/zinc/48/05/26/567480526.db2.gz KBIYCTIUWRZJQM-UHFFFAOYSA-N 0 3 375.257 3.070 10 0 GGAEHN C[NH+]1CCC(CC[N-]S(=O)(=O)c2cccc(Br)c2Cl)CC1 ZINC000551141391 567481014 /nfs/dbraw/zinc/48/10/14/567481014.db2.gz ZLDUZNRBMNXLFV-UHFFFAOYSA-N 0 3 395.750 3.113 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CNCC[C@H](C)[S@](C)=O ZINC000594498747 567481553 /nfs/dbraw/zinc/48/15/53/567481553.db2.gz VISNDRXNNMYRDT-YTEVENLXSA-N 0 3 384.343 3.190 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CNCC[C@@H](C)[S@](C)=O ZINC000594497168 567481853 /nfs/dbraw/zinc/48/18/53/567481853.db2.gz DEQKSSKNLYLZFL-IPQOISQHSA-N 0 3 384.343 3.190 10 0 GGAEHN C[C@@H]1CC[C@@H](NCC(=O)Nc2ccc(I)cc2)CS1 ZINC000594503733 567482318 /nfs/dbraw/zinc/48/23/18/567482318.db2.gz IOWDWBRUXVZVDF-ZWNOBZJWSA-N 0 3 390.290 3.103 10 0 GGAEHN COc1cc(S(=O)(=O)NC2CCN(C3CCCCC3)CC2)ccc1Cl ZINC000570422658 567483001 /nfs/dbraw/zinc/48/30/01/567483001.db2.gz AHXPOJHMMHBJOS-UHFFFAOYSA-N 0 3 386.945 3.424 10 0 GGAEHN NC(=O)[C@H](NC1CCC(OC(F)F)CC1)c1cccc(Br)c1 ZINC000642707826 567485772 /nfs/dbraw/zinc/48/57/72/567485772.db2.gz ZDEGTNJSFDHJCD-WXRRBKDZSA-N 0 3 377.229 3.116 10 0 GGAEHN CCCN1CC[C@@H](NC(=O)c2cc(Br)cc(N3CCCC3)c2)C1 ZINC000619905913 567487074 /nfs/dbraw/zinc/48/70/74/567487074.db2.gz AEPIXVRTDQJRHE-MRXNPFEDSA-N 0 3 380.330 3.263 10 0 GGAEHN C[C@@H](CNC(=O)c1cc(Br)cc2[nH]cnc21)N1CCC(C)CC1 ZINC000503461970 567487450 /nfs/dbraw/zinc/48/74/50/567487450.db2.gz NAPXUVWCSZMWRN-LBPRGKRZSA-N 0 3 379.302 3.176 10 0 GGAEHN CCN1CCN(Cc2ccc(CNC(=O)c3ccc(Cl)s3)cc2)CC1 ZINC000642769309 567487696 /nfs/dbraw/zinc/48/76/96/567487696.db2.gz KVXAZNJKFNZPPJ-UHFFFAOYSA-N 0 3 377.941 3.469 10 0 GGAEHN COC(=O)c1cc(CNC[C@@H](CO)Cc2cccc(Br)c2)c(C)o1 ZINC000594611944 567489986 /nfs/dbraw/zinc/48/99/86/567489986.db2.gz DPHUKDFNRRZASY-AWEZNQCLSA-N 0 3 396.281 3.078 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NCc1ccc(OC(F)F)cc1 ZINC000551268254 567492483 /nfs/dbraw/zinc/49/24/83/567492483.db2.gz SXGOOCUCMIGKNE-NSHDSACASA-N 0 3 387.224 3.391 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NC[C@@H]1CCC2(CCCCC2)O1 ZINC000551278345 567492969 /nfs/dbraw/zinc/49/29/69/567492969.db2.gz PZRMZICHQOJMSM-HOCLYGCPSA-N 0 3 383.330 3.471 10 0 GGAEHN CC[C@H](Cn1cncn1)N[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O ZINC000551279329 567493532 /nfs/dbraw/zinc/49/35/32/567493532.db2.gz FIMNQTDWULNZQG-HIFRSBDPSA-N 0 3 382.295 3.149 10 0 GGAEHN CC[C@@H](Cn1cncn1)N[C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O ZINC000551279328 567493598 /nfs/dbraw/zinc/49/35/98/567493598.db2.gz FIMNQTDWULNZQG-DZGCQCFKSA-N 0 3 382.295 3.149 10 0 GGAEHN CCOC(=O)[C@@H]1CC[C@H](NCc2cnn(-c3ccc(Br)cc3)c2)C1 ZINC000437351601 567493551 /nfs/dbraw/zinc/49/35/51/567493551.db2.gz ZXWAKSVIKWTLDJ-ZBFHGGJFSA-N 0 3 392.297 3.456 10 0 GGAEHN CC[C@@H]1CCCCN1CCNC(=O)c1cc(Br)cc2[nH]cnc21 ZINC000503582630 567494948 /nfs/dbraw/zinc/49/49/48/567494948.db2.gz DNKJAXUEECJYKJ-CYBMUJFWSA-N 0 3 379.302 3.320 10 0 GGAEHN Cc1cc(Cl)c(C)c(S(=O)(=O)N(C)[C@@H](CN)C(F)(F)F)c1Cl ZINC000663309959 567495572 /nfs/dbraw/zinc/49/55/72/567495572.db2.gz FGMCCGIXKSXJMZ-VIFPVBQESA-N 0 3 379.231 3.120 10 0 GGAEHN CC[C@H]1CCCCN1CCNC(=O)c1cc(Br)cc2[nH]cnc21 ZINC000503582631 567495746 /nfs/dbraw/zinc/49/57/46/567495746.db2.gz DNKJAXUEECJYKJ-ZDUSSCGKSA-N 0 3 379.302 3.320 10 0 GGAEHN COc1cc(CNC[C@@H]2CCC[N@H+](CC3CC3)C2)cc(Br)c1[O-] ZINC000663346822 567499836 /nfs/dbraw/zinc/49/98/36/567499836.db2.gz OWHZLRXGFXMJPE-AWEZNQCLSA-N 0 3 383.330 3.375 10 0 GGAEHN COc1cc(CNC[C@@H]2CCC[N@@H+](CC3CC3)C2)cc(Br)c1[O-] ZINC000663346822 567499838 /nfs/dbraw/zinc/49/98/38/567499838.db2.gz OWHZLRXGFXMJPE-AWEZNQCLSA-N 0 3 383.330 3.375 10 0 GGAEHN C[C@H](O)[C@H](NC[C@H](O)COc1cc(F)cc(Br)c1)c1ccccc1 ZINC000663376385 567502155 /nfs/dbraw/zinc/50/21/55/567502155.db2.gz QTXJSFGLIFNAHX-IWEFOYFVSA-N 0 3 398.272 3.040 10 0 GGAEHN CC(C)(C)O[C@H]1C[C@H](NCCS(=O)(=O)c2cccc(Br)c2)C1 ZINC000663372227 567502308 /nfs/dbraw/zinc/50/23/08/567502308.db2.gz HDPHXRRZGPQUOF-HDJSIYSDSA-N 0 3 390.343 3.159 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000437721901 567506401 /nfs/dbraw/zinc/50/64/01/567506401.db2.gz IHYKBRMBYPCHNL-JLJPHGGASA-N 0 3 386.323 3.259 10 0 GGAEHN Cn1cc(Br)c(CN[C@@H]2CCN(Cc3ccccc3)C3(CC3)C2)n1 ZINC000570718168 567508798 /nfs/dbraw/zinc/50/87/98/567508798.db2.gz RAODHAOVYDVHQU-MRXNPFEDSA-N 0 3 389.341 3.469 10 0 GGAEHN CC(C)Oc1ccc([C@H](CNC(=O)[C@@H]2C[C@]2(C)Br)N(C)C)cc1 ZINC000529392699 567511038 /nfs/dbraw/zinc/51/10/38/567511038.db2.gz PCLDCYRKERNJSG-BQFCYCMXSA-N 0 3 383.330 3.366 10 0 GGAEHN CN(C)C[C@@H](NC(=O)N1C[C@H]2CCC[C@@H](C1)N2)c1ccc(Cl)c(Cl)c1 ZINC000529387951 567511422 /nfs/dbraw/zinc/51/14/22/567511422.db2.gz QWFFPQKMRQUQGK-JKIFEVAISA-N 0 3 385.339 3.132 10 0 GGAEHN COc1c(Br)cc(CN2CC[C@@H](F)[C@H](N)C2)cc1Br ZINC000663506187 567512229 /nfs/dbraw/zinc/51/22/29/567512229.db2.gz ISIVLEDCBKGVGH-VXGBXAGGSA-N 0 3 396.098 3.091 10 0 GGAEHN N[C@@H]1CN(Cc2cc(Br)ccc2OCc2ccccn2)CC[C@H]1F ZINC000663506395 567512296 /nfs/dbraw/zinc/51/22/96/567512296.db2.gz VHNJBLQJAMRNPE-IAGOWNOFSA-N 0 3 394.288 3.294 10 0 GGAEHN COC(=O)c1ccc(CNC[C@H](CO)c2ccccc2)c(Br)c1 ZINC000551555141 567517207 /nfs/dbraw/zinc/51/72/07/567517207.db2.gz SIRXAPCCOSJIKA-MRXNPFEDSA-N 0 3 378.266 3.101 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)Cc1c(F)ccc(Br)c1F ZINC000503988826 567517317 /nfs/dbraw/zinc/51/73/17/567517317.db2.gz YRKONAUXCNFZEG-NSHDSACASA-N 0 3 375.257 3.260 10 0 GGAEHN COCC[C@@H](COC)NCc1cn(-c2ccc(Br)cc2)nc1C ZINC000570861100 567519718 /nfs/dbraw/zinc/51/97/18/567519718.db2.gz FBNRRZJMONZTIW-INIZCTEOSA-N 0 3 382.302 3.084 10 0 GGAEHN C[C@H]1CN(C(=O)NCCc2ccccc2Br)CCN(C2CC2)C1 ZINC000458085817 567519876 /nfs/dbraw/zinc/51/98/76/567519876.db2.gz AEAALXGDHBPOJK-CQSZACIVSA-N 0 3 380.330 3.117 10 0 GGAEHN C[C@@H]1CN(C(=O)NCCc2ccccc2Br)CCN(C2CC2)C1 ZINC000458085815 567520138 /nfs/dbraw/zinc/52/01/38/567520138.db2.gz AEAALXGDHBPOJK-AWEZNQCLSA-N 0 3 380.330 3.117 10 0 GGAEHN O=C(N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1)N1CCN2CCC1CC2 ZINC000551607701 567523105 /nfs/dbraw/zinc/52/31/05/567523105.db2.gz WPHIWCZMHOEMOB-CQSZACIVSA-N 0 3 383.323 3.062 10 0 GGAEHN O=C(NCC1(c2cccc(Br)c2)CCC1)N1CCN2CCC1CC2 ZINC000551617580 567523547 /nfs/dbraw/zinc/52/35/47/567523547.db2.gz VRAHOHWTYZTRRC-UHFFFAOYSA-N 0 3 392.341 3.360 10 0 GGAEHN CCN(C(=O)NCC(C)(C)c1ccc(Br)cc1)[C@H]1CCN(C)C1 ZINC000663714300 567524149 /nfs/dbraw/zinc/52/41/49/567524149.db2.gz RRNATKASMIYVNZ-INIZCTEOSA-N 0 3 382.346 3.462 10 0 GGAEHN COC(=O)[C@@H]1C[C@H]1[C@H](C)NCc1cc(Br)ccc1OC(F)F ZINC000594918510 567525321 /nfs/dbraw/zinc/52/53/21/567525321.db2.gz BEKRTXJCMVNANG-KPXOXKRLSA-N 0 3 378.213 3.338 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)[C@@H](CN)c1ccccc1 ZINC000570962310 567527204 /nfs/dbraw/zinc/52/72/04/567527204.db2.gz VLZOFIIPFKMXHX-WBMJQRKESA-N 0 3 377.282 3.377 10 0 GGAEHN CN(C)CCOc1cc(CNc2nc(C3CC3)ncc2Br)ccn1 ZINC000663752895 567527531 /nfs/dbraw/zinc/52/75/31/567527531.db2.gz BMXWMPSSGLEWLN-UHFFFAOYSA-N 0 3 392.301 3.064 10 0 GGAEHN COC[C@H](CCNCc1cc(Cl)ccc1I)OC ZINC000594954568 567528231 /nfs/dbraw/zinc/52/82/31/567528231.db2.gz HWCNZKBGKAHVJN-LBPRGKRZSA-N 0 3 383.657 3.086 10 0 GGAEHN CCN(C(=O)N[C@H]1CCOc2ccc(Br)cc21)[C@H]1CCN(CC)C1 ZINC000663786597 567530776 /nfs/dbraw/zinc/53/07/76/567530776.db2.gz IURUIHWXFPCLAT-HOCLYGCPSA-N 0 3 396.329 3.398 10 0 GGAEHN CCNC(=O)N1CC[C@H](N[C@H](c2ccc(Br)cc2F)C2CC2)C1 ZINC000479382459 567530882 /nfs/dbraw/zinc/53/08/82/567530882.db2.gz AAOVLUAYEHUGPY-BBRMVZONSA-N 0 3 384.293 3.433 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000594977091 567531032 /nfs/dbraw/zinc/53/10/32/567531032.db2.gz YCNPUXKLDKELRR-CXAGYDPISA-N 0 3 380.330 3.164 10 0 GGAEHN Cc1cc(Br)cc(C)c1CNC(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000594979419 567531259 /nfs/dbraw/zinc/53/12/59/567531259.db2.gz CYZZRMOCJXCNMD-MRXNPFEDSA-N 0 3 380.330 3.349 10 0 GGAEHN Cn1cc(CNCCc2ccc(I)cc2)c(C(F)F)n1 ZINC000594994672 567532819 /nfs/dbraw/zinc/53/28/19/567532819.db2.gz NEQZDWLTWHDFTA-UHFFFAOYSA-N 0 3 391.203 3.295 10 0 GGAEHN OC(CNCc1ccc(F)cc1I)(C1CC1)C1CC1 ZINC000594985236 567532804 /nfs/dbraw/zinc/53/28/04/567532804.db2.gz ZSVZEDVIZSJTQH-UHFFFAOYSA-N 0 3 375.225 3.071 10 0 GGAEHN OC(CNCc1c(F)ccc(I)c1F)(C1CC1)C1CC1 ZINC000594983492 567533096 /nfs/dbraw/zinc/53/30/96/567533096.db2.gz NQNFJRBFNHWJFD-UHFFFAOYSA-N 0 3 393.215 3.210 10 0 GGAEHN OC1(CNCc2ccc(F)cc2I)CCC(F)(F)CC1 ZINC000595000401 567534902 /nfs/dbraw/zinc/53/49/02/567534902.db2.gz KORDXUCQHDTJLL-UHFFFAOYSA-N 0 3 399.194 3.460 10 0 GGAEHN COC(=O)CC(C)(C)C[C@H](C)NCC(=O)Nc1ccc(Br)cc1 ZINC000595010522 567534385 /nfs/dbraw/zinc/53/43/85/567534385.db2.gz XHHHFNOKPRPAOK-LBPRGKRZSA-N 0 3 385.302 3.345 10 0 GGAEHN O=C(CN[C@H]1CCCSCC1)Nc1ccc(I)cc1 ZINC000595038039 567537218 /nfs/dbraw/zinc/53/72/18/567537218.db2.gz FTUODMFNCAXRKX-LBPRGKRZSA-N 0 3 390.290 3.105 10 0 GGAEHN CN(CCC(=O)N1CCOc2cc(Br)ccc2C1)c1ccncc1 ZINC000620708969 567539064 /nfs/dbraw/zinc/53/90/64/567539064.db2.gz XWHBPZSKDAUGNN-UHFFFAOYSA-N 0 3 390.281 3.092 10 0 GGAEHN CC[C@H](N[C@@H]1CCc2ccc(I)cc21)[C@H](O)C(F)F ZINC000595042508 567539417 /nfs/dbraw/zinc/53/94/17/567539417.db2.gz SGGBCGYWUFYBGE-XQQFMLRXSA-N 0 3 381.204 3.273 10 0 GGAEHN CC[C@H](N[C@@H]1CCc2ccc(I)cc21)[C@@H](O)C(F)F ZINC000595042510 567539666 /nfs/dbraw/zinc/53/96/66/567539666.db2.gz SGGBCGYWUFYBGE-YNEHKIRRSA-N 0 3 381.204 3.273 10 0 GGAEHN COC[C@@H](N[C@H](C)c1ccccc1I)C1CCOCC1 ZINC000595075625 567540017 /nfs/dbraw/zinc/54/00/17/567540017.db2.gz ZWILDKYLYDRBBV-MLGOLLRUSA-N 0 3 389.277 3.383 10 0 GGAEHN C[C@H](CCc1ccc(I)cc1)N[C@H]1C[C@@H](C)n2ncnc21 ZINC000595065631 567540652 /nfs/dbraw/zinc/54/06/52/567540652.db2.gz ISQPNSAKPQMLNB-JMSVASOKSA-N 0 3 396.276 3.499 10 0 GGAEHN NC1(C(=O)NCc2cc(Cl)ccc2I)CCCCC1 ZINC000595256532 567550104 /nfs/dbraw/zinc/55/01/04/567550104.db2.gz MWRDXGKEWMJUKH-UHFFFAOYSA-N 0 3 392.668 3.222 10 0 GGAEHN CCN(C(=O)NCC(C)(C)c1cccc(Br)c1)[C@@H]1CCN(C)C1 ZINC000663915894 567541355 /nfs/dbraw/zinc/54/13/55/567541355.db2.gz PFXFYAILRQIHGM-MRXNPFEDSA-N 0 3 382.346 3.462 10 0 GGAEHN C[C@H](NCCc1ccc(I)cc1)c1cc2n(n1)CCC2 ZINC000595094239 567542186 /nfs/dbraw/zinc/54/21/86/567542186.db2.gz JBHDINDBUVKQJE-LBPRGKRZSA-N 0 3 381.261 3.327 10 0 GGAEHN CCSC1(CN[C@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)CC1 ZINC000595092608 567542201 /nfs/dbraw/zinc/54/22/01/567542201.db2.gz LXBAWRNJPKQBLK-SNVBAGLBSA-N 0 3 393.372 3.033 10 0 GGAEHN O=C(NC[C@H]1CCCN1CCCO)N[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000458368351 567542127 /nfs/dbraw/zinc/54/21/27/567542127.db2.gz JBVNULKOQQFRCQ-WBMJQRKESA-N 0 3 386.323 3.127 10 0 GGAEHN Cn1ccnc1[C@@H](NCCc1ccc(I)cc1)C1CC1 ZINC000595094864 567542503 /nfs/dbraw/zinc/54/25/03/567542503.db2.gz NEEAEESRPRQTOD-HNNXBMFYSA-N 0 3 381.261 3.308 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])NC[C@H]1CC[N@@H+]1C1CCCCC1 ZINC000529718544 567543009 /nfs/dbraw/zinc/54/30/09/567543009.db2.gz JNRVLIFXZHJHIU-MRXNPFEDSA-N 0 3 381.314 3.220 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000529718544 567543015 /nfs/dbraw/zinc/54/30/15/567543015.db2.gz JNRVLIFXZHJHIU-MRXNPFEDSA-N 0 3 381.314 3.220 10 0 GGAEHN CN(C)C1CCN(C(=O)CCCC(=O)c2ccc(Br)cc2)CC1 ZINC000438769203 567543173 /nfs/dbraw/zinc/54/31/73/567543173.db2.gz WJEITTBYIHLHJC-UHFFFAOYSA-N 0 3 381.314 3.355 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])NC[C@@H]1CC[N@@H+]1C1CCCCC1 ZINC000529718543 567543220 /nfs/dbraw/zinc/54/32/20/567543220.db2.gz JNRVLIFXZHJHIU-INIZCTEOSA-N 0 3 381.314 3.220 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000529718543 567543230 /nfs/dbraw/zinc/54/32/30/567543230.db2.gz JNRVLIFXZHJHIU-INIZCTEOSA-N 0 3 381.314 3.220 10 0 GGAEHN CC(C)c1n[nH]c(C(=O)NC[C@@H]2CCN2C2CCCCC2)c1Br ZINC000529720465 567544111 /nfs/dbraw/zinc/54/41/11/567544111.db2.gz QWELFSORHBVFRB-ZDUSSCGKSA-N 0 3 383.334 3.432 10 0 GGAEHN C[C@H](Sc1ccc(Br)cc1)C(=O)N[C@H]1CNCCC1(F)F ZINC000571207140 567544435 /nfs/dbraw/zinc/54/44/35/567544435.db2.gz OZHUCJWPNPUSPH-CABZTGNLSA-N 0 3 379.270 3.043 10 0 GGAEHN CCNC(=O)COc1ccc(CNCc2ccc(SC)s2)cc1OC ZINC000571210337 567546829 /nfs/dbraw/zinc/54/68/29/567546829.db2.gz DKZNVVQXSNFIJX-UHFFFAOYSA-N 0 3 380.535 3.283 10 0 GGAEHN CC[C@@H]1CN(C(=O)c2cc(-c3cccc(Br)c3)no2)C[C@H](C)N1 ZINC000620903839 567548763 /nfs/dbraw/zinc/54/87/63/567548763.db2.gz GROWTYBNGJEEEG-SMDDNHRTSA-N 0 3 378.270 3.317 10 0 GGAEHN CC[C@@H]1CN(C(=O)c2coc(-c3ccc(Br)cc3F)n2)C[C@H](C)N1 ZINC000620899740 567548783 /nfs/dbraw/zinc/54/87/83/567548783.db2.gz QZAADMQRLJMIBJ-CMPLNLGQSA-N 0 3 396.260 3.456 10 0 GGAEHN Brc1cc2ncnc(N3CCC(N4CCCOCC4)CC3)c2s1 ZINC000664009001 567548733 /nfs/dbraw/zinc/54/87/33/567548733.db2.gz PMVUBRLWXSRPSC-UHFFFAOYSA-N 0 3 397.342 3.145 10 0 GGAEHN CC[C@@H](N[C@@H](C)Cn1cc(Br)ccc1=O)c1c(C)nn(C)c1C ZINC000438827850 567548735 /nfs/dbraw/zinc/54/87/35/567548735.db2.gz KLAVOMMELMCTFW-XHDPSFHLSA-N 0 3 381.318 3.091 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1cc(Br)ccc1F ZINC000620917939 567549931 /nfs/dbraw/zinc/54/99/31/567549931.db2.gz PSEYUHGXONJRLD-CQSZACIVSA-N 0 3 399.304 3.304 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)[C@@H]1SCCc2sccc21 ZINC000620915123 567550101 /nfs/dbraw/zinc/55/01/01/567550101.db2.gz CNPPVELSRVGRTH-WMLDXEAASA-N 0 3 380.579 3.180 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1ccc(Br)cc1 ZINC000620917209 567550345 /nfs/dbraw/zinc/55/03/45/567550345.db2.gz DGMCOFLZWHGLGF-MRXNPFEDSA-N 0 3 381.314 3.165 10 0 GGAEHN Cc1cc(Br)oc1C(=O)N1CC2(CCCC2)OC[C@@H]1CN(C)C ZINC000620913385 567550541 /nfs/dbraw/zinc/55/05/41/567550541.db2.gz BQXJVCGVPRJIKF-ZDUSSCGKSA-N 0 3 385.302 3.066 10 0 GGAEHN Cc1ncc(C(=O)N2CC3(CCCC3)OC[C@@H]2CN(C)C)c(Cl)c1Cl ZINC000620910499 567550995 /nfs/dbraw/zinc/55/09/95/567550995.db2.gz RREYTJNGPYQNOZ-ZDUSSCGKSA-N 0 3 386.323 3.412 10 0 GGAEHN Cc1cc(Br)oc1C(=O)N1CC2(CCCC2)OC[C@H]1CN(C)C ZINC000620913384 567551021 /nfs/dbraw/zinc/55/10/21/567551021.db2.gz BQXJVCGVPRJIKF-CYBMUJFWSA-N 0 3 385.302 3.066 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1cscc1Br ZINC000620911433 567551048 /nfs/dbraw/zinc/55/10/48/567551048.db2.gz GCRSQTFKBRXSIT-GFCCVEGCSA-N 0 3 387.343 3.226 10 0 GGAEHN CCN(C(=O)NCCCc1ccc(Br)cc1F)[C@H]1CCN(C)C1 ZINC000664148553 567554816 /nfs/dbraw/zinc/55/48/16/567554816.db2.gz BJSGDNKPHVTMSO-HNNXBMFYSA-N 0 3 386.309 3.256 10 0 GGAEHN Cc1cc(Br)cc(C)c1N1CCC[C@H](N[C@H]2CN(C)C[C@@H]2C)C1=O ZINC000552095844 567558091 /nfs/dbraw/zinc/55/80/91/567558091.db2.gz GEMQNXDPCGRZNM-XIRDDKMYSA-N 0 3 394.357 3.101 10 0 GGAEHN Cc1cc(Br)cnc1NCc1ccc(CN2CC[C@@H](O)C2)cc1 ZINC000664238185 567558669 /nfs/dbraw/zinc/55/86/69/567558669.db2.gz XYVXKYADAITUIC-QGZVFWFLSA-N 0 3 376.298 3.331 10 0 GGAEHN C[C@H](Cc1c(Cl)cccc1Cl)NC[C@H]1CCCCN1S(C)(=O)=O ZINC000552100753 567559378 /nfs/dbraw/zinc/55/93/78/567559378.db2.gz UAYNLQYHTBXFBI-CHWSQXEVSA-N 0 3 379.353 3.328 10 0 GGAEHN Brc1cnn(CCN[C@H]2CCCc3nn(-c4ccccc4)cc32)c1 ZINC000552099779 567559388 /nfs/dbraw/zinc/55/93/88/567559388.db2.gz SXPUDGPXDIFITJ-KRWDZBQOSA-N 0 3 386.297 3.499 10 0 GGAEHN CC[C@@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccc(OC(F)F)cc1 ZINC000552097152 567559447 /nfs/dbraw/zinc/55/94/47/567559447.db2.gz UZJURAKHSDOJPH-GDBMZVCRSA-N 0 3 376.469 3.143 10 0 GGAEHN COc1cc(NCc2ccc(CN3CC[C@H](O)C3)cc2)c(Br)cn1 ZINC000664235317 567559750 /nfs/dbraw/zinc/55/97/50/567559750.db2.gz FHZXWYSDACBPQC-HNNXBMFYSA-N 0 3 392.297 3.031 10 0 GGAEHN O=C(Cc1c(F)ccc(Br)c1F)NC[C@@H]1CCCCN1C1CC1 ZINC000505107005 567560068 /nfs/dbraw/zinc/56/00/68/567560068.db2.gz FXTOSLUTQIEALF-LBPRGKRZSA-N 0 3 387.268 3.403 10 0 GGAEHN Cc1cccc(C(=O)NC[C@@H]2CCN2C2CCCC2)c1I ZINC000530026843 567562019 /nfs/dbraw/zinc/56/20/19/567562019.db2.gz CNFMMHBTYYHRKF-AWEZNQCLSA-N 0 3 398.288 3.346 10 0 GGAEHN Cc1cccc(C(=O)NC[C@H]2CCN2C2CCCC2)c1I ZINC000530026844 567561843 /nfs/dbraw/zinc/56/18/43/567561843.db2.gz CNFMMHBTYYHRKF-CQSZACIVSA-N 0 3 398.288 3.346 10 0 GGAEHN COc1cc(C(=O)NC[C@@H]2CCN2C2CCCC2)cc(OC)c1Br ZINC000530026661 567561952 /nfs/dbraw/zinc/56/19/52/567561952.db2.gz MZFLZFSNGYCVKI-AWEZNQCLSA-N 0 3 397.313 3.213 10 0 GGAEHN CN(C)C[C@H](NC(=O)[C@H]1CCn2cncc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031264 567562102 /nfs/dbraw/zinc/56/21/02/567562102.db2.gz DMKMRTNRUNKZPA-GUYCJALGSA-N 0 3 381.307 3.171 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCC1)c1c[nH]c2ncc(Br)cc12 ZINC000530029201 567562138 /nfs/dbraw/zinc/56/21/38/567562138.db2.gz TZCPZHGEFNMKCT-CYBMUJFWSA-N 0 3 377.286 3.072 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCC1)c1ccccc1I ZINC000530029483 567562481 /nfs/dbraw/zinc/56/24/81/567562481.db2.gz ZSHHVQMNXYZWBE-CYBMUJFWSA-N 0 3 384.261 3.038 10 0 GGAEHN COc1cc(C[NH2+]C[C@@H](O)[C@@H](C)c2ccccc2)cc(Br)c1[O-] ZINC000644601349 567563441 /nfs/dbraw/zinc/56/34/41/567563441.db2.gz BHWOOTZKUREKPT-BLLLJJGKSA-N 0 3 380.282 3.418 10 0 GGAEHN CN(C)C[C@H](NC(=O)[C@@H]1C[C@H]1c1cncn1C)c1ccc(Cl)c(Cl)c1 ZINC000530034769 567563988 /nfs/dbraw/zinc/56/39/88/567563988.db2.gz XRZFSFHSRBYOCW-IOASZLSFSA-N 0 3 381.307 3.250 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N1CC[C@]2(C1)CCCN(C)C2 ZINC000458679787 567564499 /nfs/dbraw/zinc/56/44/99/567564499.db2.gz QOASOUIMBSECFR-GOSISDBHSA-N 0 3 396.329 3.085 10 0 GGAEHN CC(C)[C@@H]1CN(C(=O)c2cc(Br)cc(N3CCCC3)c2)CCN1 ZINC000621160592 567564949 /nfs/dbraw/zinc/56/49/49/567564949.db2.gz HQVFZNVYEHIQTE-KRWDZBQOSA-N 0 3 380.330 3.119 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N1CCN(C2CC2)C[C@H](C)C1 ZINC000458688132 567565617 /nfs/dbraw/zinc/56/56/17/567565617.db2.gz XBYASFBHBZVWST-ZDUSSCGKSA-N 0 3 396.329 3.083 10 0 GGAEHN CCn1c(CNC[C@H](O)CCOC(C)C)nc2cc(Br)ccc21 ZINC000644632150 567566658 /nfs/dbraw/zinc/56/66/58/567566658.db2.gz XOWFAGDSNUAJKH-CQSZACIVSA-N 0 3 384.318 3.084 10 0 GGAEHN CC(C)N1CC[C@H](N(C)C(=O)N[C@H]2CCOc3c(Br)cccc32)C1 ZINC000458728645 567569728 /nfs/dbraw/zinc/56/97/28/567569728.db2.gz MXNHJRPTDFZDMU-BBRMVZONSA-N 0 3 396.329 3.397 10 0 GGAEHN CC(C)N1CC[C@@H](N(C)C(=O)N[C@H]2CCOc3c(Br)cccc32)C1 ZINC000458728646 567569957 /nfs/dbraw/zinc/56/99/57/567569957.db2.gz MXNHJRPTDFZDMU-CJNGLKHVSA-N 0 3 396.329 3.397 10 0 GGAEHN CCN(C(=O)NCC(C)(C)c1ccccc1Br)[C@H]1CCN(C)C1 ZINC000664499927 567571856 /nfs/dbraw/zinc/57/18/56/567571856.db2.gz LTVBPEIJMUHFKQ-AWEZNQCLSA-N 0 3 382.346 3.462 10 0 GGAEHN CN1C[C@@H]2CCN(CC(=O)N3CCC[C@H]3c3ccc(Cl)c(Cl)c3)[C@@H]2C1 ZINC000644735779 567573287 /nfs/dbraw/zinc/57/32/87/567573287.db2.gz GCYWLUYWDPHKQO-JCGIZDLHSA-N 0 3 382.335 3.293 10 0 GGAEHN CCN(C(=O)N[C@H](C)[C@H](OC)c1ccc(Br)cc1)[C@@H]1CCN(C)C1 ZINC000664583761 567577318 /nfs/dbraw/zinc/57/73/18/567577318.db2.gz YUMIVQUTUWBMEW-XYPHTWIQSA-N 0 3 398.345 3.261 10 0 GGAEHN COc1cc(CN[C@@H]2CCC[C@H]2Cc2cnn(C)c2)c(Br)cn1 ZINC000621321685 567578158 /nfs/dbraw/zinc/57/81/58/567578158.db2.gz TWUMNRPGXBZANI-XJKSGUPXSA-N 0 3 379.302 3.087 10 0 GGAEHN COc1cc(CN[C@@H]2CCC[C@@H]2Cc2cnn(C)c2)c(Br)cn1 ZINC000621321684 567578258 /nfs/dbraw/zinc/57/82/58/567578258.db2.gz TWUMNRPGXBZANI-CZUORRHYSA-N 0 3 379.302 3.087 10 0 GGAEHN C[C@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccc(Br)c(F)c1 ZINC000552333388 567578511 /nfs/dbraw/zinc/57/85/11/567578511.db2.gz CZTDWZDJJVXTJP-WCQYABFASA-N 0 3 393.322 3.053 10 0 GGAEHN CC[C@@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccccc1OC(F)F ZINC000552333719 567578588 /nfs/dbraw/zinc/57/85/88/567578588.db2.gz MWKQBIYYCIGPEE-DZGCQCFKSA-N 0 3 376.469 3.143 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)c3csc(-c4cc(Br)cs4)n3)[C@@H]2C1 ZINC000644812107 567578918 /nfs/dbraw/zinc/57/89/18/567578918.db2.gz CBVWBGKZJNKVLI-JOYOIKCWSA-N 0 3 398.351 3.410 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)c3ccc(Br)c(C(F)(F)F)c3)[C@@H]2C1 ZINC000644812433 567579131 /nfs/dbraw/zinc/57/91/31/567579131.db2.gz CSRWSBKHOVXQHP-GXFFZTMASA-N 0 3 377.204 3.244 10 0 GGAEHN C[C@@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccc(F)c(Br)c1 ZINC000552333459 567579220 /nfs/dbraw/zinc/57/92/20/567579220.db2.gz FZEFTBRTUQSZKQ-DGCLKSJQSA-N 0 3 393.322 3.053 10 0 GGAEHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)Cc1c(F)ccc(Br)c1F ZINC000552333012 567579309 /nfs/dbraw/zinc/57/93/09/567579309.db2.gz QSTYWQDXSGJTOF-NEPJUHHUSA-N 0 3 387.268 3.355 10 0 GGAEHN C[C@@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccc(Br)c(F)c1 ZINC000552333387 567579321 /nfs/dbraw/zinc/57/93/21/567579321.db2.gz CZTDWZDJJVXTJP-DGCLKSJQSA-N 0 3 393.322 3.053 10 0 GGAEHN C[C@@H](NC(=O)N1CC[C@H](N2CC=CC2)C1)c1ccc(F)c(Br)c1 ZINC000458858213 567579562 /nfs/dbraw/zinc/57/95/62/567579562.db2.gz SYKKXOXYBPSFAA-OCCSQVGLSA-N 0 3 382.277 3.305 10 0 GGAEHN CC(C)(CN[C@@H]1CCCOc2ccc(Br)cc21)N1CCOCC1 ZINC000480080045 567580374 /nfs/dbraw/zinc/58/03/74/567580374.db2.gz FWCPJPCIDLGEFS-MRXNPFEDSA-N 0 3 383.330 3.363 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)c2ccc(Br)c(OC(F)(F)F)c2)C1 ZINC000644814672 567580653 /nfs/dbraw/zinc/58/06/53/567580653.db2.gz LNQUBBQLFFRCBN-JQWIXIFHSA-N 0 3 393.203 3.124 10 0 GGAEHN CCCOc1c(Br)cc(C(=O)N2CC[C@H]3CN(C)C[C@@H]32)cc1OC ZINC000644819962 567580738 /nfs/dbraw/zinc/58/07/38/567580738.db2.gz UMAJZNOCNOLAAE-WFASDCNBSA-N 0 3 397.313 3.023 10 0 GGAEHN Cc1cc(C(=O)N2CC[C@@H]3CN(C)C[C@@H]32)nn1-c1ccc(Cl)cc1Cl ZINC000644818375 567580847 /nfs/dbraw/zinc/58/08/47/567580847.db2.gz LVVRQLATAYIQLW-PXAZEXFGSA-N 0 3 379.291 3.264 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)c2coc(-c3ccc(Br)cc3F)n2)C1 ZINC000644816367 567581196 /nfs/dbraw/zinc/58/11/96/567581196.db2.gz VBVOCJOHWSPFCC-BONVTDFDSA-N 0 3 394.244 3.019 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)Cc2csc3ccc(Br)cc23)C1 ZINC000644820470 567581230 /nfs/dbraw/zinc/58/12/30/567581230.db2.gz WOHDBPHVFQCXPD-NHYWBVRUSA-N 0 3 379.323 3.369 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CC[C@@H]2CN(C)C[C@@H]21 ZINC000644840327 567581788 /nfs/dbraw/zinc/58/17/88/567581788.db2.gz KHCQDWGLKRSAPR-KDOFPFPSSA-N 0 3 375.314 3.079 10 0 GGAEHN CN1C[C@@H]2CCN(Cc3ccc(OC(F)(F)F)c(Br)c3)[C@@H]2C1 ZINC000644840284 567581864 /nfs/dbraw/zinc/58/18/64/567581864.db2.gz JUJOBIYXVMXPHX-WCQYABFASA-N 0 3 379.220 3.484 10 0 GGAEHN CNC(=O)[C@H](C)Oc1ccc(Br)cc1CNCC[C@H]1CC1(F)F ZINC000621377365 567581954 /nfs/dbraw/zinc/58/19/54/567581954.db2.gz WSIHISXBVSHIQR-JQWIXIFHSA-N 0 3 391.256 3.097 10 0 GGAEHN CN1CCC[C@]2(CCN(C(=O)Cc3c(F)ccc(Br)c3F)C2)C1 ZINC000505537915 567582251 /nfs/dbraw/zinc/58/22/51/567582251.db2.gz HPPCZELGZDQIKR-KRWDZBQOSA-N 0 3 387.268 3.214 10 0 GGAEHN CC(=O)N1CC[C@@H](NCc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000621387851 567582850 /nfs/dbraw/zinc/58/28/50/567582850.db2.gz SZEVYIJNSNKLOX-CQSZACIVSA-N 0 3 380.311 3.283 10 0 GGAEHN CCN(C(=O)NCc1cc2cc(Br)ccc2[nH]1)[C@@H]1CCN(C)C1 ZINC000664690785 567583138 /nfs/dbraw/zinc/58/31/38/567583138.db2.gz WQLKIFJFCJMQFT-OAHLLOKOSA-N 0 3 379.302 3.166 10 0 GGAEHN CN(C)C[C@H](c1ccc(Cl)c(Cl)c1)N1C(=O)N[C@H](CC(F)(F)F)C1=O ZINC000530215383 567584183 /nfs/dbraw/zinc/58/41/83/567584183.db2.gz WJWFSQNCUPDEPB-VXGBXAGGSA-N 0 3 398.212 3.469 10 0 GGAEHN O=C1N[C@H](c2ccc(Br)cc2)C(=O)N1C[C@H]1CCN1C1CCCC1 ZINC000530212589 567584961 /nfs/dbraw/zinc/58/49/61/567584961.db2.gz LEMOXJMQIGDAIO-HZPDHXFCSA-N 0 3 392.297 3.059 10 0 GGAEHN Cc1cscc1NC(=O)C(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1 ZINC000439431906 567584970 /nfs/dbraw/zinc/58/49/70/567584970.db2.gz AIIHMJSZYYQPTA-CZUORRHYSA-N 0 3 377.535 3.256 10 0 GGAEHN CCN(C(=O)N[C@@H](C)c1ccc(Br)cc1OC)[C@H]1CCN(C)C1 ZINC000664730151 567585233 /nfs/dbraw/zinc/58/52/33/567585233.db2.gz PUVKIWGIDJSKGD-JSGCOSHPSA-N 0 3 384.318 3.254 10 0 GGAEHN C[C@@H](NC1CCN(CCC(F)(F)F)CC1)c1ncc(Br)cn1 ZINC000644895678 567587920 /nfs/dbraw/zinc/58/79/20/567587920.db2.gz QGRAXWHTFIGRNR-SNVBAGLBSA-N 0 3 381.240 3.307 10 0 GGAEHN CCN(C(=O)N[C@H]1CSc2ccc(Br)cc21)[C@@H]1CCN(C)C1 ZINC000664773546 567588053 /nfs/dbraw/zinc/58/80/53/567588053.db2.gz UVFQCSDCJQMONX-OCCSQVGLSA-N 0 3 384.343 3.332 10 0 GGAEHN CN(C)C[C@H](NC(=O)Cc1ccc(Br)cc1O)c1ccc(F)cc1 ZINC000552412735 567589149 /nfs/dbraw/zinc/58/91/49/567589149.db2.gz OMEVCSMXWZLDSH-INIZCTEOSA-N 0 3 395.272 3.255 10 0 GGAEHN O[C@@H](CN[C@@H](c1cccnc1)C1CC1)COc1cc(F)cc(Br)c1 ZINC000439458261 567589270 /nfs/dbraw/zinc/58/92/70/567589270.db2.gz SOBJVVHOTOYRQC-FUHWJXTLSA-N 0 3 395.272 3.464 10 0 GGAEHN COC(=O)CC[C@H](N)C(=O)NC[C@@H](Cc1ccc(Cl)cc1Cl)C(C)C ZINC000571795354 567589503 /nfs/dbraw/zinc/58/95/03/567589503.db2.gz VCMIPBHWCBVRGB-CJNGLKHVSA-N 0 3 389.323 3.205 10 0 GGAEHN COC(=O)CC[C@@H](N)C(=O)NC[C@@H](Cc1ccc(Cl)cc1Cl)C(C)C ZINC000571795355 567589606 /nfs/dbraw/zinc/58/96/06/567589606.db2.gz VCMIPBHWCBVRGB-CZUORRHYSA-N 0 3 389.323 3.205 10 0 GGAEHN CN1CCC[C@]2(CCN(C(=O)C3(c4ccccc4Br)CC3)C2)C1 ZINC000505680851 567591452 /nfs/dbraw/zinc/59/14/52/567591452.db2.gz HCXSWCNZAKEYGG-SFHVURJKSA-N 0 3 377.326 3.425 10 0 GGAEHN CN(C)[C@]1(CNC(=O)c2cc3c(cccc3Br)[nH]2)CCSC1 ZINC000480271999 567593299 /nfs/dbraw/zinc/59/32/99/567593299.db2.gz AYODESJQBTUDRH-INIZCTEOSA-N 0 3 382.327 3.098 10 0 GGAEHN Cc1c(C)c(C)c(CS(=O)(=O)C(C)C(=O)NCC(F)(F)F)c(C)c1C ZINC000480329053 567597348 /nfs/dbraw/zinc/59/73/48/567597348.db2.gz GBJNYIYHCIUOBJ-CQSZACIVSA-N 0 3 379.444 3.211 10 0 GGAEHN CN1CCC[C@@]2(CCN(C(=O)Nc3cnc4c(Br)cccn34)C2)C1 ZINC000645009522 567599577 /nfs/dbraw/zinc/59/95/77/567599577.db2.gz XDHPVLYPRIUAKD-QGZVFWFLSA-N 0 3 392.301 3.046 10 0 GGAEHN Cc1c(Cl)cccc1S(=O)(=O)NC[C@@H]1CCN(Cc2ccccc2)C1 ZINC000480437256 567604681 /nfs/dbraw/zinc/60/46/81/567604681.db2.gz ORCFIQDCUCDKRF-KRWDZBQOSA-N 0 3 378.925 3.449 10 0 GGAEHN COCCN1CCC(N[C@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621749962 567609081 /nfs/dbraw/zinc/60/90/81/567609081.db2.gz FUPCGPCHMCCQJU-OAHLLOKOSA-N 0 3 377.273 3.456 10 0 GGAEHN CN(C)C1(CN[C@H](c2ccc(Br)cc2)C(F)F)CCOCC1 ZINC000621752641 567609193 /nfs/dbraw/zinc/60/91/93/567609193.db2.gz BNJHIKFKROAJCK-CQSZACIVSA-N 0 3 377.273 3.456 10 0 GGAEHN CS[C@@H]1CN(C(=O)Cc2cccc(Br)c2C)C[C@H]1N1CCCC1 ZINC000480575027 567612552 /nfs/dbraw/zinc/61/25/52/567612552.db2.gz FESDNPIPGBVBHT-IAGOWNOFSA-N 0 3 397.382 3.338 10 0 GGAEHN CS[C@H]1CN(C(=O)Cc2cccc(Br)c2C)C[C@H]1N1CCCC1 ZINC000480575031 567612676 /nfs/dbraw/zinc/61/26/76/567612676.db2.gz FESDNPIPGBVBHT-SJORKVTESA-N 0 3 397.382 3.338 10 0 GGAEHN CCCN(C(=O)N[C@@H]1CCOc2ccc(Br)cc21)[C@@H]1CCN(C)C1 ZINC000645204624 567613530 /nfs/dbraw/zinc/61/35/30/567613530.db2.gz LSZCZCGGJDHELF-GDBMZVCRSA-N 0 3 396.329 3.398 10 0 GGAEHN Cn1cc(C[C@@H]2CCN(C[C@@H](O)COc3c(Cl)cccc3Cl)C2)cn1 ZINC000530627036 567614458 /nfs/dbraw/zinc/61/44/58/567614458.db2.gz BEFLVNBKEXJJRB-DZGCQCFKSA-N 0 3 384.307 3.031 10 0 GGAEHN Cn1cc(C[C@H]2CCN(C[C@@H](O)COc3c(Cl)cccc3Cl)C2)cn1 ZINC000530627038 567615079 /nfs/dbraw/zinc/61/50/79/567615079.db2.gz BEFLVNBKEXJJRB-UKRRQHHQSA-N 0 3 384.307 3.031 10 0 GGAEHN CCOc1cc(C[NH2+]CC2(C(=O)N(C)C)CCCC2)cc(Br)c1[O-] ZINC000459408471 567621873 /nfs/dbraw/zinc/62/18/73/567621873.db2.gz GOTJJDKPQHBJMO-UHFFFAOYSA-N 0 3 399.329 3.292 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)N[C@H](CCO)c1ccccc1Br ZINC000665361099 567622202 /nfs/dbraw/zinc/62/22/02/567622202.db2.gz IVXXDUHUJHQPSD-CZUORRHYSA-N 0 3 398.345 3.045 10 0 GGAEHN O=S(=O)(CCNCCC1CC(F)(F)C1)c1cccc(Br)c1 ZINC000572236336 567624347 /nfs/dbraw/zinc/62/43/47/567624347.db2.gz BOFLDHBSPWJMMX-UHFFFAOYSA-N 0 3 382.270 3.248 10 0 GGAEHN CCOc1cc(C[NH2+]CCCOC[C@@H]2CCOC2)cc(Br)c1[O-] ZINC000459440448 567626123 /nfs/dbraw/zinc/62/61/23/567626123.db2.gz UXAYLUAGUQDEJO-ZDUSSCGKSA-N 0 3 388.302 3.086 10 0 GGAEHN CCCN(C(=O)NCc1ccc(Br)cc1OC)[C@@H]1CCN(C)C1 ZINC000645453980 567626634 /nfs/dbraw/zinc/62/66/34/567626634.db2.gz ZCBNWASLGDRBIT-OAHLLOKOSA-N 0 3 384.318 3.083 10 0 GGAEHN CCN1CCC(NC(=O)c2cc(Br)cc(N3CCCC3)c2)CC1 ZINC000665530983 567628320 /nfs/dbraw/zinc/62/83/20/567628320.db2.gz JUDXLNIOHITJAG-UHFFFAOYSA-N 0 3 380.330 3.263 10 0 GGAEHN CC(C)[C@H](NCC(F)(F)F)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000665537295 567628345 /nfs/dbraw/zinc/62/83/45/567628345.db2.gz LKNXEVVGNKAMJL-ZFWWWQNUSA-N 0 3 377.476 3.178 10 0 GGAEHN CCOc1cc(C[N@H+](C[C@H](C)C(=O)OC)C2CC2)cc(Br)c1[O-] ZINC000459481035 567629036 /nfs/dbraw/zinc/62/90/36/567629036.db2.gz MIWHGDUWIBTWAD-NSHDSACASA-N 0 3 386.286 3.327 10 0 GGAEHN CCOc1cc(C[N@@H+](C[C@H](C)C(=O)OC)C2CC2)cc(Br)c1[O-] ZINC000459481035 567629041 /nfs/dbraw/zinc/62/90/41/567629041.db2.gz MIWHGDUWIBTWAD-NSHDSACASA-N 0 3 386.286 3.327 10 0 GGAEHN CCOc1cc(C[N@H+](C[C@@H](C)C(=O)OC)C2CC2)cc(Br)c1[O-] ZINC000459481034 567629093 /nfs/dbraw/zinc/62/90/93/567629093.db2.gz MIWHGDUWIBTWAD-LLVKDONJSA-N 0 3 386.286 3.327 10 0 GGAEHN CCOc1cc(C[N@@H+](C[C@@H](C)C(=O)OC)C2CC2)cc(Br)c1[O-] ZINC000459481034 567629096 /nfs/dbraw/zinc/62/90/96/567629096.db2.gz MIWHGDUWIBTWAD-LLVKDONJSA-N 0 3 386.286 3.327 10 0 GGAEHN Cn1cncc1CCN(CCc1ccc(Cl)cc1)C[C@H](O)C(F)(F)F ZINC000459521071 567632277 /nfs/dbraw/zinc/63/22/77/567632277.db2.gz HCRGRSWBBMBJLO-INIZCTEOSA-N 0 3 375.822 3.084 10 0 GGAEHN CC[C@@H]1CC[C@@H](C)C[C@H]1NCc1ccc(S(=O)(=O)N2CCOCC2)s1 ZINC000572341631 567633004 /nfs/dbraw/zinc/63/30/04/567633004.db2.gz XJKUNSXRPHCNMC-BFYDXBDKSA-N 0 3 386.583 3.073 10 0 GGAEHN CCOC(=O)[C@@H]1CC[C@H]([NH2+]Cc2cc(Br)c([O-])c(OCC)c2)C1 ZINC000459527006 567634619 /nfs/dbraw/zinc/63/46/19/567634619.db2.gz IRLNBDXVKYTBON-OLZOCXBDSA-N 0 3 386.286 3.375 10 0 GGAEHN CN1CCC[C@H](N2CCN(c3nccc4cc(Br)ccc43)CC2)C1 ZINC000665701480 567636404 /nfs/dbraw/zinc/63/64/04/567636404.db2.gz VBCQNFMNEDNQCS-KRWDZBQOSA-N 0 3 389.341 3.214 10 0 GGAEHN O[C@@H]1CCC[C@H]1N1CCN(c2nccc3cc(Br)ccc32)CC1 ZINC000665698149 567636415 /nfs/dbraw/zinc/63/64/15/567636415.db2.gz WNVQUHYWQXYWGE-IAGOWNOFSA-N 0 3 376.298 3.033 10 0 GGAEHN CCC[C@H]1CN(Cc2nc3cc(Br)ccc3[nH]2)CCN1CCOC ZINC000480856291 567636364 /nfs/dbraw/zinc/63/63/64/567636364.db2.gz JYLOFFOUQSMSKS-HNNXBMFYSA-N 0 3 395.345 3.258 10 0 GGAEHN CCC[C@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)CCN1CCOC ZINC000480856291 567636368 /nfs/dbraw/zinc/63/63/68/567636368.db2.gz JYLOFFOUQSMSKS-HNNXBMFYSA-N 0 3 395.345 3.258 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)NCc1ccccc1Br ZINC000622119438 567638001 /nfs/dbraw/zinc/63/80/01/567638001.db2.gz CLLPHRPUZUUDND-KRWDZBQOSA-N 0 3 390.325 3.421 10 0 GGAEHN O=C(NC1CCN(C2CC2)CC1)c1cc(Br)cc(N2CCCC2)c1 ZINC000665802458 567639226 /nfs/dbraw/zinc/63/92/26/567639226.db2.gz CQIMKBCIIVSNDZ-UHFFFAOYSA-N 0 3 392.341 3.406 10 0 GGAEHN CCOc1cc(C[NH2+]CC2(CF)CCOCC2)cc(Br)c1[O-] ZINC000459584464 567639326 /nfs/dbraw/zinc/63/93/26/567639326.db2.gz UJNNJMRPNRYOJS-UHFFFAOYSA-N 0 3 376.266 3.409 10 0 GGAEHN CCOc1cc(CN2CC[N@@H+](C3CC3)C[C@H](C)C2)cc(Br)c1[O-] ZINC000459573131 567639434 /nfs/dbraw/zinc/63/94/34/567639434.db2.gz RPWTWPZQEOSCCI-CYBMUJFWSA-N 0 3 383.330 3.470 10 0 GGAEHN CCOc1cc(CN2CC[N@H+](C3CC3)C[C@H](C)C2)cc(Br)c1[O-] ZINC000459573131 567639437 /nfs/dbraw/zinc/63/94/37/567639437.db2.gz RPWTWPZQEOSCCI-CYBMUJFWSA-N 0 3 383.330 3.470 10 0 GGAEHN CCN(C(=O)Nc1cc(OC)c(OC)cc1Br)[C@@H]1CCN(C)C1 ZINC000665836125 567640055 /nfs/dbraw/zinc/64/00/55/567640055.db2.gz KZLGLGVSDTZYTP-LLVKDONJSA-N 0 3 386.290 3.024 10 0 GGAEHN COC(=O)CC1(CNC2(c3ccc(Br)cc3)CCOCC2)CC1 ZINC000440776445 567644251 /nfs/dbraw/zinc/64/42/51/567644251.db2.gz QXZPZWHVNLTXQZ-UHFFFAOYSA-N 0 3 382.298 3.388 10 0 GGAEHN O=C(C(C[C@@H]1COCCO1)C(F)(F)F)N1CCCSc2ccccc21 ZINC000665927605 567644306 /nfs/dbraw/zinc/64/43/06/567644306.db2.gz WRYNYDKGKFIYON-OLZOCXBDSA-N 0 3 375.412 3.499 10 0 GGAEHN CCN(C(=O)Nc1ccc(I)cc1C)[C@H]1CCN(C)C1 ZINC000596632139 567645308 /nfs/dbraw/zinc/64/53/08/567645308.db2.gz YJFQQDRODKMOCJ-ZDUSSCGKSA-N 0 3 387.265 3.158 10 0 GGAEHN COc1cc(CNCCc2cn(C)cn2)cc(Br)c1OC(F)F ZINC000459653851 567645850 /nfs/dbraw/zinc/64/58/50/567645850.db2.gz DOGWVESYIFMSCA-UHFFFAOYSA-N 0 3 390.228 3.125 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000440910617 567648052 /nfs/dbraw/zinc/64/80/52/567648052.db2.gz DCYRXSSXGBEHGH-TZMCWYRMSA-N 0 3 390.325 3.454 10 0 GGAEHN C[C@H]1C[C@@H](NC(=O)CSCc2cc(-c3cccs3)on2)CN1C1CC1 ZINC000440925709 567649592 /nfs/dbraw/zinc/64/95/92/567649592.db2.gz NDLFAGDYELJAET-QWHCGFSZSA-N 0 3 377.535 3.378 10 0 GGAEHN CCN(C(=O)Nc1cc(Br)ccc1-n1cccn1)[C@H]1CCN(C)C1 ZINC000666038813 567650116 /nfs/dbraw/zinc/65/01/16/567650116.db2.gz ZIOPYMBDUMAENY-AWEZNQCLSA-N 0 3 392.301 3.193 10 0 GGAEHN COc1cnccc1N1CCN(c2ncc(Cl)cc2Br)CC1 ZINC000481042463 567653042 /nfs/dbraw/zinc/65/30/42/567653042.db2.gz QWXONFLSFIXGNB-UHFFFAOYSA-N 0 3 383.677 3.228 10 0 GGAEHN COc1cnccc1N1CCN(c2ncc(Br)cc2Cl)CC1 ZINC000481036613 567653485 /nfs/dbraw/zinc/65/34/85/567653485.db2.gz LRKHWWHEVWRJJH-UHFFFAOYSA-N 0 3 383.677 3.228 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)NCc1ccc(Br)c(F)c1 ZINC000572639151 567654821 /nfs/dbraw/zinc/65/48/21/567654821.db2.gz QRKYHUNEDFJMCD-KRWDZBQOSA-N 0 3 392.272 3.356 10 0 GGAEHN OC[C@@]1(O)CCCN(Cc2ccc(-c3ccccc3Br)s2)C1 ZINC000459719680 567654994 /nfs/dbraw/zinc/65/49/94/567654994.db2.gz NVTYWIFQPDWVTN-QGZVFWFLSA-N 0 3 382.323 3.497 10 0 GGAEHN CCN(C(=O)Nc1ccc(Br)c(C(=O)OC)c1)[C@H]1CCN(CC)C1 ZINC000596820410 567655485 /nfs/dbraw/zinc/65/54/85/567655485.db2.gz ONTTXVODZNJLJA-ZDUSSCGKSA-N 0 3 398.301 3.184 10 0 GGAEHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1ncsc1Br ZINC000553465255 567656407 /nfs/dbraw/zinc/65/64/07/567656407.db2.gz CNMXZMHAAGMLQB-CYBMUJFWSA-N 0 3 380.311 3.300 10 0 GGAEHN C[C@H](NC(=O)CN1CCC[C@@H]([C@@H]2CCOC2)C1)c1ccc(Br)cc1 ZINC000441201931 567657753 /nfs/dbraw/zinc/65/77/53/567657753.db2.gz HBZAEFXLNCRKKH-USXIJHARSA-N 0 3 395.341 3.375 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cnc(-c3ccc(F)c(F)c3)s2)C[C@H]1N(C)C ZINC000507087739 567657995 /nfs/dbraw/zinc/65/79/95/567657995.db2.gz QKOZXPPIVHUMIU-UKRRQHHQSA-N 0 3 383.489 3.206 10 0 GGAEHN COc1cc(C[NH2+]CC[C@H]2COc3ccccc3O2)cc(Br)c1[O-] ZINC000481088856 567658183 /nfs/dbraw/zinc/65/81/83/567658183.db2.gz JBHBZFZSSIGPPK-ZDUSSCGKSA-N 0 3 394.265 3.483 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cnc(-c3ccc(F)c(F)c3)s2)C[C@@H]1N(C)C ZINC000507087735 567658135 /nfs/dbraw/zinc/65/81/35/567658135.db2.gz QKOZXPPIVHUMIU-DZGCQCFKSA-N 0 3 383.489 3.206 10 0 GGAEHN Cc1ccc2c(c1Br)CN(C(=O)Nc1ccn(CCN(C)C)n1)C2 ZINC000666182975 567659126 /nfs/dbraw/zinc/65/91/26/567659126.db2.gz BZCIKPSZIYYIQU-UHFFFAOYSA-N 0 3 392.301 3.063 10 0 GGAEHN CN(Cc1ccccc1Br)C(=O)CN1CCC[C@H]([C@H]2CCOC2)C1 ZINC000441290100 567659243 /nfs/dbraw/zinc/65/92/43/567659243.db2.gz UCCQASQMPGKCRS-RDJZCZTQSA-N 0 3 395.341 3.156 10 0 GGAEHN CN(Cc1ccccc1Br)C(=O)CN1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000441290096 567659269 /nfs/dbraw/zinc/65/92/69/567659269.db2.gz UCCQASQMPGKCRS-DOTOQJQBSA-N 0 3 395.341 3.156 10 0 GGAEHN O[C@@H](COc1ccc(Cl)cc1Br)CN1C[C@@H]2C[C@H]1CS2 ZINC000459794544 567659591 /nfs/dbraw/zinc/65/95/91/567659591.db2.gz MZJXOIVNOGBPNG-TUAOUCFPSA-N 0 3 378.719 3.032 10 0 GGAEHN CCN(C(=O)Nc1ccc(Br)c(C(=O)OC)c1C)[C@@H]1CCN(C)C1 ZINC000596872812 567659822 /nfs/dbraw/zinc/65/98/22/567659822.db2.gz ZZMDUALSFBBEFE-GFCCVEGCSA-N 0 3 398.301 3.102 10 0 GGAEHN CCN(C(=O)Nc1cccc(C(=O)OC)c1Br)[C@@H]1CCN(CC)C1 ZINC000596872320 567660277 /nfs/dbraw/zinc/66/02/77/567660277.db2.gz GFEDZTFFUOJOST-GFCCVEGCSA-N 0 3 398.301 3.184 10 0 GGAEHN COc1ccccc1[C@H]1[C@@H](N)CCCN1C(=O)c1ccc(Br)cn1 ZINC000572720702 567661182 /nfs/dbraw/zinc/66/11/82/567661182.db2.gz LVTDXTBGWINANH-YOEHRIQHSA-N 0 3 390.281 3.157 10 0 GGAEHN CCN(CC)CCN(C(=O)Cc1cscn1)c1ccc(Br)cn1 ZINC000622860428 567663148 /nfs/dbraw/zinc/66/31/48/567663148.db2.gz ZDLKODUDKMBHLK-UHFFFAOYSA-N 0 3 397.342 3.218 10 0 GGAEHN CN(C)[C@]1(CNC(=O)C(C)(C)c2cccc(Br)c2)CCSC1 ZINC000481220096 567663631 /nfs/dbraw/zinc/66/36/31/567663631.db2.gz HUSBOZGPLKMJCU-KRWDZBQOSA-N 0 3 385.371 3.280 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000507218788 567666677 /nfs/dbraw/zinc/66/66/77/567666677.db2.gz MIFKGTZOBVNZHU-SWLSCSKDSA-N 0 3 382.302 3.056 10 0 GGAEHN C[C@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccc(OC(F)(F)F)cc1 ZINC000507245358 567669562 /nfs/dbraw/zinc/66/95/62/567669562.db2.gz ZBCNPFIQOGLYIV-GXTWGEPZSA-N 0 3 380.432 3.050 10 0 GGAEHN CN1CC[C@@H]2CN(C(=O)N[C@@H]3CSCc4ccc(Br)cc43)C[C@@H]21 ZINC000666400191 567672517 /nfs/dbraw/zinc/67/25/17/567672517.db2.gz DXPBZXVBMIHRMT-LYRGGWFBSA-N 0 3 396.354 3.083 10 0 GGAEHN CC[C@@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccc(Br)cc1 ZINC000507268281 567673136 /nfs/dbraw/zinc/67/31/36/567673136.db2.gz QEBOJIWFTIMODG-HZPDHXFCSA-N 0 3 389.359 3.304 10 0 GGAEHN C[C@@H](NCCCN1CCC[C@H]1C(=O)N(C)C)c1sccc1Br ZINC000531705950 567674562 /nfs/dbraw/zinc/67/45/62/567674562.db2.gz DZBFKBPPKHUTOO-OCCSQVGLSA-N 0 3 388.375 3.104 10 0 GGAEHN CN(CCN(C)C1CC1)C(=O)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000666401854 567674605 /nfs/dbraw/zinc/67/46/05/567674605.db2.gz QRDFFUDFBWMLMS-MRXNPFEDSA-N 0 3 398.370 3.473 10 0 GGAEHN C[C@@H](NCC1(O)Cc2ccccc2C1)c1ccccc1I ZINC000531721382 567675649 /nfs/dbraw/zinc/67/56/49/567675649.db2.gz FYMFQWGAHABDEL-CYBMUJFWSA-N 0 3 393.268 3.472 10 0 GGAEHN CN(C)[C@H]1CCCN(C(=O)N[C@H]2CSCc3ccc(Br)cc32)C1 ZINC000666402689 567676021 /nfs/dbraw/zinc/67/60/21/567676021.db2.gz GWWCWRMLTSTOQJ-HOCLYGCPSA-N 0 3 398.370 3.473 10 0 GGAEHN CN1CCCN(C(=O)N[C@H]2CSCc3ccc(Br)cc32)CC1 ZINC000666405413 567676740 /nfs/dbraw/zinc/67/67/40/567676740.db2.gz XVSUBPFLHKHKHJ-HNNXBMFYSA-N 0 3 384.343 3.084 10 0 GGAEHN CCc1nc(C)c([C@@H](C)N[C@H]2CCN(S(=O)(=O)c3ccccc3)C2)s1 ZINC000573014678 567681279 /nfs/dbraw/zinc/68/12/79/567681279.db2.gz DOOKSSLNZXWFAF-HIFRSBDPSA-N 0 3 379.551 3.128 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@]1(C)CCCO1)c1ccc(Br)cn1 ZINC000573005542 567681358 /nfs/dbraw/zinc/68/13/58/567681358.db2.gz SOSCJJSPZCKRBD-KRWDZBQOSA-N 0 3 384.318 3.088 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2ccc(C(=O)OC)c(Cl)c2)n1 ZINC000597109720 567681958 /nfs/dbraw/zinc/68/19/58/567681958.db2.gz GVIOPXIUVDJGKS-UHFFFAOYSA-N 0 3 382.869 3.092 10 0 GGAEHN CC[NH+](CC)[C@@H](C[N-]S(=O)(=O)c1cccnc1C(F)(F)F)CC(C)C ZINC000553763997 567682131 /nfs/dbraw/zinc/68/21/31/567682131.db2.gz NVJZOEMCQAVBAF-CYBMUJFWSA-N 0 3 381.464 3.135 10 0 GGAEHN CS[C@@H]1CN(CC(=O)Nc2cc(Cl)ccc2Cl)C[C@@H]1N1CCCC1 ZINC000460351911 567685142 /nfs/dbraw/zinc/68/51/42/567685142.db2.gz BDOLKKKYMPLXNS-JKSUJKDBSA-N 0 3 388.364 3.444 10 0 GGAEHN CCOc1cc(C[NH2+][C@@H]2CCC[C@@H]([S@](C)=O)C2)cc(Br)c1[O-] ZINC000597184841 567686761 /nfs/dbraw/zinc/68/67/61/567686761.db2.gz QJYMHOCUCSNCCV-VJBOLBCHSA-N 0 3 390.343 3.333 10 0 GGAEHN CN1CCN([C@H]2CC[C@@H](NC(=O)c3cc(Cl)c(F)cc3Cl)CC2)CC1 ZINC000645982531 567687004 /nfs/dbraw/zinc/68/70/04/567687004.db2.gz ZSSQJPVCULTSFB-BETUJISGSA-N 0 3 388.314 3.421 10 0 GGAEHN O=S(=O)(c1c(Cl)ccc(F)c1F)N1CCCC[C@H](N2CCCC2)C1 ZINC000553812917 567687785 /nfs/dbraw/zinc/68/77/85/567687785.db2.gz AVXHVYNXOLOQAE-LBPRGKRZSA-N 0 3 378.872 3.257 10 0 GGAEHN CC1(C)CCCN[C@H]1C(=O)NC[C@@H]1CCN(c2cccc(Br)c2)C1 ZINC000573094247 567687966 /nfs/dbraw/zinc/68/79/66/567687966.db2.gz UNIXFDXELPJBGZ-YOEHRIQHSA-N 0 3 394.357 3.170 10 0 GGAEHN CN(C)c1c(Cl)cccc1NC(=O)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000666613929 567689548 /nfs/dbraw/zinc/68/95/48/567689548.db2.gz IYYLSOHMEDREER-GHMZBOCLSA-N 0 3 380.794 3.329 10 0 GGAEHN CN(C)C[C@]1(O)CCCN(C(=O)CCCCc2ccc(Br)cc2)C1 ZINC000646024630 567690180 /nfs/dbraw/zinc/69/01/80/567690180.db2.gz ZDEJOFXHTIWTGL-LJQANCHMSA-N 0 3 397.357 3.077 10 0 GGAEHN Cc1cc(Br)c(CNC(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)s1 ZINC000666640885 567691114 /nfs/dbraw/zinc/69/11/14/567691114.db2.gz YRWDTAAFZNHYPA-TZMCWYRMSA-N 0 3 386.359 3.445 10 0 GGAEHN COC(=O)c1ccc(CNCCc2ccc(I)cc2)o1 ZINC000597232943 567691263 /nfs/dbraw/zinc/69/12/63/567691263.db2.gz XQIRLSZWCUSLHW-UHFFFAOYSA-N 0 3 385.201 3.003 10 0 GGAEHN Cc1cc(Br)c(CNC(=O)N2CCN(C3CC3)C[C@@H](C)C2)s1 ZINC000666638958 567691399 /nfs/dbraw/zinc/69/13/99/567691399.db2.gz RWWLXTJMAJOCAR-LLVKDONJSA-N 0 3 386.359 3.445 10 0 GGAEHN CC(C)[C@@H](NCC(=O)Nc1ccc(Br)cc1F)C1(CO)CC=CC1 ZINC000646084983 567692593 /nfs/dbraw/zinc/69/25/93/567692593.db2.gz GMNUFVKQESEXTC-QGZVFWFLSA-N 0 3 399.304 3.470 10 0 GGAEHN CC[C@@H](NC[C@@](C)(O)CCC(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481652495 567693212 /nfs/dbraw/zinc/69/32/12/567693212.db2.gz AOTDGBJQDUGDJQ-AEFFLSMTSA-N 0 3 390.977 3.476 10 0 GGAEHN CC[C@@H]([NH2+]CC1CCC(OC)CC1)c1ccc(Cl)c(S(=O)(=O)[N-]C)c1 ZINC000481675244 567693970 /nfs/dbraw/zinc/69/39/70/567693970.db2.gz HHDRFTYNUWUXRB-PUJMQQBBSA-N 0 3 388.961 3.494 10 0 GGAEHN Cc1sc2nc(C)nc(SCC(=O)N3CCC[C@@H]3CN(C)C)c2c1C ZINC000532045918 567694275 /nfs/dbraw/zinc/69/42/75/567694275.db2.gz FMQZAWAIKXAUQC-CQSZACIVSA-N 0 3 378.567 3.261 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)CCOc1cccc(Br)c1 ZINC000573208540 567696526 /nfs/dbraw/zinc/69/65/26/567696526.db2.gz JWZQVOYLRZQKCN-GOSISDBHSA-N 0 3 389.293 3.303 10 0 GGAEHN Cc1cc(NC(=O)N2CCOC3(CCN(C)CC3)C2)ccc1Br ZINC000646167641 567697895 /nfs/dbraw/zinc/69/78/95/567697895.db2.gz YLRUQFXSFJOQNX-UHFFFAOYSA-N 0 3 382.302 3.086 10 0 GGAEHN Cc1c(Br)cncc1C(=O)Nc1ccc(OCCN(C)C)cc1 ZINC000666711647 567698466 /nfs/dbraw/zinc/69/84/66/567698466.db2.gz AZDMKMOHMNIDGT-UHFFFAOYSA-N 0 3 378.270 3.345 10 0 GGAEHN CCSCc1ccnc(NC(=O)C(C[C@@H]2COCCO2)C(F)(F)F)c1 ZINC000597455187 567699804 /nfs/dbraw/zinc/69/98/04/567699804.db2.gz HKDAJFSPLOOFAX-CHWSQXEVSA-N 0 3 378.416 3.257 10 0 GGAEHN Cc1c(Br)cccc1NC(=O)N1CCOC2(CCN(C)CC2)C1 ZINC000646254989 567703103 /nfs/dbraw/zinc/70/31/03/567703103.db2.gz MEMUOQUIKIKWCE-UHFFFAOYSA-N 0 3 382.302 3.086 10 0 GGAEHN COc1ccc(COC[C@H](O)CNCc2ccsc2C(F)(F)F)cc1 ZINC000623379346 567704381 /nfs/dbraw/zinc/70/43/81/567704381.db2.gz KXPBNCOFDQWVEC-CQSZACIVSA-N 0 3 375.412 3.443 10 0 GGAEHN COc1ccc(COC[C@@H](O)CNCc2ccsc2C(F)(F)F)cc1 ZINC000623379345 567704997 /nfs/dbraw/zinc/70/49/97/567704997.db2.gz KXPBNCOFDQWVEC-AWEZNQCLSA-N 0 3 375.412 3.443 10 0 GGAEHN CCN1CCCN(c2nnc(-c3cc(Br)c[nH]3)n2CC(C)C)CC1 ZINC000460846742 567705379 /nfs/dbraw/zinc/70/53/79/567705379.db2.gz NFSLYAGJRXXHQO-UHFFFAOYSA-N 0 3 395.349 3.224 10 0 GGAEHN CN(C[C@H]1CCCN(C)C1)C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000507793960 567705877 /nfs/dbraw/zinc/70/58/77/567705877.db2.gz XMYRQKVFTPAKQD-BBRMVZONSA-N 0 3 396.329 3.256 10 0 GGAEHN Cc1cc(C)c(NC(=O)N2CCOC3(CCN(C)CC3)C2)c(Br)c1 ZINC000646314223 567706194 /nfs/dbraw/zinc/70/61/94/567706194.db2.gz QIDFLYRZIDWIAB-UHFFFAOYSA-N 0 3 396.329 3.394 10 0 GGAEHN C[C@H](N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C)c1ncc(Br)cn1 ZINC000573344261 567706189 /nfs/dbraw/zinc/70/61/89/567706189.db2.gz QAHIBVHWVDISRG-GRDNDAEWSA-N 0 3 375.314 3.410 10 0 GGAEHN CN(C)[C@@H]1CCCN(C(=O)N[C@@H]2CCOc3c(Br)cccc32)C1 ZINC000507806614 567706969 /nfs/dbraw/zinc/70/69/69/567706969.db2.gz CVMCEHGCJNTEGC-IUODEOHRSA-N 0 3 382.302 3.008 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N1CCC[C@@H]1CN1CCCCC1 ZINC000460884369 567707899 /nfs/dbraw/zinc/70/78/99/567707899.db2.gz RWWNMBDTFDKDDE-QGZVFWFLSA-N 0 3 395.341 3.477 10 0 GGAEHN COCC[C@](C)(O)CNCc1cc(Br)c(C)cc1Br ZINC000623421513 567708647 /nfs/dbraw/zinc/70/86/47/567708647.db2.gz OJZBJUWOXOVILH-AWEZNQCLSA-N 0 3 395.135 3.397 10 0 GGAEHN COc1cc(CNCCOc2ncc(Cl)cc2Cl)cc2c1OCCO2 ZINC000532394093 567712351 /nfs/dbraw/zinc/71/23/51/567712351.db2.gz YYWZYEUWOUISCV-UHFFFAOYSA-N 0 3 385.247 3.337 10 0 GGAEHN COC[C@H](O)CCNCc1cc(Br)c(C)cc1Br ZINC000623478656 567712584 /nfs/dbraw/zinc/71/25/84/567712584.db2.gz TVTKWBWAPUXRSH-LLVKDONJSA-N 0 3 381.108 3.007 10 0 GGAEHN C[C@@H](N[C@H]1CCN(S(=O)(=O)c2ccccc2)C1)c1cc2c(s1)CCC2 ZINC000554140969 567712926 /nfs/dbraw/zinc/71/29/26/567712926.db2.gz RGYATUGPEJFGPV-ZBFHGGJFSA-N 0 3 376.547 3.351 10 0 GGAEHN COC[C@@H](O)CCNCc1cc(Br)c(C)cc1Br ZINC000623478657 567713438 /nfs/dbraw/zinc/71/34/38/567713438.db2.gz TVTKWBWAPUXRSH-NSHDSACASA-N 0 3 381.108 3.007 10 0 GGAEHN Cc1cc(Br)c(CNCCCOCCO)cc1Br ZINC000623487519 567714134 /nfs/dbraw/zinc/71/41/34/567714134.db2.gz FOVCFAZKGHLFSI-UHFFFAOYSA-N 0 3 381.108 3.009 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CCC[C@]3(CCN(C)C3)C2)c1 ZINC000597716144 567714094 /nfs/dbraw/zinc/71/40/94/567714094.db2.gz OHCHDDNWRQLOMY-QGZVFWFLSA-N 0 3 398.288 3.158 10 0 GGAEHN Cc1cc(NC(=O)N2CCOC3(CCN(C)CC3)C2)cc(C)c1Br ZINC000646385736 567714270 /nfs/dbraw/zinc/71/42/70/567714270.db2.gz RIXHDBZYIPRGPE-UHFFFAOYSA-N 0 3 396.329 3.394 10 0 GGAEHN CC[C@H](C(=O)N[C@H](CC(=O)OC)c1cccc(Br)c1)N(CC)CC ZINC000460979562 567714531 /nfs/dbraw/zinc/71/45/31/567714531.db2.gz LNROGNQHVGWIMM-HZPDHXFCSA-N 0 3 399.329 3.290 10 0 GGAEHN CC[C@@H](C(=O)N[C@H](CC(=O)OC)c1cccc(Br)c1)N(CC)CC ZINC000460979560 567714754 /nfs/dbraw/zinc/71/47/54/567714754.db2.gz LNROGNQHVGWIMM-CVEARBPZSA-N 0 3 399.329 3.290 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cn3cc(Cl)cc(Cl)c3n2)C[C@H]1N1CCCC1 ZINC000442889360 567715943 /nfs/dbraw/zinc/71/59/43/567715943.db2.gz GDJHPXSWBNYGJK-HUUCEWRRSA-N 0 3 399.347 3.293 10 0 GGAEHN Cc1cc(CNC[C@H](CO)Cc2ccc(F)c(F)c2)ncc1Br ZINC000623506202 567715976 /nfs/dbraw/zinc/71/59/76/567715976.db2.gz GWKKCAZXXNQISF-CYBMUJFWSA-N 0 3 385.252 3.372 10 0 GGAEHN CN1CC[C@@H](NCc2cc(C(F)(F)F)cc(S(C)(=O)=O)c2)CC1(C)C ZINC000623516722 567717803 /nfs/dbraw/zinc/71/78/03/567717803.db2.gz BYSOKXXUZHXMHS-CQSZACIVSA-N 0 3 378.460 3.071 10 0 GGAEHN Cc1sc(Br)c(C(=O)N2CCOC[C@@H]2[C@@H]2CCCN2C)c1C ZINC000646446000 567718680 /nfs/dbraw/zinc/71/86/80/567718680.db2.gz XLZQBTUJFRKWFD-QWHCGFSZSA-N 0 3 387.343 3.063 10 0 GGAEHN Cc1nc(-c2cccs2)sc1C(=O)N1CCOC[C@@H]1[C@@H]1CCCN1C ZINC000646454808 567718773 /nfs/dbraw/zinc/71/87/73/567718773.db2.gz LKLVIBSPLXULIS-UONOGXRCSA-N 0 3 377.535 3.115 10 0 GGAEHN C[C@@H]1C[C@H]1N1C[C@@H](NCc2ccc(OC(F)F)c(Br)c2)CC1=O ZINC000507953929 567718828 /nfs/dbraw/zinc/71/88/28/567718828.db2.gz WCWNITXYBKNYCM-SUZMYJTESA-N 0 3 389.240 3.149 10 0 GGAEHN C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)N1CCOC[C@H]1[C@@H]1CCCN1C ZINC000646456741 567718906 /nfs/dbraw/zinc/71/89/06/567718906.db2.gz XOHWOZHHXCNVDR-ZLIFDBKOSA-N 0 3 387.307 3.082 10 0 GGAEHN C[C@@H]1C[C@@H]1N1C[C@H](NCc2ccc(OC(F)F)c(Br)c2)CC1=O ZINC000507953932 567719006 /nfs/dbraw/zinc/71/90/06/567719006.db2.gz WCWNITXYBKNYCM-XWIASGKRSA-N 0 3 389.240 3.149 10 0 GGAEHN Cc1ccc(C(=O)NC[C@H]2CCN2C(C)(C)C)cc1I ZINC000597856861 567719293 /nfs/dbraw/zinc/71/92/93/567719293.db2.gz BPQOKKOXDZXGAC-CYBMUJFWSA-N 0 3 386.277 3.202 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)c1cccc(F)c1I ZINC000597858168 567719462 /nfs/dbraw/zinc/71/94/62/567719462.db2.gz LFXAVOGNKOYODC-JTQLQIEISA-N 0 3 390.240 3.033 10 0 GGAEHN Cc1ccc(I)c(C(=O)NC[C@H]2CCN2C(C)(C)C)c1 ZINC000597859046 567719501 /nfs/dbraw/zinc/71/95/01/567719501.db2.gz QPSCISYSWCMILS-GFCCVEGCSA-N 0 3 386.277 3.202 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)c1csc(-c2ccc(Cl)s2)n1 ZINC000646443611 567719414 /nfs/dbraw/zinc/71/94/14/567719414.db2.gz HFBOEOVDMMNCLB-STQMWFEESA-N 0 3 397.953 3.460 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)c1cccc(F)c1I ZINC000597858169 567719624 /nfs/dbraw/zinc/71/96/24/567719624.db2.gz LFXAVOGNKOYODC-SNVBAGLBSA-N 0 3 390.240 3.033 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)c1c(F)cccc1I ZINC000597859087 567719721 /nfs/dbraw/zinc/71/97/21/567719721.db2.gz RSKFXJHONSLQIR-SNVBAGLBSA-N 0 3 390.240 3.033 10 0 GGAEHN O=C(NCCN1CCCC1)c1c(F)ccc(C(F)(F)F)c1Br ZINC000623544780 567720770 /nfs/dbraw/zinc/72/07/70/567720770.db2.gz KWEIFPOMIZQPNV-UHFFFAOYSA-N 0 3 383.183 3.433 10 0 GGAEHN COC(=O)c1ccc(CNC[C@H](O)COc2c(Cl)cccc2Cl)s1 ZINC000573558432 567721990 /nfs/dbraw/zinc/72/19/90/567721990.db2.gz UIFFVYHZRGECJR-JTQLQIEISA-N 0 3 390.288 3.371 10 0 GGAEHN Cc1cc(CNCc2ccc(CN3CC[C@H](O)C3)cc2)ncc1Br ZINC000623564094 567722099 /nfs/dbraw/zinc/72/20/99/567722099.db2.gz RRUBKDJGHHWCNY-SFHVURJKSA-N 0 3 390.325 3.009 10 0 GGAEHN O[C@@H]1CCN(Cc2ccc(CNCc3ccsc3Br)cc2)C1 ZINC000623564205 567722279 /nfs/dbraw/zinc/72/22/79/567722279.db2.gz VRUXSWCKEGEKLS-MRXNPFEDSA-N 0 3 381.339 3.367 10 0 GGAEHN CO[C@H](CNCc1c[nH]nc1-c1ccc(Br)s1)[C@H]1CCOC1 ZINC000623562001 567722661 /nfs/dbraw/zinc/72/26/61/567722661.db2.gz DZYRNDHIULJLNX-CMPLNLGQSA-N 0 3 386.315 3.042 10 0 GGAEHN Cc1nccc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c1Br ZINC000554344589 567722654 /nfs/dbraw/zinc/72/26/54/567722654.db2.gz FJUWKXBULSSIEV-HNNXBMFYSA-N 0 3 395.276 3.138 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NCCN1[C@H](C)CCC[C@H]1C ZINC000461118699 567722913 /nfs/dbraw/zinc/72/29/13/567722913.db2.gz NNOVOPMUOCMLFW-ZIAGYGMSSA-N 0 3 383.330 3.379 10 0 GGAEHN CCCN1CCC(CNS(=O)(=O)c2ccc(C)c(C(F)(F)F)c2)CC1 ZINC000508030694 567723983 /nfs/dbraw/zinc/72/39/83/567723983.db2.gz QIZJCMXGTZYFCI-UHFFFAOYSA-N 0 3 378.460 3.414 10 0 GGAEHN CN(CCNS(=O)(=O)Cc1cccc(C(F)(F)F)c1)C1CCCCC1 ZINC000508037306 567724242 /nfs/dbraw/zinc/72/42/42/567724242.db2.gz KHPYXCOKSBEIGF-UHFFFAOYSA-N 0 3 378.460 3.389 10 0 GGAEHN CCN(C(=O)Nc1nc(-c2ccc(SC)cc2)ns1)[C@@H]1CCN(C)C1 ZINC000667111596 567726339 /nfs/dbraw/zinc/72/63/39/567726339.db2.gz DYBPZKJPZXOMTB-CYBMUJFWSA-N 0 3 377.539 3.485 10 0 GGAEHN COc1cccc(N2C[C@H](NCc3ccc(Br)cc3)CC2=O)c1 ZINC000508078681 567726764 /nfs/dbraw/zinc/72/67/64/567726764.db2.gz NPHRAQIGDQRQRI-OAHLLOKOSA-N 0 3 375.266 3.353 10 0 GGAEHN COc1cc(CNCC2(OCCO)CCC(F)(F)CC2)ccc1SC ZINC000623636176 567726776 /nfs/dbraw/zinc/72/67/76/567726776.db2.gz FXXXQDKOLOGJQN-UHFFFAOYSA-N 0 3 375.481 3.464 10 0 GGAEHN OCCOC1(CNCc2cnc([C@H]3CCCO3)s2)CCC(F)(F)CC1 ZINC000623636876 567726940 /nfs/dbraw/zinc/72/69/40/567726940.db2.gz FHQBFOQCNRDRKC-CQSZACIVSA-N 0 3 376.469 3.041 10 0 GGAEHN OCCOC1(CNCc2cnc([C@@H]3CCCO3)s2)CCC(F)(F)CC1 ZINC000623636875 567726972 /nfs/dbraw/zinc/72/69/72/567726972.db2.gz FHQBFOQCNRDRKC-AWEZNQCLSA-N 0 3 376.469 3.041 10 0 GGAEHN OC[C@]1(NCc2ccnn2CC2CC2)CCc2cc(Br)ccc2C1 ZINC000623645079 567727749 /nfs/dbraw/zinc/72/77/49/567727749.db2.gz NANRZZJXDUSYDI-IBGZPJMESA-N 0 3 390.325 3.065 10 0 GGAEHN COc1ccc(CN[C@]2(CO)CCc3cc(Br)ccc3C2)cc1O ZINC000623644428 567727908 /nfs/dbraw/zinc/72/79/08/567727908.db2.gz XIUJSGPAJANHEV-LJQANCHMSA-N 0 3 392.293 3.173 10 0 GGAEHN CCOc1cncc(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)c1 ZINC000623645097 567728220 /nfs/dbraw/zinc/72/82/20/567728220.db2.gz ODPGVUNXHZLFQG-IBGZPJMESA-N 0 3 391.309 3.252 10 0 GGAEHN OC[C@@]1(NCc2ccnn2CC2CC2)CCc2cc(Br)ccc2C1 ZINC000623645080 567728345 /nfs/dbraw/zinc/72/83/45/567728345.db2.gz NANRZZJXDUSYDI-LJQANCHMSA-N 0 3 390.325 3.065 10 0 GGAEHN CCN(C(=O)c1ccc(Cl)c(I)c1)[C@H]1CCN(C)C1 ZINC000597947249 567728606 /nfs/dbraw/zinc/72/86/06/567728606.db2.gz WSGZCUAZGSBGKJ-NSHDSACASA-N 0 3 392.668 3.111 10 0 GGAEHN COc1ncc(Br)cc1CNC1CCN(CCC(F)(F)F)CC1 ZINC000623664771 567729044 /nfs/dbraw/zinc/72/90/44/567729044.db2.gz NOZPQDLCWWTCNY-UHFFFAOYSA-N 0 3 396.251 3.359 10 0 GGAEHN CCN(C(=O)c1cc(I)cc(C)c1C)[C@@H]1CCN(C)C1 ZINC000597945974 567729285 /nfs/dbraw/zinc/72/92/85/567729285.db2.gz LMKIMXSTPGQIIC-CQSZACIVSA-N 0 3 386.277 3.074 10 0 GGAEHN C[C@@H]1C[C@H](c2ccc(Br)cc2)CN1C(=O)NC1CCN(C)CC1 ZINC000623704555 567732287 /nfs/dbraw/zinc/73/22/87/567732287.db2.gz ADEBZOALRQHVHB-HIFRSBDPSA-N 0 3 380.330 3.431 10 0 GGAEHN C[C@H]1C[C@H](c2ccc(Br)cc2)CN1C(=O)NC1CCN(C)CC1 ZINC000623704557 567732461 /nfs/dbraw/zinc/73/24/61/567732461.db2.gz ADEBZOALRQHVHB-ZFWWWQNUSA-N 0 3 380.330 3.431 10 0 GGAEHN O=C(N[C@H]1CCN(C2CC2)C1)c1cc(Br)cc(N2CCCC2)c1 ZINC000667182059 567732712 /nfs/dbraw/zinc/73/27/12/567732712.db2.gz TXYCPCPWMMINIV-HNNXBMFYSA-N 0 3 378.314 3.016 10 0 GGAEHN CC(C)CN1CCN(c2nnc(-c3ccccc3Br)n2C)CC1 ZINC000508145535 567733167 /nfs/dbraw/zinc/73/31/67/567733167.db2.gz XRWLLSARCOBUIT-UHFFFAOYSA-N 0 3 378.318 3.023 10 0 GGAEHN CN1CCC[C@H](CNC(=O)NCC/C=C/c2ccc(Br)cc2)C1 ZINC000623721849 567733301 /nfs/dbraw/zinc/73/33/01/567733301.db2.gz SIQHDEGONYQXNZ-OUGHUQCRSA-N 0 3 380.330 3.493 10 0 GGAEHN O=C(NCC/C=C/c1ccc(Br)cc1)N[C@H]1CCN(C2CC2)C1 ZINC000623719179 567733378 /nfs/dbraw/zinc/73/33/78/567733378.db2.gz KBOFIGMQOYQRLI-VQRJYJFOSA-N 0 3 378.314 3.388 10 0 GGAEHN C[C@@H](CNC(=O)NCc1ccc(Br)c(F)c1F)N(C)C1CC1 ZINC000623725774 567733637 /nfs/dbraw/zinc/73/36/37/567733637.db2.gz JWVUDTUNKIZYBE-VIFPVBQESA-N 0 3 376.245 3.009 10 0 GGAEHN CN1CCC[C@@H](CNC(=O)NCC/C=C/c2ccc(Br)cc2)C1 ZINC000623721848 567733983 /nfs/dbraw/zinc/73/39/83/567733983.db2.gz SIQHDEGONYQXNZ-AUYOJAJCSA-N 0 3 380.330 3.493 10 0 GGAEHN Cn1c(-c2ccc(Br)cc2)nnc1N1CCN(C2CCCC2)CC1 ZINC000508186376 567736031 /nfs/dbraw/zinc/73/60/31/567736031.db2.gz XOPJELKCSJLFEW-UHFFFAOYSA-N 0 3 390.329 3.309 10 0 GGAEHN Brc1cccc2c1OCC[C@H]2NC1CCN(c2cnccn2)CC1 ZINC000554559255 567736206 /nfs/dbraw/zinc/73/62/06/567736206.db2.gz COKJDNMSWMVPHY-MRXNPFEDSA-N 0 3 389.297 3.321 10 0 GGAEHN C[C@H](NC(=O)N1CCc2cc(F)cc(Br)c2C1)C1=CCN(C)CC1 ZINC000623873761 567742584 /nfs/dbraw/zinc/74/25/84/567742584.db2.gz QQQMGERICKXBON-LBPRGKRZSA-N 0 3 396.304 3.306 10 0 GGAEHN O=C(NC[C@@H](c1cccs1)N1CCCC1)[C@H]1CCCN1CC(F)(F)F ZINC000461744089 567745942 /nfs/dbraw/zinc/74/59/42/567745942.db2.gz DFDIPADTFFVOTN-KGLIPLIRSA-N 0 3 375.460 3.028 10 0 GGAEHN CO[C@@H]1CC[C@H](C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)C1 ZINC000667427342 567746026 /nfs/dbraw/zinc/74/60/26/567746026.db2.gz CGOJRHXMTRCOHA-DOTOQJQBSA-N 0 3 383.330 3.154 10 0 GGAEHN COCc1nc2n(n1)C[C@@H](N[C@@H](C)c1cc(Br)ccc1C)CC2 ZINC000623920078 567746446 /nfs/dbraw/zinc/74/64/46/567746446.db2.gz ZWKLHZBHOKEMEU-JSGCOSHPSA-N 0 3 379.302 3.161 10 0 GGAEHN C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2C)C1 ZINC000623918121 567746485 /nfs/dbraw/zinc/74/64/85/567746485.db2.gz IPHSKVCNLRHSCM-PETRGTFGSA-N 0 3 375.822 3.284 10 0 GGAEHN C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2C)C1 ZINC000623918118 567746743 /nfs/dbraw/zinc/74/67/43/567746743.db2.gz IPHSKVCNLRHSCM-MAWWSGROSA-N 0 3 375.822 3.284 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3[nH]c4ccc(Br)cc4c3Cl)[C@H]2C1 ZINC000646915667 567747904 /nfs/dbraw/zinc/74/79/04/567747904.db2.gz SHVICHALBNYUTR-RNCFNFMXSA-N 0 3 382.689 3.360 10 0 GGAEHN C[C@@H](Cc1ncc(C(F)(F)F)cc1Cl)NC[C@@H]1CCCCS1(=O)=O ZINC000623958423 567749046 /nfs/dbraw/zinc/74/90/46/567749046.db2.gz LYPOVZYWDNFLCJ-JQWIXIFHSA-N 0 3 384.851 3.242 10 0 GGAEHN C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)NC[C@@H]1CCCCS1(=O)=O ZINC000623958424 567749147 /nfs/dbraw/zinc/74/91/47/567749147.db2.gz LYPOVZYWDNFLCJ-PWSUYJOCSA-N 0 3 384.851 3.242 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)COc3ccc4ccccc4c3Br)[C@@H]2C1 ZINC000646927858 567749924 /nfs/dbraw/zinc/74/99/24/567749924.db2.gz SJBIFXAYKXEOQK-GOEBONIOSA-N 0 3 389.293 3.144 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)COc3ccc4cc(Br)ccc4c3)[C@@H]2C1 ZINC000646937427 567749962 /nfs/dbraw/zinc/74/99/62/567749962.db2.gz LKFANQPKKRRPOU-CRAIPNDOSA-N 0 3 389.293 3.144 10 0 GGAEHN C[C@@H](Cc1ncc(C(F)(F)F)cc1Cl)NCC1(S(C)(=O)=O)CCC1 ZINC000623976006 567750605 /nfs/dbraw/zinc/75/06/05/567750605.db2.gz WENPWEPQQUWTBR-JTQLQIEISA-N 0 3 384.851 3.242 10 0 GGAEHN C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)NCC1(S(C)(=O)=O)CCC1 ZINC000623976007 567750703 /nfs/dbraw/zinc/75/07/03/567750703.db2.gz WENPWEPQQUWTBR-SNVBAGLBSA-N 0 3 384.851 3.242 10 0 GGAEHN O=C(NCCN1CCCCCC1)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000623979752 567751964 /nfs/dbraw/zinc/75/19/64/567751964.db2.gz KXHYLFBUJMYHSR-BPQIPLTHSA-N 0 3 377.326 3.327 10 0 GGAEHN COCCn1cc(CN[C@@H](C)Cc2ncc(C(F)(F)F)cc2Cl)cn1 ZINC000623977975 567752428 /nfs/dbraw/zinc/75/24/28/567752428.db2.gz GEDSELWUPGNOPC-NSHDSACASA-N 0 3 376.810 3.318 10 0 GGAEHN C[C@@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@@H](C)C1(S(C)(=O)=O)CC1 ZINC000623982482 567752662 /nfs/dbraw/zinc/75/26/62/567752662.db2.gz WCVIUJHDVJRBKB-UWVGGRQHSA-N 0 3 384.851 3.240 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)[C@H]1CCCN1CC(F)(F)F)c1ccsc1 ZINC000461905905 567753080 /nfs/dbraw/zinc/75/30/80/567753080.db2.gz WBGJJGDIXYMSCA-HUUCEWRRSA-N 0 3 377.476 3.274 10 0 GGAEHN COC[C@H](C)CN[C@H]1CCCN(c2c(C)cc(Br)cc2C)C1=O ZINC000554874376 567754386 /nfs/dbraw/zinc/75/43/86/567754386.db2.gz VTPVZINYANXLQA-WBMJQRKESA-N 0 3 383.330 3.433 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1CC(=O)Nc1ccc(Br)cc1F ZINC000574083961 567755196 /nfs/dbraw/zinc/75/51/96/567755196.db2.gz IIOMYVPXPQLYDZ-KRWDZBQOSA-N 0 3 392.272 3.085 10 0 GGAEHN C[C@H](CN1CCCCC1)NC(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000624040328 567755823 /nfs/dbraw/zinc/75/58/23/567755823.db2.gz PDACXJXUCXFURE-UOAMXJAYSA-N 0 3 377.326 3.325 10 0 GGAEHN Cc1c(Br)cncc1C(=O)NCc1ccccc1OCCN(C)C ZINC000667574809 567757921 /nfs/dbraw/zinc/75/79/21/567757921.db2.gz TYDGBUZKQCIWQL-UHFFFAOYSA-N 0 3 392.297 3.023 10 0 GGAEHN CC[C@@H](Cc1ccccc1Br)C(=O)N[C@H]1CNCCC1(F)F ZINC000647076223 567758636 /nfs/dbraw/zinc/75/86/36/567758636.db2.gz BVGZNKFDSLBXNA-FZMZJTMJSA-N 0 3 375.257 3.131 10 0 GGAEHN C[C@@H](N[C@@H]1CCN(c2ccc3nncn3n2)C1)c1cccc(Cl)c1Cl ZINC000624113310 567760131 /nfs/dbraw/zinc/76/01/31/567760131.db2.gz CDKLFYYVQXKLMN-VXGBXAGGSA-N 0 3 377.279 3.361 10 0 GGAEHN C[C@@H](N[C@H]1CCN(c2ccc3nncn3n2)C1)c1cc(Cl)ccc1Cl ZINC000624114376 567760302 /nfs/dbraw/zinc/76/03/02/567760302.db2.gz YZABAQJAGWOPME-YPMHNXCESA-N 0 3 377.279 3.361 10 0 GGAEHN C[C@H](N[C@H]1CCN(c2ccc3nncn3n2)C1)c1ccc(Cl)cc1Cl ZINC000624114037 567760448 /nfs/dbraw/zinc/76/04/48/567760448.db2.gz RTMHAUFNJMUXSE-AAEUAGOBSA-N 0 3 377.279 3.361 10 0 GGAEHN C[C@@H](NCC1(OCCO)CCC(F)(F)CC1)c1ccc(Br)cn1 ZINC000624104053 567760577 /nfs/dbraw/zinc/76/05/77/567760577.db2.gz WNBZCGXYBJEKHW-GFCCVEGCSA-N 0 3 393.272 3.452 10 0 GGAEHN C[C@@H](N[C@H]1C[C@H](C(N)=O)C1)c1ccc(Br)cc1Br ZINC000624129820 567761900 /nfs/dbraw/zinc/76/19/00/567761900.db2.gz YMVINOVVOHCMHK-NQMVMOMDSA-N 0 3 376.092 3.126 10 0 GGAEHN COc1ncc(Br)cc1CN[C@H]1CCC[C@@H](c2ccnn2C)C1 ZINC000624134440 567761972 /nfs/dbraw/zinc/76/19/72/567761972.db2.gz VCCKLNUDTGRYCN-DOMZBBRYSA-N 0 3 379.302 3.402 10 0 GGAEHN CCn1nccc1CCN(CCC(=O)OC)Cc1cccc(Br)c1 ZINC000555016419 567762351 /nfs/dbraw/zinc/76/23/51/567762351.db2.gz NJBAFXQBLSALDC-UHFFFAOYSA-N 0 3 394.313 3.273 10 0 GGAEHN CN1CC[C@]2(CCN(C(=O)Nc3ccc(-c4ccc(Cl)s4)nn3)C2)C1 ZINC000667677654 567764245 /nfs/dbraw/zinc/76/42/45/567764245.db2.gz YQBMPLUSCBPMTJ-KRWDZBQOSA-N 0 3 377.901 3.418 10 0 GGAEHN C[C@H](NC[C@H]1COCCN1C)c1ccc(Br)cc1C(F)(F)F ZINC000624175533 567764913 /nfs/dbraw/zinc/76/49/13/567764913.db2.gz RIDVWAFDIDLEMK-JQWIXIFHSA-N 0 3 381.236 3.449 10 0 GGAEHN C[C@H](NC[C@@H]1COCCN1C)c1ccc(Br)cc1Br ZINC000624171793 567764964 /nfs/dbraw/zinc/76/49/64/567764964.db2.gz CKMMPGPQTDLPCS-CMPLNLGQSA-N 0 3 392.135 3.193 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)Nc2ccc(-c3ccc(Cl)s3)nn2)CCSC1 ZINC000667680374 567765772 /nfs/dbraw/zinc/76/57/72/567765772.db2.gz FOUAMSMUDUXBAR-MRXNPFEDSA-N 0 3 397.957 3.417 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@H]1[C@@H]2COC[C@@H]21)c1cccc(Br)c1 ZINC000667688156 567768159 /nfs/dbraw/zinc/76/81/59/567768159.db2.gz HHMPQEYNPWVNKF-FVQHAEBGSA-N 0 3 381.314 3.016 10 0 GGAEHN Brc1ccccc1N1CC[C@@H](NCc2ccnn2-c2ccccn2)C1 ZINC000647182495 567768161 /nfs/dbraw/zinc/76/81/61/567768161.db2.gz FXTPGBUTQUFXHF-OAHLLOKOSA-N 0 3 398.308 3.398 10 0 GGAEHN Brc1ccc(N2CC[C@H](NCc3ccnn3-c3ccccn3)C2)cc1 ZINC000647179192 567768466 /nfs/dbraw/zinc/76/84/66/567768466.db2.gz GXZHGANBKVSCHV-INIZCTEOSA-N 0 3 398.308 3.398 10 0 GGAEHN CC[C@H](CNCc1ccc(S(N)(=O)=O)cc1F)Oc1ccccc1Cl ZINC000647189656 567769224 /nfs/dbraw/zinc/76/92/24/567769224.db2.gz HXQNUQUEWCEQKO-CYBMUJFWSA-N 0 3 386.876 3.074 10 0 GGAEHN C[C@H](N[C@@H]1CCOC[C@@H]1O)c1ccc(Br)cc1Br ZINC000624235246 567769490 /nfs/dbraw/zinc/76/94/90/567769490.db2.gz HDLKDJUCJUXDQQ-CKLFPEKLSA-N 0 3 379.092 3.012 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)CCCc3cccc(Br)c3)[C@H]2C1 ZINC000647216759 567770839 /nfs/dbraw/zinc/77/08/39/567770839.db2.gz YPAUHABYOFPAFK-ZWKOTPCHSA-N 0 3 395.341 3.093 10 0 GGAEHN C[C@H](NC[C@@H]1CN(Cc2ccncc2)CCO1)c1cc(Br)cs1 ZINC000624263857 567771122 /nfs/dbraw/zinc/77/11/22/567771122.db2.gz PIIOIYNHWMIMNY-XJKSGUPXSA-N 0 3 396.354 3.457 10 0 GGAEHN C[C@@H](NC[C@@H]1CN(Cc2ccncc2)CCO1)c1ccc(Br)cc1 ZINC000624266589 567771418 /nfs/dbraw/zinc/77/14/18/567771418.db2.gz QVXKDFNMJSPRLC-DNVCBOLYSA-N 0 3 390.325 3.396 10 0 GGAEHN C[C@@H](NC[C@@H]1CN(Cc2ccncc2)CCO1)c1cccc(Br)c1 ZINC000624266626 567771472 /nfs/dbraw/zinc/77/14/72/567771472.db2.gz RSVOFHJNWJJNNW-DNVCBOLYSA-N 0 3 390.325 3.396 10 0 GGAEHN OC[C@H](CNCc1cc(OC(F)F)ccc1Br)c1cccnc1 ZINC000647211508 567771724 /nfs/dbraw/zinc/77/17/24/567771724.db2.gz YBPNHXMJLCXXIE-ZDUSSCGKSA-N 0 3 387.224 3.311 10 0 GGAEHN OC[C@@H](CNCc1cc(OC(F)F)ccc1Br)c1cccnc1 ZINC000647211507 567771855 /nfs/dbraw/zinc/77/18/55/567771855.db2.gz YBPNHXMJLCXXIE-CYBMUJFWSA-N 0 3 387.224 3.311 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3ccc(C)c(Br)c3C)[C@H]2C1 ZINC000647219386 567772013 /nfs/dbraw/zinc/77/20/13/567772013.db2.gz WIHNKQMJVXRSNX-JKSUJKDBSA-N 0 3 381.314 3.001 10 0 GGAEHN Cc1noc([C@H]2OCC[C@H]2N[C@H](C)Cc2ccc(Br)cc2F)n1 ZINC000624303409 567772388 /nfs/dbraw/zinc/77/23/88/567772388.db2.gz BTDSGTBLRFEZNC-ZWZTZDBGSA-N 0 3 384.249 3.330 10 0 GGAEHN Cn1cnc(CCCNCc2cc(C(F)(F)F)ccc2Br)n1 ZINC000647231937 567772672 /nfs/dbraw/zinc/77/26/72/567772672.db2.gz YXQOBGSHBMBHOD-UHFFFAOYSA-N 0 3 377.208 3.319 10 0 GGAEHN O=S1(=O)C[C@@H](CN[C@H]2CCc3cccc(Cl)c3C2)Oc2ccccc21 ZINC000647223634 567773184 /nfs/dbraw/zinc/77/31/84/567773184.db2.gz IMQJIWJNXYYTMJ-LSDHHAIUSA-N 0 3 377.893 3.022 10 0 GGAEHN CC(C)(CNCc1nc(-c2cccc(Br)c2)c[nH]1)[C@]1(O)CCOC1 ZINC000647246796 567774349 /nfs/dbraw/zinc/77/43/49/567774349.db2.gz QMJYTCTXTKOPBG-SFHVURJKSA-N 0 3 394.313 3.106 10 0 GGAEHN CSc1cc(Cl)c(C(F)(F)F)cc1NC(=O)NC[C@]1(O)CCN(C)C1 ZINC000667824179 567775743 /nfs/dbraw/zinc/77/57/43/567775743.db2.gz LXDLXNZDECHXIC-CQSZACIVSA-N 0 3 397.850 3.269 10 0 GGAEHN NCc1cccc2c1N(S(=O)(=O)c1ccc(Br)s1)CCC2 ZINC000624388377 567777669 /nfs/dbraw/zinc/77/76/69/567777669.db2.gz VTWGBDHOTFVXIA-UHFFFAOYSA-N 0 3 387.324 3.111 10 0 GGAEHN Cc1ccc(Br)cc1S(=O)(=O)N1CCCc2cccc(CN)c21 ZINC000624387846 567777945 /nfs/dbraw/zinc/77/79/45/567777945.db2.gz CXHCKVRHVVVXFM-UHFFFAOYSA-N 0 3 395.322 3.358 10 0 GGAEHN Cc1cc(S(=O)(=O)NCCN[C@@H](CC(C)C)c2ccncc2)c(C)s1 ZINC000647294701 567777983 /nfs/dbraw/zinc/77/79/83/567777983.db2.gz LEBLMEAHHPFVIC-KRWDZBQOSA-N 0 3 381.567 3.415 10 0 GGAEHN C[C@@H](NC[C@H](CO)Cc1ccc(Br)cc1)c1cc2n(n1)CCCC2 ZINC000647301293 567779196 /nfs/dbraw/zinc/77/91/96/567779196.db2.gz BEUPVOZRSPPWEK-GDBMZVCRSA-N 0 3 392.341 3.484 10 0 GGAEHN CC(C)(CN[C@H](c1ccc(Br)cc1)[C@@H]1CCCO1)[C@]1(O)CCOC1 ZINC000647340683 567779626 /nfs/dbraw/zinc/77/96/26/567779626.db2.gz NCOHNRZEADDKNH-SCTDSRPQSA-N 0 3 398.341 3.436 10 0 GGAEHN C[C@@H](CS(=O)(=O)c1ccccc1)NCC[C@@H]1CSc2ccccc2O1 ZINC000647320946 567779749 /nfs/dbraw/zinc/77/97/49/567779749.db2.gz NNKYFVFDHXEGCO-JKSUJKDBSA-N 0 3 377.531 3.382 10 0 GGAEHN COc1cc(CNC2CCC(O)(C(F)(F)F)CC2)c(Br)cc1O ZINC000647361707 567782463 /nfs/dbraw/zinc/78/24/63/567782463.db2.gz NKJJGJKNNNVQOY-UHFFFAOYSA-N 0 3 398.219 3.489 10 0 GGAEHN N[C@H](CC(F)F)C(=O)NCc1ccc(Br)cc1C(F)(F)F ZINC000574516617 567782799 /nfs/dbraw/zinc/78/27/99/567782799.db2.gz OIPXWNHUIJJKEZ-SECBINFHSA-N 0 3 375.135 3.067 10 0 GGAEHN CN1CC[C@@H](CNC(=O)c2c(F)ccc(C(F)(F)F)c2Br)C1 ZINC000624485613 567782859 /nfs/dbraw/zinc/78/28/59/567782859.db2.gz ZKZMPHUZMAUEBY-QMMMGPOBSA-N 0 3 383.183 3.289 10 0 GGAEHN COc1sc(CN[C@@H]2CCCN(c3cc(C)nn3C)C2)cc1Br ZINC000444034280 567785455 /nfs/dbraw/zinc/78/54/55/567785455.db2.gz PINGQICBCOWPDR-GFCCVEGCSA-N 0 3 399.358 3.320 10 0 GGAEHN CCC[NH+]1CCC(C[N-]S(=O)(=O)c2ccc(C(F)(F)F)cc2F)CC1 ZINC000444030809 567785666 /nfs/dbraw/zinc/78/56/66/567785666.db2.gz LTDPPWAOZVFLRR-UHFFFAOYSA-N 0 3 382.423 3.245 10 0 GGAEHN Cc1cc(N2CCC[C@@H](NCc3cc(Br)ccc3F)C2)n(C)n1 ZINC000444020529 567785820 /nfs/dbraw/zinc/78/58/20/567785820.db2.gz ZTICLYVAIHJPFH-OAHLLOKOSA-N 0 3 381.293 3.389 10 0 GGAEHN COc1ccc(Br)c(CN[C@H]2CCCN(c3cc(C)nn3C)C2)c1 ZINC000444007122 567785893 /nfs/dbraw/zinc/78/58/93/567785893.db2.gz CKUZOEAJQWGLIT-HNNXBMFYSA-N 0 3 393.329 3.258 10 0 GGAEHN Cc1cc(N2CCC[C@@H](NCc3cc(F)ccc3Br)C2)n(C)n1 ZINC000444014987 567785928 /nfs/dbraw/zinc/78/59/28/567785928.db2.gz ZGFLWIGEIZPURY-OAHLLOKOSA-N 0 3 381.293 3.389 10 0 GGAEHN Cc1cc(N2CC[C@H](N[C@@H]3CO[C@@H](C4CC4)C3)C2=O)ccc1Br ZINC000667993416 567786622 /nfs/dbraw/zinc/78/66/22/567786622.db2.gz YCLUGZLXBZIWDV-RRQGHBQHSA-N 0 3 379.298 3.020 10 0 GGAEHN Cc1cc(N2CC[C@H](N[C@H]3CO[C@H](C4CC4)C3)C2=O)ccc1Br ZINC000667993414 567786749 /nfs/dbraw/zinc/78/67/49/567786749.db2.gz YCLUGZLXBZIWDV-COXVUDFISA-N 0 3 379.298 3.020 10 0 GGAEHN CCN1CCC(N(C)C(=O)CCc2ccc(OC)cc2Br)CC1 ZINC000667998277 567787290 /nfs/dbraw/zinc/78/72/90/567787290.db2.gz VEIWZMHJGQUOPV-UHFFFAOYSA-N 0 3 383.330 3.333 10 0 GGAEHN CS(=O)(=O)N1CCC[C@H](CN2CCC[C@@H]2Cc2c(F)cccc2Cl)C1 ZINC000444060544 567787642 /nfs/dbraw/zinc/78/76/42/567787642.db2.gz VUPAWDGIMMFMJG-HUUCEWRRSA-N 0 3 388.936 3.158 10 0 GGAEHN Cc1cccc(C(=O)N2CC[C@H](OCCN3CCCCC3)C2)c1Br ZINC000533845819 567789445 /nfs/dbraw/zinc/78/94/45/567789445.db2.gz PQZZHPBVGVUDEX-INIZCTEOSA-N 0 3 395.341 3.475 10 0 GGAEHN Cc1ccc(C[C@H](CO)NC[C@@H](O)COc2c(Cl)cccc2Cl)cc1 ZINC000647530009 567789911 /nfs/dbraw/zinc/78/99/11/567789911.db2.gz BYRPRIIPLQWBQQ-HZPDHXFCSA-N 0 3 384.303 3.235 10 0 GGAEHN COc1cc(NC(=O)N[C@@H]2CCCN(C)C2)c(Cl)cc1Br ZINC000668032905 567789951 /nfs/dbraw/zinc/78/99/51/567789951.db2.gz OEIYLICAUBYYSH-SECBINFHSA-N 0 3 376.682 3.327 10 0 GGAEHN COc1cc(NC(=O)N[C@H]2CCCN(C)C2)c(Cl)cc1Br ZINC000668032906 567790095 /nfs/dbraw/zinc/79/00/95/567790095.db2.gz OEIYLICAUBYYSH-VIFPVBQESA-N 0 3 376.682 3.327 10 0 GGAEHN CN(CCNC(=O)c1c(F)ccc(C(F)(F)F)c1Br)C1CC1 ZINC000624597265 567790501 /nfs/dbraw/zinc/79/05/01/567790501.db2.gz AHXIYIQLWWDXOS-UHFFFAOYSA-N 0 3 383.183 3.431 10 0 GGAEHN COc1nc(NC[C@@H]2CCCN(C)[C@H]2c2cccs2)ncc1Br ZINC000444083217 567791211 /nfs/dbraw/zinc/79/12/11/567791211.db2.gz KEYQFUJQIDLBIT-SMDDNHRTSA-N 0 3 397.342 3.226 10 0 GGAEHN CC(C)C[C@H](Nc1ncc(C(F)(F)F)cc1Cl)C(=O)NCCN(C)C ZINC000533911388 567792753 /nfs/dbraw/zinc/79/27/53/567792753.db2.gz GMQMLYVTMAPGRS-ZDUSSCGKSA-N 0 3 380.842 3.258 10 0 GGAEHN CN(C)C[C@]1(O)CCCN(C(=O)CSc2cc(Cl)ccc2Cl)C1 ZINC000647625239 567793388 /nfs/dbraw/zinc/79/33/88/567793388.db2.gz ZDMQQHCLHVXBFN-MRXNPFEDSA-N 0 3 377.337 3.001 10 0 GGAEHN Cn1cc([C@H](NC[C@H](O)COc2cccc(Br)c2)C(C)(C)C)cn1 ZINC000574712874 567793776 /nfs/dbraw/zinc/79/37/76/567793776.db2.gz KOLRLOWQAKVHGM-RDJZCZTQSA-N 0 3 396.329 3.299 10 0 GGAEHN N[C@@H]1CCCc2cn(Cc3nc(-c4ccc(Br)s4)no3)nc21 ZINC000574750158 567795654 /nfs/dbraw/zinc/79/56/54/567795654.db2.gz XVQJBCUDRGOOBA-SECBINFHSA-N 0 3 380.271 3.142 10 0 GGAEHN Cc1c(Br)cncc1CN(C)C1CCN(c2cnccn2)CC1 ZINC000668085894 567795839 /nfs/dbraw/zinc/79/58/39/567795839.db2.gz WXUVFPPUBAFLIG-UHFFFAOYSA-N 0 3 376.302 3.043 10 0 GGAEHN CC(C)C[C@H](NC(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)NCCN(C)C ZINC000534007466 567796766 /nfs/dbraw/zinc/79/67/66/567796766.db2.gz ZWGQRGJEDMAILM-HNNXBMFYSA-N 0 3 389.327 3.207 10 0 GGAEHN CN1CC[C@H](NC(=O)COc2cccc(Br)c2)[C@@H]1c1ccccc1 ZINC000534022053 567796929 /nfs/dbraw/zinc/79/69/29/567796929.db2.gz UVQFXKONDNNGSW-HKUYNNGSSA-N 0 3 389.293 3.390 10 0 GGAEHN COC[C@H](CC1CCOCC1)N[C@H]1COc2cc(F)c(Br)cc21 ZINC000668107560 567796948 /nfs/dbraw/zinc/79/69/48/567796948.db2.gz GCAVJODHCIVFBH-LRDDRELGSA-N 0 3 388.277 3.443 10 0 GGAEHN CN1CC[C@@H](NC(=O)COc2cccc(Br)c2)[C@H]1c1ccccc1 ZINC000534022054 567797025 /nfs/dbraw/zinc/79/70/25/567797025.db2.gz UVQFXKONDNNGSW-IEBWSBKVSA-N 0 3 389.293 3.390 10 0 GGAEHN CN(C)CCN(Cc1cc2n(n1)CCC2)Cc1ccc(Br)cc1 ZINC000668158962 567799620 /nfs/dbraw/zinc/79/96/20/567799620.db2.gz GSYFNYQJMGIHNM-UHFFFAOYSA-N 0 3 377.330 3.156 10 0 GGAEHN C[C@H](CCNCc1c[nH]nc1-c1ccc(Br)s1)[S@](C)=O ZINC000598968435 567800736 /nfs/dbraw/zinc/80/07/36/567800736.db2.gz NEAJSFHZPDGJRM-YBYGRFCBSA-N 0 3 376.345 3.147 10 0 GGAEHN CN(CCc1cccc(Br)c1)C(=O)CCN(C)c1ccncc1 ZINC000574862868 567801003 /nfs/dbraw/zinc/80/10/03/567801003.db2.gz WOMHETPOBOCLHW-UHFFFAOYSA-N 0 3 376.298 3.372 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000668234886 567802554 /nfs/dbraw/zinc/80/25/54/567802554.db2.gz XZXAAVRCRYAZQJ-UHFFFAOYSA-N 0 3 394.357 3.463 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)CSc1cc(Cl)ccc1Cl ZINC000647822535 567802962 /nfs/dbraw/zinc/80/29/62/567802962.db2.gz VGIMKJJDSOCESM-HUUCEWRRSA-N 0 3 389.348 3.407 10 0 GGAEHN CNC(=O)[C@H](CCSC)N[C@H](C)Cc1ncc(C(F)(F)F)cc1Cl ZINC000599047255 567804005 /nfs/dbraw/zinc/80/40/05/567804005.db2.gz QXPOLFJGINNYRT-SKDRFNHKSA-N 0 3 383.867 3.142 10 0 GGAEHN CSCC[C@H](N[C@@H](C)Cc1ncc(C(F)(F)F)cc1Cl)C(=O)N(C)C ZINC000599046427 567804220 /nfs/dbraw/zinc/80/42/20/567804220.db2.gz JGCVQHXJAGHAOZ-GWCFXTLKSA-N 0 3 397.894 3.484 10 0 GGAEHN CC[C@@H](N[C@H]1CCN(C2CCC2)C1=O)c1ccc(I)cc1 ZINC000599093292 567805038 /nfs/dbraw/zinc/80/50/38/567805038.db2.gz OJICRMWNSDSLSP-CVEARBPZSA-N 0 3 398.288 3.485 10 0 GGAEHN C[C@H](N[C@H]1CCN(C2CCC2)C1=O)c1ccc(I)cc1 ZINC000599092946 567805235 /nfs/dbraw/zinc/80/52/35/567805235.db2.gz LBZDXQFUOJEIQR-NHYWBVRUSA-N 0 3 384.261 3.095 10 0 GGAEHN COc1c(Br)cc(Br)cc1CNCCCN1CCC1 ZINC000534311364 567807365 /nfs/dbraw/zinc/80/73/65/567807365.db2.gz PWBUPLYATXCJHL-UHFFFAOYSA-N 0 3 392.135 3.406 10 0 GGAEHN CCOC(=O)c1cnc(N[C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)cn1 ZINC000599172059 567808495 /nfs/dbraw/zinc/80/84/95/567808495.db2.gz JNYBFOANCDKARK-OAHLLOKOSA-N 0 3 383.279 3.097 10 0 GGAEHN C[C@H](Cc1cc(Br)ccc1F)NC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000534379512 567809039 /nfs/dbraw/zinc/80/90/39/567809039.db2.gz CNPARHBWEMBSDO-WBMJQRKESA-N 0 3 398.320 3.397 10 0 GGAEHN COc1ccc(CCC(=O)N2CC[C@@H](N3CCCCC3)C2)c(Br)c1 ZINC000668443177 567810049 /nfs/dbraw/zinc/81/00/49/567810049.db2.gz WILCHERWGMWSNM-MRXNPFEDSA-N 0 3 395.341 3.477 10 0 GGAEHN Cc1cc(Br)ccc1CN(C)CCc1nnnn1-c1ccccc1 ZINC000444692476 567810261 /nfs/dbraw/zinc/81/02/61/567810261.db2.gz BVICCIXHNHGYBD-UHFFFAOYSA-N 0 3 386.297 3.408 10 0 GGAEHN COc1cc(Br)c(Cl)cc1C(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000575047581 567810513 /nfs/dbraw/zinc/81/05/13/567810513.db2.gz XFNDPTHKXKGKIV-NSHDSACASA-N 0 3 387.705 3.420 10 0 GGAEHN CCOc1cc(C[NH2+][C@H](COC)C2CCOCC2)cc(Br)c1[O-] ZINC000668461888 567810529 /nfs/dbraw/zinc/81/05/29/567810529.db2.gz HJFHAVGGRUBABW-OAHLLOKOSA-N 0 3 388.302 3.085 10 0 GGAEHN O=C(N[C@@H]1CCN(CC2CC2)C1)c1c(F)c(F)c(Br)c(F)c1F ZINC000668457822 567811176 /nfs/dbraw/zinc/81/11/76/567811176.db2.gz PZOCHQYTLIIJAV-MRVPVSSYSA-N 0 3 395.194 3.220 10 0 GGAEHN O[C@@H](COc1ccc(Br)cc1)CN1CC[C@@H](CC(F)(F)F)C1 ZINC000444713759 567811646 /nfs/dbraw/zinc/81/16/46/567811646.db2.gz ZRGDVVZPXKRTIV-WCQYABFASA-N 0 3 382.220 3.463 10 0 GGAEHN O[C@@H](COc1ccc(Br)cc1)CN1CC[C@H](CC(F)(F)F)C1 ZINC000444713758 567811681 /nfs/dbraw/zinc/81/16/81/567811681.db2.gz ZRGDVVZPXKRTIV-DGCLKSJQSA-N 0 3 382.220 3.463 10 0 GGAEHN C[C@@H]1C(=O)N(CCN(C)C)CN1Cc1csc(-c2ccc(Cl)cc2)n1 ZINC000648064470 567812622 /nfs/dbraw/zinc/81/26/22/567812622.db2.gz AEDLXSIIHDKCGE-CYBMUJFWSA-N 0 3 378.929 3.015 10 0 GGAEHN C[C@H]1C(=O)N(CCN(C)C)CN1Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000648065574 567812678 /nfs/dbraw/zinc/81/26/78/567812678.db2.gz IKESHKJYLFIWAM-ZDUSSCGKSA-N 0 3 378.929 3.015 10 0 GGAEHN CC(C)(CNC(=O)NCCNc1ccncc1)c1ccc(Cl)c(Cl)c1 ZINC000534524126 567813660 /nfs/dbraw/zinc/81/36/60/567813660.db2.gz GVHUBFVAJDFELI-UHFFFAOYSA-N 0 3 381.307 3.499 10 0 GGAEHN O=C(NCCNc1ccncc1)c1cc(Br)cc(C(F)(F)F)c1 ZINC000534530576 567813714 /nfs/dbraw/zinc/81/37/14/567813714.db2.gz GCRWIURCTPWXTD-UHFFFAOYSA-N 0 3 388.187 3.127 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1C[C@H](C)C(O)[C@@H](C)C1 ZINC000668553853 567813866 /nfs/dbraw/zinc/81/38/66/567813866.db2.gz HVLSHAVYSWQSEH-STQMWFEESA-N 0 3 378.314 3.392 10 0 GGAEHN C[C@H](Cc1ccc(Br)c(F)c1)N[C@@H]1CC[C@@H](C)S(=O)(=O)C1 ZINC000668561684 567813887 /nfs/dbraw/zinc/81/38/87/567813887.db2.gz QFCZUSVBDMSZJL-NQBHXWOUSA-N 0 3 378.307 3.075 10 0 GGAEHN CN(C(=O)c1cc(Br)cc(N2CCCC2)c1)[C@H]1CN2CCC1CC2 ZINC000668588041 567814005 /nfs/dbraw/zinc/81/40/05/567814005.db2.gz DEHOMQQSIAFDFR-SFHVURJKSA-N 0 3 392.341 3.216 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1CC[C@@]2(O)C[C@H]2C1 ZINC000668598720 567814720 /nfs/dbraw/zinc/81/47/20/567814720.db2.gz NAMLGOGBXWTCTP-KBXCAEBGSA-N 0 3 376.298 3.208 10 0 GGAEHN COc1cc(Br)c(CN[C@H]2CCC[C@H]2Cc2cnn(C)c2)cc1O ZINC000668610257 567814810 /nfs/dbraw/zinc/81/48/10/567814810.db2.gz RGFGUJGKYJEVML-BBRMVZONSA-N 0 3 394.313 3.398 10 0 GGAEHN CN(C(=O)C(C)(C)Oc1ccc(Br)cc1)[C@H]1CCN(C2CC2)C1 ZINC000668599148 567814853 /nfs/dbraw/zinc/81/48/53/567814853.db2.gz RSDSXUKCYTYCOP-HNNXBMFYSA-N 0 3 381.314 3.302 10 0 GGAEHN Nc1c(Br)cc(Br)cc1CN[C@H]1C[C@H](O)C12CCC2 ZINC000668623086 567815029 /nfs/dbraw/zinc/81/50/29/567815029.db2.gz ITMUHQQMZVTNNT-RYUDHWBXSA-N 0 3 390.119 3.187 10 0 GGAEHN CN(C)CCn1cc(NC(=O)c2cc3c(cncc3Br)s2)cn1 ZINC000648270073 567816365 /nfs/dbraw/zinc/81/63/65/567816365.db2.gz SQSRGDNJWISIJY-UHFFFAOYSA-N 0 3 394.298 3.069 10 0 GGAEHN CC(C)[C@@H](NC(=O)c1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000048089495 570218096 /nfs/dbraw/zinc/21/80/96/570218096.db2.gz QITLVFLGFZLIDH-JOCHJYFZSA-N 0 3 393.531 3.222 10 0 GGAEHN CC(C)(N)c1cn(C2CCN(C(=O)c3ccc(-c4ccco4)cc3)CC2)nn1 ZINC000019852034 570225654 /nfs/dbraw/zinc/22/56/54/570225654.db2.gz DBHXNHMBGOFWCP-UHFFFAOYSA-N 0 3 379.464 3.209 10 0 GGAEHN Cc1nn(-c2ccc(F)cc2F)c(C)c1CC(=O)NCCN1CCC(C)CC1 ZINC000048275055 570229505 /nfs/dbraw/zinc/22/95/05/570229505.db2.gz BUHDZZVEKUTTKV-UHFFFAOYSA-N 0 3 390.478 3.158 10 0 GGAEHN CCN1CCN(c2ccc(NC(=O)[C@H]3COc4ccccc4C3)c(C)c2)CC1 ZINC000048342564 570239983 /nfs/dbraw/zinc/23/99/83/570239983.db2.gz FWYGODZWYCNELM-LJQANCHMSA-N 0 3 379.504 3.327 10 0 GGAEHN CCOC(=O)c1cc2c(cc1F)[C@@H](N)C[C@]1(CCN(C(=O)OC(C)(C)C)C1)O2 ZINC000725259955 570307470 /nfs/dbraw/zinc/30/74/70/570307470.db2.gz KWAKFVYOJIZAFV-YWZLYKJASA-N 0 3 394.443 3.164 10 0 GGAEHN COc1ccc([C@@H](CNC(=O)c2ccc3nc(C)c(C)nc3c2)N(C)C)cc1 ZINC000022616379 570323623 /nfs/dbraw/zinc/32/36/23/570323623.db2.gz SESSQEIUGNKYIB-OAQYLSRUSA-N 0 3 378.476 3.288 10 0 GGAEHN COCCn1c(C)cc(O)c([C@H](c2ccc(OC)cc2)N2CCCCC2)c1=O ZINC000020604633 570331615 /nfs/dbraw/zinc/33/16/15/570331615.db2.gz UKXNQBWEXOYXIV-NRFANRHFSA-N 0 3 386.492 3.093 10 0 GGAEHN O=c1[nH]c(CN2CCCN(Cc3ccccc3)CC2)nc2sc3c(c21)CCC3 ZINC000022917191 570335095 /nfs/dbraw/zinc/33/50/95/570335095.db2.gz ZTRYNIBLPUQMPJ-UHFFFAOYSA-N 0 3 394.544 3.181 10 0 GGAEHN CC(=O)c1ccc(-c2ccc3nc(C(=O)NCCN4CCCC4)cn3c2)cc1 ZINC000034831099 570335112 /nfs/dbraw/zinc/33/51/12/570335112.db2.gz XITGDNWKSVDTJG-UHFFFAOYSA-N 0 3 376.460 3.030 10 0 GGAEHN CC1CCN(c2nnc(C(=O)NCCN3CCCCC3)c3ccccc32)CC1 ZINC000034837817 570335903 /nfs/dbraw/zinc/33/59/03/570335903.db2.gz DNZQVWIOQGNYEB-UHFFFAOYSA-N 0 3 381.524 3.082 10 0 GGAEHN OCCn1c(CN[C@H]2CCN(Cc3ccccc3)C2)nc2ccc(Cl)cc21 ZINC000022924805 570336205 /nfs/dbraw/zinc/33/62/05/570336205.db2.gz DURJTKQHUKWFNU-SFHVURJKSA-N 0 3 384.911 3.046 10 0 GGAEHN C[C@H](NCC1(N2CCOCC2)CCCCC1)C(=O)Nc1ccc(Cl)cc1F ZINC000022931449 570337184 /nfs/dbraw/zinc/33/71/84/570337184.db2.gz LJWWXBUPUYJUBU-HNNXBMFYSA-N 0 3 397.922 3.431 10 0 GGAEHN CCOc1cccc(CNCCN2CCOCC2)c1OCc1ccccc1F ZINC000022937122 570338686 /nfs/dbraw/zinc/33/86/86/570338686.db2.gz OCXTUVJQHYKDSB-UHFFFAOYSA-N 0 3 388.483 3.225 10 0 GGAEHN CCCCn1c2ccccc2nc1N1CCC(C(=O)NCCN2CCCC2)CC1 ZINC000034909962 570340392 /nfs/dbraw/zinc/34/03/92/570340392.db2.gz DBKSAHMOWCFBMT-UHFFFAOYSA-N 0 3 397.567 3.265 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)c1nc(Cc2ccccc2)n(-c2ccccc2)n1 ZINC000034911118 570340838 /nfs/dbraw/zinc/34/08/38/570340838.db2.gz JPXHTLOSXRUNIS-HXUWFJFHSA-N 0 3 389.503 3.072 10 0 GGAEHN CN(C(=O)c1nc(Cc2ccccc2)n(-c2ccccc2)n1)C1CCN(C)CC1 ZINC000034911100 570340898 /nfs/dbraw/zinc/34/08/98/570340898.db2.gz HSCZLYIXYIXXNZ-UHFFFAOYSA-N 0 3 389.503 3.024 10 0 GGAEHN Cc1ccc(C(=O)N/C(=C\c2ccco2)C(=O)NCCN2CCCCC2)cc1C ZINC000006215475 570342985 /nfs/dbraw/zinc/34/29/85/570342985.db2.gz LZXQSCAKZKWBBZ-PGMHBOJBSA-N 0 3 395.503 3.269 10 0 GGAEHN CN(CCN1CCCCC1)C(=O)c1cc(-c2cnn(C)c2)nc2ccccc21 ZINC000023428913 570362166 /nfs/dbraw/zinc/36/21/66/570362166.db2.gz JCPDOROHBTXFLM-UHFFFAOYSA-N 0 3 377.492 3.193 10 0 GGAEHN Cc1nn(C)c2ncc(CNCc3ccccc3CN3C[C@@H](C)O[C@H](C)C3)cc12 ZINC000237575489 570381078 /nfs/dbraw/zinc/38/10/78/570381078.db2.gz IVONGRWHXSYKIS-IAGOWNOFSA-N 0 3 393.535 3.176 10 0 GGAEHN Cc1nn(C)c2ncc(CNCc3ccccc3CN3C[C@@H](C)O[C@@H](C)C3)cc12 ZINC000237779004 570396035 /nfs/dbraw/zinc/39/60/35/570396035.db2.gz IVONGRWHXSYKIS-CALCHBBNSA-N 0 3 393.535 3.176 10 0 GGAEHN Cc1ccc(C)c(N2CCN(C(=O)[C@@H]3CCCN(c4ccncc4)C3)CC2)c1 ZINC000033128823 570401853 /nfs/dbraw/zinc/40/18/53/570401853.db2.gz QBZJVTWNMLXKEP-HXUWFJFHSA-N 0 3 378.520 3.264 10 0 GGAEHN C[C@H](N[C@@H]1CCCC[C@H]1NC(=O)OC(C)(C)C)C(=O)N1C[C@H](C)C[C@@H](C)C1 ZINC000221907475 570403289 /nfs/dbraw/zinc/40/32/89/570403289.db2.gz JNRHZMFLPVOTPD-UYTYNIKBSA-N 0 3 381.561 3.305 10 0 GGAEHN CSc1ccc(N2C[C@@H](C(=O)NC[C@H](c3ccccc3)N(C)C)CC2=O)cc1 ZINC000025238825 570408879 /nfs/dbraw/zinc/40/88/79/570408879.db2.gz ONFQUTAENVPJQS-FXAWDEMLSA-N 0 3 397.544 3.181 10 0 GGAEHN CSc1ccc(N2C[C@H](C(=O)NC[C@@H](c3ccccc3)N(C)C)CC2=O)cc1 ZINC000025238834 570408927 /nfs/dbraw/zinc/40/89/27/570408927.db2.gz ONFQUTAENVPJQS-XLIONFOSSA-N 0 3 397.544 3.181 10 0 GGAEHN O=c1oc2ccccc2n1CCN1CCCN(Cc2ccc(Cl)cc2)CC1 ZINC000026914426 570430032 /nfs/dbraw/zinc/43/00/32/570430032.db2.gz UNEFDTHNPWJHSU-UHFFFAOYSA-N 0 3 385.895 3.456 10 0 GGAEHN CC(C)CN1CCCC[C@H]1C(=O)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1 ZINC000241930383 570431901 /nfs/dbraw/zinc/43/19/01/570431901.db2.gz UIBOGNJVVSJTRI-UZLBHIALSA-N 0 3 379.495 3.418 10 0 GGAEHN COc1ccc(OC[C@H](O)CN(Cc2ccccc2C)C[C@H]2CCCO2)cc1 ZINC000248150160 570443918 /nfs/dbraw/zinc/44/39/18/570443918.db2.gz JMPCQSYIWZWKNS-NFBKMPQASA-N 0 3 385.504 3.425 10 0 GGAEHN COc1ccc(COC[C@H](O)CN[C@@H]2CCSc3ccccc32)cc1OC ZINC000089464543 570454100 /nfs/dbraw/zinc/45/41/00/570454100.db2.gz LNZOZEAGCKMUBA-SJLPKXTDSA-N 0 3 389.517 3.408 10 0 GGAEHN CC(C)CNC(=O)[C@H]1Cc2ccccc2N2CCN(CCc3ccccc3)C[C@H]12 ZINC000035894172 570474329 /nfs/dbraw/zinc/47/43/29/570474329.db2.gz OQSNJTBOUXXRGX-LADGPHEKSA-N 0 3 391.559 3.364 10 0 GGAEHN COc1ccccc1[C@H](CC(=O)NCCN(C)C)c1cn(C)c2ccccc12 ZINC000035910541 570477826 /nfs/dbraw/zinc/47/78/26/570477826.db2.gz SUCKIHAZPWKISR-IBGZPJMESA-N 0 3 379.504 3.387 10 0 GGAEHN CC[C@@H](C)N(C(=O)CN(C)C1CCN(Cc2cc(C)no2)CC1)[C@H](C)CC ZINC000072308329 570527755 /nfs/dbraw/zinc/52/77/55/570527755.db2.gz QPWXLSYJABARCA-QZTJIDSGSA-N 0 3 378.561 3.305 10 0 GGAEHN COc1ccc(OC[C@@H](O)CN(Cc2cccc(C)c2)C[C@H]2CCCO2)cc1 ZINC000036100653 570538090 /nfs/dbraw/zinc/53/80/90/570538090.db2.gz AYGNGCIRTBWTHL-NZQKXSOJSA-N 0 3 385.504 3.425 10 0 GGAEHN COc1ccc(OC[C@@H](O)CN(Cc2cccc(C)c2)C[C@@H]2CCCO2)cc1 ZINC000036100650 570538122 /nfs/dbraw/zinc/53/81/22/570538122.db2.gz AYGNGCIRTBWTHL-REWPJTCUSA-N 0 3 385.504 3.425 10 0 GGAEHN CCCC(=O)OC[C@@H](O)CN(Cc1ccc2c(c1)OCO2)Cc1ccccc1C ZINC000036104648 570541614 /nfs/dbraw/zinc/54/16/14/570541614.db2.gz BBQUCCYAODIDTL-FQEVSTJZSA-N 0 3 399.487 3.430 10 0 GGAEHN CN(CCc1ccccn1)[C@@H]1CCCN(Cc2cccn2-c2ccccn2)C1 ZINC000022851645 570556028 /nfs/dbraw/zinc/55/60/28/570556028.db2.gz WAOHAZVAXBAMRL-OAQYLSRUSA-N 0 3 375.520 3.406 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)[C@H](C)NC(=O)Nc1ccccc1)c1ccccc1 ZINC000032983781 570572090 /nfs/dbraw/zinc/57/20/90/570572090.db2.gz QPAUDEDFTOUKCY-FXAWDEMLSA-N 0 3 382.508 3.396 10 0 GGAEHN Cc1nc2ccccn2c(=O)c1CCN1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000225846361 570625757 /nfs/dbraw/zinc/62/57/57/570625757.db2.gz RLNOQKOOWJOEQL-LJQANCHMSA-N 0 3 391.471 3.154 10 0 GGAEHN O[C@@H](CN[C@@H]1CCSc2ccc(F)cc21)COCc1ccc2c(c1)OCO2 ZINC000036396209 570679695 /nfs/dbraw/zinc/67/96/95/570679695.db2.gz QWMUNGGWXKVVCI-DOTOQJQBSA-N 0 3 391.464 3.259 10 0 GGAEHN O=C(NC[C@@H]1CCCN(Cc2cccs2)C1)c1cnn(CC(F)(F)F)c1 ZINC000239672820 570683882 /nfs/dbraw/zinc/68/38/82/570683882.db2.gz BVLGZDNMELFORT-ZDUSSCGKSA-N 0 3 386.443 3.149 10 0 GGAEHN COCCN1CCC[C@H]1CN[C@@H](C)c1cnccc1NC(=O)OC(C)(C)C ZINC000241590531 570687017 /nfs/dbraw/zinc/68/70/17/570687017.db2.gz PFOPCHLPKUBFQB-HOTGVXAUSA-N 0 3 378.517 3.190 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)c1c(C)nn(-c2ccc(F)cc2)c1-n1cccc1 ZINC000006940126 570713392 /nfs/dbraw/zinc/71/33/92/570713392.db2.gz CPKKCFVRDHMOHX-LJQANCHMSA-N 0 3 395.482 3.325 10 0 GGAEHN COc1ccc(NC(=O)c2cccnc2N2CCN[C@H](c3ccccc3)C2)cc1 ZINC000065255742 570753694 /nfs/dbraw/zinc/75/36/94/570753694.db2.gz UPTIFQCEDBAPKL-NRFANRHFSA-N 0 3 388.471 3.493 10 0 GGAEHN Cc1cccc(CNC(=O)c2cccnc2N2CCN[C@@H](c3ccccc3)C2)c1 ZINC000065255781 570754103 /nfs/dbraw/zinc/75/41/03/570754103.db2.gz HOYRQANXDNYKNZ-JOCHJYFZSA-N 0 3 386.499 3.471 10 0 GGAEHN O=C(NCCc1cccs1)c1ccc(N2CCN[C@H](c3ccccc3)C2)nc1 ZINC000065256120 570754608 /nfs/dbraw/zinc/75/46/08/570754608.db2.gz VIAXAZIINSWAIM-FQEVSTJZSA-N 0 3 392.528 3.267 10 0 GGAEHN O=C(NCc1cccs1)c1ccc(N2CCN[C@H](c3ccccc3)C2)nc1 ZINC000065256126 570754851 /nfs/dbraw/zinc/75/48/51/570754851.db2.gz OSYGOUIGBJRNKF-IBGZPJMESA-N 0 3 378.501 3.224 10 0 GGAEHN Cc1ccc(CNC(=O)c2ccnc(N3CCN[C@@H](c4ccccc4)C3)c2)cc1 ZINC000065255928 570754855 /nfs/dbraw/zinc/75/48/55/570754855.db2.gz JDRIMLNNANEPAE-JOCHJYFZSA-N 0 3 386.499 3.471 10 0 GGAEHN CC(C)CN1CCN(c2nnc(-c3nc(C4CC4)no3)c3ccccc32)CC1 ZINC000065258298 570759817 /nfs/dbraw/zinc/75/98/17/570759817.db2.gz LEEURMUIWXVWKL-UHFFFAOYSA-N 0 3 378.480 3.335 10 0 GGAEHN CCOc1ccc(CN2CC[C@H](c3nc4cccnc4n3CCOC)C2)cc1 ZINC000065285386 570781185 /nfs/dbraw/zinc/78/11/85/570781185.db2.gz SCUXGOQUXNNXDH-SFHVURJKSA-N 0 3 380.492 3.466 10 0 GGAEHN Cc1oc2c(c1C(=O)NC1CCN(C)CC1)CN(Cc1ccc(F)cc1)CC2 ZINC000065291956 570784398 /nfs/dbraw/zinc/78/43/98/570784398.db2.gz WEUIFJCNSDBWGF-UHFFFAOYSA-N 0 3 385.483 3.109 10 0 GGAEHN COC(=O)c1ncoc1-c1ccccc1C(=O)N1CCN(C2CCCCC2)CC1 ZINC000033131167 570822051 /nfs/dbraw/zinc/82/20/51/570822051.db2.gz QZANNTCYHXMFMS-UHFFFAOYSA-N 0 3 397.475 3.219 10 0 GGAEHN O=C(NCCCN1CCN(Cc2ccccc2)CC1)C1(c2ccc(F)cc2)CC1 ZINC000032827703 570840666 /nfs/dbraw/zinc/84/06/66/570840666.db2.gz XTGJVONBEUFPBP-UHFFFAOYSA-N 0 3 395.522 3.181 10 0 GGAEHN CCN1CCN(CCCNC(=O)c2ccc(-n3ccc4ccccc43)s2)CC1 ZINC000022937350 570882538 /nfs/dbraw/zinc/88/25/38/570882538.db2.gz YFOSIWJCGRXEFA-UHFFFAOYSA-N 0 3 396.560 3.449 10 0 GGAEHN Cc1cccc(N2CCN(CC[C@H](C)NC(=O)COC3CCCCC3)CC2)c1 ZINC000044522111 570882652 /nfs/dbraw/zinc/88/26/52/570882652.db2.gz NYNBUPOGGGTMTC-FQEVSTJZSA-N 0 3 387.568 3.361 10 0 GGAEHN COc1cccc(N2C(=O)C3ON(c4ccccc4)[C@@H](c4ccco4)[C@H]3C2=O)c1 ZINC000103561003 570886652 /nfs/dbraw/zinc/88/66/52/570886652.db2.gz KYNAPNJVTRUHCO-HSALFYBXSA-N 0 3 390.395 3.339 10 0 GGAEHN C[C@@H](C(=O)N1[C@H](C)CCC[C@@H]1C)N1CCC(C(=O)NCc2ccccc2)CC1 ZINC000104124284 570895636 /nfs/dbraw/zinc/89/56/36/570895636.db2.gz FHFCRYKRHKSARB-OTWHNJEPSA-N 0 3 385.552 3.193 10 0 GGAEHN C[C@H](C(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F)N1C[C@H](C)C[C@@H](C)C1 ZINC000104213870 570897463 /nfs/dbraw/zinc/89/74/63/570897463.db2.gz NTNOGZXQOWPDOJ-RBSFLKMASA-N 0 3 399.457 3.469 10 0 GGAEHN CCOC(=O)C1=C(CN([C@H](C)C2CC2)C2CC2)NC(=O)N[C@H]1c1ccc(C)o1 ZINC000105720360 570931686 /nfs/dbraw/zinc/93/16/86/570931686.db2.gz JGDTXBLJFWQPEA-YJYMSZOUSA-N 0 3 387.480 3.022 10 0 GGAEHN CC(C(=O)NC1CCC(C)CC1)S(=O)(=O)CCCOc1ccc(F)cc1 ZINC000032929860 570943201 /nfs/dbraw/zinc/94/32/01/570943201.db2.gz XIIHJJZDKWMNKI-CKDBGZEDSA-N 0 3 385.501 3.093 10 0 GGAEHN O=C(NCCN1CCCC1)c1cccc(-c2nc(-c3cccc(F)c3)no2)c1 ZINC000033279111 570953291 /nfs/dbraw/zinc/95/32/91/570953291.db2.gz PDVZHFJFPMJGQT-UHFFFAOYSA-N 0 3 380.423 3.368 10 0 GGAEHN CN1CCCN(c2ccc(NC(=O)N(C[C@H]3CCOC3)C3CC3)cc2F)CC1 ZINC000252452503 570958803 /nfs/dbraw/zinc/95/88/03/570958803.db2.gz MELCYVXPEUGSKS-MRXNPFEDSA-N 0 3 390.503 3.000 10 0 GGAEHN O=C(/C=C\c1ccc(Cl)c(C(F)(F)F)c1)NC[C@@H]1CN2CCC[C@H]2CO1 ZINC000252458628 570959783 /nfs/dbraw/zinc/95/97/83/570959783.db2.gz YBWAXKXVGNZOIE-PSVOHZHUSA-N 0 3 388.817 3.351 10 0 GGAEHN CCOC(=O)[C@H]1CCCN(C[C@H](O)COc2ccc(OC)cc2C(C)(C)C)C1 ZINC000004144405 570963897 /nfs/dbraw/zinc/96/38/97/570963897.db2.gz WATXPUBQTSDBQD-IRXDYDNUSA-N 0 3 393.524 3.008 10 0 GGAEHN COc1cccc(CN(CCN(C)C)C(=O)NCCc2cc(F)ccc2F)c1 ZINC000252490863 570973364 /nfs/dbraw/zinc/97/33/64/570973364.db2.gz LDGNVLBXSHBZMJ-UHFFFAOYSA-N 0 3 391.462 3.289 10 0 GGAEHN COc1ccc([C@H](NC[C@@H]([C@H]2CCOC2)N2CCOCC2)c2ccccc2)cc1 ZINC000108171279 570985141 /nfs/dbraw/zinc/98/51/41/570985141.db2.gz RCQXQJZICBGOCP-OEMFJLHTSA-N 0 3 396.531 3.112 10 0 GGAEHN CCN1CCN(Cc2ccccc2CNC(=O)N[C@H]2CCc3ccccc32)CC1 ZINC000045305364 570989951 /nfs/dbraw/zinc/98/99/51/570989951.db2.gz MLQNCVCBASKNGO-QHCPKHFHSA-N 0 3 392.547 3.311 10 0 GGAEHN O=C(NCC1CCN(Cc2cccs2)CC1)c1cnn(CC(F)(F)F)c1 ZINC000252572372 570996388 /nfs/dbraw/zinc/99/63/88/570996388.db2.gz ZDCMACOPGUIMEY-UHFFFAOYSA-N 0 3 386.443 3.149 10 0 GGAEHN CN(C(=O)Nc1ccccc1N1CCCC1)C1CCN(CCn2cccn2)CC1 ZINC000109380633 571005588 /nfs/dbraw/zinc/00/55/88/571005588.db2.gz FMCSWWROSNKYNC-UHFFFAOYSA-N 0 3 396.539 3.112 10 0 GGAEHN CC(C)C[C@@H](N[C@@H](C)C(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccccc1 ZINC000019625351 571021736 /nfs/dbraw/zinc/02/17/36/571021736.db2.gz ZOHDYDWKZVMLMB-HNAYVOBHSA-N 0 3 389.521 3.038 10 0 GGAEHN Cc1cccc(CN(C(=O)C2CC2)c2ccc(CC(=O)NCCN(C)C)cc2)c1 ZINC000037556876 571030983 /nfs/dbraw/zinc/03/09/83/571030983.db2.gz WYJDEFZZUFQMJD-UHFFFAOYSA-N 0 3 393.531 3.159 10 0 GGAEHN O=C(Nc1cc(-c2cccs2)[nH]n1)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000616333086 651896326 /nfs/dbraw/zinc/89/63/26/651896326.db2.gz SUUXCBAOMOVQPA-ZJUUUORDSA-N 0 3 375.372 3.061 10 0 GGAEHN COc1ccc(OC)c(CCNC(=O)N2CCCN(Cc3ccccc3)CC2)c1 ZINC000054758988 1406819137 /nfs/dbraw/zinc/81/91/37/1406819137.db2.gz FUPUGXKFCDEUFW-UHFFFAOYSA-N 0 3 397.519 3.164 10 0 GGAEHN Cc1ccc(OC[C@H](O)CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1 ZINC000055032012 1406874007 /nfs/dbraw/zinc/87/40/07/1406874007.db2.gz KZFQOFOYWRMEPY-HXUWFJFHSA-N 0 3 383.492 3.021 10 0 GGAEHN CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(C[NH+]3CCCCC3)cc2)cc1 ZINC000014231292 1399094301 /nfs/dbraw/zinc/09/43/01/1399094301.db2.gz RBOBCNQNWGRWNN-UHFFFAOYSA-N 0 3 387.505 3.432 10 0 GGAEHN CCCN1CCN(CCCNC(=O)c2cc3c(o2)c2ccccc2nc3C)CC1 ZINC000020323435 1399345414 /nfs/dbraw/zinc/34/54/14/1399345414.db2.gz LVGSZNBPYGECDR-UHFFFAOYSA-N 0 3 394.519 3.437 10 0 GGAEHN Cc1ccc(Cl)cc1NC(=O)N1CCN(c2cc(N(C)C)nc(C)n2)CC1 ZINC000021795844 1399409733 /nfs/dbraw/zinc/40/97/33/1399409733.db2.gz MRYKZMAODLFVBT-UHFFFAOYSA-N 0 3 388.903 3.167 10 0 GGAEHN O=C(NCCCN1CCN(Cc2ccccc2)CC1)[C@H]1C[C@@H]1c1ccc(F)cc1 ZINC000047459953 1404843880 /nfs/dbraw/zinc/84/38/80/1404843880.db2.gz FHOWTHMXBFPESC-PKTZIBPZSA-N 0 3 395.522 3.253 10 0 GGAEHN CCCOc1ccc(CNCc2ccc(NS(C)(=O)=O)cc2)cc1OC ZINC000047750974 1404920835 /nfs/dbraw/zinc/92/08/35/1404920835.db2.gz DOIMBVBUHGANJT-UHFFFAOYSA-N 0 3 378.494 3.145 10 0 GGAEHN COc1cccc(-c2n[nH]cc2CNCc2cccc(CN3CCOCC3)c2)c1 ZINC000048745615 1405279937 /nfs/dbraw/zinc/27/99/37/1405279937.db2.gz BOWWJXOEDGFMQW-UHFFFAOYSA-N 0 3 392.503 3.207 10 0 GGAEHN CS(=O)(=O)Cc1ccc(CNCc2cccc(OCc3ccccn3)c2)cc1 ZINC000048779876 1405291078 /nfs/dbraw/zinc/29/10/78/1405291078.db2.gz GMHUZWNCPSVPLR-UHFFFAOYSA-N 0 3 396.512 3.495 10 0 GGAEHN Cc1ccc([C@H](CNC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)N(C)C)cc1 ZINC000049407835 1405378554 /nfs/dbraw/zinc/37/85/54/1405378554.db2.gz FVQRDIOWFIWPCH-IRLDBZIGSA-N 0 3 393.531 3.384 10 0 GGAEHN C#CCN1CCC(C(=O)NC[C@H](c2c(F)cccc2Cl)N2CCCC2)CC1 ZINC000057170623 1407542704 /nfs/dbraw/zinc/54/27/04/1407542704.db2.gz BSEBCFQSLNVGSD-LJQANCHMSA-N 0 3 391.918 3.077 10 0 GGAEHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)[C@@H]1CCC(=O)N1Cc1ccccc1 ZINC000062075174 1408206817 /nfs/dbraw/zinc/20/68/17/1408206817.db2.gz DSZNANLKABQAPL-VXKWHMMOSA-N 0 3 391.515 3.131 10 0 GGAEHN CNS(=O)(=O)c1ccc([C@H](C)NCc2ccc(SC)c(OC)c2)cc1 ZINC000063916232 1408444855 /nfs/dbraw/zinc/44/48/55/1408444855.db2.gz GUFHOBRTNZDWLW-ZDUSSCGKSA-N 0 3 380.535 3.176 10 0 GGAEHN COc1ncccc1CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000064336174 1408536824 /nfs/dbraw/zinc/53/68/24/1408536824.db2.gz APGUCQBQYGJILX-IBGZPJMESA-N 0 3 393.409 3.161 10 0 GGAEHN COC(=O)Nc1ccc(CNC(=O)N2CCN(CC3CCCCC3)CC2)cc1 ZINC000065456669 1408672284 /nfs/dbraw/zinc/67/22/84/1408672284.db2.gz HHVQNXARTBTYEM-UHFFFAOYSA-N 0 3 388.512 3.272 10 0 GGAEHN COc1ccc(OC)c(CCNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c1 ZINC000065540299 1408685611 /nfs/dbraw/zinc/68/56/11/1408685611.db2.gz FXHIUGMZZXIBTB-FQEVSTJZSA-N 0 3 397.519 3.210 10 0 GGAEHN Fc1cccc([C@H](CNCc2cccc3c2OCCCO3)N2CCOCC2)c1 ZINC000066877227 1408939771 /nfs/dbraw/zinc/93/97/71/1408939771.db2.gz CXLADLLCTHEAOZ-FQEVSTJZSA-N 0 3 386.467 3.150 10 0 GGAEHN COc1ccccc1[C@H](C)NC(=O)[C@H](C)N1CCN(CC2CCCCC2)CC1 ZINC000067649315 1409198436 /nfs/dbraw/zinc/19/84/36/1409198436.db2.gz BGKMYJCDJJAYBE-OALUTQOASA-N 0 3 387.568 3.459 10 0 GGAEHN CN1CCN(C(=O)c2ccc(CNCc3ccccc3C(F)(F)F)cc2)CC1 ZINC000067668679 1409203327 /nfs/dbraw/zinc/20/33/27/1409203327.db2.gz ATJYZQDXDIMNQZ-UHFFFAOYSA-N 0 3 391.437 3.383 10 0 GGAEHN Cc1nccc(CNC(=O)N(CCN(C)C)Cc2ccc(C(F)(F)F)cc2)n1 ZINC000068364310 1409380956 /nfs/dbraw/zinc/38/09/56/1409380956.db2.gz DHCUZYIBSJRWCZ-UHFFFAOYSA-N 0 3 395.429 3.077 10 0 GGAEHN C[C@H](NC(=O)[C@H](C)N1CCC[C@H](C(=O)N(C)C)C1)c1cccc2ccccc21 ZINC000068970934 1409536084 /nfs/dbraw/zinc/53/60/84/1409536084.db2.gz HTFFEVNORTWHST-LNLFQRSKSA-N 0 3 381.520 3.206 10 0 GGAEHN CCOc1ccc(CN[C@@H](CN2CCN(C)CC2)c2ccccc2)cc1OC ZINC000069171345 1409580133 /nfs/dbraw/zinc/58/01/33/1409580133.db2.gz AYPYHKDMBHFHBL-NRFANRHFSA-N 0 3 383.536 3.172 10 0 GGAEHN CCOc1ccc(CN[C@H](CN2CCN(C)CC2)c2ccccc2)cc1OC ZINC000069171347 1409580273 /nfs/dbraw/zinc/58/02/73/1409580273.db2.gz AYPYHKDMBHFHBL-OAQYLSRUSA-N 0 3 383.536 3.172 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1cnn(-c2ccc(C)cc2)c1C(C)C ZINC000069505936 1409645278 /nfs/dbraw/zinc/64/52/78/1409645278.db2.gz GIIOFGQMXLKKHA-LJQANCHMSA-N 0 3 384.524 3.145 10 0 GGAEHN COc1ccc(CNCc2cccc(CN3CCOCC3)c2)cc1OC(F)F ZINC000069747616 1409690887 /nfs/dbraw/zinc/69/08/87/1409690887.db2.gz DZLLXEPQBYHLOU-UHFFFAOYSA-N 0 3 392.446 3.419 10 0 GGAEHN CN(C)CCn1c(=O)oc2ccc(NC(=O)[C@H]3C[C@@H]3c3ccc(F)cc3)cc21 ZINC000069918825 1409723488 /nfs/dbraw/zinc/72/34/88/1409723488.db2.gz AZMJGVXHIHPTLP-SJORKVTESA-N 0 3 383.423 3.037 10 0 GGAEHN Cc1nn(C)c(Cl)c1CNCc1ccc(CN2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000073803791 1409866002 /nfs/dbraw/zinc/86/60/02/1409866002.db2.gz DEUDOVRBMIMFRN-GJZGRUSLSA-N 0 3 376.932 3.281 10 0 GGAEHN C[C@H](C(=O)N1c2ccccc2CC[C@H]1C)N1CCC[C@H](Cc2nccn2C)C1 ZINC000090003866 1410060762 /nfs/dbraw/zinc/06/07/62/1410060762.db2.gz BXASEDOWLBMWTF-GUDVDZBRSA-N 0 3 380.536 3.431 10 0 GGAEHN Cn1ccnc1CC1CCN(Cc2cc(=O)oc3cc4c(cc23)CCC4)CC1 ZINC000095381586 1410310205 /nfs/dbraw/zinc/31/02/05/1410310205.db2.gz DVWJQTLLYGWHLC-UHFFFAOYSA-N 0 3 377.488 3.470 10 0 GGAEHN Cc1noc(C)c1CN1CC[C@]2(C1)COCc1cnc(-c3ccccc3)nc12 ZINC000096080381 1410322965 /nfs/dbraw/zinc/32/29/65/1410322965.db2.gz FAMMFKJWBNTCIB-QFIPXVFZSA-N 0 3 376.460 3.422 10 0 GGAEHN Cc1nc(-c2ccc(C(F)(F)F)cc2)ncc1C(=O)NCCN1CCCC1 ZINC000096323963 1410326923 /nfs/dbraw/zinc/32/69/23/1410326923.db2.gz JWLVENCKQZGDKA-UHFFFAOYSA-N 0 3 378.398 3.296 10 0 GGAEHN Cc1ccc(-n2c(CC(=O)NCCN3CCCCC3)c3[nH]cccc-3c2=O)cc1 ZINC000096386979 1410330287 /nfs/dbraw/zinc/33/02/87/1410330287.db2.gz RCJAZHWLQJBTOB-FQEVSTJZSA-N 0 3 392.503 3.084 10 0 GGAEHN CN(C)C[C@@H](NC(=O)/C=C\c1ccc(N2CCCC2=O)cc1)c1ccccc1 ZINC000096940658 1410338632 /nfs/dbraw/zinc/33/86/32/1410338632.db2.gz QMTWPFAIMSHBOL-OKULMJQMSA-N 0 3 377.488 3.246 10 0 GGAEHN CCc1ccc([C@@H](CNC(=O)/C=C\c2cc(C(=O)OC)c(C)o2)N(C)C)cc1 ZINC000096943727 1410339082 /nfs/dbraw/zinc/33/90/82/1410339082.db2.gz SCNMOAYTFDVQLY-ZCPJJFRWSA-N 0 3 384.476 3.369 10 0 GGAEHN CCCN(C(=O)NCCc1cnn(C)c1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000101793909 1410503362 /nfs/dbraw/zinc/50/33/62/1410503362.db2.gz DOXHEQORVFRHPK-NRFANRHFSA-N 0 3 383.540 3.049 10 0 GGAEHN CN(C)C[C@H](NC(=O)Nc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 ZINC000102796849 1410762284 /nfs/dbraw/zinc/76/22/84/1410762284.db2.gz RJZVZVWDYCBHSW-IBGZPJMESA-N 0 3 386.471 3.087 10 0 GGAEHN O[C@@H](CNCc1csc(Br)c1)COc1ccc(F)c(F)c1 ZINC000105499484 1411072720 /nfs/dbraw/zinc/07/27/20/1411072720.db2.gz AVWWBRZSWQYJCB-JTQLQIEISA-N 0 3 378.238 3.318 10 0 GGAEHN O[C@H](CNCc1cnn(-c2ccc(Cl)cc2)c1)COc1ccc(F)c(F)c1 ZINC000105499324 1411072748 /nfs/dbraw/zinc/07/27/48/1411072748.db2.gz CMSVYUDNXBLFFL-MRXNPFEDSA-N 0 3 393.821 3.333 10 0 GGAEHN CCN1CCN([C@@H]2CCN([C@@H](C)c3nnc(-c4cccc(Cl)c4)o3)C2)CC1 ZINC000107371227 1411366357 /nfs/dbraw/zinc/36/63/57/1411366357.db2.gz HGWHMSBXQWYDCN-MAUKXSAKSA-N 0 3 389.931 3.163 10 0 GGAEHN CCn1c2ccccc2c2cc(CN[C@H]3CCCN(S(C)(=O)=O)C3)ccc21 ZINC000109310246 1411737767 /nfs/dbraw/zinc/73/77/67/1411737767.db2.gz AUFFNQBQLADZQA-KRWDZBQOSA-N 0 3 385.533 3.328 10 0 GGAEHN C[C@@H](C(=O)Nc1ncccn1)N1CCN(CCC23CC4CC(CC(C4)C2)C3)CC1 ZINC000112202426 1412092944 /nfs/dbraw/zinc/09/29/44/1412092944.db2.gz AMSBEALIUFJNQE-JLEDNIFVSA-N 0 3 397.567 3.028 10 0 GGAEHN CCc1cc(N2CCC[C@@H](NCc3cc(OC)ccc3OC(F)F)C2)ncn1 ZINC000112710396 1412201041 /nfs/dbraw/zinc/20/10/41/1412201041.db2.gz ABCSBFHOAYCPBB-MRXNPFEDSA-N 0 3 392.450 3.408 10 0 GGAEHN CCc1cc(N2CCC[C@H](NCc3cc(OC)ccc3OC(F)F)C2)ncn1 ZINC000112710395 1412201115 /nfs/dbraw/zinc/20/11/15/1412201115.db2.gz ABCSBFHOAYCPBB-INIZCTEOSA-N 0 3 392.450 3.408 10 0 GGAEHN COc1ccc(CNC[C@@H]2CN(Cc3ccccc3)CCO2)c(OC(F)F)c1 ZINC000114758311 1412521200 /nfs/dbraw/zinc/52/12/00/1412521200.db2.gz GJLJOMZTHGWXEZ-LJQANCHMSA-N 0 3 392.446 3.287 10 0 GGAEHN COc1cccc([C@@H](O)CN2CCC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)c1 ZINC000115539232 1412703883 /nfs/dbraw/zinc/70/38/83/1412703883.db2.gz FAWNOOHQEDSVGP-LPHOPBHVSA-N 0 3 378.513 3.308 10 0 GGAEHN CN(C)C(=O)COc1ccccc1CNC[C@@H](O)c1ccc(C(C)(C)C)cc1 ZINC000116368965 1412852820 /nfs/dbraw/zinc/85/28/20/1412852820.db2.gz CRCUTBRDQNZEIZ-HXUWFJFHSA-N 0 3 384.520 3.274 10 0 GGAEHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@H](C)[C@H]3CCOC3)c2)cc1 ZINC000121696637 1414226977 /nfs/dbraw/zinc/22/69/77/1414226977.db2.gz FFJTWDQEDQLISI-WBVHZDCISA-N 0 3 390.505 3.011 10 0 GGAEHN CC[C@H](COC)[NH2+]Cc1cccc([N-]S(=O)(=O)c2ccc(OC)cc2)c1 ZINC000121728069 1414238624 /nfs/dbraw/zinc/23/86/24/1414238624.db2.gz AGJSDSSFGGFZEP-MRXNPFEDSA-N 0 3 378.494 3.011 10 0 GGAEHN COC[C@@H]([NH2+]Cc1cccc([N-]S(=O)(=O)c2ccc(OC)cc2)c1)C1CC1 ZINC000121733775 1414239929 /nfs/dbraw/zinc/23/99/29/1414239929.db2.gz GPOHZUUCFRYLCX-HXUWFJFHSA-N 0 3 390.505 3.011 10 0 GGAEHN Cc1cnn([C@@H]2CCCN(Cc3ccccc3OCC(=O)N3CCCC3)C2)c1 ZINC000123081732 1414636265 /nfs/dbraw/zinc/63/62/65/1414636265.db2.gz GXMXEVROVMEOBT-HXUWFJFHSA-N 0 3 382.508 3.030 10 0 GGAEHN CC(C)N1CCN(c2ccc(C(=O)N3CC[C@H](C)[C@@H](n4ccnc4)C3)cc2)CC1 ZINC000123407482 1414721240 /nfs/dbraw/zinc/72/12/40/1414721240.db2.gz CTDPOZHFPCWLHQ-UGKGYDQZSA-N 0 3 395.551 3.137 10 0 GGAEHN C[C@H](NC(=O)[C@H](C)N1CCN(C2CCOCC2)CC1)c1cccc2ccccc21 ZINC000177746193 1428848961 /nfs/dbraw/zinc/84/89/61/1428848961.db2.gz BWOBULZMYWXMMV-OALUTQOASA-N 0 3 395.547 3.202 10 0 GGAEHN COC(=O)Nc1ccc(CNC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1 ZINC000125103726 1415109519 /nfs/dbraw/zinc/10/95/19/1415109519.db2.gz DYKNOFKXBNPXPC-OXQOHEQNSA-N 0 3 396.491 3.327 10 0 GGAEHN CCC(=O)N1CC[C@@H](NCc2cn(-c3ccc(Br)cc3)nc2C)C1 ZINC000126743421 1415544452 /nfs/dbraw/zinc/54/44/52/1415544452.db2.gz FQYROXGGVZWXHB-MRXNPFEDSA-N 0 3 391.313 3.044 10 0 GGAEHN COC(=O)c1ccc(OCCN2CC[C@H](C)[C@@H](n3ccnc3)C2)c(Cl)c1 ZINC000129838055 1416271751 /nfs/dbraw/zinc/27/17/51/1416271751.db2.gz GSYSBSUEBLWKAB-YOEHRIQHSA-N 0 3 377.872 3.285 10 0 GGAEHN CN(C[C@@H]1CCCCO1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000130689611 1416425371 /nfs/dbraw/zinc/42/53/71/1416425371.db2.gz AWVOYMRDZODBAR-IBGZPJMESA-N 0 3 377.554 3.311 10 0 GGAEHN C[C@H](NCc1ccc(N2CCCC2)nc1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000131228407 1416526710 /nfs/dbraw/zinc/52/67/10/1416526710.db2.gz GFUVDFRENIRKPD-KRWDZBQOSA-N 0 3 394.519 3.190 10 0 GGAEHN C[C@@H](N[C@H]1CCCC[C@@H]1C(N)=O)C(=O)Nc1ccccc1Cc1ccccc1 ZINC000131239804 1416528452 /nfs/dbraw/zinc/52/84/52/1416528452.db2.gz BQVVCGWGOAFKAC-PBEJRMEISA-N 0 3 379.504 3.238 10 0 GGAEHN COCCOc1ccc([C@@H](C)NCc2cccc(CS(C)(=O)=O)c2)cc1 ZINC000131587552 1416580499 /nfs/dbraw/zinc/58/04/99/1416580499.db2.gz HCBSTNJBBKTHOE-MRXNPFEDSA-N 0 3 377.506 3.107 10 0 GGAEHN CN1CCN(c2ncc(CN[C@@H](Cc3ccccc3)c3ccccc3)cn2)CC1 ZINC000133596768 1416915399 /nfs/dbraw/zinc/91/53/99/1416915399.db2.gz BKZGAEFKBMDEPJ-QHCPKHFHSA-N 0 3 387.531 3.302 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)Nc3ccc(Br)nc3)cc2)CC1 ZINC000133940023 1416999229 /nfs/dbraw/zinc/99/92/29/1416999229.db2.gz OJEHMFBVJQZALY-UHFFFAOYSA-N 0 3 389.297 3.238 10 0 GGAEHN Cc1cccc(-c2cccc(CNCc3cnc(N4CCN(C)CC4)nc3)c2)c1 ZINC000134270374 1417047716 /nfs/dbraw/zinc/04/77/16/1417047716.db2.gz DJDHZQKTGKFFFH-UHFFFAOYSA-N 0 3 387.531 3.494 10 0 GGAEHN CCC1CCC(N(C(=O)NCCCN2CCC[C@H]2C(=O)N(C)C)C2CC2)CC1 ZINC000138415795 1417413498 /nfs/dbraw/zinc/41/34/98/1417413498.db2.gz ADJKXRRJDMKMNC-QLOJAFMTSA-N 0 3 392.588 3.072 10 0 GGAEHN C[C@@H](NC(=O)[C@@H](C)N1CCN(C[C@@H]2CCOC2)CC1)c1cccc2ccccc21 ZINC000178831537 1429186227 /nfs/dbraw/zinc/18/62/27/1429186227.db2.gz FQOSTXVUTLBGMM-AQNXPRMDSA-N 0 3 395.547 3.060 10 0 GGAEHN CC(C)(C)OC(=O)N1CCC[C@H](Nc2ccccc2CN2CCC(O)CC2)C1 ZINC000179599281 1429463984 /nfs/dbraw/zinc/46/39/84/1429463984.db2.gz AKCBZPVJPVWSAK-SFHVURJKSA-N 0 3 389.540 3.455 10 0 GGAEHN O[C@@H](CNCc1cnn(Cc2ccccc2)c1)c1cc(Cl)c2c(c1)OCCO2 ZINC000152969674 1422312134 /nfs/dbraw/zinc/31/21/34/1422312134.db2.gz HHPIJKQAWZOXJX-IBGZPJMESA-N 0 3 399.878 3.179 10 0 GGAEHN Cc1cn2c(CNC[C@@H](O)c3cc(Cl)c4c(c3)OCCO4)c(C)nc2s1 ZINC000152984718 1422317209 /nfs/dbraw/zinc/31/72/09/1422317209.db2.gz BUDKJURLKHIIPB-OAHLLOKOSA-N 0 3 393.896 3.260 10 0 GGAEHN CN(CC(=O)N[C@@H](c1cccs1)c1ccc(F)cc1)CC1CCOCC1 ZINC000155898540 1423584513 /nfs/dbraw/zinc/58/45/13/1423584513.db2.gz DJPOLCMFEXDAGN-HXUWFJFHSA-N 0 3 376.497 3.451 10 0 GGAEHN CCOC(=O)c1cc(CC)sc1NC(=O)[C@H](C)N(C)CC1CCOCC1 ZINC000156180381 1423709195 /nfs/dbraw/zinc/70/91/95/1423709195.db2.gz HBUXQXVXRCETSY-ZDUSSCGKSA-N 0 3 382.526 3.173 10 0 GGAEHN O[C@H](CNCc1ccc(OC(F)F)c(F)c1)COc1ccc(F)c(F)c1 ZINC000168267332 1425236462 /nfs/dbraw/zinc/23/64/62/1425236462.db2.gz HGIRDZPTFNWBCS-LLVKDONJSA-N 0 3 377.309 3.235 10 0 GGAEHN COc1cccc(CC(=O)N2Cc3ccccc3OC3(CCN(C)CC3)C2)c1 ZINC000169774522 1425253565 /nfs/dbraw/zinc/25/35/65/1425253565.db2.gz WAFBUEXWNGVOEF-UHFFFAOYSA-N 0 3 380.488 3.123 10 0 GGAEHN COc1ccc(OC[C@H](O)CNC2(c3ccc(Br)cc3)CC2)cc1 ZINC000170871905 1425375866 /nfs/dbraw/zinc/37/58/66/1425375866.db2.gz KFKXFFFHTZVLSA-MRXNPFEDSA-N 0 3 392.293 3.476 10 0 GGAEHN CCCN(C(=O)NCc1ccnc(C)n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000171017293 1425438673 /nfs/dbraw/zinc/43/86/73/1425438673.db2.gz AILWCMUIYQLHRT-OAQYLSRUSA-N 0 3 381.524 3.371 10 0 GGAEHN Cc1ccc([C@@H](CNC(=O)N(C)[C@@H](C)CNC(=O)OC(C)(C)C)N(C)C)cc1 ZINC000171904952 1425848291 /nfs/dbraw/zinc/84/82/91/1425848291.db2.gz ALFZZYWAFVJTFJ-FUHWJXTLSA-N 0 3 392.544 3.152 10 0 GGAEHN CN(C)Cc1ccc(N2CCN(C(=O)c3ccc(-c4ccccc4)[nH]3)CC2)nc1 ZINC000172223770 1425953991 /nfs/dbraw/zinc/95/39/91/1425953991.db2.gz NGHMOCYVBDAGNB-UHFFFAOYSA-N 0 3 389.503 3.101 10 0 GGAEHN CN(C(=O)c1ccc(-c2ncon2)cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000173713424 1426829072 /nfs/dbraw/zinc/82/90/72/1426829072.db2.gz KVWOUQLYMIPFDH-HXUWFJFHSA-N 0 3 376.460 3.473 10 0 GGAEHN COCCOC[C@H]1CCN([C@H](C)C(=O)N[C@H](C)c2cccc3ccccc32)C1 ZINC000173734837 1426834622 /nfs/dbraw/zinc/83/46/22/1426834622.db2.gz DDMPIJLSUFZACG-QRVBRYPASA-N 0 3 384.520 3.390 10 0 GGAEHN COc1cccc(CNC(=O)[C@H](C)N[C@@H](C)c2ccc(-n3cccn3)cc2)c1 ZINC000174368759 1427124054 /nfs/dbraw/zinc/12/40/54/1427124054.db2.gz GPKLCWUEVNEDFN-IRXDYDNUSA-N 0 3 378.476 3.236 10 0 GGAEHN C[C@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)NCCc1ccc(F)cc1 ZINC000174373316 1427126185 /nfs/dbraw/zinc/12/61/85/1427126185.db2.gz DKLQKSOWLJWJDS-IRXDYDNUSA-N 0 3 380.467 3.409 10 0 GGAEHN C[C@@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)NCCc1ccc(F)cc1 ZINC000174373343 1427126274 /nfs/dbraw/zinc/12/62/74/1427126274.db2.gz DKLQKSOWLJWJDS-DLBZAZTESA-N 0 3 380.467 3.409 10 0 GGAEHN Cc1nc(SCCC(=O)Nc2cccc(CN3CCSCC3)c2C)n[nH]1 ZINC000174675641 1427303733 /nfs/dbraw/zinc/30/37/33/1427303733.db2.gz BDHROBHGHZZBGJ-UHFFFAOYSA-N 0 3 391.566 3.091 10 0 GGAEHN C[C@H](NC(=O)NCCN(C)Cc1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000175816397 1427908561 /nfs/dbraw/zinc/90/85/61/1427908561.db2.gz CWVXILXZYBESKJ-SFHVURJKSA-N 0 3 377.492 3.365 10 0 GGAEHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)[C@H]1COc2ccccc2C1 ZINC000175900759 1427959663 /nfs/dbraw/zinc/95/96/63/1427959663.db2.gz AZGIGHITARESNV-HXUWFJFHSA-N 0 3 380.488 3.081 10 0 GGAEHN O=C(NCc1ccccc1CN1CCC(O)CC1)N[C@H]1C[C@H]1c1cccc(F)c1 ZINC000176019604 1428030163 /nfs/dbraw/zinc/03/01/63/1428030163.db2.gz DTOIEOSIMUDKSH-VXKWHMMOSA-N 0 3 397.494 3.138 10 0 GGAEHN O=C(NCc1ccccc1CN1CCC(O)CC1)N[C@@H]1C[C@@H]1c1cccc(F)c1 ZINC000176019564 1428030220 /nfs/dbraw/zinc/03/02/20/1428030220.db2.gz DTOIEOSIMUDKSH-FGZHOGPDSA-N 0 3 397.494 3.138 10 0 GGAEHN COc1ccccc1[C@H](C)NC(=O)CN[C@@H](C)c1ccc(-n2cccn2)cc1 ZINC000180845994 1430067035 /nfs/dbraw/zinc/06/70/35/1430067035.db2.gz GJFPKASTSZIASF-IRXDYDNUSA-N 0 3 378.476 3.409 10 0 GGAEHN C[C@@H](N[C@@H](C)C(=O)NC(=O)NCC(F)(F)F)c1ccc(-c2ccncc2)cc1 ZINC000180903352 1430099502 /nfs/dbraw/zinc/09/95/02/1430099502.db2.gz HSBDDZAHWLXNKE-OLZOCXBDSA-N 0 3 394.397 3.176 10 0 GGAEHN Cn1cc([C@@H](NCCCN2C(=O)COc3ccccc32)c2cccc(F)c2)cn1 ZINC000180919269 1430114551 /nfs/dbraw/zinc/11/45/51/1430114551.db2.gz CGXWGVNQZTWVIN-QFIPXVFZSA-N 0 3 394.450 3.054 10 0 GGAEHN CC(C)(C)OC(=O)N1CC[C@@H](N[C@@H](CO)c2cccc(Br)c2)C1 ZINC000182619399 1430503870 /nfs/dbraw/zinc/50/38/70/1430503870.db2.gz GDJMHVVSDGQPKJ-CABCVRRESA-N 0 3 385.302 3.082 10 0 GGAEHN Cc1cnc(C(C)(C)N[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)s1 ZINC000183921997 1430813677 /nfs/dbraw/zinc/81/36/77/1430813677.db2.gz CHQJBEISDTWZND-AEFFLSMTSA-N 0 3 386.565 3.055 10 0 GGAEHN COc1ccc(CN2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)[C@H]3C2)c(OC)c1 ZINC000184240955 1430861137 /nfs/dbraw/zinc/86/11/37/1430861137.db2.gz UVIYBWXVIVPXMZ-WBAXXEDZSA-N 0 3 376.497 3.439 10 0 GGAEHN [O-]c1ccc2cc(Br)ccc2c1C[N@@H+]1CCO[C@@]2(CCOC2)C1 ZINC000184292185 1430869264 /nfs/dbraw/zinc/86/92/64/1430869264.db2.gz PJEZUUZZHCKORM-SFHVURJKSA-N 0 3 378.266 3.299 10 0 GGAEHN [O-]c1ccc2cc(Br)ccc2c1C[N@H+]1CCO[C@@]2(CCOC2)C1 ZINC000184292185 1430869265 /nfs/dbraw/zinc/86/92/65/1430869265.db2.gz PJEZUUZZHCKORM-SFHVURJKSA-N 0 3 378.266 3.299 10 0 GGAEHN COc1ccc(C[C@@H](C)C[NH2+][C@@H](c2nc(-c3nc[n-]n3)no2)C(C)C)cc1F ZINC000185307004 1431107900 /nfs/dbraw/zinc/10/79/00/1431107900.db2.gz CVJIXAKMVRKPML-MLGOLLRUSA-N 0 3 388.447 3.168 10 0 GGAEHN CCOC(=O)c1nn(C)cc1CNC[C@@H]1CCN(c2cc(Cl)ccc2C)C1 ZINC000186332369 1431385160 /nfs/dbraw/zinc/38/51/60/1431385160.db2.gz DOKZYIGWCYNJHS-HNNXBMFYSA-N 0 3 390.915 3.175 10 0 GGAEHN CCOc1cc(CN2CC[C@H](O)[C@H](C)C2)ccc1OCC(=O)Nc1ccccc1 ZINC000190060583 1432312786 /nfs/dbraw/zinc/31/27/86/1432312786.db2.gz FOTVEOLOBUYTTH-XLIONFOSSA-N 0 3 398.503 3.306 10 0 GGAEHN FC(F)(F)c1ccc(N2CCN(CC3CCC4(CC3)OCCO4)CC2)nc1 ZINC000190170409 1432332959 /nfs/dbraw/zinc/33/29/59/1432332959.db2.gz CLNCNQALNXBSGS-UHFFFAOYSA-N 0 3 385.430 3.156 10 0 GGAEHN Cc1cc(C)c(N2CC[C@H](N3CCC(Cc4nccn4C)CC3)C2=O)c(C)c1 ZINC000190525918 1432397989 /nfs/dbraw/zinc/39/79/89/1432397989.db2.gz VTPWFQSSYRVNPH-FQEVSTJZSA-N 0 3 380.536 3.405 10 0 GGAEHN COc1cc(C)cc(CNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c1 ZINC000190607633 1432418922 /nfs/dbraw/zinc/41/89/22/1432418922.db2.gz FMAKSIKJPBZGIR-JOCHJYFZSA-N 0 3 397.519 3.094 10 0 GGAEHN COc1ccc2nc(C(=O)N3CC[C@H](CN(C)Cc4cccnc4)C3)ccc2c1 ZINC000190649931 1432430495 /nfs/dbraw/zinc/43/04/95/1432430495.db2.gz FWYIKIKUAAIIQU-GOSISDBHSA-N 0 3 390.487 3.233 10 0 GGAEHN COc1ccc2nc(C(=O)N3CC[C@@H](CN(C)Cc4cccnc4)C3)ccc2c1 ZINC000190649905 1432430767 /nfs/dbraw/zinc/43/07/67/1432430767.db2.gz FWYIKIKUAAIIQU-SFHVURJKSA-N 0 3 390.487 3.233 10 0 GGAEHN COc1ccc2c(c1)CCN2C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000190861130 1432511713 /nfs/dbraw/zinc/51/17/13/1432511713.db2.gz FSVQFCLYWMTCLL-NRFANRHFSA-N 0 3 395.503 3.058 10 0 GGAEHN COc1ccc(OC[C@H](O)CN2CCC(Oc3ccc(F)cc3F)CC2)cc1 ZINC000193671193 1433037596 /nfs/dbraw/zinc/03/75/96/1433037596.db2.gz ZDSQFKZLYJTMRF-MRXNPFEDSA-N 0 3 393.430 3.257 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)[C@@H]1CCCCC(=O)N1)c1ccc(C(F)(F)F)cc1 ZINC000193921869 1433084940 /nfs/dbraw/zinc/08/49/40/1433084940.db2.gz HKBAEDFNCQRKGG-DLBZAZTESA-N 0 3 399.457 3.263 10 0 GGAEHN CN(C)c1noc([C@H]2CCCN(Cc3ccccc3OCc3cccnc3)C2)n1 ZINC000194937777 1433268360 /nfs/dbraw/zinc/26/83/60/1433268360.db2.gz LRNQGJCSHQMEFT-IBGZPJMESA-N 0 3 393.491 3.489 10 0 GGAEHN CN(C)c1noc([C@@H]2CCCN(Cc3ccccc3OCc3cccnc3)C2)n1 ZINC000194937761 1433268569 /nfs/dbraw/zinc/26/85/69/1433268569.db2.gz LRNQGJCSHQMEFT-LJQANCHMSA-N 0 3 393.491 3.489 10 0 GGAEHN c1csc(-c2nc(CNC[C@@]3(N4CCOCC4)CCSC3)cs2)c1 ZINC000236702016 1433376537 /nfs/dbraw/zinc/37/65/37/1433376537.db2.gz CXYQSWJECFBNHX-KRWDZBQOSA-N 0 3 381.592 3.169 10 0 GGAEHN CC1CCN([C@H](CNC(=O)[C@H]2Cc3ccccc3CN2)c2cccs2)CC1 ZINC000236730690 1433377275 /nfs/dbraw/zinc/37/72/75/1433377275.db2.gz CMMJCEUMRGWZLR-WOJBJXKFSA-N 0 3 383.561 3.352 10 0 GGAEHN CN(C)C(=O)c1ccc(CNC[C@H](c2c(F)cccc2Cl)N2CCCC2)[nH]1 ZINC000237066887 1433387712 /nfs/dbraw/zinc/38/77/12/1433387712.db2.gz DFLLUTDLVKDVEG-GOSISDBHSA-N 0 3 392.906 3.436 10 0 GGAEHN COc1ccc(-c2n[nH]cc2CNCc2ccccc2CN2CCCC2=O)cc1 ZINC000237377355 1433399743 /nfs/dbraw/zinc/39/97/43/1433399743.db2.gz BTEIVGMYDVAGNV-UHFFFAOYSA-N 0 3 390.487 3.498 10 0 GGAEHN COc1ccc([C@@H](CNCc2c(Cl)nc3ccccn32)N(C)C)cc1OC ZINC000237493859 1433406288 /nfs/dbraw/zinc/40/62/88/1433406288.db2.gz DQJHRNHASOAIFH-OAHLLOKOSA-N 0 3 388.899 3.397 10 0 GGAEHN C[C@H](NCc1cccc2c1OCCO2)c1cc(F)ccc1N1CCN(C)CC1 ZINC000237497431 1433406542 /nfs/dbraw/zinc/40/65/42/1433406542.db2.gz AVNOMVBJDAUOCG-INIZCTEOSA-N 0 3 385.483 3.200 10 0 GGAEHN CCN1CCN(c2ccc(NS(=O)(=O)c3ccc(F)cc3C)cc2)CC1 ZINC000243357877 1433449261 /nfs/dbraw/zinc/44/92/61/1433449261.db2.gz LYPTZFVNMYTBFW-UHFFFAOYSA-N 0 3 377.485 3.077 10 0 GGAEHN COC(=O)c1ccccc1NC(=S)NC1CCN(Cc2ccccc2)CC1 ZINC000244281795 1433452413 /nfs/dbraw/zinc/45/24/13/1433452413.db2.gz WUMWZRAISKVJRS-UHFFFAOYSA-N 0 3 383.517 3.424 10 0 GGAEHN COCCOC[C@@H]1CCN([C@H](C)C(=O)N[C@H](C)c2cccc3ccccc32)C1 ZINC000245436052 1433467305 /nfs/dbraw/zinc/46/73/05/1433467305.db2.gz DDMPIJLSUFZACG-GUDVDZBRSA-N 0 3 384.520 3.390 10 0 GGAEHN COC(=O)c1ccc(OCCN2CC[C@H](C)[C@H](n3ccnc3)C2)c(Cl)c1 ZINC000245571536 1433486821 /nfs/dbraw/zinc/48/68/21/1433486821.db2.gz GSYSBSUEBLWKAB-WMLDXEAASA-N 0 3 377.872 3.285 10 0 GGAEHN CN(C)[C@H](CNC(=O)[C@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1)c1ccccc1 ZINC000246743951 1433658648 /nfs/dbraw/zinc/65/86/48/1433658648.db2.gz FMUKPAREIBOHCT-IPMKNSEASA-N 0 3 389.540 3.489 10 0 GGAEHN CN(C)[C@H](CNC(=O)[C@@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1)c1ccccc1 ZINC000246743927 1433658675 /nfs/dbraw/zinc/65/86/75/1433658675.db2.gz FMUKPAREIBOHCT-GUDVDZBRSA-N 0 3 389.540 3.489 10 0 GGAEHN C[C@H](C(=O)N[C@@H](C)c1cccc2ccccc21)N1CCN(C[C@H]2CCOC2)CC1 ZINC000246900728 1433685046 /nfs/dbraw/zinc/68/50/46/1433685046.db2.gz FQOSTXVUTLBGMM-XUVXKRRUSA-N 0 3 395.547 3.060 10 0 GGAEHN COC(=O)c1ccc(CN2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)[C@@H]3C2)s1 ZINC000248556388 1433808305 /nfs/dbraw/zinc/80/83/05/1433808305.db2.gz BMGWOFFHHCPJGU-CFVMTHIKSA-N 0 3 380.510 3.270 10 0 GGAEHN COc1c(C)cnc(CN2C[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)[C@@H]3C2)c1C ZINC000248598632 1433810391 /nfs/dbraw/zinc/81/03/91/1433810391.db2.gz NENDYIDOMYQCIY-GVDBMIGSSA-N 0 3 375.513 3.442 10 0 GGAEHN COc1ccc(CN2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)[C@@H]3C2)c(OC)c1 ZINC000248650849 1433813731 /nfs/dbraw/zinc/81/37/31/1433813731.db2.gz UVIYBWXVIVPXMZ-QGTPRVQTSA-N 0 3 376.497 3.439 10 0 GGAEHN Cc1ccc([C@H](CNC(=O)N[C@@H]2c3ccccc3C[C@H]2O)N2CCCC2)cc1 ZINC000250425001 1433856123 /nfs/dbraw/zinc/85/61/23/1433856123.db2.gz FNAYSFMHLXQBKL-BHDDXSALSA-N 0 3 379.504 3.089 10 0 GGAEHN CCO[C@H](O)[C@@H]1N[C@H](c2ccc(Cl)cc2)C([N+](=O)[O-])[C@H]1c1ccccc1 ZINC000252627423 1433863543 /nfs/dbraw/zinc/86/35/43/1433863543.db2.gz RTTHNEXNTOBPTG-JKEDJMADSA-N 0 3 376.840 3.137 10 0 GGAEHN CCOc1ccc(-c2n[nH]cc2CN2CCC3(CC2)C[C@](C)(O)CCO3)cc1 ZINC000257175461 1433893473 /nfs/dbraw/zinc/89/34/73/1433893473.db2.gz PFRDCXYIKVEVPR-OAQYLSRUSA-N 0 3 385.508 3.371 10 0 GGAEHN CN(Cc1cccc(F)c1F)[C@@H]1CCc2nnc(C3CCOCC3)n2CC1 ZINC000257177528 1433893640 /nfs/dbraw/zinc/89/36/40/1433893640.db2.gz WZEPDCOPDUMPEE-MRXNPFEDSA-N 0 3 376.451 3.287 10 0 GGAEHN CN(C)Cc1ccc(-c2noc(CN3C(=O)CSc4ccccc43)n2)cc1 ZINC000267091394 1434406848 /nfs/dbraw/zinc/40/68/48/1434406848.db2.gz SOSAJXZSCBMIJZ-UHFFFAOYSA-N 0 3 380.473 3.437 10 0 GGAEHN CN(C)CCn1cc(NC(=O)C[C@H](c2ccccc2)C(F)(F)F)ccc1=O ZINC000270057795 1434697821 /nfs/dbraw/zinc/69/78/21/1434697821.db2.gz DQQMPZCKYSAPIW-MRXNPFEDSA-N 0 3 381.398 3.085 10 0 GGAEHN CC(=O)Nc1ccc([O-])c(C(=O)N(C)CCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000271305121 1434814660 /nfs/dbraw/zinc/81/46/60/1434814660.db2.gz HLCHGLYEFTVOHR-UHFFFAOYSA-N 0 3 396.491 3.124 10 0 GGAEHN CN(C)CCn1cc(NC(=O)c2ccc(Cl)cc2C(F)(F)F)ccc1=O ZINC000274566924 1435078463 /nfs/dbraw/zinc/07/84/63/1435078463.db2.gz AEUPQXHLJLVYBR-UHFFFAOYSA-N 0 3 387.789 3.334 10 0 GGAEHN COc1ccccc1S(=O)(=O)CCCN1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@H]1O ZINC000281293767 1435802778 /nfs/dbraw/zinc/80/27/78/1435802778.db2.gz HAXIHVMZHHDAKI-FCGDIQPGSA-N 0 3 395.565 3.121 10 0 GGAEHN Cc1nc(-c2ccc(C(=O)Nc3ccc(=O)n(CCN(C)C)c3)cc2)cs1 ZINC000281567303 1435813787 /nfs/dbraw/zinc/81/37/87/1435813787.db2.gz DBMHAGQOFYVUMD-UHFFFAOYSA-N 0 3 382.489 3.094 10 0 GGAEHN Cn1c2ccc(C(F)(F)F)cc2nc1CNC1(CO)Cc2ccccc2C1 ZINC000553790172 1126096994 /nfs/dbraw/zinc/09/69/94/1126096994.db2.gz OJZWNDNZSIZWQN-UHFFFAOYSA-N 0 3 375.394 3.212 10 0 GGAEHN COC(=O)c1ccccc1-c1ccc(CNC2(CO)Cc3ccccc3C2)o1 ZINC000482223580 1126094904 /nfs/dbraw/zinc/09/49/04/1126094904.db2.gz OHBFDPJTCUUPGJ-UHFFFAOYSA-N 0 3 377.440 3.353 10 0 GGAEHN Cc1nn(-c2ccncc2)cc1CN[C@@H](Cc1ccccc1)[C@H](O)C(F)(F)F ZINC000680121100 1126105661 /nfs/dbraw/zinc/10/56/61/1126105661.db2.gz QYMJUBHYXDSRSS-OALUTQOASA-N 0 3 390.409 3.200 10 0 GGAEHN C[C@H](O)c1ncc(CN[C@](C)(CO)Cc2ccc(Br)cc2)s1 ZINC000865714888 1126114671 /nfs/dbraw/zinc/11/46/71/1126114671.db2.gz FUKJNROBMGXHRG-ZBEGNZNMSA-N 0 3 385.327 3.042 10 0 GGAEHN CC(C)(C)OC(=O)N1CC[C@H](NCc2cnc(-c3cccs3)s2)[C@H](O)C1 ZINC000865745652 1126116060 /nfs/dbraw/zinc/11/60/60/1126116060.db2.gz GKCROXWFKCMBPX-UONOGXRCSA-N 0 3 395.550 3.332 10 0 GGAEHN CC(C)(C)OC(=O)N1CC[C@@H](NCc2cnc(-c3cccs3)s2)[C@@H](O)C1 ZINC000865745650 1126116068 /nfs/dbraw/zinc/11/60/68/1126116068.db2.gz GKCROXWFKCMBPX-KGLIPLIRSA-N 0 3 395.550 3.332 10 0 GGAEHN COC(=O)c1cc(CN[C@@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)ccc1C ZINC001308035469 1126162270 /nfs/dbraw/zinc/16/22/70/1126162270.db2.gz QJUXDOQESXIZCS-ZWKOTPCHSA-N 0 3 381.394 3.406 10 0 GGAEHN C[C@@](CO)(Cc1ccccc1F)[NH2+]Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC001460858439 1126192405 /nfs/dbraw/zinc/19/24/05/1126192405.db2.gz BVCLTZPAJFGEKG-NRFANRHFSA-N 0 3 381.407 3.304 10 0 GGAEHN C[C@](CO)(Cc1ccccc1F)[NH2+]Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC001460858441 1126192416 /nfs/dbraw/zinc/19/24/16/1126192416.db2.gz BVCLTZPAJFGEKG-OAQYLSRUSA-N 0 3 381.407 3.304 10 0 GGAEHN CCCc1cnc(NCCNC[C@H](O)COc2ccc(Cl)c(Cl)c2)nc1 ZINC000004299544 204037057 /nfs/dbraw/zinc/03/70/57/204037057.db2.gz KYRVIANWYTYSDU-AWEZNQCLSA-N 0 3 399.322 3.177 10 0 GGAEHN CCOC(=O)N1CCC(N(CCN(C)C)C(=S)Nc2ccccc2F)CC1 ZINC000004710309 204067936 /nfs/dbraw/zinc/06/79/36/204067936.db2.gz RMBCTIZSTJLMOU-UHFFFAOYSA-N 0 3 396.532 3.007 10 0 GGAEHN CCOC(=O)N1CCC(N(CCN(C)C)C(=S)Nc2cccc(F)c2)CC1 ZINC000004688358 204064059 /nfs/dbraw/zinc/06/40/59/204064059.db2.gz HOKKOMDVTIXAFG-UHFFFAOYSA-N 0 3 396.532 3.007 10 0 GGAEHN CCOc1ccc(CN(C)C[C@@H](O)COCc2ccc(OC)cc2)cc1OC ZINC000006787514 204205713 /nfs/dbraw/zinc/20/57/13/204205713.db2.gz DUAQFJCCMHHOJY-LJQANCHMSA-N 0 3 389.492 3.112 10 0 GGAEHN C[C@H](OC[C@@H](O)CNC[C@@H]1COc2ccccc2O1)c1ccc(Cl)cc1 ZINC000006865265 204215756 /nfs/dbraw/zinc/21/57/56/204215756.db2.gz PDLJMIAOCAFJQW-JCGIZDLHSA-N 0 3 377.868 3.208 10 0 GGAEHN CCOC(=O)[C@@H]1CCCN(C[C@@H](O)COc2ccc(OC)cc2C(C)(C)C)C1 ZINC000006576722 204185423 /nfs/dbraw/zinc/18/54/23/204185423.db2.gz WATXPUBQTSDBQD-IAGOWNOFSA-N 0 3 393.524 3.008 10 0 GGAEHN COC(=O)c1ccc(C(=O)OC)c(NC(=O)CN[C@H](c2ccccc2)C(C)C)c1 ZINC000008002634 204257833 /nfs/dbraw/zinc/25/78/33/204257833.db2.gz WMDDXAIPUKXERR-FQEVSTJZSA-N 0 3 398.459 3.185 10 0 GGAEHN COCCN(CCOC)C[C@H](O)CO[C@H](c1ccccc1)c1ccccc1C ZINC000006940295 204226805 /nfs/dbraw/zinc/22/68/05/204226805.db2.gz CNHBVPIBRBYILG-JTHBVZDNSA-N 0 3 387.520 3.057 10 0 GGAEHN COC(=O)c1ccc(C(=O)OC)c(NC(=O)CN[C@@H](c2ccccc2)C(C)C)c1 ZINC000008002635 204258024 /nfs/dbraw/zinc/25/80/24/204258024.db2.gz WMDDXAIPUKXERR-HXUWFJFHSA-N 0 3 398.459 3.185 10 0 GGAEHN Cc1ccc(-c2nnc(CCC(=O)N[C@@H](CN(C)C)c3ccccc3)o2)cc1 ZINC000007818474 204253199 /nfs/dbraw/zinc/25/31/99/204253199.db2.gz SANHMAXOIQPJIB-IBGZPJMESA-N 0 3 378.476 3.397 10 0 GGAEHN COc1ccc(NC(=O)C2=C(C)C(=O)OC23CCN(C(C)C)CC3)cc1Cl ZINC000008600204 204281386 /nfs/dbraw/zinc/28/13/86/204281386.db2.gz PRLVFRUBTIEQMA-UHFFFAOYSA-N 0 3 392.883 3.403 10 0 biogenic GGAEHN CN(C)S(=O)(=O)c1ccc(OCCN2CC=C(c3ccccc3)CC2)cc1 ZINC000008745890 204287189 /nfs/dbraw/zinc/28/71/89/204287189.db2.gz VZDYXFZJYYAKGB-UHFFFAOYSA-N 0 3 386.517 3.105 10 0 GGAEHN O=C(C[C@H]1Sc2ccccc2NC1=O)NC1CCN(Cc2ccccc2)CC1 ZINC000008076039 204261450 /nfs/dbraw/zinc/26/14/50/204261450.db2.gz DQJWZPIPAYVEBR-HXUWFJFHSA-N 0 3 395.528 3.270 10 0 GGAEHN CCN1CCN(c2ccc(NC(=O)C[C@@H]3OC(=O)c4ccccc43)cc2C)CC1 ZINC000008429283 204277043 /nfs/dbraw/zinc/27/70/43/204277043.db2.gz RLKKKICXKNYABP-NRFANRHFSA-N 0 3 393.487 3.377 10 0 GGAEHN CCCN(CCC)CCNS(=O)(=O)c1cc(-c2cc(C)no2)ccc1C ZINC000009268695 204305414 /nfs/dbraw/zinc/30/54/14/204305414.db2.gz GACZKLIJTKVKAW-UHFFFAOYSA-N 0 3 379.526 3.359 10 0 GGAEHN CCn1nc(C(=O)NC[C@H](c2cccs2)N2CCCC2)c2ccccc2c1=O ZINC000009516088 204313653 /nfs/dbraw/zinc/31/36/53/204313653.db2.gz CCNJKLAZNIRTJT-QGZVFWFLSA-N 0 3 396.516 3.045 10 0 GGAEHN O=C(CN1CCC(Cc2ccccc2)CC1)N1CCN(c2ccccc2)CC1 ZINC000009997029 204328655 /nfs/dbraw/zinc/32/86/55/204328655.db2.gz CSCXMWVHIGGVCA-UHFFFAOYSA-N 0 3 377.532 3.290 10 0 GGAEHN CCCn1nc(C(=O)NCCCN(C)Cc2ccccc2)c2ccccc2c1=O ZINC000009981975 204329399 /nfs/dbraw/zinc/32/93/99/204329399.db2.gz WIYIKMOEBUUYJI-UHFFFAOYSA-N 0 3 392.503 3.058 10 0 GGAEHN COc1cc(CNCCOCCO)ccc1OCc1ccc(F)cc1Cl ZINC000010436165 204334968 /nfs/dbraw/zinc/33/49/68/204334968.db2.gz YBPIQOKMGXQAAZ-UHFFFAOYSA-N 0 3 383.847 3.165 10 0 GGAEHN COc1cccc(CN2CCC[C@]3(CCN(Cc4cnc(C)nc4)C3)C2)c1OC ZINC000011874510 204359270 /nfs/dbraw/zinc/35/92/70/204359270.db2.gz IOHLCGYPFYAWRE-QHCPKHFHSA-N 0 3 396.535 3.290 10 0 GGAEHN Cn1nccc1C(=O)N1CCC([C@H]2CCN(Cc3ccc(Cl)cc3)C2)CC1 ZINC000012028702 204368002 /nfs/dbraw/zinc/36/80/02/204368002.db2.gz JQUOMFGNWIBRGF-SFHVURJKSA-N 0 3 386.927 3.448 10 0 GGAEHN CCCCNC(=O)N1CCC[C@H](N(C)CCc2ccc(OC)c(OC)c2)C1 ZINC000012076530 204370426 /nfs/dbraw/zinc/37/04/26/204370426.db2.gz KCAGIGFXMUOQKZ-SFHVURJKSA-N 0 3 377.529 3.152 10 0 GGAEHN CCOc1ccc2nc(N3CCC(NCc4nccn4CC)CC3)nc(C)c2c1 ZINC000012151103 204377405 /nfs/dbraw/zinc/37/74/05/204377405.db2.gz QQDAOOZEQVYOPE-UHFFFAOYSA-N 0 3 394.523 3.312 10 0 GGAEHN CN(Cc1ccno1)Cc1ccc(OC[C@@H](O)CN(C)Cc2ccccc2)cc1 ZINC000012313944 204395643 /nfs/dbraw/zinc/39/56/43/204395643.db2.gz SBNQLYAQDHGTJQ-NRFANRHFSA-N 0 3 395.503 3.178 10 0 GGAEHN CCc1ccc([C@@H]2CCc3nc(C(=O)NCCN4CCCCC4)cn3C2)cc1 ZINC000034899369 204978776 /nfs/dbraw/zinc/97/87/76/204978776.db2.gz LMWSLWHZCWPERS-HXUWFJFHSA-N 0 3 380.536 3.391 10 0 GGAEHN CCOC(=O)C1=C(CN(C)C2CCCCC2)N(C)C(=O)N[C@@H]1c1ccccc1 ZINC000035991608 205000135 /nfs/dbraw/zinc/00/01/35/205000135.db2.gz VJPFDWNJMBXXKL-HXUWFJFHSA-N 0 3 385.508 3.464 10 0 GGAEHN COc1ccc(CN(C[C@@H](O)COc2ccccc2C)C[C@@H]2CCCO2)cc1 ZINC000036095276 205004844 /nfs/dbraw/zinc/00/48/44/205004844.db2.gz RJDQZZHLYOTZFW-IRLDBZIGSA-N 0 3 385.504 3.425 10 0 GGAEHN COc1ccc(OC[C@@H](O)CN(Cc2ccc(OC)c(OC)c2)C2CC2)cc1 ZINC000036095842 205005370 /nfs/dbraw/zinc/00/53/70/205005370.db2.gz RMFSWBMNTHIEPQ-SFHVURJKSA-N 0 3 387.476 3.117 10 0 GGAEHN CCCC(=O)OC[C@H](O)CN(Cc1ccccc1)Cc1ccc2c(c1)OCO2 ZINC000036103575 205006593 /nfs/dbraw/zinc/00/65/93/205006593.db2.gz NSFZPTZSGGLOEN-LJQANCHMSA-N 0 3 385.460 3.122 10 0 GGAEHN CCN(CC)c1onc(-c2ccccc2)c1CN(CCN(C)C)C(=O)C1CC1 ZINC000036249513 205009274 /nfs/dbraw/zinc/00/92/74/205009274.db2.gz FJNRUGDPYYBWBE-UHFFFAOYSA-N 0 3 384.524 3.488 10 0 GGAEHN Cc1cccc([C@H]2CC[C@H](C(=O)NCCN(C)C)CN2C(=O)C2CCCC2)c1 ZINC000037545813 205028450 /nfs/dbraw/zinc/02/84/50/205028450.db2.gz LIVKSFWUGVRFFF-LEWJYISDSA-N 0 3 385.552 3.143 10 0 GGAEHN CN(C)CCNC(=O)[C@@H]1CC[C@@H](c2ccccc2)N(C(=O)c2ccccc2F)C1 ZINC000037545746 205028764 /nfs/dbraw/zinc/02/87/64/205028764.db2.gz HREXZVDJFVYUGO-NQIIRXRSSA-N 0 3 397.494 3.097 10 0 GGAEHN CN(C)CCNC(=O)[C@@H]1CC[C@H](c2ccccc2)N(C(=O)c2ccccc2F)C1 ZINC000037545744 205028893 /nfs/dbraw/zinc/02/88/93/205028893.db2.gz HREXZVDJFVYUGO-WIYYLYMNSA-N 0 3 397.494 3.097 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)[C@@H]1CCCN1C(=O)c1ccco1)c1ccsc1 ZINC000040157472 205060569 /nfs/dbraw/zinc/06/05/69/205060569.db2.gz QLGWTWGPPIICLX-DLBZAZTESA-N 0 3 389.521 3.145 10 0 GGAEHN C[C@@H]1CN(C(=O)C2CCN(CCOc3ccc(Cl)cc3)CC2)C[C@@H](C)O1 ZINC000045803037 205098030 /nfs/dbraw/zinc/09/80/30/205098030.db2.gz MMJBEIBGIKQISQ-HZPDHXFCSA-N 0 3 380.916 3.067 10 0 GGAEHN CN(c1ncnc(Nc2ccccc2Br)c1N)C1CCN(C)CC1 ZINC000040781473 205072463 /nfs/dbraw/zinc/07/24/63/205072463.db2.gz NLXSGSNDPQUDEF-UHFFFAOYSA-N 0 3 391.317 3.095 10 0 GGAEHN CN(c1ncnc(Nc2ccc(C(F)(F)F)cc2)c1N)C1CCN(C)CC1 ZINC000040799912 205072591 /nfs/dbraw/zinc/07/25/91/205072591.db2.gz XLNZKCWKPJFXDR-UHFFFAOYSA-N 0 3 380.418 3.352 10 0 GGAEHN CN(c1ncnc(Oc2ccc(Br)cc2)c1N)C1CCN(C)CC1 ZINC000040800777 205073329 /nfs/dbraw/zinc/07/33/29/205073329.db2.gz GHJAMBQPQCZSOE-UHFFFAOYSA-N 0 3 392.301 3.144 10 0 GGAEHN CC(C)[C@H](CNC(=O)[C@H](C)Sc1nncs1)N1CCc2ccccc2C1 ZINC000052531758 205134027 /nfs/dbraw/zinc/13/40/27/205134027.db2.gz JLVGKBZWFYKPSA-YOEHRIQHSA-N 0 3 390.578 3.218 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)C1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000052954685 205135182 /nfs/dbraw/zinc/13/51/82/205135182.db2.gz DAJFELFOKCCXGU-QGZVFWFLSA-N 0 3 384.442 3.354 10 0 GGAEHN C[C@H]1CCCN(CCNC(=O)N[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000054817130 205141231 /nfs/dbraw/zinc/14/12/31/205141231.db2.gz VXXVKZPHPGHKPV-XJKSGUPXSA-N 0 3 396.329 3.304 10 0 GGAEHN COCCN1CC[C@@H](CNC(=O)c2ccccc2NCc2sccc2C)C1 ZINC000055166429 205142752 /nfs/dbraw/zinc/14/27/52/205142752.db2.gz KWBGBWDDZBXOKL-KRWDZBQOSA-N 0 3 387.549 3.367 10 0 GGAEHN CC(C)S(=O)(=O)C(C)C(=O)NC1(c2cccc(Br)c2)CCC1 ZINC000056378373 205151470 /nfs/dbraw/zinc/15/14/70/205151470.db2.gz CGQHDHYOANPOBT-LBPRGKRZSA-N 0 3 388.327 3.156 10 0 GGAEHN Cc1c(C(=O)N2CCCC[C@@H]2CN(C)C)cnn1-c1ccc(C(F)(F)F)cn1 ZINC000058202165 205168963 /nfs/dbraw/zinc/16/89/63/205168963.db2.gz HGDZUGRKHSLDDM-OAHLLOKOSA-N 0 3 395.429 3.151 10 0 GGAEHN O=C(Nc1ccn(Cc2cccnc2)n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000058246860 205170423 /nfs/dbraw/zinc/17/04/23/205170423.db2.gz BFANZUBTSPJXBF-HXUWFJFHSA-N 0 3 375.476 3.177 10 0 GGAEHN CC(C)CN1CCCC[C@H]1C(=O)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1 ZINC000058431899 205175089 /nfs/dbraw/zinc/17/50/89/205175089.db2.gz UIBOGNJVVSJTRI-JXFKEZNVSA-N 0 3 379.495 3.418 10 0 GGAEHN O=C(NCCN1CCCCCC1)c1ccc(-c2cc(N3CCCC3)ncn2)cc1 ZINC000064989350 205204849 /nfs/dbraw/zinc/20/48/49/205204849.db2.gz TZWLIXQEAFUFTH-UHFFFAOYSA-N 0 3 393.535 3.350 10 0 GGAEHN COc1ccc2oc(-c3noc(C(=O)NCCN4CCCCCC4)n3)c(C)c2c1 ZINC000065010350 205206569 /nfs/dbraw/zinc/20/65/69/205206569.db2.gz INICZJJRLHYFMW-UHFFFAOYSA-N 0 3 398.463 3.406 10 0 GGAEHN Cc1ccccc1Cn1nnc2cc(C(=O)NCCN3CCCCC3)ccc21 ZINC000065030291 205207990 /nfs/dbraw/zinc/20/79/90/205207990.db2.gz CWDNYYLADUQPAO-UHFFFAOYSA-N 0 3 377.492 3.004 10 0 GGAEHN COc1ccc2c(c1)c(CN1CCC(C(=O)NCCc3ccco3)CC1)cn2C ZINC000065060043 205208156 /nfs/dbraw/zinc/20/81/56/205208156.db2.gz GLKFRUWPEWWSMG-UHFFFAOYSA-N 0 3 395.503 3.351 10 0 GGAEHN Cc1ccc2c(cc(NC(=O)C3CCC3)cc2C(=O)NCCN2CCCCC2)n1 ZINC000065136080 205212431 /nfs/dbraw/zinc/21/24/31/205212431.db2.gz SRSYREVEWVXYAZ-UHFFFAOYSA-N 0 3 394.519 3.498 10 0 GGAEHN CCn1cc(CC(=O)NC2CCN(Cc3ccccc3)CC2)c2cccnc21 ZINC000065155802 205214827 /nfs/dbraw/zinc/21/48/27/205214827.db2.gz QSIHFQZCLRLYQQ-UHFFFAOYSA-N 0 3 376.504 3.380 10 0 GGAEHN CC(=O)Nc1cccc2c(C(=O)N3CCN(C4CCCCC4)CC3)ccnc12 ZINC000065178139 205215800 /nfs/dbraw/zinc/21/58/00/205215800.db2.gz XXUOEMLSSWTHRE-UHFFFAOYSA-N 0 3 380.492 3.284 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1ccc(-c2ccnc(N3CCCC3)n2)cc1 ZINC000065171683 205216465 /nfs/dbraw/zinc/21/64/65/205216465.db2.gz GZEATJHODSKWPJ-GOSISDBHSA-N 0 3 393.535 3.348 10 0 GGAEHN COc1ccc(CNC(=O)C2=CCN(Cc3cccc(C)c3)CC2)cc1OC ZINC000064818027 205197047 /nfs/dbraw/zinc/19/70/47/205197047.db2.gz WHDDVSDCOJBTBH-UHFFFAOYSA-N 0 3 380.488 3.461 10 0 GGAEHN c1cc(-c2nc(-c3ccc4c(c3)nnn4CCN3CCCCC3)no2)ccn1 ZINC000065255021 205223218 /nfs/dbraw/zinc/22/32/18/205223218.db2.gz QJJLDVQXXUCXCX-UHFFFAOYSA-N 0 3 375.436 3.029 10 0 GGAEHN O=C(Nc1ccccc1)c1ccc(N2CC[C@H](NCc3ccc(O)cc3)C2)nc1 ZINC000065257033 205224233 /nfs/dbraw/zinc/22/42/33/205224233.db2.gz YAJQMGOUKKIQBF-FQEVSTJZSA-N 0 3 388.471 3.408 10 0 GGAEHN Cc1nc(C23C[C@H]4C[C@@H](C2)CC(n2cncn2)(C4)C3)n(-c2ccnc(C)c2)n1 ZINC000065387601 205233902 /nfs/dbraw/zinc/23/39/02/205233902.db2.gz ZFZDUUHAAHNRPQ-AGXSTUJCSA-N 0 3 375.480 3.118 10 0 GGAEHN COc1ncc(CN2CC[C@H](c3ccnc(-c4ccc(CO)cc4)c3)C2)cn1 ZINC000065426662 205234449 /nfs/dbraw/zinc/23/44/49/205234449.db2.gz DNAXJXKXSQXTHP-FQEVSTJZSA-N 0 3 376.460 3.029 10 0 GGAEHN COc1cccc2cc(CNCc3ccc(N4CCCN(C)CC4)nc3)oc21 ZINC000065566987 205238208 /nfs/dbraw/zinc/23/82/08/205238208.db2.gz IYASWYAUNVQEFL-UHFFFAOYSA-N 0 3 380.492 3.268 10 0 GGAEHN O=C(NCCN1CCCCC1)c1cccc2c1CCN2C(=O)c1ccccc1 ZINC000065210007 205219965 /nfs/dbraw/zinc/21/99/65/205219965.db2.gz WCLYQDPKDOUJTP-UHFFFAOYSA-N 0 3 377.488 3.105 10 0 GGAEHN COc1ccc([C@@H](CNC(=O)N[C@@H](C)c2c(C)nn(C)c2C)N2CCCC2)cc1 ZINC000067536107 205248038 /nfs/dbraw/zinc/24/80/38/205248038.db2.gz LDDXLUZZZSDHDF-MGPUTAFESA-N 0 3 399.539 3.243 10 0 GGAEHN CN(Cc1c(F)cccc1Cl)C(=O)c1cnn(CCN2CCCCC2)c1 ZINC000072283601 205320932 /nfs/dbraw/zinc/32/09/32/205320932.db2.gz YRKKMBXUMWRERZ-UHFFFAOYSA-N 0 3 378.879 3.434 10 0 GGAEHN CCc1cc2c(cc1CC)CC([NH2+]C[C@H](O)c1ccc([O-])c3c1CCC(=O)N3)C2 ZINC000084742328 205398746 /nfs/dbraw/zinc/39/87/46/205398746.db2.gz CEVVMMPBOCCERE-QFIPXVFZSA-N 0 3 394.515 3.192 10 0 GGAEHN C[C@H](NC[C@H](O)Cc1ccc2ccccc2c1)c1ccc2c(c1)NC(=O)CO2 ZINC000225396693 206045010 /nfs/dbraw/zinc/04/50/10/206045010.db2.gz JRINESWTMRLYRQ-MGPUTAFESA-N 0 3 376.456 3.425 10 0 GGAEHN Cc1cc(C)n2c(CN[C@H](CNC(=O)OC(C)(C)C)C(C)(C)C)cnc2n1 ZINC000225589322 206059566 /nfs/dbraw/zinc/05/95/66/206059566.db2.gz RYFTZFHDTFIFCO-MRXNPFEDSA-N 0 3 375.517 3.375 10 0 GGAEHN Cn1cc(-c2csc(CNc3cccc(CN4CCC(CO)CC4)c3)n2)cn1 ZINC000240423774 206127045 /nfs/dbraw/zinc/12/70/45/206127045.db2.gz FQSJDLWYPBBDII-UHFFFAOYSA-N 0 3 397.548 3.360 10 0 GGAEHN O[C@H](COCCOc1ccc(Cl)cc1)CN1CCC[C@@H](C(F)(F)F)C1 ZINC000014200853 206120825 /nfs/dbraw/zinc/12/08/25/206120825.db2.gz UEVFWOBSABNDMR-HIFRSBDPSA-N 0 3 381.822 3.371 10 0 GGAEHN CN(C)CCOc1cccc(CNC(=O)Nc2nn(C)cc2-c2ccccc2)c1 ZINC000241774024 206128542 /nfs/dbraw/zinc/12/85/42/206128542.db2.gz RMKGDEFZAFJPEO-UHFFFAOYSA-N 0 3 393.491 3.349 10 0 GGAEHN CCN1CCC(NC(=O)CSc2nc(C(C)C)n(-c3ccccc3)n2)CC1 ZINC000010344643 221101921 /nfs/dbraw/zinc/10/19/21/221101921.db2.gz MXKDVXFYHNRCPY-UHFFFAOYSA-N 0 3 387.553 3.083 10 0 GGAEHN CN(C(=O)c1cccs1)[C@H](Cc1ccccc1F)C1CCN(CCO)CC1 ZINC000011813080 221125759 /nfs/dbraw/zinc/12/57/59/221125759.db2.gz GHCDXQAPQZHWSC-LJQANCHMSA-N 0 3 390.524 3.275 10 0 GGAEHN CCCN1CCN(c2ncnc3sc(C(=O)NCc4ccco4)c(C)c32)CC1 ZINC000064957333 136158376 /nfs/dbraw/zinc/15/83/76/136158376.db2.gz VKKYLVPVTBMVLY-UHFFFAOYSA-N 0 3 399.520 3.055 10 0 GGAEHN O=C(NCc1cccc(F)c1)c1ccc(N2CCN[C@@H](c3ccccc3)C2)nc1 ZINC000065256119 136162034 /nfs/dbraw/zinc/16/20/34/136162034.db2.gz NWGWDARMQSOWFS-OAQYLSRUSA-N 0 3 390.462 3.302 10 0 GGAEHN CCN1CCN(c2ccc(NC(=O)c3sc4nccn4c3C)c(C)c2)CC1 ZINC000095435199 136179055 /nfs/dbraw/zinc/17/90/55/136179055.db2.gz BQQZAKAFDAGMTQ-UHFFFAOYSA-N 0 3 383.521 3.407 10 0 GGAEHN COc1cccc(N2C(=O)CN([C@H]3CCN(Cc4ccccc4)C3)C[C@@H]2C)c1 ZINC000215941881 136203037 /nfs/dbraw/zinc/20/30/37/136203037.db2.gz KPXXDRXWXMBHBQ-RXVVDRJESA-N 0 3 379.504 3.007 10 0 GGAEHN CCOC(=O)c1cc2ccsc2n1CC(=O)NCCN(C)Cc1ccccc1 ZINC000064664574 222077622 /nfs/dbraw/zinc/07/76/22/222077622.db2.gz XJZGTOADVVUJIO-UHFFFAOYSA-N 0 3 399.516 3.128 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)c1nc(-c2ccc(N3CCCCCC3)cc2)no1 ZINC000064746552 222078847 /nfs/dbraw/zinc/07/88/47/222078847.db2.gz RANQJOVPMJHYBE-LJQANCHMSA-N 0 3 397.523 3.331 10 0 GGAEHN CN(C)CCNC(=O)C[C@H]1COc2ccc(Cl)cc2N1Cc1ccccc1 ZINC000096323058 535882855 /nfs/dbraw/zinc/88/28/55/535882855.db2.gz MBNXYFOCJMRJPP-SFHVURJKSA-N 0 3 387.911 3.176 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N(C)C[C@@H]1CCCN(C)C1 ZINC000115803379 564199559 /nfs/dbraw/zinc/19/95/59/564199559.db2.gz NBGWOLLJMXYGEZ-GDBMZVCRSA-N 0 3 382.346 3.363 10 0 GGAEHN Cn1cc([C@H]2CCN(CCC(=O)Nc3ccccc3Br)C2)cn1 ZINC000116310055 564207219 /nfs/dbraw/zinc/20/72/19/564207219.db2.gz XXKLABHQCGXHNM-ZDUSSCGKSA-N 0 3 377.286 3.001 10 0 GGAEHN C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)N1CCO[C@H](CN(C)C)C1 ZINC000116783713 564216957 /nfs/dbraw/zinc/21/69/57/564216957.db2.gz JPZIWJLVYQQNFW-DGCLKSJQSA-N 0 3 377.337 3.263 10 0 GGAEHN CN(C)C[C@H]1CN(C(=O)CSc2cccc3cccc(Cl)c32)CCO1 ZINC000116798176 564217178 /nfs/dbraw/zinc/21/71/78/564217178.db2.gz XUMOTRWWGJYEIT-HNNXBMFYSA-N 0 3 378.925 3.374 10 0 GGAEHN CN(C)C[C@@H]1CN(C(=O)CSCc2ccc(Cl)cc2Cl)CCO1 ZINC000116796745 564217262 /nfs/dbraw/zinc/21/72/62/564217262.db2.gz TWKKLOWLUUJVRG-CQSZACIVSA-N 0 3 377.337 3.016 10 0 GGAEHN Cc1nc(-c2cccc(Cl)c2)sc1C(=O)N1CCO[C@@H](CN(C)C)C1 ZINC000116797706 564217288 /nfs/dbraw/zinc/21/72/88/564217288.db2.gz FEMJMCXBGZQXBE-HNNXBMFYSA-N 0 3 379.913 3.175 10 0 GGAEHN NC(=O)[C@@H](NCCc1c[nH]c2ccc(F)cc12)c1ccc(Br)cc1 ZINC000116907597 564219553 /nfs/dbraw/zinc/21/95/53/564219553.db2.gz GUWHLVWPIYYPNE-KRWDZBQOSA-N 0 3 390.256 3.428 10 0 GGAEHN C[C@@H](NC(=O)N1CCO[C@H](CN(C)C)C1)c1c(Cl)ccc(F)c1Cl ZINC000117036685 564221700 /nfs/dbraw/zinc/22/17/00/564221700.db2.gz BPFCHJPZRDXDHU-GHMZBOCLSA-N 0 3 378.275 3.166 10 0 GGAEHN CC[C@@H](Cc1cccc(Br)c1)C(=O)Nc1cnn(CCN(C)C)c1 ZINC000117140881 564222857 /nfs/dbraw/zinc/22/28/57/564222857.db2.gz QFRMDDLMCUVYIR-HNNXBMFYSA-N 0 3 393.329 3.415 10 0 GGAEHN CCN1CCC[C@H](NC(=O)c2cc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000117705541 564230241 /nfs/dbraw/zinc/23/02/41/564230241.db2.gz WPQYBYPIRASNHN-AWEZNQCLSA-N 0 3 377.286 3.053 10 0 GGAEHN CCC[C@H](C(=O)NC[C@@H]1CCN(c2cccc(Br)c2)C1)N(C)C ZINC000119164584 564258309 /nfs/dbraw/zinc/25/83/09/564258309.db2.gz ICOXSEJZXZPJGF-WMLDXEAASA-N 0 3 382.346 3.122 10 0 GGAEHN CCC[C@@H](C(=O)NC[C@H]1CCN(c2cccc(Br)c2)C1)N(C)C ZINC000119164706 564258321 /nfs/dbraw/zinc/25/83/21/564258321.db2.gz ICOXSEJZXZPJGF-PBHICJAKSA-N 0 3 382.346 3.122 10 0 GGAEHN CCC[C@H](C(=O)NC[C@H]1CCN(c2cccc(Br)c2)C1)N(C)C ZINC000119164807 564258355 /nfs/dbraw/zinc/25/83/55/564258355.db2.gz ICOXSEJZXZPJGF-RHSMWYFYSA-N 0 3 382.346 3.122 10 0 GGAEHN CCC[C@@H](C(=O)NC[C@@H]1CCN(c2cccc(Br)c2)C1)N(C)C ZINC000119164500 564258509 /nfs/dbraw/zinc/25/85/09/564258509.db2.gz ICOXSEJZXZPJGF-YOEHRIQHSA-N 0 3 382.346 3.122 10 0 GGAEHN C[C@H](C(=O)NC[C@H](O)CN1CCc2ccccc2C1)c1ccc(Cl)s1 ZINC000119683789 564283163 /nfs/dbraw/zinc/28/31/63/564283163.db2.gz ONYBMVDSZVUXLY-BBRMVZONSA-N 0 3 378.925 3.040 10 0 GGAEHN C[C@H](N[C@@H]1CCN(c2ncccc2Cl)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000120028746 564300804 /nfs/dbraw/zinc/30/08/04/564300804.db2.gz PLYPKEUMIIJYLJ-DZGCQCFKSA-N 0 3 379.913 3.068 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)c1nnc(Cc2ccc(Cl)cc2Cl)o1 ZINC000020851779 564307694 /nfs/dbraw/zinc/30/76/94/564307694.db2.gz QWLOCGKNHDCRRE-CYBMUJFWSA-N 0 3 383.279 3.181 10 0 GGAEHN CC(=O)NCCCN[C@H](C)c1ccc(Br)cc1Br ZINC000121373654 564366911 /nfs/dbraw/zinc/36/69/11/564366911.db2.gz IMVQYYIAELDTMF-SECBINFHSA-N 0 3 378.108 3.388 10 0 GGAEHN CN(C)CCn1cc(NC(=O)Nc2cc(F)c(Br)cc2F)cn1 ZINC000121495340 564371867 /nfs/dbraw/zinc/37/18/67/564371867.db2.gz CBDVBCWMWOWXQO-UHFFFAOYSA-N 0 3 388.216 3.129 10 0 GGAEHN C[C@H](CN1CCCN(Cc2cnn(C)c2)CC1)c1cccc(Br)c1 ZINC000121594946 564376791 /nfs/dbraw/zinc/37/67/91/564376791.db2.gz CAFNRNPIEUKNHE-MRXNPFEDSA-N 0 3 391.357 3.494 10 0 GGAEHN CC(C)C[C@@H](CNC(=O)c1c(F)cccc1I)N(C)C ZINC000121666314 564380448 /nfs/dbraw/zinc/38/04/48/564380448.db2.gz BVVHVOQJALTPQO-NSHDSACASA-N 0 3 392.256 3.136 10 0 GGAEHN C[C@@H](CC(=O)N(C)CCCN1CCN(C)CC1)c1ccc(Br)cc1 ZINC000121679707 564381269 /nfs/dbraw/zinc/38/12/69/564381269.db2.gz RGGZJEOSJFNQFR-INIZCTEOSA-N 0 3 396.373 3.039 10 0 GGAEHN C[C@@H](NC[C@H](O)COc1cccc(Br)c1)c1ccc2c(c1)OCO2 ZINC000030535975 564382216 /nfs/dbraw/zinc/38/22/16/564382216.db2.gz XDRYRFKVZQHXHP-DOMZBBRYSA-N 0 3 394.265 3.268 10 0 GGAEHN C[C@@H](NC[C@@H](O)COc1ccc(Br)cc1)c1ccc2c(c1)OCO2 ZINC000030536003 564382533 /nfs/dbraw/zinc/38/25/33/564382533.db2.gz VAPVULBAABRVHJ-IUODEOHRSA-N 0 3 394.265 3.268 10 0 GGAEHN O=C(NC[C@@H](O)CN1CCCCC1)c1ccc2cc(Br)ccc2c1 ZINC000121792441 564387339 /nfs/dbraw/zinc/38/73/39/564387339.db2.gz FLHDQVXDHOZVFP-GOSISDBHSA-N 0 3 391.309 3.179 10 0 GGAEHN COc1ccc(CCC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1Br ZINC000122792325 564428021 /nfs/dbraw/zinc/42/80/21/564428021.db2.gz DBOXILBSCXYPAQ-UKRRQHHQSA-N 0 3 383.330 3.331 10 0 GGAEHN CN1CCN([C@@H]2CCCCN(Cc3csc(-c4cccs4)n3)C2)CC1 ZINC000122817283 564428622 /nfs/dbraw/zinc/42/86/22/564428622.db2.gz UISPBBRWMDFZRV-QGZVFWFLSA-N 0 3 376.595 3.474 10 0 GGAEHN COc1ccc(CCNc2nnc(SC[C@H](C)N(C)C)s2)cc1OC ZINC000479209570 564431068 /nfs/dbraw/zinc/43/10/68/564431068.db2.gz UYJPGUZLDAIWQB-LBPRGKRZSA-N 0 3 382.555 3.252 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)c2cnn(-c3cccc(Br)c3)c2)CCN1C ZINC000122972554 564434151 /nfs/dbraw/zinc/43/41/51/564434151.db2.gz SHXSRTMPHAQZGU-CZUORRHYSA-N 0 3 391.313 3.190 10 0 GGAEHN COc1c(Br)cc(Br)cc1CN[C@@H](C)[C@H](C)CO ZINC000123222212 564442013 /nfs/dbraw/zinc/44/20/13/564442013.db2.gz NVKAHMBBUDBCAR-BDAKNGLRSA-N 0 3 381.108 3.327 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)Cc2nc(-c3cc(Br)cs3)no2)CCN1C ZINC000123389164 564446879 /nfs/dbraw/zinc/44/68/79/564446879.db2.gz SAQIQJVALIGAMQ-PWSUYJOCSA-N 0 3 385.331 3.475 10 0 GGAEHN COc1cc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc(OC)c1Br ZINC000123603126 564454943 /nfs/dbraw/zinc/45/49/43/564454943.db2.gz JZZWPAACFYCSMW-WCQYABFASA-N 0 3 385.302 3.021 10 0 GGAEHN COC1CCN(CCNC(=O)C[C@@H](C)c2ccc(Br)cc2)CC1 ZINC000123765084 564461060 /nfs/dbraw/zinc/46/10/60/564461060.db2.gz ODNSSQMHHLJKJB-CQSZACIVSA-N 0 3 383.330 3.170 10 0 GGAEHN C[C@@H]1C[C@H](N(C)Cc2nc(Cc3cccc(Br)c3)no2)CCN1C ZINC000123925888 564466330 /nfs/dbraw/zinc/46/63/30/564466330.db2.gz PGYJCQMNXFKTIR-CZUORRHYSA-N 0 3 393.329 3.337 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)Cc2nc(-c3ccc(Br)s3)no2)CCN1C ZINC000123928656 564466682 /nfs/dbraw/zinc/46/66/82/564466682.db2.gz FCVXGRNGTFDDMJ-MNOVXSKESA-N 0 3 385.331 3.475 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)c2ccn(-c3cccc(Br)c3)n2)CCN1C ZINC000124029682 564469778 /nfs/dbraw/zinc/46/97/78/564469778.db2.gz BHXBCEWBQVUHRA-HIFRSBDPSA-N 0 3 391.313 3.190 10 0 GGAEHN CC(C(=O)NCc1cccs1)S(=O)(=O)Cc1csc(C(C)(C)C)n1 ZINC000046184227 564498308 /nfs/dbraw/zinc/49/83/08/564498308.db2.gz MZIRIHNNPQAIGZ-LLVKDONJSA-N 0 3 386.564 3.122 10 0 GGAEHN CN1CCN([C@@H]2CCCCN(C(=O)Nc3ccc(Br)cc3)C2)CC1 ZINC000124968029 564499234 /nfs/dbraw/zinc/49/92/34/564499234.db2.gz NUSMTJVHWDFRTK-QGZVFWFLSA-N 0 3 395.345 3.083 10 0 GGAEHN CN1CCN([C@@H]2CCCCN(C(=O)Nc3ccccc3Br)C2)CC1 ZINC000124963373 564499298 /nfs/dbraw/zinc/49/92/98/564499298.db2.gz PBUJLMQKDRAIDF-OAHLLOKOSA-N 0 3 395.345 3.083 10 0 GGAEHN COc1ccc(CCC(=O)NCCN2CCCC[C@H]2C)cc1Br ZINC000046860555 564508849 /nfs/dbraw/zinc/50/88/49/564508849.db2.gz DDLDPKLMIQPFEL-CQSZACIVSA-N 0 3 383.330 3.381 10 0 GGAEHN COc1cc(C(=O)NCCN2CCCC[C@@H]2C)cc(OC)c1Br ZINC000046859793 564509462 /nfs/dbraw/zinc/50/94/62/564509462.db2.gz HELZJVWLPHBSDT-LBPRGKRZSA-N 0 3 385.302 3.071 10 0 GGAEHN C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NCCN1CCCC[C@@H]1C ZINC000048221205 564534578 /nfs/dbraw/zinc/53/45/78/564534578.db2.gz CGJSNWIQUMFWOO-QWHCGFSZSA-N 0 3 386.323 3.102 10 0 GGAEHN O=C(NCc1ccc([O-])c(Br)c1)N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000126168436 564538799 /nfs/dbraw/zinc/53/87/99/564538799.db2.gz NQIOWWNHUPHUFQ-OAHLLOKOSA-N 0 3 396.329 3.315 10 0 GGAEHN CN1CCC[C@H](NC(=O)Nc2ccc(Br)cc2Br)C1 ZINC000048769862 564545863 /nfs/dbraw/zinc/54/58/63/564545863.db2.gz BUWMUXCJOXNAFP-JTQLQIEISA-N 0 3 391.107 3.427 10 0 GGAEHN C[C@@H](NC(=O)NC[C@@H](O)CN1CCCCC1)c1cc(F)c(Cl)cc1Cl ZINC000049174914 564549667 /nfs/dbraw/zinc/54/96/67/564549667.db2.gz KCTINWCDQZHHDT-VXGBXAGGSA-N 0 3 392.302 3.340 10 0 GGAEHN C[C@@H](NC(=O)NC[C@H](O)CN1CCCCC1)c1cc(F)c(Cl)cc1Cl ZINC000049174912 564549680 /nfs/dbraw/zinc/54/96/80/564549680.db2.gz KCTINWCDQZHHDT-NEPJUHHUSA-N 0 3 392.302 3.340 10 0 GGAEHN CN(CCOc1ccccc1Br)[C@@H]1CCCN(c2cccnn2)C1 ZINC000126619664 564555320 /nfs/dbraw/zinc/55/53/20/564555320.db2.gz FJAAVILJEFLUFV-OAHLLOKOSA-N 0 3 391.313 3.219 10 0 GGAEHN O=C(CN[C@@H](c1ccc(Cl)cc1)C1CC1)NC(=O)NCc1cccs1 ZINC000052661801 564575162 /nfs/dbraw/zinc/57/51/62/564575162.db2.gz ZYKLISWLXJSBLO-QGZVFWFLSA-N 0 3 377.897 3.468 10 0 GGAEHN CCC(C)(C)NC(=O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000052833917 564577802 /nfs/dbraw/zinc/57/78/02/564577802.db2.gz WROFJNDWGUKBCH-UHFFFAOYSA-N 0 3 383.330 3.349 10 0 GGAEHN CCN(CC)[C@H](C)CN[C@@H](C)c1ccc(S(=O)(=O)C(F)F)c(OC)c1 ZINC000127597069 564589645 /nfs/dbraw/zinc/58/96/45/564589645.db2.gz VJUYMCFIGRYVLF-OLZOCXBDSA-N 0 3 378.485 3.072 10 0 GGAEHN Cn1cc(CCN[C@@H]2CCCOc3ccc(I)cc32)cn1 ZINC000127871801 564598644 /nfs/dbraw/zinc/59/86/44/564598644.db2.gz AABORSAVDNSQJD-OAHLLOKOSA-N 0 3 397.260 3.071 10 0 GGAEHN CC[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1cc(C)ccc1Br ZINC000127886890 564600150 /nfs/dbraw/zinc/60/01/50/564600150.db2.gz TVIFIIWCXLNIJZ-UONOGXRCSA-N 0 3 387.343 3.005 10 0 GGAEHN NS(=O)(=O)c1ccc(CCN[C@H]2CCCOc3ccc(Cl)cc32)cc1 ZINC000127974625 564602545 /nfs/dbraw/zinc/60/25/45/564602545.db2.gz HQLGGMMRPXSFQL-KRWDZBQOSA-N 0 3 380.897 3.033 10 0 GGAEHN CN(C)CCOc1ccccc1C(=O)NCc1ccc(F)cc1Br ZINC000054265908 564602526 /nfs/dbraw/zinc/60/25/26/564602526.db2.gz MMSNDSKHSMODKF-UHFFFAOYSA-N 0 3 395.272 3.459 10 0 GGAEHN C[C@@H](NC(=O)N1CCN(c2ccncc2)CC1)c1ccccc1Br ZINC000054391205 564604619 /nfs/dbraw/zinc/60/46/19/564604619.db2.gz OBRQDFHYILEBMO-CQSZACIVSA-N 0 3 389.297 3.437 10 0 GGAEHN CCN1CCC[C@H](NC(=O)Nc2cc(OC)c(OC)cc2Br)C1 ZINC000054484029 564605453 /nfs/dbraw/zinc/60/54/53/564605453.db2.gz HDZUSHIVWCARRP-NSHDSACASA-N 0 3 386.290 3.072 10 0 GGAEHN CC(C(=O)N[C@@H]1CCCC[C@H]1C)S(=O)(=O)Cc1nc(C(C)(C)C)cs1 ZINC000128051259 564605931 /nfs/dbraw/zinc/60/59/31/564605931.db2.gz HJUJOFWJKCLMNR-MGPQQGTHSA-N 0 3 386.583 3.439 10 0 GGAEHN Brc1ccc2c(c1)C=C(CN1CCC[C@@H](Cn3cncn3)C1)CO2 ZINC000128533200 564620976 /nfs/dbraw/zinc/62/09/76/564620976.db2.gz BOYMGLFZPSZYPR-CQSZACIVSA-N 0 3 389.297 3.229 10 0 GGAEHN O=C(CN1CCc2c(Cl)cc(Cl)cc2C1)NC1CCN(C2CC2)CC1 ZINC000128669500 564625524 /nfs/dbraw/zinc/62/55/24/564625524.db2.gz BLIUZRVJIPWDDN-UHFFFAOYSA-N 0 3 382.335 3.095 10 0 GGAEHN C[C@H](NCc1cc(F)cc(Br)c1)c1ccc(-n2cnnn2)cc1 ZINC000129171844 564640568 /nfs/dbraw/zinc/64/05/68/564640568.db2.gz NBZMIZKDIZFAMM-NSHDSACASA-N 0 3 376.233 3.415 10 0 GGAEHN C[C@@H](NCc1cc(F)cc(Br)c1)c1ccc(-n2cnnn2)cc1 ZINC000129172078 564640969 /nfs/dbraw/zinc/64/09/69/564640969.db2.gz NBZMIZKDIZFAMM-LLVKDONJSA-N 0 3 376.233 3.415 10 0 GGAEHN CC(C)COC1CCN(C[C@@H](O)COc2cccc(Br)c2)CC1 ZINC000056293118 564645160 /nfs/dbraw/zinc/64/51/60/564645160.db2.gz KKKPVSDEQDOOSO-MRXNPFEDSA-N 0 3 386.330 3.326 10 0 GGAEHN CN(C)CCOc1ccccc1C(=O)NCc1ccc(Br)s1 ZINC000129376372 564646094 /nfs/dbraw/zinc/64/60/94/564646094.db2.gz KQDRAPCHQNYLOH-UHFFFAOYSA-N 0 3 383.311 3.381 10 0 GGAEHN C[C@@H](CCNCc1ccc(Br)c(Br)c1)[S@](C)=O ZINC000129405217 564647238 /nfs/dbraw/zinc/64/72/38/564647238.db2.gz HGORVVZKAVAOHG-HUTHGQBESA-N 0 3 383.149 3.458 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)NCc1ccc(Br)s1 ZINC000057202763 564663476 /nfs/dbraw/zinc/66/34/76/564663476.db2.gz YOBAVEJAVPLQPK-AWEZNQCLSA-N 0 3 396.354 3.483 10 0 GGAEHN CN1CCC[C@H](NC(=O)NCC2(c3cccc(Br)c3)CCC2)C1 ZINC000057859806 564676748 /nfs/dbraw/zinc/67/67/48/564676748.db2.gz IYXVMWOIIOIHPQ-INIZCTEOSA-N 0 3 380.330 3.264 10 0 GGAEHN O=C(NCCc1cc(Cl)ccc1Br)N1CC[C@@H](N2CC=CC2)C1 ZINC000130716430 564689867 /nfs/dbraw/zinc/68/98/67/564689867.db2.gz KFRZKDCKTKBETM-OAHLLOKOSA-N 0 3 398.732 3.301 10 0 GGAEHN COCCN(C)CCN[C@H](C)c1ccc(Br)cc1Br ZINC000061376729 564705812 /nfs/dbraw/zinc/70/58/12/564705812.db2.gz KCQMMLKZKXQOKR-LLVKDONJSA-N 0 3 394.151 3.440 10 0 GGAEHN CC(C)(CNC(=O)N1CC[C@@H](N2CC=CC2)C1)c1ccccc1Br ZINC000131383748 564710262 /nfs/dbraw/zinc/71/02/62/564710262.db2.gz DJWVGHAPLYPDFZ-OAHLLOKOSA-N 0 3 392.341 3.382 10 0 GGAEHN COc1ccc(Br)cc1CNC(=O)NCCN1CCCC[C@@H]1C ZINC000064623759 564733811 /nfs/dbraw/zinc/73/38/11/564733811.db2.gz MOMMFOHRJGBBQZ-ZDUSSCGKSA-N 0 3 384.318 3.131 10 0 GGAEHN CCN1CCC[C@H](NC(=O)c2[nH]nc(-c3ccccc3)c2Br)C1 ZINC000065216418 564741780 /nfs/dbraw/zinc/74/17/80/564741780.db2.gz GZPHCGMKGLMICM-ZDUSSCGKSA-N 0 3 377.286 3.053 10 0 GGAEHN COC[C@](C)(CCO)NCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000132562920 564746936 /nfs/dbraw/zinc/74/69/36/564746936.db2.gz WWYFKYQHAHDLHF-WMZOPIPTSA-N 0 3 389.323 3.034 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N1CC[C@@H](N2CCCC2)C1 ZINC000066186698 564756905 /nfs/dbraw/zinc/75/69/05/564756905.db2.gz AQDYXCOZOLYORX-RHSMWYFYSA-N 0 3 380.330 3.260 10 0 GGAEHN C[C@H]1CN(C2CCN(CC(=O)Nc3c(Cl)cccc3Cl)CC2)CCO1 ZINC000066561753 564769457 /nfs/dbraw/zinc/76/94/57/564769457.db2.gz PTLFUSZKFNMPQQ-ZDUSSCGKSA-N 0 3 386.323 3.117 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNCC[C@H](C)[S@](C)=O ZINC000133435654 564774132 /nfs/dbraw/zinc/77/41/32/564774132.db2.gz AHRXUAJKRLVDRA-DAOPMYJZSA-N 0 3 398.370 3.498 10 0 GGAEHN CNS(=O)(=O)CCCN(C)[C@H](C)c1sc(-c2ccc(C)cc2)nc1C ZINC000134211326 564796449 /nfs/dbraw/zinc/79/64/49/564796449.db2.gz ORSQXJWOVYWJMK-OAHLLOKOSA-N 0 3 381.567 3.359 10 0 GGAEHN COc1c(Br)cc(Br)cc1CN[C@@H]1CCO[C@@H]1C ZINC000134244262 564797222 /nfs/dbraw/zinc/79/72/22/564797222.db2.gz BMHDJVZIYHDEGN-PRHODGIISA-N 0 3 379.092 3.487 10 0 GGAEHN CN(C)Cc1ccc(C(=O)N2CCN(Cc3ccc(Cl)s3)CC2)cc1 ZINC000068259610 564812811 /nfs/dbraw/zinc/81/28/11/564812811.db2.gz MUVAVSWVBNGWLO-UHFFFAOYSA-N 0 3 377.941 3.421 10 0 GGAEHN CN1CCC(C(=O)NCc2ccc(Br)cc2C(F)(F)F)CC1 ZINC000135100679 564823843 /nfs/dbraw/zinc/82/38/43/564823843.db2.gz QWZWXBYRQYUSQS-UHFFFAOYSA-N 0 3 379.220 3.426 10 0 GGAEHN COCc1nc(C)c(C(=O)NC[C@H]2CCCN(C)[C@@H]2c2cccs2)s1 ZINC000135694073 564838510 /nfs/dbraw/zinc/83/85/10/564838510.db2.gz BYJFDHCDJNTEFS-CJNGLKHVSA-N 0 3 379.551 3.472 10 0 GGAEHN CCC[C@@H](C(=O)N1CCN(C(=O)c2cccc(Cl)c2Cl)CC1)N(C)C ZINC000136430425 564850764 /nfs/dbraw/zinc/85/07/64/564850764.db2.gz UXCYLWPZEXZVRQ-HNNXBMFYSA-N 0 3 386.323 3.008 10 0 GGAEHN COC(=O)CCN(CCOc1c(Cl)cccc1Cl)C[C@H]1CCCO1 ZINC000079354574 564867701 /nfs/dbraw/zinc/86/77/01/564867701.db2.gz SESHQIWQGQIYNG-CYBMUJFWSA-N 0 3 376.280 3.416 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN[C@H]1CCCN(C)C1 ZINC000139858932 564869962 /nfs/dbraw/zinc/86/99/62/564869962.db2.gz FXBAHHJQTKFFJL-INIZCTEOSA-N 0 3 377.330 3.435 10 0 GGAEHN COc1c(Br)cc(Br)cc1CNC[C@@H]1CCC[C@@H]1O ZINC000091316085 564870038 /nfs/dbraw/zinc/87/00/38/564870038.db2.gz HODWTLUAIQAROF-ZANVPECISA-N 0 3 393.119 3.471 10 0 GGAEHN C[C@@H]1CCCN(CCNC(=O)CSCc2cc(-c3cccs3)on2)C1 ZINC000140279118 564871180 /nfs/dbraw/zinc/87/11/80/564871180.db2.gz GLNNJXNZQVOYDR-CQSZACIVSA-N 0 3 379.551 3.484 10 0 GGAEHN CCOc1c(Br)cc(Br)cc1CNCC1CC(O)C1 ZINC000091525950 564871158 /nfs/dbraw/zinc/87/11/58/564871158.db2.gz UULCBJDJFYXPRK-UHFFFAOYSA-N 0 3 393.119 3.471 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CCCC[C@@H]1CC(N)=O ZINC000092588369 564878704 /nfs/dbraw/zinc/87/87/04/564878704.db2.gz GTFMCFKEWAWTIR-QGZVFWFLSA-N 0 3 391.313 3.173 10 0 GGAEHN NC(=O)c1c(F)cc(Br)cc1NCCN1CCc2ccccc2C1 ZINC000092828247 564882253 /nfs/dbraw/zinc/88/22/53/564882253.db2.gz AWGHGAUZRJDCIH-UHFFFAOYSA-N 0 3 392.272 3.157 10 0 GGAEHN COc1c(Br)cc(CN[C@@H]2CCO[C@H]2C)cc1Br ZINC000149454204 564885786 /nfs/dbraw/zinc/88/57/86/564885786.db2.gz PRHJNXPAXQZFHE-QPUJVOFHSA-N 0 3 379.092 3.487 10 0 GGAEHN CC[C@@H]1CCCCCN1CC(=O)NCC(=O)Nc1ccccc1Br ZINC000150748861 564889426 /nfs/dbraw/zinc/88/94/26/564889426.db2.gz CVPPJVRWOVFCHI-CQSZACIVSA-N 0 3 396.329 3.158 10 0 GGAEHN COC[C@@](C)(CCO)NCc1ccc(Br)c(Br)c1 ZINC000150872788 564894700 /nfs/dbraw/zinc/89/47/00/564894700.db2.gz GDBKMWNGYDFXHG-CYBMUJFWSA-N 0 3 381.108 3.089 10 0 GGAEHN CN(C)[C@@H](CNc1cc(Br)cc(F)c1C(N)=O)Cc1ccccc1 ZINC000094131836 564897419 /nfs/dbraw/zinc/89/74/19/564897419.db2.gz HKXODJNSZDAYHH-CQSZACIVSA-N 0 3 394.288 3.272 10 0 GGAEHN OC[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NCc1ccccc1Br ZINC000095400276 564899010 /nfs/dbraw/zinc/89/90/10/564899010.db2.gz BWBCWGDOLIIYDN-ICSRJNTNSA-N 0 3 389.337 3.422 10 0 GGAEHN CC[C@H](N[C@H]1CCN(C2CCOCC2)C1=O)c1ccc(Br)cc1 ZINC000150981450 564899800 /nfs/dbraw/zinc/89/98/00/564899800.db2.gz MDKSXTYGVXYXBM-IRXDYDNUSA-N 0 3 381.314 3.270 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)NCCc1ccc(Br)s1 ZINC000097413814 564907456 /nfs/dbraw/zinc/90/74/56/564907456.db2.gz JXFLVNJUWNTQHP-LBPRGKRZSA-N 0 3 376.364 3.329 10 0 GGAEHN OCc1ccc(CN[C@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)o1 ZINC000151195050 564909242 /nfs/dbraw/zinc/90/92/42/564909242.db2.gz RSKQZZNFPIIJKQ-NSHDSACASA-N 0 3 375.778 3.208 10 0 GGAEHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1)[C@H]1CCCO1 ZINC000098027052 564911410 /nfs/dbraw/zinc/91/14/10/564911410.db2.gz FZGJZWRIGVSICN-RHSMWYFYSA-N 0 3 398.345 3.090 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)Cc1c[nH]c2cc(Br)ccc12 ZINC000151296971 564913844 /nfs/dbraw/zinc/91/38/44/564913844.db2.gz QXCSKHALEYRSQE-CYBMUJFWSA-N 0 3 378.314 3.464 10 0 GGAEHN CCCC(=O)N[C@H]1CCCN(CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000101563545 564917856 /nfs/dbraw/zinc/91/78/56/564917856.db2.gz RNFWHHJTGAZUFU-INIZCTEOSA-N 0 3 396.329 3.158 10 0 GGAEHN Cc1cc(Br)ccc1CNC[C@@H](O)COc1ccc2c(c1)OCO2 ZINC000151426649 564919949 /nfs/dbraw/zinc/91/99/49/564919949.db2.gz XGAKCSJMAUHRKH-OAHLLOKOSA-N 0 3 394.265 3.016 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CCC[C@@H](N3CCCC3)C2)c1 ZINC000101688199 564920705 /nfs/dbraw/zinc/92/07/05/564920705.db2.gz QRHLRPZKMWKCJN-CQSZACIVSA-N 0 3 398.288 3.300 10 0 GGAEHN Cc1c(Cl)cccc1-n1ccnc1SCC(=O)NC1CCN(C)CC1 ZINC000101987756 564923810 /nfs/dbraw/zinc/92/38/10/564923810.db2.gz FPEGFAWWXHZXAP-UHFFFAOYSA-N 0 3 378.929 3.137 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)Cc2cc(Cl)cc(Cl)c2)[C@H](C)C1 ZINC000151515330 564924504 /nfs/dbraw/zinc/92/45/04/564924504.db2.gz ZCRJDZAVPAJDJI-WBMJQRKESA-N 0 3 379.353 3.485 10 0 GGAEHN Cc1[nH]c(=S)sc1CC(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000102648110 564932060 /nfs/dbraw/zinc/93/20/60/564932060.db2.gz WFXDKTZWLKQPNJ-BETUJISGSA-N 0 3 383.583 3.004 10 0 GGAEHN CC[NH+]1CCC(CCNC(=O)NCc2ccc([O-])c(Br)c2)CC1 ZINC000151767374 564936285 /nfs/dbraw/zinc/93/62/85/564936285.db2.gz QWMMUBRHAHEJFD-UHFFFAOYSA-N 0 3 384.318 3.076 10 0 GGAEHN C[NH+](C)CC1CCC([N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2F)CC1 ZINC000151790591 564936505 /nfs/dbraw/zinc/93/65/05/564936505.db2.gz HQAUUKMUWKTKLA-UHFFFAOYSA-N 0 3 382.423 3.243 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NC[C@H](c1ccccc1)N(C)C ZINC000152046335 564944973 /nfs/dbraw/zinc/94/49/73/564944973.db2.gz LJPBEYVKMMZTPC-QGZVFWFLSA-N 0 3 391.309 3.419 10 0 GGAEHN CCCC[C@H]1CCC[C@@H]1NCc1ccc(S(=O)(=O)N2CCOCC2)s1 ZINC000152145138 564948468 /nfs/dbraw/zinc/94/84/68/564948468.db2.gz OLHPUFJVMHMTPV-RDJZCZTQSA-N 0 3 386.583 3.218 10 0 GGAEHN C[C@@H](CCC1CCCC1)NCc1ccc(S(=O)(=O)N2CCOCC2)s1 ZINC000152150748 564948834 /nfs/dbraw/zinc/94/88/34/564948834.db2.gz YYWQGSSOYXTBFF-HNNXBMFYSA-N 0 3 386.583 3.218 10 0 GGAEHN C[C@H](NC[C@H](O)c1ccc(Br)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000103501088 564949889 /nfs/dbraw/zinc/94/98/89/564949889.db2.gz NGMVMBAYCSQTRQ-SJCJKPOMSA-N 0 3 398.322 3.237 10 0 GGAEHN COc1c(Br)cc(CN[C@@H]2CCCOC2)cc1Br ZINC000103956763 564952053 /nfs/dbraw/zinc/95/20/53/564952053.db2.gz QAEYUNHYPYKLAU-SNVBAGLBSA-N 0 3 379.092 3.489 10 0 GGAEHN COCCN(CCN(C)C)C(=O)N[C@H](C)c1c(Cl)ccc(F)c1Cl ZINC000105167863 564963282 /nfs/dbraw/zinc/96/32/82/564963282.db2.gz BAZHTFRGPPYLGL-LLVKDONJSA-N 0 3 380.291 3.413 10 0 GGAEHN CCOCCN1CCN(CCC(=O)Nc2cc(Cl)ccc2Cl)C[C@@H]1C ZINC000106111431 564977839 /nfs/dbraw/zinc/97/78/39/564977839.db2.gz QOOHFYHMJLVWNC-AWEZNQCLSA-N 0 3 388.339 3.365 10 0 GGAEHN CN(Cc1ccc(Br)cc1F)C1CCN(CCn2cccn2)CC1 ZINC000106130970 564978947 /nfs/dbraw/zinc/97/89/47/564978947.db2.gz RPKFKHVRWKBHIL-UHFFFAOYSA-N 0 3 395.320 3.381 10 0 GGAEHN CN(Cc1ccc(F)cc1Br)C1CCN(CCn2cccn2)CC1 ZINC000106131034 564979408 /nfs/dbraw/zinc/97/94/08/564979408.db2.gz LJUUPCDOFILKKF-UHFFFAOYSA-N 0 3 395.320 3.381 10 0 GGAEHN O[C@H](COc1cc(Cl)ccc1Cl)CN1CCC(Cn2cccn2)CC1 ZINC000106182460 564980346 /nfs/dbraw/zinc/98/03/46/564980346.db2.gz VEVUXEPETVZHNY-INIZCTEOSA-N 0 3 384.307 3.342 10 0 GGAEHN O[C@@H](COc1cc(Cl)ccc1Cl)CN1CCC(Cn2cccn2)CC1 ZINC000106182464 564980460 /nfs/dbraw/zinc/98/04/60/564980460.db2.gz VEVUXEPETVZHNY-MRXNPFEDSA-N 0 3 384.307 3.342 10 0 GGAEHN CN1CCN(CCCNC(=O)[C@@]2(C)CC2(Cl)Cl)[C@H](c2ccccc2)C1 ZINC000106623929 564986220 /nfs/dbraw/zinc/98/62/20/564986220.db2.gz XYXIFIPMTXBTSZ-FUHWJXTLSA-N 0 3 384.351 3.065 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)c2cn(-c3ccc(Br)cc3)cn2)CCN1C ZINC000153247263 564989097 /nfs/dbraw/zinc/98/90/97/564989097.db2.gz BABPFJOWGKFYRD-XJKSGUPXSA-N 0 3 391.313 3.190 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)c2cn(-c3ccc(Br)cc3)cn2)CCN1C ZINC000153247476 564989614 /nfs/dbraw/zinc/98/96/14/564989614.db2.gz BABPFJOWGKFYRD-BBRMVZONSA-N 0 3 391.313 3.190 10 0 GGAEHN CC(C)c1n[nH]c(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)c1Br ZINC000106909653 564991808 /nfs/dbraw/zinc/99/18/08/564991808.db2.gz HASFKNCQDIEVGB-AWEZNQCLSA-N 0 3 393.329 3.198 10 0 GGAEHN COCCN(CCN(C)C)C(=O)N[C@@H](c1ccc(Cl)cc1)C(F)(F)F ZINC000153454037 564996410 /nfs/dbraw/zinc/99/64/10/564996410.db2.gz MVGBVCZVRCRRFH-AWEZNQCLSA-N 0 3 381.826 3.163 10 0 GGAEHN COC(=O)c1cc(Br)ccc1NC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000153551201 565000211 /nfs/dbraw/zinc/00/02/11/565000211.db2.gz JYGYOEMVNSNISP-WCQYABFASA-N 0 3 398.301 3.182 10 0 GGAEHN COC(=O)c1cc(Br)ccc1NC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000153551119 565000553 /nfs/dbraw/zinc/00/05/53/565000553.db2.gz JYGYOEMVNSNISP-DGCLKSJQSA-N 0 3 398.301 3.182 10 0 GGAEHN O=C(c1c[nH]c2cccc(Br)c12)N1CCN(c2ccncc2)CC1 ZINC000153568715 565001628 /nfs/dbraw/zinc/00/16/28/565001628.db2.gz SQIHIZRURUJQHT-UHFFFAOYSA-N 0 3 385.265 3.288 10 0 GGAEHN OC[C@H]1CN(Cc2ccccc2)CC[C@@H]1NCc1ccccc1Br ZINC000108084766 565005621 /nfs/dbraw/zinc/00/56/21/565005621.db2.gz BWBCWGDOLIIYDN-QUCCMNQESA-N 0 3 389.337 3.422 10 0 GGAEHN CC[C@H](CNC(=O)N1CC[C@H](N(C)C)C1)Cc1cccc(Br)c1 ZINC000153827917 565013372 /nfs/dbraw/zinc/01/33/72/565013372.db2.gz QSROQWPCYXKCLG-YOEHRIQHSA-N 0 3 382.346 3.363 10 0 GGAEHN NC(=O)C[C@H]1CCCCN1Cc1ccnc(-c2ccc(Br)cc2)n1 ZINC000153985105 565019962 /nfs/dbraw/zinc/01/99/62/565019962.db2.gz YZOHADAPABYFQA-MRXNPFEDSA-N 0 3 389.297 3.136 10 0 GGAEHN C[C@@H](O)C1CCN(Cc2ccnc(-c3ccc(Br)cc3)n2)CC1 ZINC000154224839 565030215 /nfs/dbraw/zinc/03/02/15/565030215.db2.gz HAIHFKSMOPOWGH-CYBMUJFWSA-N 0 3 376.298 3.499 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(Br)cc1Cl ZINC000110086615 565036266 /nfs/dbraw/zinc/03/62/66/565036266.db2.gz GATYMIGHWWURGE-GFCCVEGCSA-N 0 3 390.709 3.335 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)NC[C@H](C)N(C)C1CC1 ZINC000110698393 565043862 /nfs/dbraw/zinc/04/38/62/565043862.db2.gz ZVNYMXPBYWSGSA-LBPRGKRZSA-N 0 3 378.314 3.311 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1[C@@H](C)C(=O)Nc1ccc(Br)cc1 ZINC000154575600 565044819 /nfs/dbraw/zinc/04/48/19/565044819.db2.gz PTTFGFTXXSWINK-GUYCJALGSA-N 0 3 391.313 3.446 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N1CCC[C@H](N(C)C)C1 ZINC000110788709 565046022 /nfs/dbraw/zinc/04/60/22/565046022.db2.gz ISFULQWGZISARR-AWEZNQCLSA-N 0 3 378.314 3.265 10 0 GGAEHN C[C@@H](O)C1CCN(CCCOc2cccc(I)c2)CC1 ZINC000111287303 565051824 /nfs/dbraw/zinc/05/18/24/565051824.db2.gz IQZXEVYYYNBXHK-CYBMUJFWSA-N 0 3 389.277 3.153 10 0 GGAEHN C[C@H](O)C1CCN(CCCOc2cccc(I)c2)CC1 ZINC000111287302 565052271 /nfs/dbraw/zinc/05/22/71/565052271.db2.gz IQZXEVYYYNBXHK-ZDUSSCGKSA-N 0 3 389.277 3.153 10 0 GGAEHN C[C@H]1CCCN1C1CCN(c2ccccc2S(=O)(=O)C(F)(F)F)CC1 ZINC000154898768 565056108 /nfs/dbraw/zinc/05/61/08/565056108.db2.gz AETNVXQAGZFYBO-ZDUSSCGKSA-N 0 3 376.444 3.433 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)N(C)[C@@H](C)c1ccccc1Br ZINC000111864421 565058342 /nfs/dbraw/zinc/05/83/42/565058342.db2.gz BUFLZNYUBBEWFA-LSDHHAIUSA-N 0 3 398.345 3.262 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)N(C)[C@H](C)c1ccccc1Br ZINC000111864418 565058451 /nfs/dbraw/zinc/05/84/51/565058451.db2.gz BUFLZNYUBBEWFA-CABCVRRESA-N 0 3 398.345 3.262 10 0 GGAEHN O=C(CCN1CCC(OCCCO)CC1)Nc1cc(Cl)ccc1Cl ZINC000155053688 565060630 /nfs/dbraw/zinc/06/06/30/565060630.db2.gz WWAPQNUSPTYDSI-UHFFFAOYSA-N 0 3 375.296 3.185 10 0 GGAEHN CN(C)CCN(CCN(C)C)C(=O)N[C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000155081719 565061413 /nfs/dbraw/zinc/06/14/13/565061413.db2.gz YXILIQRQXQCYTD-MRXNPFEDSA-N 0 3 387.355 3.116 10 0 GGAEHN COCCN1CCC[C@@H]1CNCc1nc(-c2ccc(Br)cc2)c[nH]1 ZINC000112373717 565063396 /nfs/dbraw/zinc/06/33/96/565063396.db2.gz KRYVATMBKNINPD-MRXNPFEDSA-N 0 3 393.329 3.040 10 0 GGAEHN CCc1nc2n(n1)C[C@H](N[C@@H](C)C(=O)Nc1ccc(Cl)c(Cl)c1)CC2 ZINC000112551004 565064361 /nfs/dbraw/zinc/06/43/61/565064361.db2.gz ULVIPARLXUALDF-CMPLNLGQSA-N 0 3 382.295 3.079 10 0 GGAEHN COc1ccc(Br)c(C(=O)N[C@H](Cc2ccccc2)CN(C)C)c1 ZINC000155309406 565065980 /nfs/dbraw/zinc/06/59/80/565065980.db2.gz SKLUCDQDGQEJCE-OAHLLOKOSA-N 0 3 391.309 3.360 10 0 GGAEHN Cc1sc2ncnc(SCC(=O)N3C[C@H]4CCCN4C[C@@H]3C)c2c1C ZINC000113223545 565068382 /nfs/dbraw/zinc/06/83/82/565068382.db2.gz HXKWXWRQRVCOAV-SMDDNHRTSA-N 0 3 376.551 3.095 10 0 GGAEHN C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1[nH]nc(-c2ccccc2)c1Br ZINC000113225468 565068429 /nfs/dbraw/zinc/06/84/29/565068429.db2.gz JCQZNSKVKLHAFE-TZMCWYRMSA-N 0 3 389.297 3.148 10 0 GGAEHN C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1 ZINC000113222304 565068448 /nfs/dbraw/zinc/06/84/48/565068448.db2.gz BUNHZJYYFADIEM-IUODEOHRSA-N 0 3 379.291 3.488 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)cc1OC ZINC000113224771 565068475 /nfs/dbraw/zinc/06/84/75/565068475.db2.gz RYNLRVLATSQIOL-GXTWGEPZSA-N 0 3 397.313 3.165 10 0 GGAEHN CN(C)[C@H](CNC(=O)Cc1ccc(Br)s1)Cc1ccccc1 ZINC000114315144 565073683 /nfs/dbraw/zinc/07/36/83/565073683.db2.gz JRHUWZIASMENBE-AWEZNQCLSA-N 0 3 381.339 3.342 10 0 GGAEHN CN(C)CCOc1cccc(CNC(=O)Cc2ccc(Br)s2)c1 ZINC000114327500 565073871 /nfs/dbraw/zinc/07/38/71/565073871.db2.gz LPMRDSAAWNXNIR-UHFFFAOYSA-N 0 3 397.338 3.310 10 0 GGAEHN CCN(C)Cc1cccc(CNC(=O)C(=O)c2ccc(Br)cc2)c1 ZINC000114319876 565073944 /nfs/dbraw/zinc/07/39/44/565073944.db2.gz GCFVSNFBZROEQA-UHFFFAOYSA-N 0 3 389.293 3.400 10 0 GGAEHN CN(C[C@H]1CCN(C)C1)C(=O)c1ccc(Br)cc1Br ZINC000156051340 565074576 /nfs/dbraw/zinc/07/45/76/565074576.db2.gz PMZYXSSXRLNKPC-JTQLQIEISA-N 0 3 390.119 3.235 10 0 GGAEHN CCN(CCc1nccs1)C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000156173535 565075542 /nfs/dbraw/zinc/07/55/42/565075542.db2.gz DIPAAILAIFWCNK-UHFFFAOYSA-N 0 3 382.599 3.079 10 0 GGAEHN CC[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1cccc(C)c1Br ZINC000156435639 565086897 /nfs/dbraw/zinc/08/68/97/565086897.db2.gz YTKGOBDUQSAKGN-UONOGXRCSA-N 0 3 387.343 3.005 10 0 GGAEHN Cc1nc(C(F)(F)F)c(CS(=O)(=O)C(C)C(=O)NC2CCCCC2)s1 ZINC000183710436 565089966 /nfs/dbraw/zinc/08/99/66/565089966.db2.gz SSIYKXQGEYKVCC-VIFPVBQESA-N 0 3 398.472 3.223 10 0 GGAEHN O=C(CCN1CCC(c2ncc[nH]2)CC1)Nc1cccc(Br)c1 ZINC000266765114 565090473 /nfs/dbraw/zinc/09/04/73/565090473.db2.gz RAKCTVDMCGMTCS-UHFFFAOYSA-N 0 3 377.286 3.380 10 0 GGAEHN Cc1cc(C)n2c(CNCCOc3ccc(Br)cc3)cnc2n1 ZINC000156537493 565094001 /nfs/dbraw/zinc/09/40/01/565094001.db2.gz ICYRJFHZAWPNIV-UHFFFAOYSA-N 0 3 375.270 3.277 10 0 GGAEHN Cc1ccc(C)c(OC[C@H](O)CN[C@@H](CO)c2cccc(Br)c2)c1 ZINC000183885985 565101516 /nfs/dbraw/zinc/10/15/16/565101516.db2.gz AJRLHQHTNRKVMZ-MSOLQXFVSA-N 0 3 394.309 3.129 10 0 GGAEHN C[C@H](CN(C)C[C@H](O)COc1cccc(Br)c1)c1nccs1 ZINC000183938097 565106054 /nfs/dbraw/zinc/10/60/54/565106054.db2.gz WYBUTTGURGLTNM-OCCSQVGLSA-N 0 3 385.327 3.381 10 0 GGAEHN COc1cc(C(=O)N[C@H](Cc2ccccc2)CN(C)C)sc1Br ZINC000157232767 565124110 /nfs/dbraw/zinc/12/41/10/565124110.db2.gz YMIWDDXBRBSONC-CYBMUJFWSA-N 0 3 397.338 3.422 10 0 GGAEHN COc1c(Br)cc(CNCC2(CCO)CC2)cc1Br ZINC000157314774 565128485 /nfs/dbraw/zinc/12/84/85/565128485.db2.gz QKZVMUVSGVFFPN-UHFFFAOYSA-N 0 3 393.119 3.472 10 0 GGAEHN O=C(Nc1ccc([S@@](=O)C(F)(F)F)cc1)N1CC[C@H](N2CCCC2)C1 ZINC000370136908 565130321 /nfs/dbraw/zinc/13/03/21/565130321.db2.gz VWGFDDAMQXOHLJ-ZJWNCGCPSA-N 0 3 375.416 3.016 10 0 GGAEHN CN(CCCN1CCN(C)CC1)C(=O)N[C@@H]1CCCc2sc(Cl)cc21 ZINC000292834160 565137212 /nfs/dbraw/zinc/13/72/12/565137212.db2.gz BQRMCHXVBWAQSJ-OAHLLOKOSA-N 0 3 384.977 3.058 10 0 GGAEHN C[C@H](NC[C@H]1CCCN(S(C)(=O)=O)C1)c1nc(-c2ccccc2)cs1 ZINC000184517002 565140470 /nfs/dbraw/zinc/14/04/70/565140470.db2.gz FCWDNGKPKXGFRP-LSDHHAIUSA-N 0 3 379.551 3.132 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)c1ccc(Sc2ccccc2Cl)nn1 ZINC000268145426 565142409 /nfs/dbraw/zinc/14/24/09/565142409.db2.gz ODRSGMPDXATDIB-ZDUSSCGKSA-N 0 3 376.913 3.447 10 0 GGAEHN C[C@@](O)(CN1CCC2(CC1)OCCCO2)c1ccc(Br)cc1F ZINC000292951685 565143416 /nfs/dbraw/zinc/14/34/16/565143416.db2.gz IROQRQZHVONTNC-MRXNPFEDSA-N 0 3 388.277 3.025 10 0 GGAEHN COC(=O)c1cc(NC(=O)CC2CCN(C)CC2)cc(Br)c1F ZINC000292984516 565144781 /nfs/dbraw/zinc/14/47/81/565144781.db2.gz RRTMIXUJSZJIRP-UHFFFAOYSA-N 0 3 387.249 3.045 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)NCc2cc3cc(Br)ccc3[nH]2)C1 ZINC000184738638 565155263 /nfs/dbraw/zinc/15/52/63/565155263.db2.gz ZHBBBRNEWHTKOX-CQSZACIVSA-N 0 3 379.302 3.214 10 0 GGAEHN OCCN(Cc1ccc(Cl)c(Cl)c1)C[C@@H](O)COCc1ccccc1 ZINC000158131182 565157671 /nfs/dbraw/zinc/15/76/71/565157671.db2.gz WFAHGOFDPSKBQE-QGZVFWFLSA-N 0 3 384.303 3.365 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)Cc2c[nH]c3cc(Br)ccc23)CCN1C ZINC000158450189 565170206 /nfs/dbraw/zinc/17/02/06/565170206.db2.gz ZDOQPQKSGQWRIG-DOMZBBRYSA-N 0 3 378.314 3.414 10 0 GGAEHN CC(=O)NC1CCC(N[C@@H](C)c2ccccc2I)CC1 ZINC000268852827 565170846 /nfs/dbraw/zinc/17/08/46/565170846.db2.gz POTVUFSGIVCLHJ-XGNXJENSSA-N 0 3 386.277 3.389 10 0 GGAEHN Cc1cnn([C@@H]2CCN(C[C@](C)(O)c3ccc(Br)cc3F)C2)c1 ZINC000293533492 565173785 /nfs/dbraw/zinc/17/37/85/565173785.db2.gz JPHXTEPBZBHEJR-PBHICJAKSA-N 0 3 382.277 3.248 10 0 GGAEHN C[C@@H](CCN1CCN(C)CC1)NC(=O)N[C@@H]1CCCc2sc(Cl)cc21 ZINC000293596966 565175795 /nfs/dbraw/zinc/17/57/95/565175795.db2.gz ZLZRPRDKQMSRKK-DZGCQCFKSA-N 0 3 384.977 3.104 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)Nc2ccnn2Cc2cccc(Cl)c2Cl)C1 ZINC000158765658 565181122 /nfs/dbraw/zinc/18/11/22/565181122.db2.gz NARQNCHCDFJUOW-CYBMUJFWSA-N 0 3 382.295 3.406 10 0 GGAEHN C[C@@](O)(CN1CCC[C@H](c2ncc[nH]2)C1)c1ccc(Br)cc1F ZINC000293836415 565186872 /nfs/dbraw/zinc/18/68/72/565186872.db2.gz QECSLLIXUWWOFC-YVEFUNNKSA-N 0 3 382.277 3.398 10 0 GGAEHN O=C1COc2ccccc2N1CCCNCc1ccc(Br)c(F)c1 ZINC000159113168 565194360 /nfs/dbraw/zinc/19/43/60/565194360.db2.gz AKSUCYJSUGOVSA-UHFFFAOYSA-N 0 3 393.256 3.494 10 0 GGAEHN O=C(NCc1cc2cc(Br)ccc2[nH]1)N1CC[C@@H](N2CC=CC2)C1 ZINC000185567758 565208586 /nfs/dbraw/zinc/20/85/86/565208586.db2.gz MRALFIAUYSJDMN-MRXNPFEDSA-N 0 3 389.297 3.086 10 0 GGAEHN O=C(NCc1cc2cc(Br)ccc2[nH]1)N1CC[C@H](N2CC=CC2)C1 ZINC000185567739 565208911 /nfs/dbraw/zinc/20/89/11/565208911.db2.gz MRALFIAUYSJDMN-INIZCTEOSA-N 0 3 389.297 3.086 10 0 GGAEHN O=C(c1cc(Br)ccc1Br)N1CCN2CCC[C@H]2C1 ZINC000160398993 565243650 /nfs/dbraw/zinc/24/36/50/565243650.db2.gz JOPMHQBDWFMDSK-NSHDSACASA-N 0 3 388.103 3.132 10 0 GGAEHN CC[C@H](Cc1ccccc1Br)N(C)C[C@@H](C)CS(C)(=O)=O ZINC000185923316 565228934 /nfs/dbraw/zinc/22/89/34/565228934.db2.gz MRMBECHRMDQNHJ-UKRRQHHQSA-N 0 3 376.360 3.383 10 0 GGAEHN O=C1C[C@H]([C@H]2CCCCN2Cc2cc(Br)cc3cccnc32)CN1 ZINC000372334640 565232611 /nfs/dbraw/zinc/23/26/11/565232611.db2.gz RVMYZUBVPZCXJI-WMLDXEAASA-N 0 3 388.309 3.488 10 0 GGAEHN Brc1ccc([C@H](NCCN2CCCCC2)c2cncnc2)cc1 ZINC000186099511 565239749 /nfs/dbraw/zinc/23/97/49/565239749.db2.gz YZDWQKZQQIYDEB-SFHVURJKSA-N 0 3 375.314 3.404 10 0 GGAEHN Cn1cc(CCCN[C@@H](c2ccc(Br)cc2)c2cncnc2)cn1 ZINC000186163501 565243581 /nfs/dbraw/zinc/24/35/81/565243581.db2.gz GEFWGPYVYMESNY-SFHVURJKSA-N 0 3 386.297 3.284 10 0 GGAEHN O=C(c1cc(Br)ccc1Br)N1CCN2CCC[C@@H]2C1 ZINC000160398913 565243975 /nfs/dbraw/zinc/24/39/75/565243975.db2.gz JOPMHQBDWFMDSK-LLVKDONJSA-N 0 3 388.103 3.132 10 0 GGAEHN CCN(Cc1cccc(Br)c1)C(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C ZINC000372570444 565245147 /nfs/dbraw/zinc/24/51/47/565245147.db2.gz LFCSDGFIXVJUTH-FRQCXROJSA-N 0 3 395.341 3.330 10 0 GGAEHN O=C(CCN1CCC[C@H](c2ccncn2)C1)Nc1ccccc1Br ZINC000372578016 565246767 /nfs/dbraw/zinc/24/67/67/565246767.db2.gz JCJNJEIVBSCDAJ-AWEZNQCLSA-N 0 3 389.297 3.447 10 0 GGAEHN COc1ccc(Cl)cc1C[C@H]1CCCN(CC2CCS(=O)(=O)CC2)C1 ZINC000271295432 565247438 /nfs/dbraw/zinc/24/74/38/565247438.db2.gz NNWWKJJBANSOLG-MRXNPFEDSA-N 0 3 385.957 3.428 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)c1cc(Br)ccc1Br ZINC000160535969 565248895 /nfs/dbraw/zinc/24/88/95/565248895.db2.gz CBBGYAOUEBYXIV-NSHDSACASA-N 0 3 390.119 3.378 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)c1cc(Br)ccc1Br ZINC000160536096 565249485 /nfs/dbraw/zinc/24/94/85/565249485.db2.gz CBBGYAOUEBYXIV-LLVKDONJSA-N 0 3 390.119 3.378 10 0 GGAEHN CCO[C@H]1C[C@@H](NCc2cc3c(c(Br)c2)OCO3)C12CCOCC2 ZINC000186277983 565250686 /nfs/dbraw/zinc/25/06/86/565250686.db2.gz MEEJCMSOKJZWKI-CVEARBPZSA-N 0 3 398.297 3.242 10 0 GGAEHN Brc1ccc([C@@H](N[C@@H]2CCc3n[nH]cc3C2)c2cncnc2)cc1 ZINC000186287561 565252431 /nfs/dbraw/zinc/25/24/31/565252431.db2.gz LKVHLNARCSGWND-SJLPKXTDSA-N 0 3 384.281 3.199 10 0 GGAEHN CS(=O)(=O)[C@@H]1CCC[C@@H](N[C@H]2CCOc3c(Br)cccc32)C1 ZINC000271496354 565255441 /nfs/dbraw/zinc/25/54/41/565255441.db2.gz MLADHOVTYVKFHK-JMSVASOKSA-N 0 3 388.327 3.218 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N(C)[C@H](C)C1CCN(C)CC1 ZINC000272243508 565282135 /nfs/dbraw/zinc/28/21/35/565282135.db2.gz XXKKEHJSABBOAA-CYBMUJFWSA-N 0 3 383.330 3.189 10 0 GGAEHN O=S(=O)(c1c(Cl)ccnc1Cl)N1CCCC[C@@H](N2CCCC2)C1 ZINC000272253214 565282411 /nfs/dbraw/zinc/28/24/11/565282411.db2.gz TVHLWYVZYKSJTG-GFCCVEGCSA-N 0 3 378.325 3.027 10 0 GGAEHN CCc1nc(CC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cs1 ZINC000373418810 565284071 /nfs/dbraw/zinc/28/40/71/565284071.db2.gz SFPXNQCHHCZABH-UHFFFAOYSA-N 0 3 375.460 3.170 10 0 GGAEHN O=C(CSCc1cscn1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000373418384 565284126 /nfs/dbraw/zinc/28/41/26/565284126.db2.gz PZGMDUQQEASCLR-UHFFFAOYSA-N 0 3 393.500 3.298 10 0 GGAEHN O=C(NCCc1cccs1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000373430519 565285437 /nfs/dbraw/zinc/28/54/37/565285437.db2.gz KWRZCSGJYQNMII-UHFFFAOYSA-N 0 3 375.460 3.395 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)c1coc(-c2ccc(Br)cc2F)n1 ZINC000272416323 565287533 /nfs/dbraw/zinc/28/75/33/565287533.db2.gz LYWVZNNFMCRWNS-GFCCVEGCSA-N 0 3 396.260 3.409 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)c1coc(-c2ccc(Br)cc2F)n1 ZINC000272416326 565287991 /nfs/dbraw/zinc/28/79/91/565287991.db2.gz LYWVZNNFMCRWNS-LBPRGKRZSA-N 0 3 396.260 3.409 10 0 GGAEHN NC(=O)COc1cccc(CN[C@H]2CCc3c2ccc(F)c3Br)c1 ZINC000295866231 565290449 /nfs/dbraw/zinc/29/04/49/565290449.db2.gz XBQQNNODMSQVHC-INIZCTEOSA-N 0 3 393.256 3.229 10 0 GGAEHN O=C1[C@@H](N[C@H]2CCCc3cc(Br)ccc32)CCN1C1CCOCC1 ZINC000373565278 565292305 /nfs/dbraw/zinc/29/23/05/565292305.db2.gz ZOKZSGIJUOTIRB-ROUUACIJSA-N 0 3 393.325 3.196 10 0 GGAEHN O=C1[C@H](N[C@H]2CCCc3cc(Br)ccc32)CCN1C1CCOCC1 ZINC000373565279 565292830 /nfs/dbraw/zinc/29/28/30/565292830.db2.gz ZOKZSGIJUOTIRB-ZWKOTPCHSA-N 0 3 393.325 3.196 10 0 GGAEHN O=C1[C@@H](N[C@@H]2CCCc3cc(Br)ccc32)CCN1C1CCOCC1 ZINC000373565276 565293055 /nfs/dbraw/zinc/29/30/55/565293055.db2.gz ZOKZSGIJUOTIRB-MSOLQXFVSA-N 0 3 393.325 3.196 10 0 GGAEHN NC(=O)C[C@@H](NCc1nc2cc(Br)ccc2[nH]1)C1CCCCC1 ZINC000161924233 565297558 /nfs/dbraw/zinc/29/75/58/565297558.db2.gz MGVNVUFSQUFAAJ-CQSZACIVSA-N 0 3 379.302 3.239 10 0 GGAEHN NC(=O)C[C@@H](NCc1nc2ccc(Br)cc2[nH]1)C1CCCCC1 ZINC000161924233 565297562 /nfs/dbraw/zinc/29/75/62/565297562.db2.gz MGVNVUFSQUFAAJ-CQSZACIVSA-N 0 3 379.302 3.239 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)N[C@@H](C)C(=O)NCc1ccco1 ZINC000161985275 565300473 /nfs/dbraw/zinc/30/04/73/565300473.db2.gz CDIVZNKHCZVDTI-NEPJUHHUSA-N 0 3 383.261 3.407 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1C[C@H](O)c1ccc(F)c(Br)c1 ZINC000187125802 565311389 /nfs/dbraw/zinc/31/13/89/565311389.db2.gz ORKLMHRUCKREHF-YOEHRIQHSA-N 0 3 382.277 3.291 10 0 GGAEHN CCn1ccnc1CNC1CCN(Cc2ccccc2Br)CC1 ZINC000296390536 565315754 /nfs/dbraw/zinc/31/57/54/565315754.db2.gz KAHVIKPLAXGOHQ-UHFFFAOYSA-N 0 3 377.330 3.420 10 0 GGAEHN COc1c(Br)cccc1CN[C@@H]1CCc2nc(C(C)C)nn2C1 ZINC000187219202 565317045 /nfs/dbraw/zinc/31/70/45/565317045.db2.gz VGMHQFRBLCELBJ-CYBMUJFWSA-N 0 3 379.302 3.277 10 0 GGAEHN Cc1cnn(CCNCc2cc(Br)cc(Br)c2N)c1 ZINC000187297658 565321542 /nfs/dbraw/zinc/32/15/42/565321542.db2.gz ZZCXGTLGCQQPRX-UHFFFAOYSA-N 0 3 388.107 3.089 10 0 GGAEHN CC[C@@H](NCCc1ncccc1C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000296639516 565327565 /nfs/dbraw/zinc/32/75/65/565327565.db2.gz XZGIANBUXJRRPO-MRXNPFEDSA-N 0 3 381.929 3.235 10 0 GGAEHN CC[C@H](NCCc1ncccc1C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000296639514 565327860 /nfs/dbraw/zinc/32/78/60/565327860.db2.gz XZGIANBUXJRRPO-INIZCTEOSA-N 0 3 381.929 3.235 10 0 GGAEHN Cc1cc(C)c(NC(=O)NC[C@H](O)CN2CCCCC2)cc1Br ZINC000187552409 565340857 /nfs/dbraw/zinc/34/08/57/565340857.db2.gz BIPVMFKAZIEZJK-AWEZNQCLSA-N 0 3 384.318 3.034 10 0 GGAEHN CS[C@H]1CN(CC(=O)Nc2c(Cl)cccc2Cl)C[C@H]1N1CCCC1 ZINC000273934068 565347022 /nfs/dbraw/zinc/34/70/22/565347022.db2.gz CLGNONGHVYFEMX-CABCVRRESA-N 0 3 388.364 3.444 10 0 GGAEHN CS[C@H]1CN(CC(=O)Nc2cccc(Cl)c2Cl)C[C@@H]1N1CCCC1 ZINC000273966786 565349838 /nfs/dbraw/zinc/34/98/38/565349838.db2.gz GHKFNIPYIUAQQR-GJZGRUSLSA-N 0 3 388.364 3.444 10 0 GGAEHN O=C1C[C@@H]([C@@H]2CCCCN2Cc2ccc(Br)c3cccnc23)CN1 ZINC000374894631 565358896 /nfs/dbraw/zinc/35/88/96/565358896.db2.gz LTBXZSHDMYBWET-PBHICJAKSA-N 0 3 388.309 3.488 10 0 GGAEHN O=C1C[C@H]([C@@H]2CCCCN2Cc2ccc(Br)c3cccnc23)CN1 ZINC000374894855 565359059 /nfs/dbraw/zinc/35/90/59/565359059.db2.gz LTBXZSHDMYBWET-YOEHRIQHSA-N 0 3 388.309 3.488 10 0 GGAEHN CC(C(=O)N1CCc2sccc2C1)S(=O)(=O)Cc1cccc(Cl)c1 ZINC000375009668 565363766 /nfs/dbraw/zinc/36/37/66/565363766.db2.gz YYNUUIXPDYHJHY-LBPRGKRZSA-N 0 3 383.922 3.290 10 0 GGAEHN CCOc1cc(CN[C@@H]2COc3ccccc3[C@H]2O)cc(Br)c1O ZINC000297405825 565371362 /nfs/dbraw/zinc/37/13/62/565371362.db2.gz KVBQDVSSOYKBGW-RHSMWYFYSA-N 0 3 394.265 3.138 10 0 GGAEHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(F)cc2CSC)cc1 ZINC000167132074 565377357 /nfs/dbraw/zinc/37/73/57/565377357.db2.gz OYEFYJDJJNEBNS-CYBMUJFWSA-N 0 3 382.526 3.448 10 0 GGAEHN CC(C)N1CC[C@@H](NCCCS(C)(=O)=O)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000170616754 565383105 /nfs/dbraw/zinc/38/31/05/565383105.db2.gz HXJFIINVPIYTIM-SJORKVTESA-N 0 3 376.925 3.027 10 0 GGAEHN CC(C)N1CC[C@H](NCCCS(C)(=O)=O)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000170616753 565383274 /nfs/dbraw/zinc/38/32/74/565383274.db2.gz HXJFIINVPIYTIM-IRXDYDNUSA-N 0 3 376.925 3.027 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cccn2Cc2cccs2)C[C@H]1N1CCCC1 ZINC000275075377 565392869 /nfs/dbraw/zinc/39/28/69/565392869.db2.gz CMBDRZNOJWYHTM-MSOLQXFVSA-N 0 3 375.563 3.250 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)CCCc1ccc(Br)s1 ZINC000170809235 565392846 /nfs/dbraw/zinc/39/28/46/565392846.db2.gz UWDMSHJZEDFCOB-ZDUSSCGKSA-N 0 3 389.359 3.060 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)NCC2(c3ccc(Br)cc3)CCC2)C1 ZINC000170833151 565394321 /nfs/dbraw/zinc/39/43/21/565394321.db2.gz ANFAZDUUWYBTLQ-MRXNPFEDSA-N 0 3 380.330 3.216 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)Cc2csc(COc3ccc(Cl)cc3)n2)C1 ZINC000170857547 565395638 /nfs/dbraw/zinc/39/56/38/565395638.db2.gz ZRGWIVZTSDIQKV-OAHLLOKOSA-N 0 3 379.913 3.081 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)CCc2ncc(-c3ccccc3Br)o2)C1 ZINC000170855832 565396240 /nfs/dbraw/zinc/39/62/40/565396240.db2.gz MMDLJYKTHDEWRH-ZDUSSCGKSA-N 0 3 392.297 3.199 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)COc2ccc3ccccc3c2Br)C1 ZINC000170867165 565396871 /nfs/dbraw/zinc/39/68/71/565396871.db2.gz YGAKKLNIPXSVIE-CQSZACIVSA-N 0 3 377.282 3.144 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)c2cccnc2Oc2cccc(Br)c2)C1 ZINC000170866177 565396963 /nfs/dbraw/zinc/39/69/63/565396963.db2.gz SKVKLARRBSABIC-CQSZACIVSA-N 0 3 390.281 3.413 10 0 GGAEHN CC(C)[C@@H](C)NC(=O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000170913585 565398477 /nfs/dbraw/zinc/39/84/77/565398477.db2.gz QVWOGXSZJHXWEY-CQSZACIVSA-N 0 3 383.330 3.205 10 0 GGAEHN O=C(c1cc(Cl)c[nH]1)N1CCC(NCc2ccc(Br)o2)CC1 ZINC000375749034 565403474 /nfs/dbraw/zinc/40/34/74/565403474.db2.gz BABSNLBAUZSLGL-UHFFFAOYSA-N 0 3 386.677 3.418 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)Nc2ccc(Br)cc2Br)C1 ZINC000171070071 565406688 /nfs/dbraw/zinc/40/66/88/565406688.db2.gz ZYDMJMNIDJPFPC-JTQLQIEISA-N 0 3 391.107 3.379 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)Nc2ccc(I)cc2Cl)C1 ZINC000171075060 565407930 /nfs/dbraw/zinc/40/79/30/565407930.db2.gz NIAMFENJFCWPOH-JTQLQIEISA-N 0 3 393.656 3.112 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)Nc2cc(Br)ccc2Br)C1 ZINC000171074924 565408008 /nfs/dbraw/zinc/40/80/08/565408008.db2.gz IVSSUQUBMXJCOW-JTQLQIEISA-N 0 3 391.107 3.379 10 0 GGAEHN COCCCN1CCC(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)CC1 ZINC000171126624 565411492 /nfs/dbraw/zinc/41/14/92/565411492.db2.gz PRTBMRWOVGAEQJ-CYBMUJFWSA-N 0 3 389.323 3.378 10 0 GGAEHN COCCCN1CCC(NC(=O)N[C@H](C)c2ccccc2Br)CC1 ZINC000171191115 565417171 /nfs/dbraw/zinc/41/71/71/565417171.db2.gz DPWLTZREESGISJ-CQSZACIVSA-N 0 3 398.345 3.310 10 0 GGAEHN CC(C)(C)N1CC[C@H](NCCS(C)(=O)=O)[C@H]1c1ccc(Cl)c(F)c1 ZINC000298535754 565419608 /nfs/dbraw/zinc/41/96/08/565419608.db2.gz MQIQKQKVBVHWHQ-JKSUJKDBSA-N 0 3 376.925 3.027 10 0 GGAEHN Oc1ccccc1CCNCc1ccc(Br)cc1N1CCOCC1 ZINC000188719778 565419700 /nfs/dbraw/zinc/41/97/00/565419700.db2.gz FEFOZSPJAROUSC-UHFFFAOYSA-N 0 3 391.309 3.324 10 0 GGAEHN CCOc1cc(CNCC[S@](=O)C(C)(C)C)cc(Br)c1O ZINC000298575911 565421294 /nfs/dbraw/zinc/42/12/94/565421294.db2.gz XIJCIWRGTYTOBO-NRFANRHFSA-N 0 3 378.332 3.190 10 0 GGAEHN COC(=O)[C@H](C)CN(C[C@H](O)COc1c(Cl)cccc1Cl)C1CC1 ZINC000171300303 565425074 /nfs/dbraw/zinc/42/50/74/565425074.db2.gz CVLJGVPGYPZZAL-YPMHNXCESA-N 0 3 376.280 3.007 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)N(CCCO)Cc2ccc(Cl)c(Cl)c2)C1 ZINC000171316854 565426142 /nfs/dbraw/zinc/42/61/42/565426142.db2.gz VIFNAKAZNYQLOV-OAHLLOKOSA-N 0 3 388.339 3.372 10 0 GGAEHN C[C@@H]1CN(Cc2ccc(Br)c(F)c2)CC[C@@H]1N1CCN(C)CC1 ZINC000376202799 565426491 /nfs/dbraw/zinc/42/64/91/565426491.db2.gz FQBTYZPWHDKKQH-KDOFPFPSSA-N 0 3 384.337 3.046 10 0 GGAEHN Cn1cc([C@@H]2CCCN2CCC(=O)Nc2ccc(Br)cc2F)cn1 ZINC000171412508 565430129 /nfs/dbraw/zinc/43/01/29/565430129.db2.gz MRUNYNRIRWIWHF-INIZCTEOSA-N 0 3 395.276 3.487 10 0 GGAEHN COc1cccc(NC(=O)CCN[C@@H](CO)c2cccc(Br)c2)c1 ZINC000298887998 565432938 /nfs/dbraw/zinc/43/29/38/565432938.db2.gz KXTNMYDBWFPTIE-KRWDZBQOSA-N 0 3 393.281 3.110 10 0 GGAEHN CC[C@H]1CN(CCOc2cc(F)cc(Br)c2)CCN1CCOC ZINC000188956690 565435551 /nfs/dbraw/zinc/43/55/51/565435551.db2.gz LYWSSCSJKKTEHH-INIZCTEOSA-N 0 3 389.309 3.010 10 0 GGAEHN O=S(=O)(c1ccc(Cl)nc1Cl)N1CCCC[C@H](N2CCCC2)C1 ZINC000171645370 565442143 /nfs/dbraw/zinc/44/21/43/565442143.db2.gz FYLUIUQXLDWEDE-LBPRGKRZSA-N 0 3 378.325 3.027 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2sccc2Br)n1 ZINC000276291295 565444070 /nfs/dbraw/zinc/44/40/70/565444070.db2.gz ZWZLUARYHSXZEF-UHFFFAOYSA-N 0 3 375.313 3.476 10 0 GGAEHN O=S(=O)(CCO)c1ccc(CN[C@@H](c2ccc(Cl)cc2)C2CC2)cc1 ZINC000189169710 565448969 /nfs/dbraw/zinc/44/89/69/565448969.db2.gz YGOUSDXQABPXMK-LJQANCHMSA-N 0 3 379.909 3.347 10 0 GGAEHN O[C@H](COc1cccc(Br)c1)CN1CCC([C@@H]2CCCO2)CC1 ZINC000189170232 565449588 /nfs/dbraw/zinc/44/95/88/565449588.db2.gz MBTFWIDDFWOXDT-WMZOPIPTSA-N 0 3 384.314 3.080 10 0 GGAEHN O=C(NC[C@H]1CN2CCC[C@H]2CO1)Nc1cc(Cl)ccc1C(F)(F)F ZINC000376742825 565452427 /nfs/dbraw/zinc/45/24/27/565452427.db2.gz JFLHKZFRDQCVLZ-RYUDHWBXSA-N 0 3 377.794 3.344 10 0 GGAEHN C[C@H](CCc1ccc(Br)cc1)NC(=O)N1CCN2CCC[C@@H]2C1 ZINC000171903866 565456428 /nfs/dbraw/zinc/45/64/28/565456428.db2.gz GXBKBRNYCUXIOA-RHSMWYFYSA-N 0 3 380.330 3.260 10 0 GGAEHN CC(C)(CNC(=O)N1CCN2CCC[C@H]2C1)c1ccc(Br)cc1 ZINC000171902270 565456524 /nfs/dbraw/zinc/45/65/24/565456524.db2.gz KXHAMZMTJZQVNW-INIZCTEOSA-N 0 3 380.330 3.216 10 0 GGAEHN CC(C)(CNC(=O)N1CCN2CCC[C@@H]2C1)c1ccc(Br)cc1 ZINC000171902269 565456810 /nfs/dbraw/zinc/45/68/10/565456810.db2.gz KXHAMZMTJZQVNW-MRXNPFEDSA-N 0 3 380.330 3.216 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)NC[C@@H](C)N(C)C1CC1 ZINC000189362363 565461615 /nfs/dbraw/zinc/46/16/15/565461615.db2.gz WOAJKCRQZWPEFI-VXGBXAGGSA-N 0 3 384.318 3.301 10 0 GGAEHN O=C(C[C@@H]1CSCCS1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000376973628 565461959 /nfs/dbraw/zinc/46/19/59/565461959.db2.gz XJXMRRFIDIIVHH-JXQTWKCFSA-N 0 3 382.517 3.147 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)NC[C@@H]1CCCN(C)C1 ZINC000189489936 565468902 /nfs/dbraw/zinc/46/89/02/565468902.db2.gz MPXBTBGQUBWEAB-OLZOCXBDSA-N 0 3 384.318 3.160 10 0 GGAEHN Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)N1CCO[C@H](CN(C)C)C1 ZINC000172305048 565476607 /nfs/dbraw/zinc/47/66/07/565476607.db2.gz YCKNJGVJHYBRLW-OAHLLOKOSA-N 0 3 379.913 3.175 10 0 GGAEHN CCN1CCN(C[C@@H](C)CNC(=O)c2c(Cl)cc(F)cc2Cl)CC1 ZINC000277177487 565481524 /nfs/dbraw/zinc/48/15/24/565481524.db2.gz DPMSYWKWYFDXFJ-LBPRGKRZSA-N 0 3 376.303 3.136 10 0 GGAEHN CC[C@@H](CO)N1CCN(c2ccc3cc(Br)c(F)cc3n2)CC1 ZINC000301531067 565493605 /nfs/dbraw/zinc/49/36/05/565493605.db2.gz HRYJAFWOZXOINS-ZDUSSCGKSA-N 0 3 382.277 3.029 10 0 GGAEHN CCN1CCC[C@@H]1CN(Cc1ccncc1)c1ncc(Br)cn1 ZINC000301540756 565493764 /nfs/dbraw/zinc/49/37/64/565493764.db2.gz JWZUFDASKNISRB-MRXNPFEDSA-N 0 3 376.302 3.125 10 0 GGAEHN OC[C@@H](NCCOCC(F)(F)C(F)(F)F)c1cccc(Br)c1 ZINC000189882085 565494923 /nfs/dbraw/zinc/49/49/23/565494923.db2.gz MYYQLIDBSUHAIY-LLVKDONJSA-N 0 3 392.162 3.286 10 0 GGAEHN COc1cc(CNCC2(CCO)CC2)cc(Br)c1OC(F)F ZINC000189995397 565500968 /nfs/dbraw/zinc/50/09/68/565500968.db2.gz MLMZTFOFNUJFTQ-UHFFFAOYSA-N 0 3 380.229 3.311 10 0 GGAEHN Brc1csc(-c2noc(CN3CCN4CCCC[C@@H]4C3)n2)c1 ZINC000172803161 565504892 /nfs/dbraw/zinc/50/48/92/565504892.db2.gz QOKPVCUFUXRRFX-GFCCVEGCSA-N 0 3 383.315 3.231 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1CC[C@@H](O)[C@H](C)C1 ZINC000190057832 565505542 /nfs/dbraw/zinc/50/55/42/565505542.db2.gz AVTHREXUFSHSEN-KZULUSFZSA-N 0 3 378.314 3.454 10 0 GGAEHN Brc1ccc2ncnc(NC3CCN([C@@H]4CCOC4)CC3)c2c1 ZINC000301726619 565506781 /nfs/dbraw/zinc/50/67/81/565506781.db2.gz QIUBBQMZFAEJTO-CQSZACIVSA-N 0 3 377.286 3.058 10 0 GGAEHN CCC[C@H]1CN(c2ncnc3ccc(Br)cc32)CCN1CCOC ZINC000301934882 565520192 /nfs/dbraw/zinc/52/01/92/565520192.db2.gz QOVMWWLFWDMMNA-HNNXBMFYSA-N 0 3 393.329 3.329 10 0 GGAEHN Cc1nccn1CCCCNC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000173024384 565520373 /nfs/dbraw/zinc/52/03/73/565520373.db2.gz VNIYYYLDNTYGKD-UHFFFAOYSA-N 0 3 376.258 3.041 10 0 GGAEHN C[C@@H]1CN(C(=O)c2cc(Cl)sc2Cl)CC[C@H]1N1CCN(C)CC1 ZINC000378322005 565521375 /nfs/dbraw/zinc/52/13/75/565521375.db2.gz ZPEQVGMOUUQHIC-DGCLKSJQSA-N 0 3 376.353 3.153 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)CCc2nc3cc(Br)ccc3s2)C1 ZINC000173045691 565522534 /nfs/dbraw/zinc/52/25/34/565522534.db2.gz RUQKDANARRWLBE-GFCCVEGCSA-N 0 3 382.327 3.154 10 0 GGAEHN CN1CCC2(CCCN2C(=O)c2n[nH]c3ccc(Br)cc32)CC1 ZINC000378334852 565522731 /nfs/dbraw/zinc/52/27/31/565522731.db2.gz NPBSVYZCDVILDK-UHFFFAOYSA-N 0 3 377.286 3.026 10 0 GGAEHN CN(C)C[C@@H]1CN(c2ccc3cc(Br)cc(Cl)c3n2)CCO1 ZINC000302016765 565525942 /nfs/dbraw/zinc/52/59/42/565525942.db2.gz LXRXJWLQIVUQNL-CYBMUJFWSA-N 0 3 384.705 3.418 10 0 GGAEHN COC[C@H](O)CN1CCC(Nc2nc(-c3ccccc3Cl)cs2)CC1 ZINC000302116051 565532034 /nfs/dbraw/zinc/53/20/34/565532034.db2.gz CAEWDMMCVAPJBU-CQSZACIVSA-N 0 3 381.929 3.347 10 0 GGAEHN Cc1ncc(/C=C/C(=O)N2CC[C@H](CN(C)Cc3scnc3C)C2)s1 ZINC000190515070 565537900 /nfs/dbraw/zinc/53/79/00/565537900.db2.gz FRCOWHBSKVZGTC-MBVDDHJVSA-N 0 3 376.551 3.210 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)Nc2ccnc(Cl)c2)C1 ZINC000190509068 565537915 /nfs/dbraw/zinc/53/79/15/565537915.db2.gz ILYXMVJVZQITDZ-CYBMUJFWSA-N 0 3 379.917 3.486 10 0 GGAEHN Cn1ncc(Br)c1CNC[C@H]1CCCCN1Cc1ccccc1 ZINC000379632507 565538351 /nfs/dbraw/zinc/53/83/51/565538351.db2.gz NTFVCLDUFOMLOW-MRXNPFEDSA-N 0 3 377.330 3.327 10 0 GGAEHN C[C@@H](CCN1CCN(C)CC1)Nc1ccc2cccc(Br)c2n1 ZINC000302231272 565538410 /nfs/dbraw/zinc/53/84/10/565538410.db2.gz CCMKFCOZCFYBDU-AWEZNQCLSA-N 0 3 377.330 3.435 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)c2csc(C3CC3)n2)C1 ZINC000190537566 565539775 /nfs/dbraw/zinc/53/97/75/565539775.db2.gz BLAFVOUPAVXLFH-ZDUSSCGKSA-N 0 3 376.551 3.380 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)c2scnc2C2CC2)C1 ZINC000190533326 565540317 /nfs/dbraw/zinc/54/03/17/565540317.db2.gz JXVMLJZSDVIQRJ-CYBMUJFWSA-N 0 3 376.551 3.380 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)CSCc2cscn2)C1 ZINC000190541446 565540430 /nfs/dbraw/zinc/54/04/30/565540430.db2.gz IYKINDPMLBTHPX-CQSZACIVSA-N 0 3 396.607 3.122 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)c2scnc2C2CC2)C1 ZINC000190533301 565540487 /nfs/dbraw/zinc/54/04/87/565540487.db2.gz JXVMLJZSDVIQRJ-ZDUSSCGKSA-N 0 3 376.551 3.380 10 0 GGAEHN COCc1ccsc1C(=O)N1CC[C@H](CN(C)Cc2scnc2C)C1 ZINC000190533528 565540514 /nfs/dbraw/zinc/54/05/14/565540514.db2.gz OBNIGLFNFRXMCC-CQSZACIVSA-N 0 3 379.551 3.254 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)c2cc(Br)c[nH]2)C1 ZINC000190544449 565541528 /nfs/dbraw/zinc/54/15/28/565541528.db2.gz AXXIYOPWEQCNHN-GFCCVEGCSA-N 0 3 397.342 3.136 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)Cc2ccc(Cl)c(Cl)c2)[C@H](C)C1 ZINC000173258114 565541809 /nfs/dbraw/zinc/54/18/09/565541809.db2.gz ZGRLURAPVCYLLL-MLGOLLRUSA-N 0 3 379.353 3.485 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(C)c(C(F)(F)F)c2)[C@H](C)C1 ZINC000173257187 565542008 /nfs/dbraw/zinc/54/20/08/565542008.db2.gz NFWRBMRCLGCOCN-CZUORRHYSA-N 0 3 378.460 3.365 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(Br)c(C)c2)[C@H](C)C1 ZINC000173256303 565542077 /nfs/dbraw/zinc/54/20/77/565542077.db2.gz BPZCTKLDXHJDCC-CZUORRHYSA-N 0 3 389.359 3.108 10 0 GGAEHN CSc1ccc(Cl)c(C(=O)N2CCCC[C@H](N3CCN(C)CC3)C2)c1 ZINC000173279609 565543741 /nfs/dbraw/zinc/54/37/41/565543741.db2.gz WMYBHKVBWTXZLO-HNNXBMFYSA-N 0 3 381.973 3.304 10 0 GGAEHN CN1CCN([C@H]2CCCCN(C(=O)Cc3ccc(Cl)cc3Cl)C2)CC1 ZINC000173288807 565544660 /nfs/dbraw/zinc/54/46/60/565544660.db2.gz BNCFLZPIONFRCT-KRWDZBQOSA-N 0 3 384.351 3.164 10 0 GGAEHN CN(Cc1cccnc1)C[C@H]1CCN(C(=O)c2ccc(Br)cc2)C1 ZINC000190598552 565545103 /nfs/dbraw/zinc/54/51/03/565545103.db2.gz YCRKKUQZKWZGSV-MRXNPFEDSA-N 0 3 388.309 3.438 10 0 GGAEHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)c2ccc(Br)o2)C1 ZINC000190611457 565546220 /nfs/dbraw/zinc/54/62/20/565546220.db2.gz CXJMLGQJURMUMZ-AWEZNQCLSA-N 0 3 378.270 3.031 10 0 GGAEHN Fc1ccc(Br)cc1-c1nnc(N2CCN3CCC[C@@H]3C2)s1 ZINC000302615460 565547279 /nfs/dbraw/zinc/54/72/79/565547279.db2.gz FVVWXOWSJQTJHV-LLVKDONJSA-N 0 3 383.290 3.391 10 0 GGAEHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)c2cccc(Br)c2)C1 ZINC000190637664 565548203 /nfs/dbraw/zinc/54/82/03/565548203.db2.gz QCUBHDWLZKTRBA-INIZCTEOSA-N 0 3 388.309 3.438 10 0 GGAEHN Cc1ccccc1C1(CNCc2c(Br)cnn2C)CCOCC1 ZINC000278288159 565549997 /nfs/dbraw/zinc/54/99/97/565549997.db2.gz BDQUIBHVDGDVMT-UHFFFAOYSA-N 0 3 378.314 3.329 10 0 GGAEHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)c2occc2Br)C1 ZINC000190669441 565550558 /nfs/dbraw/zinc/55/05/58/565550558.db2.gz VAYRSJXCOOHMIZ-AWEZNQCLSA-N 0 3 378.270 3.031 10 0 GGAEHN Cn1ncc(Br)c1CNC[C@@H]1CCCN(Cc2cccs2)C1 ZINC000278346382 565553365 /nfs/dbraw/zinc/55/33/65/565553365.db2.gz HJFIVWBILDDTLQ-ZDUSSCGKSA-N 0 3 383.359 3.246 10 0 GGAEHN CCc1nc(C2CCN(Cc3nc4cc(Br)ccc4[nH]3)CC2)n[nH]1 ZINC000190725836 565554246 /nfs/dbraw/zinc/55/42/46/565554246.db2.gz YJLNJCGNERRYTL-UHFFFAOYSA-N 0 3 389.301 3.386 10 0 GGAEHN CCc1n[nH]c(C2CCN(Cc3nc4cc(Br)ccc4[nH]3)CC2)n1 ZINC000190725836 565554253 /nfs/dbraw/zinc/55/42/53/565554253.db2.gz YJLNJCGNERRYTL-UHFFFAOYSA-N 0 3 389.301 3.386 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)CCc1nc2cc(Br)ccc2s1 ZINC000173406333 565556634 /nfs/dbraw/zinc/55/66/34/565556634.db2.gz NXRLYEHFTYEQSL-LBPRGKRZSA-N 0 3 382.327 3.202 10 0 GGAEHN Cc1cc(N2CCC[C@@H](N[C@@H](C)c3cccc(Br)c3)C2=O)n(C)n1 ZINC000173455210 565558832 /nfs/dbraw/zinc/55/88/32/565558832.db2.gz WZEDGSHEIDCLHM-XJKSGUPXSA-N 0 3 391.313 3.337 10 0 GGAEHN COc1ccc([C@H](C)NC(=O)N2CC[C@@H](N3CC=CC3)C2)cc1Br ZINC000173558865 565566641 /nfs/dbraw/zinc/56/66/41/565566641.db2.gz DMOHCRZONXHYKG-DZGCQCFKSA-N 0 3 394.313 3.174 10 0 GGAEHN Cn1ncc(Br)c1CNc1cccc(CN2CCSCC2)c1 ZINC000278578979 565566725 /nfs/dbraw/zinc/56/67/25/565566725.db2.gz YEPIMKFMRWIGLU-UHFFFAOYSA-N 0 3 381.343 3.344 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1ccn(-c2cccc(Br)c2)n1 ZINC000303292524 565569659 /nfs/dbraw/zinc/56/96/59/565569659.db2.gz LETKBFAXQKUKTA-AWEZNQCLSA-N 0 3 391.313 3.239 10 0 GGAEHN COc1c(Br)cc(CN[C@H](C)C(C)(C)O)cc1Br ZINC000393970346 565569762 /nfs/dbraw/zinc/56/97/62/565569762.db2.gz GCTMVJWKVPCIOU-MRVPVSSYSA-N 0 3 381.108 3.469 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1cc(Br)c(F)cc1C ZINC000190918180 565570520 /nfs/dbraw/zinc/57/05/20/565570520.db2.gz SWSLDIUWSVHMOW-LBPRGKRZSA-N 0 3 388.281 3.129 10 0 GGAEHN CC(C)[C@@H](CN(C)Cc1ccccc1)NCc1c(Br)cnn1C ZINC000397963107 565576521 /nfs/dbraw/zinc/57/65/21/565576521.db2.gz QFAWUQNFKQIUEC-QGZVFWFLSA-N 0 3 379.346 3.429 10 0 GGAEHN Cn1ncc(Br)c1CNCCCCC(=O)OCc1ccccc1 ZINC000278790723 565577530 /nfs/dbraw/zinc/57/75/30/565577530.db2.gz QOCOULGDFNZDQP-UHFFFAOYSA-N 0 3 380.286 3.186 10 0 GGAEHN Fc1cc(CNCCn2cc(Br)cn2)ccc1Br ZINC000310918092 565579794 /nfs/dbraw/zinc/57/97/94/565579794.db2.gz QSDAVYBEBNSQAX-UHFFFAOYSA-N 0 3 377.055 3.337 10 0 GGAEHN C[C@@H]1C[C@@H](NCc2c(Br)cnn2C)CCN1C(=O)OC(C)(C)C ZINC000278824085 565579776 /nfs/dbraw/zinc/57/97/76/565579776.db2.gz UGQKFLAJMOUWLX-NEPJUHHUSA-N 0 3 387.322 3.060 10 0 GGAEHN CC[C@H](NC(=O)N1CCCN(C2CC2)CC1)c1nc(C(F)(F)F)cs1 ZINC000173743107 565581472 /nfs/dbraw/zinc/58/14/72/565581472.db2.gz VYJPWPZEGPCZND-LBPRGKRZSA-N 0 3 376.448 3.493 10 0 GGAEHN C[C@H](NCC[C@@]1(O)CCOC1)c1ccc(Br)cc1Br ZINC000404197929 565582518 /nfs/dbraw/zinc/58/25/18/565582518.db2.gz GLIIXXAAZWTVOF-IINYFYTJSA-N 0 3 393.119 3.404 10 0 GGAEHN CN(C)C1(CN(C)S(=O)(=O)c2c(Cl)cccc2Br)CCC1 ZINC000313959833 565584254 /nfs/dbraw/zinc/58/42/54/565584254.db2.gz BJPAENAGILZYQL-UHFFFAOYSA-N 0 3 395.750 3.207 10 0 GGAEHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1nscc1Br ZINC000404927053 565584529 /nfs/dbraw/zinc/58/45/29/565584529.db2.gz IAWKMDGEPVTJBV-AWEZNQCLSA-N 0 3 380.311 3.473 10 0 GGAEHN C[C@@H]1CC(O)C[C@@H](C)N1C[C@H](O)COc1ccc(Cl)cc1Br ZINC000191152204 565585099 /nfs/dbraw/zinc/58/50/99/565585099.db2.gz ATKXPQJIKRDZIF-GYSYKLTISA-N 0 3 392.721 3.076 10 0 GGAEHN O=S(=O)([N-]CCC[NH+]1CCCCC1)c1c(Cl)cccc1Br ZINC000314016320 565585540 /nfs/dbraw/zinc/58/55/40/565585540.db2.gz MCLGMEDPBOSGMR-UHFFFAOYSA-N 0 3 395.750 3.257 10 0 GGAEHN NC(=O)C1CCC(NCc2cc(Br)ccc2OC(F)F)CC1 ZINC000315386035 565589706 /nfs/dbraw/zinc/58/97/06/565589706.db2.gz DZNOIAZJADJQIY-UHFFFAOYSA-N 0 3 377.229 3.184 10 0 GGAEHN COc1cccc(N2CC[C@@H](CNCc3c(Br)c(C)nn3C)C2)c1 ZINC000279056875 565593527 /nfs/dbraw/zinc/59/35/27/565593527.db2.gz DWQBMBBSOXSSAS-AWEZNQCLSA-N 0 3 393.329 3.116 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1S(=O)(=O)c1cc(Cl)sc1Cl ZINC000317511715 565593889 /nfs/dbraw/zinc/59/38/89/565593889.db2.gz NHGPWBQIMHCCOW-LLVKDONJSA-N 0 3 377.318 3.302 10 0 GGAEHN C[C@@H](N[C@@H]1CCCN(c2cnn(C)c2)C1=O)c1cccc(Br)c1 ZINC000173890638 565597272 /nfs/dbraw/zinc/59/72/72/565597272.db2.gz NAADSGOECBMZOD-MLGOLLRUSA-N 0 3 377.286 3.029 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CCC[C@@H](N(C)C)C1 ZINC000191439847 565605240 /nfs/dbraw/zinc/60/52/40/565605240.db2.gz VOMQHWVFVBYFSH-GXTWGEPZSA-N 0 3 384.318 3.254 10 0 GGAEHN COc1cc(Br)ccc1C(=O)N1CCc2ccccc2[C@H]1CN ZINC000321904446 565606821 /nfs/dbraw/zinc/60/68/21/565606821.db2.gz VNRGTPAAISTOOG-MRXNPFEDSA-N 0 3 375.266 3.156 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C ZINC000174075899 565611559 /nfs/dbraw/zinc/61/15/59/565611559.db2.gz JGGOZMIHIOZMHG-XKQJLSEDSA-N 0 3 380.330 3.258 10 0 GGAEHN CCOC(=O)c1csc(C2CCN(CCCOCC(F)(F)F)CC2)n1 ZINC000191563303 565613634 /nfs/dbraw/zinc/61/36/34/565613634.db2.gz VOSBUZXFQAAEGW-UHFFFAOYSA-N 0 3 380.432 3.468 10 0 GGAEHN COc1ccc(CN[C@@H]2CCCN(c3ncccn3)C2)c(Br)c1 ZINC000323584394 565613732 /nfs/dbraw/zinc/61/37/32/565613732.db2.gz ZWEXUSHMAFUXPP-CQSZACIVSA-N 0 3 377.286 3.006 10 0 GGAEHN C[C@H](CCc1ccc(Br)cc1)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000174255858 565625056 /nfs/dbraw/zinc/62/50/56/565625056.db2.gz RVHHWWWEFCITCD-QAPCUYQASA-N 0 3 392.341 3.426 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)NCCc2cc(Br)ccc2F)CCN1C ZINC000174362850 565631159 /nfs/dbraw/zinc/63/11/59/565631159.db2.gz HAGOJXPLKYSYHE-DOMZBBRYSA-N 0 3 386.309 3.255 10 0 GGAEHN COCc1csc(NC(=O)NCC2CCN(Cc3cccs3)CC2)n1 ZINC000174404597 565633279 /nfs/dbraw/zinc/63/32/79/565633279.db2.gz LAFCCZWCKDWSQU-UHFFFAOYSA-N 0 3 380.539 3.385 10 0 GGAEHN COCc1csc(NC(=O)NCC2(N3CCSCC3)CCCCC2)n1 ZINC000174406103 565633383 /nfs/dbraw/zinc/63/33/83/565633383.db2.gz ZFCQMWROEOPYEO-UHFFFAOYSA-N 0 3 384.571 3.163 10 0 GGAEHN CCN(CCNC(=O)N[C@H]1CCOc2c(Br)cccc21)C1CC1 ZINC000409703570 565634397 /nfs/dbraw/zinc/63/43/97/565634397.db2.gz AYGXTIYMXNKVHI-HNNXBMFYSA-N 0 3 382.302 3.056 10 0 GGAEHN O=C(NCCCOc1ccc(Cl)cc1Cl)N1CC[C@H](N2CC=CC2)C1 ZINC000174425081 565634668 /nfs/dbraw/zinc/63/46/68/565634668.db2.gz ZHTCLLKZMHOYNM-HNNXBMFYSA-N 0 3 384.307 3.418 10 0 GGAEHN CN(C)C1(CNC(=O)N[C@@H]2CCOc3c(Br)cccc32)CCC1 ZINC000409701248 565634715 /nfs/dbraw/zinc/63/47/15/565634715.db2.gz OUGRXRUOKHSADW-CQSZACIVSA-N 0 3 382.302 3.056 10 0 GGAEHN CCc1nn(C)c(Cl)c1CNC[C@@H]1CCc2nc(C(F)(F)F)cn2C1 ZINC000328622877 565635528 /nfs/dbraw/zinc/63/55/28/565635528.db2.gz BOVICULAQAPTLT-JTQLQIEISA-N 0 3 375.826 3.203 10 0 GGAEHN CCc1nn(C)c(Cl)c1CNC[C@H]1CCc2nc(C(F)(F)F)cn2C1 ZINC000328622882 565635953 /nfs/dbraw/zinc/63/59/53/565635953.db2.gz BOVICULAQAPTLT-SNVBAGLBSA-N 0 3 375.826 3.203 10 0 GGAEHN CC1CCN(CCNC(=O)N[C@@H]2CCOc3c(Br)cccc32)CC1 ZINC000409716041 565636512 /nfs/dbraw/zinc/63/65/12/565636512.db2.gz VRWHXCSXCKGGPZ-MRXNPFEDSA-N 0 3 396.329 3.304 10 0 GGAEHN C[C@H](CN1CCCCC1)NC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000409748684 565639097 /nfs/dbraw/zinc/63/90/97/565639097.db2.gz QNKMCKCPDGMPEI-CZUORRHYSA-N 0 3 396.329 3.446 10 0 GGAEHN COc1cc(Cl)c(Cl)cc1NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C ZINC000191963697 565646467 /nfs/dbraw/zinc/64/64/67/565646467.db2.gz VFTDPIDLMASBEY-NSHDSACASA-N 0 3 390.311 3.033 10 0 GGAEHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1c(F)ccc(Br)c1F ZINC000409987492 565655174 /nfs/dbraw/zinc/65/51/74/565655174.db2.gz KKCKQFAGHQIVNW-NEPJUHHUSA-N 0 3 387.268 3.355 10 0 GGAEHN CCN1CC[C@@H](N(C)CCS(=O)(=O)c2cc(Cl)ccc2Cl)[C@H](C)C1 ZINC000174774061 565657474 /nfs/dbraw/zinc/65/74/74/565657474.db2.gz WNKKKCAEURTFFP-CZUORRHYSA-N 0 3 393.380 3.429 10 0 GGAEHN O=C1[C@H](N2CCC[C@@H](c3nc[nH]n3)C2)CCN1c1ccc(Cl)c(Cl)c1 ZINC000329235704 565659687 /nfs/dbraw/zinc/65/96/87/565659687.db2.gz IUCQIJGWKMRBJU-IAQYHMDHSA-N 0 3 380.279 3.096 10 0 GGAEHN O=C1[C@@H](N2CCC[C@H](c3nc[nH]n3)C2)CCN1c1ccc(Cl)c(Cl)c1 ZINC000329235705 565659734 /nfs/dbraw/zinc/65/97/34/565659734.db2.gz IUCQIJGWKMRBJU-NHYWBVRUSA-N 0 3 380.279 3.096 10 0 GGAEHN CN1C(=O)C[C@H](NCCOCC(F)(F)C(F)F)[C@H]1c1ccc(Cl)cc1 ZINC000192158841 565664516 /nfs/dbraw/zinc/66/45/16/565664516.db2.gz XPWSEXPZBZGGAQ-GXTWGEPZSA-N 0 3 382.785 3.118 10 0 GGAEHN CN1C(=O)C[C@@H](NCCOCC(F)(F)C(F)F)[C@@H]1c1ccc(Cl)cc1 ZINC000192158835 565664781 /nfs/dbraw/zinc/66/47/81/565664781.db2.gz XPWSEXPZBZGGAQ-OCCSQVGLSA-N 0 3 382.785 3.118 10 0 GGAEHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1coc(Br)c1 ZINC000192211533 565670018 /nfs/dbraw/zinc/67/00/18/565670018.db2.gz ORADYECNCMYNTI-MRXNPFEDSA-N 0 3 393.281 3.063 10 0 GGAEHN O=C(NCC1(c2cccc(Br)c2)CC1)N1CC[C@@H](N2CC=CC2)C1 ZINC000174977235 565671545 /nfs/dbraw/zinc/67/15/45/565671545.db2.gz OKJUZCGINFFARW-QGZVFWFLSA-N 0 3 390.325 3.136 10 0 GGAEHN C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cc(-c2ccc(Br)cc2)n[nH]1 ZINC000329582636 565671760 /nfs/dbraw/zinc/67/17/60/565671760.db2.gz XIWREZOFVRXUNL-WFASDCNBSA-N 0 3 389.297 3.148 10 0 GGAEHN Cc1cc(NC(=O)NC[C@H](O)CN2CCCCC2)cc(C)c1Br ZINC000192418121 565686356 /nfs/dbraw/zinc/68/63/56/565686356.db2.gz ABUISZRIYNAQGB-HNNXBMFYSA-N 0 3 384.318 3.034 10 0 GGAEHN O=C(NCC1(c2ccccc2Br)CC1)N1CC[C@@H](N2CC=CC2)C1 ZINC000175271550 565689153 /nfs/dbraw/zinc/68/91/53/565689153.db2.gz DESGPWZBSMMQGZ-OAHLLOKOSA-N 0 3 390.325 3.136 10 0 GGAEHN O=C(NCC1(c2ccccc2Br)CC1)N1CC[C@H](N2CC=CC2)C1 ZINC000175271533 565689672 /nfs/dbraw/zinc/68/96/72/565689672.db2.gz DESGPWZBSMMQGZ-HNNXBMFYSA-N 0 3 390.325 3.136 10 0 GGAEHN CN(C)CCOc1cc(NC(=O)Cc2sccc2Br)ccn1 ZINC000410632963 565691794 /nfs/dbraw/zinc/69/17/94/565691794.db2.gz REODJFLMLNWRKR-UHFFFAOYSA-N 0 3 384.299 3.027 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)Cc1nc(-c2cccc(Br)c2)no1 ZINC000175345063 565694168 /nfs/dbraw/zinc/69/41/68/565694168.db2.gz AFVICNRSUIIJKY-OAHLLOKOSA-N 0 3 379.302 3.415 10 0 GGAEHN CCN1CCC[C@H]1CN(C)Cc1nnc(-c2ccccc2Br)o1 ZINC000175350061 565695135 /nfs/dbraw/zinc/69/51/35/565695135.db2.gz NYJACVVRRIWZPP-ZDUSSCGKSA-N 0 3 379.302 3.415 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1cc2c(cc1Br)CCC2 ZINC000192473278 565695142 /nfs/dbraw/zinc/69/51/42/565695142.db2.gz MUGNECBPSPRDHE-HNNXBMFYSA-N 0 3 396.329 3.170 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)N[C@@H]1CCC[C@@H](S(C)(=O)=O)C1 ZINC000330493504 565708481 /nfs/dbraw/zinc/70/84/81/565708481.db2.gz MUCHPNQTLCAXSI-IACUBPJLSA-N 0 3 390.343 3.464 10 0 GGAEHN C[C@H]1C[C@H](NC(=O)N2CCc3cccc(Br)c3C2)CN1C1CC1 ZINC000175556488 565708535 /nfs/dbraw/zinc/70/85/35/565708535.db2.gz MSJIUYOOWYCDFX-JSGCOSHPSA-N 0 3 378.314 3.142 10 0 GGAEHN CSC1(CN[C@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)CCC1 ZINC000281103022 565711740 /nfs/dbraw/zinc/71/17/40/565711740.db2.gz LDSNPDGMDCHNPA-SNVBAGLBSA-N 0 3 393.372 3.033 10 0 GGAEHN C[C@H](NCCCN1CCN(C)CC1)c1cc2cc(Br)ccc2o1 ZINC000192924316 565719618 /nfs/dbraw/zinc/71/96/18/565719618.db2.gz AWYUQOYMXQISOX-AWEZNQCLSA-N 0 3 380.330 3.483 10 0 GGAEHN O=C(CCNC1(CO)Cc2ccccc2C1)Nc1c(Cl)cccc1Cl ZINC000411271558 565721294 /nfs/dbraw/zinc/72/12/94/565721294.db2.gz AIIIBXBLXOTQIP-UHFFFAOYSA-N 0 3 379.287 3.442 10 0 GGAEHN C[C@@H]1CCCCN1C(=O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000411341171 565725269 /nfs/dbraw/zinc/72/52/69/565725269.db2.gz PEZDYRQSWYCSCR-OAHLLOKOSA-N 0 3 395.341 3.445 10 0 GGAEHN Cc1nc(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)c(Br)s1 ZINC000411550050 565735864 /nfs/dbraw/zinc/73/58/64/565735864.db2.gz IZZPHNHINCERIN-ZDUSSCGKSA-N 0 3 382.327 3.117 10 0 GGAEHN O=C(NCCNCc1c[nH]c(-c2ccccc2)n1)c1ccc(Br)cc1 ZINC000175980398 565738773 /nfs/dbraw/zinc/73/87/73/565738773.db2.gz MVDKTWBFJCCROJ-UHFFFAOYSA-N 0 3 399.292 3.359 10 0 GGAEHN O=C(NCCNCc1cnc(-c2ccccc2)[nH]1)c1ccc(Br)cc1 ZINC000175980398 565738777 /nfs/dbraw/zinc/73/87/77/565738777.db2.gz MVDKTWBFJCCROJ-UHFFFAOYSA-N 0 3 399.292 3.359 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)N(C)[C@H]1CCN(C)C[C@@H]1C ZINC000176048953 565743254 /nfs/dbraw/zinc/74/32/54/565743254.db2.gz ZOFCRKUNBCOGQP-ZQIUZPCESA-N 0 3 382.346 3.362 10 0 GGAEHN C[C@H](CC(=O)NCCN1CCN(C)C(C)(C)C1)c1ccc(Br)cc1 ZINC000281705992 565743429 /nfs/dbraw/zinc/74/34/29/565743429.db2.gz HJQKYWZNKXNVAH-OAHLLOKOSA-N 0 3 396.373 3.085 10 0 GGAEHN COC(=O)C[C@](C)(NCCc1ccccn1)c1ccc(Br)cc1 ZINC000411727863 565747813 /nfs/dbraw/zinc/74/78/13/565747813.db2.gz QKAXHYSAPZTEMM-SFHVURJKSA-N 0 3 377.282 3.455 10 0 GGAEHN Cc1nc([C@H](C)N2CC[C@@H](Cc3cccc(I)c3)C2)n[nH]1 ZINC000411776819 565751280 /nfs/dbraw/zinc/75/12/80/565751280.db2.gz XYZXHZJYVLVXSY-FZMZJTMJSA-N 0 3 396.276 3.343 10 0 GGAEHN Cc1nc([C@@H](C)N2CC[C@@H](Cc3cccc(I)c3)C2)n[nH]1 ZINC000411776820 565751495 /nfs/dbraw/zinc/75/14/95/565751495.db2.gz XYZXHZJYVLVXSY-RISCZKNCSA-N 0 3 396.276 3.343 10 0 GGAEHN CN(C)C[C@@H](NC(=O)[C@@H]1Cc2cc(Br)ccc2O1)c1ccccc1 ZINC000193472624 565754131 /nfs/dbraw/zinc/75/41/31/565754131.db2.gz QYNREOKQESTWOD-AEFFLSMTSA-N 0 3 389.293 3.172 10 0 GGAEHN O[C@H](COc1c(Cl)cccc1Cl)CN1CCC(c2ccncn2)CC1 ZINC000411830238 565756947 /nfs/dbraw/zinc/75/69/47/565756947.db2.gz XLYVWHRJPCGAIA-AWEZNQCLSA-N 0 3 382.291 3.403 10 0 GGAEHN O[C@@H](COc1c(Cl)cccc1Cl)CN1CCC(c2ccncn2)CC1 ZINC000411830239 565757469 /nfs/dbraw/zinc/75/74/69/565757469.db2.gz XLYVWHRJPCGAIA-CQSZACIVSA-N 0 3 382.291 3.403 10 0 GGAEHN O=C(c1ccc(CN2CCC(CO)CC2)cc1)N1CCC=C(Br)C1 ZINC000282135858 565766402 /nfs/dbraw/zinc/76/64/02/565766402.db2.gz BQEQFYSXQQWZNW-UHFFFAOYSA-N 0 3 393.325 3.016 10 0 GGAEHN COC(=O)[C@H]1CSCCN(CCC(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000412079446 565769253 /nfs/dbraw/zinc/76/92/53/565769253.db2.gz PAGFGFAWZVTOAM-LLVKDONJSA-N 0 3 391.320 3.160 10 0 GGAEHN CN(C)CCOc1ccc(CNC(=O)c2c(F)cccc2Br)cc1 ZINC000176431322 565771503 /nfs/dbraw/zinc/77/15/03/565771503.db2.gz CXUKQZPSGKFXHR-UHFFFAOYSA-N 0 3 395.272 3.459 10 0 GGAEHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)NCc1cc(F)cc(Br)c1 ZINC000176438244 565771801 /nfs/dbraw/zinc/77/18/01/565771801.db2.gz WCOIDVWMDYZUPR-CVEARBPZSA-N 0 3 384.293 3.356 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2ccc(-c3cnn(C)c3)s2)n1 ZINC000282368267 565775628 /nfs/dbraw/zinc/77/56/28/565775628.db2.gz XYZDJBJAONFMMJ-UHFFFAOYSA-N 0 3 376.507 3.114 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000282497997 565782396 /nfs/dbraw/zinc/78/23/96/565782396.db2.gz OPFGKTMKQNPZLD-WQVCFCJDSA-N 0 3 396.329 3.254 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)N[C@@H]2CCOc3c(Br)cccc32)CCN1C ZINC000282570343 565785575 /nfs/dbraw/zinc/78/55/75/565785575.db2.gz VPGQVDZNUXAYKH-DVOMOZLQSA-N 0 3 396.329 3.397 10 0 GGAEHN CC(C)OCCN1CCC(NC(=O)Cc2ccc(Br)s2)CC1 ZINC000176698568 565795380 /nfs/dbraw/zinc/79/53/80/565795380.db2.gz RGMJFDVPVSOKDA-UHFFFAOYSA-N 0 3 389.359 3.059 10 0 GGAEHN COc1ccc(Br)cc1CNC[C@H]1CCC2(CCOCC2)[C@@H]1O ZINC000282903109 565802118 /nfs/dbraw/zinc/80/21/18/565802118.db2.gz UKHBHFRHKHFXOK-CXAGYDPISA-N 0 3 384.314 3.115 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000283011791 565806060 /nfs/dbraw/zinc/80/60/60/565806060.db2.gz ZPZYQQBZZBCPCU-MRXNPFEDSA-N 0 3 396.329 3.256 10 0 GGAEHN O=C(NCC1(N2CCSCC2)CCCC1)N1CCC[C@@H](C(F)(F)F)C1 ZINC000194286661 565806119 /nfs/dbraw/zinc/80/61/19/565806119.db2.gz CRDQYUGGCBARKD-CQSZACIVSA-N 0 3 379.492 3.332 10 0 GGAEHN C[C@H]1COCC[C@H]1C(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000194353714 565810779 /nfs/dbraw/zinc/81/07/79/565810779.db2.gz LESGAHKAMAFXGI-WMLDXEAASA-N 0 3 383.330 3.012 10 0 GGAEHN Cc1cc(CN[C@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1Br ZINC000283286590 565815412 /nfs/dbraw/zinc/81/54/12/565815412.db2.gz MKWJHJLZDWMWAF-GFCCVEGCSA-N 0 3 383.311 3.256 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)c1ccn(-c2cccc(Br)c2)n1 ZINC000176971826 565819795 /nfs/dbraw/zinc/81/97/95/565819795.db2.gz GHNVSIGFACGYEP-MRXNPFEDSA-N 0 3 391.313 3.191 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)c1[nH]nc(-c2ccccc2)c1Br ZINC000177032235 565823987 /nfs/dbraw/zinc/82/39/87/565823987.db2.gz HVAXZAOVFNGSAX-AWEZNQCLSA-N 0 3 391.313 3.396 10 0 GGAEHN O=C1CCCN1C[C@H](O)CN1CCC(Cc2cc(Cl)ccc2Cl)CC1 ZINC000177064650 565826607 /nfs/dbraw/zinc/82/66/07/565826607.db2.gz LODJXKVVRDSIDI-QGZVFWFLSA-N 0 3 385.335 3.231 10 0 GGAEHN CN1CC[C@H](NCC(=O)Nc2ccccc2Br)[C@H]1c1ccccc1 ZINC000283918605 565834983 /nfs/dbraw/zinc/83/49/83/565834983.db2.gz GIFAUJAHZBZPBU-PKOBYXMFSA-N 0 3 388.309 3.423 10 0 GGAEHN C[C@H](NC(=O)C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1)c1ccc(Cl)cc1Cl ZINC000284370254 565851427 /nfs/dbraw/zinc/85/14/27/565851427.db2.gz LQGUSGPDBMNXPU-OBJOEFQTSA-N 0 3 386.323 3.112 10 0 GGAEHN Cc1c(C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)ccn1C ZINC000195150004 565862351 /nfs/dbraw/zinc/86/23/51/565862351.db2.gz YLBJNJVIANWBER-UHFFFAOYSA-N 0 3 378.314 3.300 10 0 GGAEHN C[C@@H](Cn1cc(Br)cn1)N[C@@H](C)c1ccc(N2CCOC2=O)cc1 ZINC000177754077 565871614 /nfs/dbraw/zinc/87/16/14/565871614.db2.gz QMNCMHUIVQMSOX-STQMWFEESA-N 0 3 393.285 3.342 10 0 GGAEHN Brc1ccc(-c2noc(CN3CCN4CCCC[C@@H]4C3)n2)s1 ZINC000177761056 565873257 /nfs/dbraw/zinc/87/32/57/565873257.db2.gz LBLNOTZZXWBNRN-LLVKDONJSA-N 0 3 383.315 3.231 10 0 GGAEHN CN1C(=O)CC[C@H](N[C@H]2CCCc3c4cc(Br)ccc4[nH]c32)C1=O ZINC000333462997 565882664 /nfs/dbraw/zinc/88/26/64/565882664.db2.gz GVYYEOUHUYAFJC-GJZGRUSLSA-N 0 3 390.281 3.045 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)c1ccc(Br)cc1Br ZINC000218772319 565900778 /nfs/dbraw/zinc/90/07/78/565900778.db2.gz YUXJWNPBMFYWCG-JTQLQIEISA-N 0 3 376.092 3.036 10 0 GGAEHN C[C@H](NC(=O)CN1CCC(c2ccn[nH]2)CC1)c1ccc(Br)cc1 ZINC000195506186 565888621 /nfs/dbraw/zinc/88/86/21/565888621.db2.gz ZDZJVKNOJNXXLP-ZDUSSCGKSA-N 0 3 391.313 3.229 10 0 GGAEHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)Nc1cc(N(C)C)c(Br)cn1 ZINC000333647146 565889961 /nfs/dbraw/zinc/88/99/61/565889961.db2.gz JWZNBGOAMXVOPZ-STQMWFEESA-N 0 3 396.333 3.001 10 0 GGAEHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)Nc1cc(N(C)C)c(Br)cn1 ZINC000333647143 565890298 /nfs/dbraw/zinc/89/02/98/565890298.db2.gz JWZNBGOAMXVOPZ-OLZOCXBDSA-N 0 3 396.333 3.001 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NC[C@@H](c1cccc(F)c1)N(C)C ZINC000414052164 565890683 /nfs/dbraw/zinc/89/06/83/565890683.db2.gz KSKWBRMMHDIBBT-DYVFJYSZSA-N 0 3 396.304 3.031 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NC[C@H](c1ccco1)N1CCCC1 ZINC000414057966 565891332 /nfs/dbraw/zinc/89/13/32/565891332.db2.gz SSEVCNRXDWHMEN-GOEBONIOSA-N 0 3 394.313 3.019 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)c1ccc(Br)c(F)c1 ZINC000195717284 565892261 /nfs/dbraw/zinc/89/22/61/565892261.db2.gz RHJCOFOHEIAESM-HNNXBMFYSA-N 0 3 379.273 3.491 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NCCOc1cccc(Cl)c1 ZINC000414082405 565893944 /nfs/dbraw/zinc/89/39/44/565893944.db2.gz WASXLOBZTITYQA-LBPRGKRZSA-N 0 3 385.689 3.321 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@H]1CCOc2ccc(F)cc21 ZINC000414093064 565894334 /nfs/dbraw/zinc/89/43/34/565894334.db2.gz LXYDSXWMXUPGIL-ABAIWWIYSA-N 0 3 381.245 3.252 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000414092023 565894457 /nfs/dbraw/zinc/89/44/57/565894457.db2.gz DSGYUKXXQIHOMC-NSCUQIJASA-N 0 3 397.338 3.088 10 0 GGAEHN COc1ccc(C2(N[C@@H](C)Cn3cc(Br)ccc3=O)CC2)cc1 ZINC000414096692 565894734 /nfs/dbraw/zinc/89/47/34/565894734.db2.gz MHUQWZYMYXIACD-ZDUSSCGKSA-N 0 3 377.282 3.287 10 0 GGAEHN CN(C)c1cc(NC(=O)N2CCCC23CCN(C)CC3)ncc1Br ZINC000333724857 565894732 /nfs/dbraw/zinc/89/47/32/565894732.db2.gz VVPIGVDMGARKEF-UHFFFAOYSA-N 0 3 396.333 3.002 10 0 GGAEHN Cc1cccc2oc(CCN[C@@H](C)Cn3cc(Br)ccc3=O)nc21 ZINC000414110024 565895804 /nfs/dbraw/zinc/89/58/04/565895804.db2.gz LIWWSOTWGOMYFG-ZDUSSCGKSA-N 0 3 390.281 3.281 10 0 GGAEHN Cn1cnc(CCN[C@H]2CCCOc3ccc(I)cc32)c1 ZINC000414120002 565896281 /nfs/dbraw/zinc/89/62/81/565896281.db2.gz AEFWXDMPYWQASQ-HNNXBMFYSA-N 0 3 397.260 3.071 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@H](CCO)c1ccc(Cl)cc1 ZINC000414123901 565897147 /nfs/dbraw/zinc/89/71/47/565897147.db2.gz CAUNNPJHQOCMHS-BLLLJJGKSA-N 0 3 399.716 3.366 10 0 GGAEHN O=C(c1ccc(Br)c(C(F)(F)F)c1)N1CCN2CCC[C@H]2C1 ZINC000178107618 565897370 /nfs/dbraw/zinc/89/73/70/565897370.db2.gz JJSONNPTCXKEBS-NSHDSACASA-N 0 3 377.204 3.388 10 0 GGAEHN O=C(c1ccc(Br)c(C(F)(F)F)c1)N1CCN2CCC[C@@H]2C1 ZINC000178107607 565897423 /nfs/dbraw/zinc/89/74/23/565897423.db2.gz JJSONNPTCXKEBS-LLVKDONJSA-N 0 3 377.204 3.388 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NC[C@]1(C)OCCc2sccc21 ZINC000414140955 565897510 /nfs/dbraw/zinc/89/75/10/565897510.db2.gz HZRWRAJXMOIKQY-SJCJKPOMSA-N 0 3 397.338 3.139 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@@H]1CCOc2c(F)cccc21 ZINC000414127445 565898241 /nfs/dbraw/zinc/89/82/41/565898241.db2.gz FZSWTFHRQXDFDE-XHDPSFHLSA-N 0 3 381.245 3.252 10 0 GGAEHN CO[C@@](C)(CN[C@H](C)Cn1cc(Br)ccc1=O)c1ccccc1 ZINC000414146440 565899337 /nfs/dbraw/zinc/89/93/37/565899337.db2.gz LEYZXDRTQAZYOQ-KDOFPFPSSA-N 0 3 379.298 3.151 10 0 GGAEHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC[C@@H](O)Cn1ccnn1 ZINC000414172343 565900415 /nfs/dbraw/zinc/90/04/15/565900415.db2.gz DXCDJLZYYACKAB-XHDPSFHLSA-N 0 3 377.901 3.075 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@@H](CN(C)C)c1ccc(F)cc1 ZINC000414162904 565900866 /nfs/dbraw/zinc/90/08/66/565900866.db2.gz MKUQNOVDZITWKO-GUYCJALGSA-N 0 3 396.304 3.031 10 0 GGAEHN CC(C)C[C@@H]1C[C@H]1N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000414187259 565902129 /nfs/dbraw/zinc/90/21/29/565902129.db2.gz QHNIHDMZCFIWDI-MPKXVKKWSA-N 0 3 375.332 3.182 10 0 GGAEHN C[C@@H](N[C@@H](C)c1cccs1)c1ccc(S(=O)(=O)N2CCOCC2)cc1 ZINC000178178532 565904120 /nfs/dbraw/zinc/90/41/20/565904120.db2.gz LQYDCKBLMPMRLE-CABCVRRESA-N 0 3 380.535 3.181 10 0 GGAEHN CC(C)(CCN[C@@H]1CCc2c1ccc(F)c2Br)S(C)(=O)=O ZINC000414260274 565906478 /nfs/dbraw/zinc/90/64/78/565906478.db2.gz NANYAQKPRMNQIW-CYBMUJFWSA-N 0 3 378.307 3.378 10 0 GGAEHN NS(=O)(=O)c1ccc(CN[C@H](c2ccccc2)C2CC2)cc1Br ZINC000414279383 565908470 /nfs/dbraw/zinc/90/84/70/565908470.db2.gz JEQOEKAMAGJPGR-QGZVFWFLSA-N 0 3 395.322 3.337 10 0 GGAEHN NS(=O)(=O)c1ccc(CN[C@H]2CCc3cc(F)ccc32)cc1Br ZINC000414311250 565909936 /nfs/dbraw/zinc/90/99/36/565909936.db2.gz YDCUOZAMZZLAJE-HNNXBMFYSA-N 0 3 399.285 3.013 10 0 GGAEHN NS(=O)(=O)c1ccc(CNC2(c3ccccc3)CCC2)cc1Br ZINC000414319219 565911083 /nfs/dbraw/zinc/91/10/83/565911083.db2.gz NJJAXIOZSGJNDW-UHFFFAOYSA-N 0 3 395.322 3.266 10 0 GGAEHN CCS(=O)(=O)CCCN[C@@H]1CCCOc2ccc(Br)cc21 ZINC000414345433 565913998 /nfs/dbraw/zinc/91/39/98/565913998.db2.gz SWLHGZZRLBQWDV-CQSZACIVSA-N 0 3 376.316 3.077 10 0 GGAEHN CN1CCC[C@H](CNCc2ccc(S(C)(=O)=O)s2)[C@H]1c1cccs1 ZINC000414359405 565915185 /nfs/dbraw/zinc/91/51/85/565915185.db2.gz OFAIRGJSDOZUEV-DYVFJYSZSA-N 0 3 384.592 3.386 10 0 GGAEHN CN1CC[C@H](NCc2ccc(S(C)(=O)=O)s2)[C@H]1c1ccc(Cl)cc1 ZINC000414362231 565916284 /nfs/dbraw/zinc/91/62/84/565916284.db2.gz DQFUROKBARIKHF-DOTOQJQBSA-N 0 3 384.954 3.340 10 0 GGAEHN CC(C)(C)OC(=O)[C@H]1CCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000178512216 565922694 /nfs/dbraw/zinc/92/26/94/565922694.db2.gz AAVAYYITOYWBRJ-STQMWFEESA-N 0 3 390.307 3.397 10 0 GGAEHN C[C@@H]1CCCN(C(=O)CNC2(c3ccc(Br)cc3)CCOCC2)C1 ZINC000178513284 565923011 /nfs/dbraw/zinc/92/30/11/565923011.db2.gz DMAUDUHQRMNCGR-OAHLLOKOSA-N 0 3 395.341 3.303 10 0 GGAEHN Cc1nc2n(n1)C[C@@H](N[C@H]1CCCOc3ccc(Br)cc31)CC2 ZINC000178506382 565923610 /nfs/dbraw/zinc/92/36/10/565923610.db2.gz ZDYSJIWSTQOAAB-ZFWWWQNUSA-N 0 3 377.286 3.167 10 0 GGAEHN CC(C)COC[C@H](O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000178513431 565923621 /nfs/dbraw/zinc/92/36/21/565923621.db2.gz OREAJSVFYYEKDP-QGZVFWFLSA-N 0 3 386.330 3.078 10 0 GGAEHN OC1CCC(CNCc2ncc(Br)cc2Br)CC1 ZINC000227655208 565923762 /nfs/dbraw/zinc/92/37/62/565923762.db2.gz RXIMPZZZHXMALQ-UHFFFAOYSA-N 0 3 378.108 3.247 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)c1cc(Br)sc1Br ZINC000229043709 565926088 /nfs/dbraw/zinc/92/60/88/565926088.db2.gz LDSNUSQTRLVLEB-QMMMGPOBSA-N 0 3 396.148 3.439 10 0 GGAEHN O=C(Cc1c[nH]c2cc(Br)ccc12)N1CCCN(C2CC2)CC1 ZINC000178706262 565933603 /nfs/dbraw/zinc/93/36/03/565933603.db2.gz ONZGTDMLFPJHIZ-UHFFFAOYSA-N 0 3 376.298 3.170 10 0 GGAEHN O=C(c1cc(Br)cc(C(F)(F)F)c1)N1CCN2CCC[C@@H]2C1 ZINC000178886848 565943551 /nfs/dbraw/zinc/94/35/51/565943551.db2.gz HLVGBFSJFHUXNM-CYBMUJFWSA-N 0 3 377.204 3.388 10 0 GGAEHN O=C(c1cc(Br)cc(C(F)(F)F)c1)N1CCN2CCC[C@H]2C1 ZINC000178886855 565943653 /nfs/dbraw/zinc/94/36/53/565943653.db2.gz HLVGBFSJFHUXNM-ZDUSSCGKSA-N 0 3 377.204 3.388 10 0 GGAEHN COc1cc(C[NH2+]C[C@H](CO)c2ccc(F)cc2)cc(Br)c1[O-] ZINC000414537778 565946223 /nfs/dbraw/zinc/94/62/23/565946223.db2.gz ZOJJVEHPNGHUEB-CYBMUJFWSA-N 0 3 384.245 3.168 10 0 GGAEHN CC(C)N(Cc1cc(Br)c2c(c1)OCCCO2)C[C@H]1CCC(=O)N1 ZINC000414557520 565948440 /nfs/dbraw/zinc/94/84/40/565948440.db2.gz LRZDFQKIUBDVFG-CQSZACIVSA-N 0 3 397.313 3.099 10 0 GGAEHN Cc1ncc(CNC2CCN(Cc3cccc(Br)c3)CC2)cn1 ZINC000414591471 565951234 /nfs/dbraw/zinc/95/12/34/565951234.db2.gz SONVVCOCVDQPMG-UHFFFAOYSA-N 0 3 375.314 3.302 10 0 GGAEHN OC[C@@H]1CCC[C@@H](NCc2c(F)ccc(I)c2F)C1 ZINC000414579914 565951535 /nfs/dbraw/zinc/95/15/35/565951535.db2.gz QGTYKXCBOLEMKR-NXEZZACHSA-N 0 3 381.204 3.210 10 0 GGAEHN CCN(CCc1nccs1)C[C@@H](O)COc1cccc(Br)c1 ZINC000179040147 565954357 /nfs/dbraw/zinc/95/43/57/565954357.db2.gz COACDEMBBIOGIF-CQSZACIVSA-N 0 3 385.327 3.210 10 0 GGAEHN COc1ccccc1/C=C/CNCCNC(=O)c1ccc(Br)cc1 ZINC000237302318 565956428 /nfs/dbraw/zinc/95/64/28/565956428.db2.gz MZORHZLBQNGGNQ-GQCTYLIASA-N 0 3 389.293 3.491 10 0 GGAEHN CCCN(C[C@H]1CCCN(C(=O)CN)C1)[C@@H](C)c1ccccc1Br ZINC000414733379 565957397 /nfs/dbraw/zinc/95/73/97/565957397.db2.gz ATKJOJSSRJSULE-JKSUJKDBSA-N 0 3 396.373 3.419 10 0 GGAEHN CCCN(C[C@@H]1CCCN(C(=O)CN)C1)[C@H](C)c1ccccc1Br ZINC000414733373 565957752 /nfs/dbraw/zinc/95/77/52/565957752.db2.gz ATKJOJSSRJSULE-CVEARBPZSA-N 0 3 396.373 3.419 10 0 GGAEHN CCCN(C[C@H]1CCCN(C(=O)CN)C1)[C@H](C)c1ccccc1Br ZINC000414733377 565958053 /nfs/dbraw/zinc/95/80/53/565958053.db2.gz ATKJOJSSRJSULE-HZPDHXFCSA-N 0 3 396.373 3.419 10 0 GGAEHN Cc1ccc([O-])c(C[NH2+]CCC(=O)Nc2ccc(Br)cc2C)n1 ZINC000237681157 565967776 /nfs/dbraw/zinc/96/77/76/565967776.db2.gz CNPLKVBAYKBYNV-UHFFFAOYSA-N 0 3 378.270 3.285 10 0 GGAEHN O=C(CCc1ccc(Br)cc1F)NCCCNCc1cccnc1 ZINC000237694171 565967917 /nfs/dbraw/zinc/96/79/17/565967917.db2.gz ZNUGJILCZVDDIL-UHFFFAOYSA-N 0 3 394.288 3.212 10 0 GGAEHN COc1ccc(Br)cc1C1(C(=O)N(C)[C@@H]2CCN(C3CC3)C2)CC1 ZINC000415159403 565976858 /nfs/dbraw/zinc/97/68/58/565976858.db2.gz JAHDXBIDMWJSMT-OAHLLOKOSA-N 0 3 393.325 3.184 10 0 GGAEHN COc1ccc(Br)cc1C1(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)CC1 ZINC000415206102 565978447 /nfs/dbraw/zinc/97/84/47/565978447.db2.gz AWXCFOKEGSAQCP-UKRRQHHQSA-N 0 3 395.341 3.430 10 0 GGAEHN O=C(Nc1ccc2c(c1)CNC2)C(=O)N[C@@H]1CCCc2sc(Cl)cc21 ZINC000415279275 565983695 /nfs/dbraw/zinc/98/36/95/565983695.db2.gz YQYPELLZYXMEKM-CQSZACIVSA-N 0 3 375.881 3.137 10 0 GGAEHN COC(=O)[C@@H](C)CN(C[C@@H](O)COc1c(Cl)cccc1Cl)C1CC1 ZINC000245385463 565987528 /nfs/dbraw/zinc/98/75/28/565987528.db2.gz CVLJGVPGYPZZAL-WCQYABFASA-N 0 3 376.280 3.007 10 0 GGAEHN CCN(C(=O)CSc1nncs1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000363034905 565988579 /nfs/dbraw/zinc/98/85/79/565988579.db2.gz BNZXVLFEKXOKCI-ZBFHGGJFSA-N 0 3 376.551 3.314 10 0 GGAEHN CCC[C@H](C(=O)N[C@@H](C)c1cc2c(cc1Br)OCCO2)N(C)C ZINC000179562495 565989016 /nfs/dbraw/zinc/98/90/16/565989016.db2.gz QFINEZTVXIPOJP-SMDDNHRTSA-N 0 3 385.302 3.128 10 0 GGAEHN C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccccc1CSC1=NCCS1 ZINC000245412526 565989353 /nfs/dbraw/zinc/98/93/53/565989353.db2.gz AANAABMXVAPOPY-ZBFHGGJFSA-N 0 3 375.563 3.331 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)[C@H](C)NC(=O)c1cccc(Cl)c1Cl ZINC000245424449 565989396 /nfs/dbraw/zinc/98/93/96/565989396.db2.gz CMUAQFAHTHDDQV-STQMWFEESA-N 0 3 386.323 3.054 10 0 GGAEHN O=S1(=O)CCC[C@H](CN[C@H]2CCCOc3ccc(Br)cc32)C1 ZINC000287043193 565994503 /nfs/dbraw/zinc/99/45/03/565994503.db2.gz MKGWVSWATRDOPK-DOMZBBRYSA-N 0 3 388.327 3.077 10 0 GGAEHN C[C@H](O)CN1CCN(CCSc2ccnc3cc(Cl)ccc32)C[C@H]1C ZINC000245553467 565995491 /nfs/dbraw/zinc/99/54/91/565995491.db2.gz FLDYVWYDMKUIDA-CABCVRRESA-N 0 3 379.957 3.367 10 0 GGAEHN CC(C)N1CC[C@H](N[C@H]2CCCS(=O)(=O)C2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245564880 565995864 /nfs/dbraw/zinc/99/58/64/565995864.db2.gz OMBGDBYPASADQM-JCGIZDLHSA-N 0 3 388.936 3.170 10 0 GGAEHN COCc1nc(C)c(C(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)s1 ZINC000245612377 565998478 /nfs/dbraw/zinc/99/84/78/565998478.db2.gz BYJFDHCDJNTEFS-XJKSGUPXSA-N 0 3 379.551 3.472 10 0 GGAEHN CC[C@H]1CN(CC2=Cc3cc(Br)ccc3OC2)CCN1C[C@H](C)O ZINC000245707462 566001026 /nfs/dbraw/zinc/00/10/26/566001026.db2.gz FIONXEZLYHWOOH-KSSFIOAISA-N 0 3 395.341 3.002 10 0 GGAEHN CN1CC[C@@H](NC(=O)COc2ccccc2Br)[C@@H]1c1ccccc1 ZINC000179706232 566001215 /nfs/dbraw/zinc/00/12/15/566001215.db2.gz LVJSTNOBKNTOTQ-APWZRJJASA-N 0 3 389.293 3.390 10 0 GGAEHN C[C@H]1CN(CC2=Cc3cc(Cl)cc(Cl)c3OC2)C[C@H]1N1CCOCC1 ZINC000245728483 566002560 /nfs/dbraw/zinc/00/25/60/566002560.db2.gz JDWNKPHQDZBLHM-SCLBCKFNSA-N 0 3 383.319 3.422 10 0 GGAEHN O=C(NCCCNCc1cccnc1)Nc1c(F)cc(F)cc1Br ZINC000415554575 566005448 /nfs/dbraw/zinc/00/54/48/566005448.db2.gz PSLDRSOFOWANAB-UHFFFAOYSA-N 0 3 399.239 3.424 10 0 GGAEHN CN1CCC[C@H](CNC(=O)NC[C@H]2CSCCS2)[C@H]1c1cccs1 ZINC000245865858 566008821 /nfs/dbraw/zinc/00/88/21/566008821.db2.gz DVLRNYRLFRZOMB-YCPHGPKFSA-N 0 3 385.624 3.279 10 0 GGAEHN Cn1cc([C@@H]2CCN(Cc3cnn(-c4ccc(Br)cc4)c3)C2)cn1 ZINC000179807426 566009958 /nfs/dbraw/zinc/00/99/58/566009958.db2.gz SSJBGRSJRNNDIE-OAHLLOKOSA-N 0 3 386.297 3.358 10 0 GGAEHN O=C(Nc1cc(F)c(Br)cc1Cl)N[C@H]1CNCCC1(F)F ZINC000415666982 566011838 /nfs/dbraw/zinc/01/18/38/566011838.db2.gz XNTHHMNIGNHTHU-JTQLQIEISA-N 0 3 386.599 3.360 10 0 GGAEHN Cc1c(I)cccc1C(=O)N[C@H]1CN(C(C)C)C[C@H]1C ZINC000245995470 566013105 /nfs/dbraw/zinc/01/31/05/566013105.db2.gz HLXIUKPSFSSZJH-ABAIWWIYSA-N 0 3 386.277 3.058 10 0 GGAEHN CN(C)C(=O)[C@@H]1CC[C@H](CN[C@H](c2ccc(Br)cc2)C2CC2)O1 ZINC000246011588 566013905 /nfs/dbraw/zinc/01/39/05/566013905.db2.gz IHEADJAEFOTVQA-IKGGRYGDSA-N 0 3 381.314 3.126 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(OC(F)F)c(Cl)c2)[C@@H](C)C1 ZINC000246036402 566014772 /nfs/dbraw/zinc/01/47/72/566014772.db2.gz AVVVHIFLXUBLJO-SMDDNHRTSA-N 0 3 396.887 3.292 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)Cc2cccc(C(F)(F)F)c2)[C@@H](C)C1 ZINC000246056863 566015237 /nfs/dbraw/zinc/01/52/37/566015237.db2.gz CZVXRUXVEDRKOA-XJKSGUPXSA-N 0 3 378.460 3.197 10 0 GGAEHN CCN1CC[C@H](N[C@H](C)CS(=O)(=O)CC)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000246087618 566015657 /nfs/dbraw/zinc/01/56/57/566015657.db2.gz WFNOHUOFPHLQCO-DQYPLSBCSA-N 0 3 376.925 3.027 10 0 GGAEHN CCN1CCC[C@H](NC(=O)Nc2cc(OC)c(Br)c(OC)c2)C1 ZINC000179907050 566018178 /nfs/dbraw/zinc/01/81/78/566018178.db2.gz XFARFTYETLPGCH-NSHDSACASA-N 0 3 386.290 3.072 10 0 GGAEHN O=C(c1cc(Br)cc(Br)c1)N1CCN2CCC[C@H]2C1 ZINC000179913271 566018408 /nfs/dbraw/zinc/01/84/08/566018408.db2.gz RGWGDVDKQSRFBW-ZDUSSCGKSA-N 0 3 388.103 3.132 10 0 GGAEHN CC[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc(F)cc1C(F)(F)F ZINC000246135470 566018547 /nfs/dbraw/zinc/01/85/47/566018547.db2.gz JVPMVFVTJLLXMY-STQMWFEESA-N 0 3 380.407 3.092 10 0 GGAEHN C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccn(-c2ccc(Cl)cc2Cl)n1 ZINC000179944100 566020392 /nfs/dbraw/zinc/02/03/92/566020392.db2.gz FMATUTVCIBJDRS-TZMCWYRMSA-N 0 3 379.291 3.488 10 0 GGAEHN CNCc1ccccc1NC(=O)N[C@@](C)(CO)c1ccc(Br)cc1 ZINC000415895961 566021215 /nfs/dbraw/zinc/02/12/15/566021215.db2.gz CIRWGOHBLQJDHQ-SFHVURJKSA-N 0 3 392.297 3.198 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)Nc1ccc2c(c1)CNCC2 ZINC000415898726 566021556 /nfs/dbraw/zinc/02/15/56/566021556.db2.gz RHFHGAVNIZKADA-UHFFFAOYSA-N 0 3 390.281 3.425 10 0 GGAEHN CNCc1ccccc1NC(=O)N(CCO)Cc1cc(Br)cs1 ZINC000415927149 566022362 /nfs/dbraw/zinc/02/23/62/566022362.db2.gz WCQZURGWTJGSQB-UHFFFAOYSA-N 0 3 398.326 3.256 10 0 GGAEHN Brc1ccc2c(c1)[C@@H](NC[C@@H]1COC3(CCOCC3)O1)CCCO2 ZINC000179979252 566022930 /nfs/dbraw/zinc/02/29/30/566022930.db2.gz ABBYXFDYDFKYOL-ZBFHGGJFSA-N 0 3 398.297 3.175 10 0 GGAEHN Brc1ccc([C@H](NC[C@@H]2COC3(CCOCC3)O2)C2CC2)cc1 ZINC000179984382 566023010 /nfs/dbraw/zinc/02/30/10/566023010.db2.gz AEWVKGZKPIMPFG-IAGOWNOFSA-N 0 3 382.298 3.412 10 0 GGAEHN CC(C)N1C[C@@H](C)[C@H](NC(=O)Nc2ccccc2I)C1 ZINC000246285983 566024579 /nfs/dbraw/zinc/02/45/79/566024579.db2.gz BXGKTKXJUKKMFF-BXUZGUMPSA-N 0 3 387.265 3.141 10 0 GGAEHN C[C@@](CO)(NC(=O)Nc1ccc2c(c1)CNC2)c1ccc(Br)cc1 ZINC000416003246 566025040 /nfs/dbraw/zinc/02/50/40/566025040.db2.gz FDMJDACTOIYXSH-SFHVURJKSA-N 0 3 390.281 3.082 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cccc(C)c2Br)[C@@H](C)C1 ZINC000246326073 566025539 /nfs/dbraw/zinc/02/55/39/566025539.db2.gz TXQNIXSQHXOCOZ-KBPBESRZSA-N 0 3 389.359 3.108 10 0 GGAEHN Cc1cc(Cl)ccc1OCCCN[C@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000180048630 566028307 /nfs/dbraw/zinc/02/83/07/566028307.db2.gz LXJPVYSHRLYYIF-CQSZACIVSA-N 0 3 382.913 3.416 10 0 GGAEHN CN1CCC[C@H](CNC(=O)NC[C@@H](O)c2ccsc2)[C@H]1c1cccs1 ZINC000246429812 566030378 /nfs/dbraw/zinc/03/03/78/566030378.db2.gz SWQGSYSHJXDRTB-UNEWFSDZSA-N 0 3 379.551 3.225 10 0 GGAEHN CC[C@@H]1CN(Cc2cc(Br)cc3cccnc32)CCN1C[C@H](C)O ZINC000246483126 566030956 /nfs/dbraw/zinc/03/09/56/566030956.db2.gz NGZWVYIEKRSVQC-KBXCAEBGSA-N 0 3 392.341 3.274 10 0 GGAEHN CC[C@H]1CN(Cc2cc(Br)cc3cccnc32)CCN1C[C@H](C)O ZINC000246483146 566031579 /nfs/dbraw/zinc/03/15/79/566031579.db2.gz NGZWVYIEKRSVQC-KSSFIOAISA-N 0 3 392.341 3.274 10 0 GGAEHN C[C@@H]1CN(Cc2cc(Br)cc3cccnc32)C[C@H]1N1CCOCC1 ZINC000246564624 566034297 /nfs/dbraw/zinc/03/42/97/566034297.db2.gz RLCIBAACGNEMLI-RDTXWAMCSA-N 0 3 390.325 3.150 10 0 GGAEHN COc1c(Br)c(C)sc1C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000246708326 566037214 /nfs/dbraw/zinc/03/72/14/566037214.db2.gz CMXNKEMBSTWZDB-GXSJLCMTSA-N 0 3 375.332 3.382 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)c1cc(Br)cc(Br)c1 ZINC000180156460 566039012 /nfs/dbraw/zinc/03/90/12/566039012.db2.gz CDQJAQXBZJMYPW-LBPRGKRZSA-N 0 3 376.092 3.036 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)N1CCc2cc(Cl)cc(Cl)c2C1 ZINC000364221981 566039688 /nfs/dbraw/zinc/03/96/88/566039688.db2.gz QKVRVQFGSBIDKD-IDHHARJASA-N 0 3 383.319 3.411 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N(C)[C@H]1CCN(C)C[C@@H]1C ZINC000246754894 566039945 /nfs/dbraw/zinc/03/99/45/566039945.db2.gz ZOFCRKUNBCOGQP-VBQJREDUSA-N 0 3 382.346 3.362 10 0 GGAEHN COc1c(Br)c(C)sc1C(=O)N[C@H]1CN(C(C)C)C[C@H]1C ZINC000246782246 566041460 /nfs/dbraw/zinc/04/14/60/566041460.db2.gz CLFPIGZHGZMRTP-KOLCDFICSA-N 0 3 375.332 3.286 10 0 GGAEHN C[C@@H](NC[C@H](O)c1c(Cl)cccc1Cl)c1ccc(S(N)(=O)=O)cc1 ZINC000180182916 566041695 /nfs/dbraw/zinc/04/16/95/566041695.db2.gz VQBVUJAFMNXRJV-BMIGLBTASA-N 0 3 389.304 3.025 10 0 GGAEHN CN(C)[C@H](CC(=O)N[C@H](CO)c1cccc(Br)c1)c1ccccc1 ZINC000416189550 566042552 /nfs/dbraw/zinc/04/25/52/566042552.db2.gz KWBVGDQGUBNZBB-QZTJIDSGSA-N 0 3 391.309 3.292 10 0 GGAEHN C[C@H](Oc1ccc(F)cc1Br)C(=O)N1C[C@H]2CCCN2C[C@H]1C ZINC000246960974 566046838 /nfs/dbraw/zinc/04/68/38/566046838.db2.gz DJPQJTLXCLUYNQ-MBNYWOFBSA-N 0 3 385.277 3.051 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1C[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000246936841 566047463 /nfs/dbraw/zinc/04/74/63/566047463.db2.gz HJDAQPBIPPDKAB-JKSUJKDBSA-N 0 3 384.307 3.403 10 0 GGAEHN C[C@@H](NC(=O)C[C@@H](c1ccccc1)N(C)C)c1ncc(Br)cn1 ZINC000416240289 566048924 /nfs/dbraw/zinc/04/89/24/566048924.db2.gz NAFJBZKSKKTDIT-DOMZBBRYSA-N 0 3 377.286 3.109 10 0 GGAEHN FC(F)(F)c1nc(N2CCN(C[C@@H]3CCOC3)CC2)ccc1Br ZINC000287979580 566050647 /nfs/dbraw/zinc/05/06/47/566050647.db2.gz UWIFZPJQJFBVNC-NSHDSACASA-N 0 3 394.235 3.021 10 0 GGAEHN Cc1cc(C(=O)N2CCN3CCC[C@@H]3C2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000180285469 566051667 /nfs/dbraw/zinc/05/16/67/566051667.db2.gz BVDBOUFDHKZGLH-CQSZACIVSA-N 0 3 379.291 3.408 10 0 GGAEHN C[C@H](CC(=O)c1cccc(Br)c1)C(=O)N1C[C@@H]2CCCN2C[C@H]1C ZINC000247298902 566057643 /nfs/dbraw/zinc/05/76/43/566057643.db2.gz GVQGGFUBCDLVSX-CPUCHLNUSA-N 0 3 393.325 3.353 10 0 GGAEHN C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)N1CCN2CCC[C@H]2C1 ZINC000247276203 566057912 /nfs/dbraw/zinc/05/79/12/566057912.db2.gz SNGKSWRINBVDOO-OCCSQVGLSA-N 0 3 384.293 3.009 10 0 GGAEHN CC(C)N1C[C@@H](C)[C@H](NC(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)C1 ZINC000247368606 566058729 /nfs/dbraw/zinc/05/87/29/566058729.db2.gz PAODHZHFKVWCCX-GHMZBOCLSA-N 0 3 375.357 3.241 10 0 GGAEHN Cc1ccc(O[C@H](C)C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c(Br)c1 ZINC000247369557 566059176 /nfs/dbraw/zinc/05/91/76/566059176.db2.gz KRJPFIPKBWKIBN-RRFJBIMHSA-N 0 3 383.330 3.466 10 0 GGAEHN Cc1ccc(I)c(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1 ZINC000247504176 566061062 /nfs/dbraw/zinc/06/10/62/566061062.db2.gz VEILBPBZOMXOOZ-STQMWFEESA-N 0 3 386.277 3.154 10 0 GGAEHN C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000247566032 566064438 /nfs/dbraw/zinc/06/44/38/566064438.db2.gz ZZJGXVAUTUJCQS-FRRDWIJNSA-N 0 3 386.323 3.053 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)Cc2cc(Cl)cc(Cl)c2)[C@@H](C)C1 ZINC000247668858 566064462 /nfs/dbraw/zinc/06/44/62/566064462.db2.gz ZCRJDZAVPAJDJI-BLLLJJGKSA-N 0 3 379.353 3.485 10 0 GGAEHN Cc1cnn([C@H]2CCCN(C[C@@H](O)COc3ccc(Br)cc3)C2)c1 ZINC000247768811 566064925 /nfs/dbraw/zinc/06/49/25/566064925.db2.gz OOOIRNZZGSXBLF-DLBZAZTESA-N 0 3 394.313 3.031 10 0 GGAEHN CN(Cc1ccc(Br)s1)C(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C ZINC000364728307 566066668 /nfs/dbraw/zinc/06/66/68/566066668.db2.gz AFSPOAAFXUHOSX-AXAPSJFSSA-N 0 3 387.343 3.002 10 0 GGAEHN Cc1c([C@H](C)NC[C@@H]2CN(C)CCO2)cnn1-c1ccc(Cl)cc1Cl ZINC000180501405 566067991 /nfs/dbraw/zinc/06/79/91/566067991.db2.gz GNCXAANBDABGFB-SWLSCSKDSA-N 0 3 383.323 3.469 10 0 GGAEHN C[C@@H](NC(=O)N[C@H](CCO)c1ccc(Cl)c(Cl)c1)C1=CCN(C)CC1 ZINC000288328344 566068098 /nfs/dbraw/zinc/06/80/98/566068098.db2.gz VENIYNZEBUGCPC-SJKOYZFVSA-N 0 3 386.323 3.367 10 0 GGAEHN Brc1cccc(Cc2noc(CN3CCN4CCCC[C@H]4C3)n2)c1 ZINC000248367410 566075848 /nfs/dbraw/zinc/07/58/48/566075848.db2.gz UANAIVGLMFHAOG-INIZCTEOSA-N 0 3 391.313 3.093 10 0 GGAEHN CCc1nc2n(n1)C[C@H](N[C@H]1CCCOc3ccc(Br)cc31)CC2 ZINC000180612363 566076617 /nfs/dbraw/zinc/07/66/17/566076617.db2.gz PFXQZVHABJVMJB-HIFRSBDPSA-N 0 3 391.313 3.421 10 0 GGAEHN CCc1nc2n(n1)C[C@@H](N[C@H](C)c1ccc(OC)c(Br)c1)CC2 ZINC000180612662 566077103 /nfs/dbraw/zinc/07/71/03/566077103.db2.gz PEUQEPOJMIVLEU-YPMHNXCESA-N 0 3 379.302 3.277 10 0 GGAEHN C[C@@H](CN(C)C[C@@H](O)COc1cccc(Br)c1)c1nccs1 ZINC000248473995 566079844 /nfs/dbraw/zinc/07/98/44/566079844.db2.gz WYBUTTGURGLTNM-GXTWGEPZSA-N 0 3 385.327 3.381 10 0 GGAEHN O[C@@H]1CCC[C@H](CN[C@@H](c2ccc(Br)cc2)c2cncnc2)C1 ZINC000248565393 566080883 /nfs/dbraw/zinc/08/08/83/566080883.db2.gz ORLRUNNZKAGGMX-VHSSKADRSA-N 0 3 376.298 3.469 10 0 GGAEHN O[C@@H]1CCC[C@@H](CN[C@@H](c2ccc(Br)cc2)c2cncnc2)C1 ZINC000248565396 566081387 /nfs/dbraw/zinc/08/13/87/566081387.db2.gz ORLRUNNZKAGGMX-XWIAVFTESA-N 0 3 376.298 3.469 10 0 GGAEHN CCN1CCC[C@@H](N[C@H](c2ccc(Br)cc2)c2cncnc2)C1 ZINC000248584470 566083241 /nfs/dbraw/zinc/08/32/41/566083241.db2.gz WZQHIMYZZSFSLX-QZTJIDSGSA-N 0 3 375.314 3.402 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(SC)c(Cl)c2)[C@@H](C)C1 ZINC000248650175 566084982 /nfs/dbraw/zinc/08/49/82/566084982.db2.gz RZSOVZGRCZDKSG-WFASDCNBSA-N 0 3 376.975 3.413 10 0 GGAEHN C[N@@H+]1CCC[C@@H](CC[N-]S(=O)(=O)c2cccc(Br)c2Cl)C1 ZINC000416561980 566087016 /nfs/dbraw/zinc/08/70/16/566087016.db2.gz VQJXPOLENYCMPI-NSHDSACASA-N 0 3 395.750 3.113 10 0 GGAEHN C[N@H+]1CCC[C@@H](CC[N-]S(=O)(=O)c2cccc(Br)c2Cl)C1 ZINC000416561980 566087019 /nfs/dbraw/zinc/08/70/19/566087019.db2.gz VQJXPOLENYCMPI-NSHDSACASA-N 0 3 395.750 3.113 10 0 GGAEHN C[N@@H+]1CCC[C@H](CC[N-]S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000416558144 566087260 /nfs/dbraw/zinc/08/72/60/566087260.db2.gz OJUZBYDXDKTTEH-LLVKDONJSA-N 0 3 395.750 3.113 10 0 GGAEHN C[N@H+]1CCC[C@H](CC[N-]S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000416558144 566087263 /nfs/dbraw/zinc/08/72/63/566087263.db2.gz OJUZBYDXDKTTEH-LLVKDONJSA-N 0 3 395.750 3.113 10 0 GGAEHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)C2(c3ccccc3Br)CC2)C1 ZINC000248886827 566091254 /nfs/dbraw/zinc/09/12/54/566091254.db2.gz HUACGBKGYZOPNM-WMLDXEAASA-N 0 3 377.326 3.423 10 0 GGAEHN CC(C(=O)N1C[C@H](C)C[C@@H](C)C1)S(=O)(=O)Cc1csc(C(C)(C)C)n1 ZINC000248863547 566091361 /nfs/dbraw/zinc/09/13/61/566091361.db2.gz XSIKPRNTJNPQNT-MCIONIFRSA-N 0 3 386.583 3.248 10 0 GGAEHN CN1CCC(Cc2nc(Cc3cn4cc(Cl)cc(Cl)c4n3)no2)CC1 ZINC000288810274 566092231 /nfs/dbraw/zinc/09/22/31/566092231.db2.gz AMRIITPXWOLPJB-UHFFFAOYSA-N 0 3 380.279 3.499 10 0 GGAEHN C[C@H]1CN(C(=O)c2c(Cl)cc(F)cc2Cl)CC[C@@H]1N1CCN(C)CC1 ZINC000365397273 566099479 /nfs/dbraw/zinc/09/94/79/566099479.db2.gz VGZXNDMAKUBEMD-LRDDRELGSA-N 0 3 388.314 3.231 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1CC[C@@H](O)[C@@H](C)C1 ZINC000249530563 566103977 /nfs/dbraw/zinc/10/39/77/566103977.db2.gz AVTHREXUFSHSEN-KPZWWZAWSA-N 0 3 378.314 3.454 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1CC[C@H](O)[C@@H](C)C1 ZINC000249530564 566104005 /nfs/dbraw/zinc/10/40/05/566104005.db2.gz AVTHREXUFSHSEN-SGTLLEGYSA-N 0 3 378.314 3.454 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(CC(F)(F)F)cc2)[C@@H](C)C1 ZINC000249635259 566105750 /nfs/dbraw/zinc/10/57/50/566105750.db2.gz RRRBGXFLTXJICJ-BBRMVZONSA-N 0 3 378.460 3.142 10 0 GGAEHN CCN1CCC[C@H](NC(=O)N[C@H](C)c2ccc(OC)c(Br)c2)C1 ZINC000249758014 566107597 /nfs/dbraw/zinc/10/75/97/566107597.db2.gz IYHFZDDHIBMDSM-OCCSQVGLSA-N 0 3 384.318 3.302 10 0 GGAEHN C[C@@H]1[C@H](C)SCCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000365547437 566107684 /nfs/dbraw/zinc/10/76/84/566107684.db2.gz OKLCNFXOCOGBDH-RMNLLRHXSA-N 0 3 379.492 3.327 10 0 GGAEHN O=C(NCCCNCc1cccnc1)NCCc1ccc(Cl)cc1Cl ZINC000416823197 566108728 /nfs/dbraw/zinc/10/87/28/566108728.db2.gz WRKASRISVKCINW-UHFFFAOYSA-N 0 3 381.307 3.410 10 0 GGAEHN C[C@H](Oc1ccc(F)cc1Br)C(=O)NCCN1CCCC[C@H]1C ZINC000251615082 566111847 /nfs/dbraw/zinc/11/18/47/566111847.db2.gz CHMGZRWXUDBWFG-OLZOCXBDSA-N 0 3 387.293 3.346 10 0 GGAEHN CC(C)N1CC[C@H](NCCCS(C)(=O)=O)[C@H]1c1ccc(Cl)c(F)c1 ZINC000252515226 566116016 /nfs/dbraw/zinc/11/60/16/566116016.db2.gz HXJFIINVPIYTIM-DLBZAZTESA-N 0 3 376.925 3.027 10 0 GGAEHN CN(Cc1ccccc1)C[C@@H](O)CN(C)Cc1ccc(Br)cc1 ZINC000261414526 566124127 /nfs/dbraw/zinc/12/41/27/566124127.db2.gz UIDQMYBAYCQPBX-LJQANCHMSA-N 0 3 377.326 3.374 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)NC[C@@H](N)c1ccccc1 ZINC000417097002 566124640 /nfs/dbraw/zinc/12/46/40/566124640.db2.gz DDZKLBABJQFQRI-CXAGYDPISA-N 0 3 376.298 3.379 10 0 GGAEHN CN(C)C[C@H]1CN(C(=O)Nc2cc(Br)c(F)cc2Cl)CCO1 ZINC000181228374 566126415 /nfs/dbraw/zinc/12/64/15/566126415.db2.gz XSRKGCWISBOLTO-VIFPVBQESA-N 0 3 394.672 3.036 10 0 GGAEHN CC(C)c1[nH]nc(C(=O)Nc2ccc3c(c2F)CCNC3)c1Br ZINC000261635003 566126878 /nfs/dbraw/zinc/12/68/78/566126878.db2.gz BOCXLFXKGCMOBN-UHFFFAOYSA-N 0 3 381.249 3.333 10 0 GGAEHN C[C@H](NC(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C)c1ccccc1Br ZINC000261644739 566127287 /nfs/dbraw/zinc/12/72/87/566127287.db2.gz FFIWZLGWGPELPR-KMXJZHQMSA-N 0 3 381.314 3.159 10 0 GGAEHN CN(C)c1nc2sc(C(=O)Nc3ccc4c(c3F)CCNC4)cc2s1 ZINC000261707531 566130595 /nfs/dbraw/zinc/13/05/95/566130595.db2.gz KEMZPJJHUUFCTO-UHFFFAOYSA-N 0 3 376.482 3.461 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)[C@@](C)(N)c1ccc(Br)cc1 ZINC000261702333 566130920 /nfs/dbraw/zinc/13/09/20/566130920.db2.gz IOFLMCLZTWJKTR-LBTNJELSSA-N 0 3 382.346 3.002 10 0 GGAEHN NC1(C(=O)N2CCC(OCc3ccc(Cl)c(Cl)c3)CC2)CCOCC1 ZINC000261753295 566131783 /nfs/dbraw/zinc/13/17/83/566131783.db2.gz FLRAHGHFOMVWPE-UHFFFAOYSA-N 0 3 387.307 3.009 10 0 GGAEHN NC1(C(=O)Nc2ncc(Cc3cccc(Cl)c3Cl)s2)CCOCC1 ZINC000261782344 566133198 /nfs/dbraw/zinc/13/31/98/566133198.db2.gz HOEZJZHNOAYMEX-UHFFFAOYSA-N 0 3 386.304 3.487 10 0 GGAEHN Cc1sc(NC(=O)C2(N)CCOCC2)nc1-c1ccc(Br)cc1 ZINC000261755883 566133234 /nfs/dbraw/zinc/13/32/34/566133234.db2.gz FOZICOZDRYIAAW-UHFFFAOYSA-N 0 3 396.310 3.327 10 0 GGAEHN Brc1ccc(-n2cc(CN3CCNC[C@H]3c3cccnc3)cn2)cc1 ZINC000261769454 566133296 /nfs/dbraw/zinc/13/32/96/566133296.db2.gz RZJBVUDFRGYZHX-IBGZPJMESA-N 0 3 398.308 3.176 10 0 GGAEHN CCNC(=O)N1CC[C@@H](N[C@H](CCCOC)c2ccc(Br)cc2)C1 ZINC000181330968 566134031 /nfs/dbraw/zinc/13/40/31/566134031.db2.gz XMJRLJJGOCRDJP-IAGOWNOFSA-N 0 3 398.345 3.310 10 0 GGAEHN COc1cc(Br)c(CN2CCNC[C@@H]2c2cccnc2)cc1OC ZINC000261794905 566134547 /nfs/dbraw/zinc/13/45/47/566134547.db2.gz QKTNYCUTKRIPAX-MRXNPFEDSA-N 0 3 392.297 3.008 10 0 GGAEHN Brc1ccc(-c2c[nH]c(CN3CCNC[C@@H]3c3cccnc3)n2)cc1 ZINC000261787508 566134556 /nfs/dbraw/zinc/13/45/56/566134556.db2.gz UOVGAZOVCKVHHO-GOSISDBHSA-N 0 3 398.308 3.381 10 0 GGAEHN Cc1sc([C@@H](C)NC(=O)C2(N)CCOCC2)nc1-c1ccc(Cl)cc1 ZINC000261862055 566137268 /nfs/dbraw/zinc/13/72/68/566137268.db2.gz NHPOYQUHNHPCOT-LLVKDONJSA-N 0 3 379.913 3.457 10 0 GGAEHN COCCOc1c(Cl)cc(NC(=O)N2CCN3CCC[C@@H]3C2)cc1Cl ZINC000181457666 566142104 /nfs/dbraw/zinc/14/21/04/566142104.db2.gz DEQPNCANBWFBKG-CYBMUJFWSA-N 0 3 388.295 3.331 10 0 GGAEHN C[C@H](NC(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C)c1ccc(Br)cc1 ZINC000261970155 566142810 /nfs/dbraw/zinc/14/28/10/566142810.db2.gz YWPWHFDKUYMFFQ-WMNQNFFBSA-N 0 3 381.314 3.159 10 0 GGAEHN C[C@@H](NC(=O)NCCCNCc1cccnc1)c1ccc(Br)cc1 ZINC000417310732 566146251 /nfs/dbraw/zinc/14/62/51/566146251.db2.gz KPMGXRIJKDFEPN-CQSZACIVSA-N 0 3 391.313 3.384 10 0 GGAEHN C[C@@H](c1nc2ccccc2s1)[C@H](C)NCCNS(=O)(=O)c1cccs1 ZINC000181532472 566148458 /nfs/dbraw/zinc/14/84/58/566148458.db2.gz ALMVPOZTUMHUAZ-OLZOCXBDSA-N 0 3 395.575 3.418 10 0 GGAEHN C[C@@H](NCCNS(=O)(=O)c1cccs1)[C@H](C)c1nc2ccccc2s1 ZINC000181532456 566148506 /nfs/dbraw/zinc/14/85/06/566148506.db2.gz ALMVPOZTUMHUAZ-QWHCGFSZSA-N 0 3 395.575 3.418 10 0 GGAEHN C[C@H](NCCNS(=O)(=O)c1cccs1)[C@H](C)c1nc2ccccc2s1 ZINC000181532492 566148512 /nfs/dbraw/zinc/14/85/12/566148512.db2.gz ALMVPOZTUMHUAZ-STQMWFEESA-N 0 3 395.575 3.418 10 0 GGAEHN Cc1c(Br)cccc1CN[C@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000181563653 566149497 /nfs/dbraw/zinc/14/94/97/566149497.db2.gz LXXLGVSEYSOPLM-GFCCVEGCSA-N 0 3 383.311 3.256 10 0 GGAEHN COC[C@H](NC[C@H](O)COc1cccc(Br)c1)c1ccccc1 ZINC000181645471 566154676 /nfs/dbraw/zinc/15/46/76/566154676.db2.gz RGDLPWWNOZQPJQ-WMZOPIPTSA-N 0 3 380.282 3.166 10 0 GGAEHN C[C@H](NCCC(=O)N1CCN(C)CC1)c1cc2cc(Br)ccc2o1 ZINC000181686734 566158230 /nfs/dbraw/zinc/15/82/30/566158230.db2.gz VJYGFZOTLUSFPM-ZDUSSCGKSA-N 0 3 394.313 3.010 10 0 GGAEHN COC[C@H](NC[C@@H](O)COc1ccc(Br)cc1)c1ccccc1 ZINC000181683180 566158619 /nfs/dbraw/zinc/15/86/19/566158619.db2.gz YTOMWUHFQLPLGY-AEFFLSMTSA-N 0 3 380.282 3.166 10 0 GGAEHN CCSc1nccnc1C(=O)NC[C@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000366579620 566159863 /nfs/dbraw/zinc/15/98/63/566159863.db2.gz KNMVSAOQLGMFAQ-CJNGLKHVSA-N 0 3 376.551 3.463 10 0 GGAEHN C[C@@H](NC[C@H](C)N1CCN(C)CC1)c1cc2cc(Br)ccc2o1 ZINC000181702963 566159870 /nfs/dbraw/zinc/15/98/70/566159870.db2.gz SUAPOYCTEKDWAA-UONOGXRCSA-N 0 3 380.330 3.482 10 0 GGAEHN CN1CCC(Cc2nc(-c3cn4ccc(Br)cc4n3)no2)CC1 ZINC000290186419 566161228 /nfs/dbraw/zinc/16/12/28/566161228.db2.gz UFJRZPKGXMIVNG-UHFFFAOYSA-N 0 3 376.258 3.031 10 0 GGAEHN CCOCCN1CCN(CCCc2ccc(Br)cc2OC)C[C@@H]1C ZINC000181818310 566167361 /nfs/dbraw/zinc/16/73/61/566167361.db2.gz CWLIAFGXOKOBDD-INIZCTEOSA-N 0 3 399.373 3.433 10 0 GGAEHN CC[C@H]1CN(CCCc2ccc(Br)cc2OC)CCN1C[C@@H](C)O ZINC000181816537 566167529 /nfs/dbraw/zinc/16/75/29/566167529.db2.gz KTXKNKXBSMUDFP-QAPCUYQASA-N 0 3 399.373 3.167 10 0 GGAEHN CC[C@@H]1CN(CCCc2ccc(Br)cc2OC)CCN1CCOC ZINC000181818955 566167575 /nfs/dbraw/zinc/16/75/75/566167575.db2.gz LRFYUOWEHNEXKV-GOSISDBHSA-N 0 3 399.373 3.433 10 0 GGAEHN Cc1cn[nH]c1CN1CCC(C(=O)Nc2cccc(Br)c2)CC1 ZINC000290384515 566169460 /nfs/dbraw/zinc/16/94/60/566169460.db2.gz IWPQNCHGYWJQMF-UHFFFAOYSA-N 0 3 377.286 3.331 10 0 GGAEHN C[C@@H](CNC(=O)NC[C@@H](N)c1ccccc1)Oc1ccc(Br)cc1 ZINC000417774028 566175797 /nfs/dbraw/zinc/17/57/97/566175797.db2.gz KHAXEMYLVMJMQO-SUMWQHHRSA-N 0 3 392.297 3.216 10 0 GGAEHN C[C@H](CNC(=O)NC[C@H](N)c1ccccc1)Oc1cccc(Br)c1 ZINC000417793576 566176028 /nfs/dbraw/zinc/17/60/28/566176028.db2.gz LPQIWOIDXQVNDY-DYVFJYSZSA-N 0 3 392.297 3.216 10 0 GGAEHN C[C@H](N[C@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccccc1Br ZINC000182070823 566180599 /nfs/dbraw/zinc/18/05/99/566180599.db2.gz AVWIWAYXZYQPKT-BLLLJJGKSA-N 0 3 396.329 3.190 10 0 GGAEHN Cc1cc(N2CCC[C@@H](N[C@@H](C)c3ccc(Br)nc3)C2)n(C)n1 ZINC000290628357 566181546 /nfs/dbraw/zinc/18/15/46/566181546.db2.gz IWPGVNBPPMCCRD-DZGCQCFKSA-N 0 3 378.318 3.206 10 0 GGAEHN C[C@H](NC[C@H]1CC[C@H](C(=O)N(C)C)O1)c1cc2cc(Br)ccc2o1 ZINC000182107543 566184160 /nfs/dbraw/zinc/18/41/60/566184160.db2.gz TZSRWYZAVIHHKH-SGIREYDYSA-N 0 3 395.297 3.482 10 0 GGAEHN Fc1ccc(CNCCc2cnc(C3CC3)nc2)c(I)c1 ZINC000417974606 566184728 /nfs/dbraw/zinc/18/47/28/566184728.db2.gz VVXVKKSGDJHPON-UHFFFAOYSA-N 0 3 397.235 3.430 10 0 GGAEHN CC(C)[C@H](NC[C@H](O)CS(=O)(=O)c1cccs1)c1ccc(F)c(F)c1 ZINC000182164408 566186665 /nfs/dbraw/zinc/18/66/65/566186665.db2.gz BEJNOHVEFAWACO-GUYCJALGSA-N 0 3 389.489 3.148 10 0 GGAEHN C[C@@H](CS(C)(=O)=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)N2C ZINC000367163565 566188889 /nfs/dbraw/zinc/18/88/89/566188889.db2.gz KOZGWQZBXDWCIQ-YQCLPMHJSA-N 0 3 384.973 3.277 10 0 GGAEHN CS(=O)(=O)N1CC[C@@H](CN2CCC(Sc3ccc(Cl)cc3)CC2)C1 ZINC000367274570 566193390 /nfs/dbraw/zinc/19/33/90/566193390.db2.gz NICAUHFRDCCJJW-AWEZNQCLSA-N 0 3 388.986 3.178 10 0 GGAEHN N[C@H](CNC(=O)N[C@@H]1CCOc2c(Br)cccc21)c1ccccc1 ZINC000418146778 566199648 /nfs/dbraw/zinc/19/96/48/566199648.db2.gz AMZJTCMASMFYPU-HZPDHXFCSA-N 0 3 390.281 3.272 10 0 GGAEHN N[C@@H](CNC(=O)N[C@H]1CCOc2c(Br)cccc21)c1ccccc1 ZINC000418146777 566199816 /nfs/dbraw/zinc/19/98/16/566199816.db2.gz AMZJTCMASMFYPU-HOTGVXAUSA-N 0 3 390.281 3.272 10 0 GGAEHN CC[C@H](N[C@@H]1CCN(C2CCOCC2)C1=O)c1cccc(Br)c1 ZINC000367412545 566200610 /nfs/dbraw/zinc/20/06/10/566200610.db2.gz KHAGRUXFYDPLRO-DLBZAZTESA-N 0 3 381.314 3.270 10 0 GGAEHN CC[C@H](N[C@H]1CCN(C2CCOCC2)C1=O)c1cccc(Br)c1 ZINC000367412547 566200618 /nfs/dbraw/zinc/20/06/18/566200618.db2.gz KHAGRUXFYDPLRO-IRXDYDNUSA-N 0 3 381.314 3.270 10 0 GGAEHN CN(Cc1ccccc1Br)C(=O)CCN[C@@H]1CCCc2n[nH]cc21 ZINC000367534865 566205790 /nfs/dbraw/zinc/20/57/90/566205790.db2.gz YYNMJEQEHBJTJF-MRXNPFEDSA-N 0 3 391.313 3.188 10 0 GGAEHN Brc1ccccc1-c1noc(C2CCN([C@H]3CCOC3)CC2)n1 ZINC000367558944 566206914 /nfs/dbraw/zinc/20/69/14/566206914.db2.gz HMYURULKKGFICX-ZDUSSCGKSA-N 0 3 378.270 3.467 10 0 GGAEHN CN(Cc1ccc(Br)s1)C(=O)NCCCNCc1cccnc1 ZINC000418324893 566209481 /nfs/dbraw/zinc/20/94/81/566209481.db2.gz HTXVRMNIGNFHTQ-UHFFFAOYSA-N 0 3 397.342 3.227 10 0 GGAEHN CN(Cc1cc(Br)cs1)C(=O)NCCCNCc1cccnc1 ZINC000418335369 566210232 /nfs/dbraw/zinc/21/02/32/566210232.db2.gz ZPFNQUBZCIKLFA-UHFFFAOYSA-N 0 3 397.342 3.227 10 0 GGAEHN Cc1ccsc1[C@@H](NCCCNS(C)(=O)=O)c1ccc(Cl)cc1F ZINC000182530339 566210804 /nfs/dbraw/zinc/21/08/04/566210804.db2.gz MKDMUZMBQFYGIP-HNNXBMFYSA-N 0 3 390.933 3.467 10 0 GGAEHN COc1ccc(Br)cc1CN(C)C(=O)NC[C@H](N)c1ccccc1 ZINC000418421058 566212058 /nfs/dbraw/zinc/21/20/58/566212058.db2.gz BVGKDYXOOGDBJV-INIZCTEOSA-N 0 3 392.297 3.299 10 0 GGAEHN COc1ccc(Br)c(CN(C)C(=O)NC[C@H](N)c2ccccc2)c1 ZINC000418439379 566213434 /nfs/dbraw/zinc/21/34/34/566213434.db2.gz ZZKGDTKGBHTBIR-KRWDZBQOSA-N 0 3 392.297 3.299 10 0 GGAEHN CCCN(Cc1ccccc1Br)C(=O)N[C@H]1CNCCC1(F)F ZINC000418747273 566221821 /nfs/dbraw/zinc/22/18/21/566221821.db2.gz JGNFKDGARTYVQH-AWEZNQCLSA-N 0 3 390.272 3.368 10 0 GGAEHN CC(C)N(Cc1cccc(Br)c1)C(=O)N[C@H]1CNCCC1(F)F ZINC000418745095 566221837 /nfs/dbraw/zinc/22/18/37/566221837.db2.gz GEGAUVQJRRZKMI-AWEZNQCLSA-N 0 3 390.272 3.366 10 0 GGAEHN CC(C)N(Cc1ccc(Br)cc1)C(=O)N[C@H]1CNCCC1(F)F ZINC000418751040 566222024 /nfs/dbraw/zinc/22/20/24/566222024.db2.gz QCMOHEOIYLCSPQ-AWEZNQCLSA-N 0 3 390.272 3.366 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)N1CCc2sccc2[C@H]1c1cccs1 ZINC000418749199 566222283 /nfs/dbraw/zinc/22/22/83/566222283.db2.gz LYKCWOLOKCEJIE-CABCVRRESA-N 0 3 383.489 3.464 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)N1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000418745075 566222406 /nfs/dbraw/zinc/22/24/06/566222406.db2.gz GCTRSSOKOMDKFC-KGLIPLIRSA-N 0 3 375.872 3.137 10 0 GGAEHN OC[C@@H](CN[C@@H]1CCCOc2cc(Br)ccc21)c1cccnc1 ZINC000367896496 566222434 /nfs/dbraw/zinc/22/24/34/566222434.db2.gz AZSDUGNUHNEPCA-RHSMWYFYSA-N 0 3 377.282 3.424 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)N1CCC[C@@H]1c1ccc(Br)s1 ZINC000418764066 566223437 /nfs/dbraw/zinc/22/34/37/566223437.db2.gz NRKIUCABDGKEJU-KOLCDFICSA-N 0 3 394.285 3.354 10 0 GGAEHN C[C@H](NCCOc1ccc(Cl)cc1Cl)c1ccc(S(N)(=O)=O)cc1 ZINC000182861900 566226820 /nfs/dbraw/zinc/22/68/20/566226820.db2.gz DGVCOSLDGCVPLI-NSHDSACASA-N 0 3 389.304 3.370 10 0 GGAEHN CN1CC[C@@H](NCc2cnc(C3OCCO3)s2)[C@H]1c1ccc(Cl)cc1 ZINC000368031503 566228175 /nfs/dbraw/zinc/22/81/75/566228175.db2.gz UJWQUDQEDIKNIA-HZPDHXFCSA-N 0 3 379.913 3.377 10 0 GGAEHN CN(C)S(=O)(=O)c1cc(Cl)ccc1OCCN(C)Cc1ccccc1 ZINC000418978733 566229583 /nfs/dbraw/zinc/22/95/83/566229583.db2.gz WRIOLKAXKMQNNI-UHFFFAOYSA-N 0 3 382.913 3.101 10 0 GGAEHN CN(C)C1(CNc2ccc3nnc(-c4cc(Cl)cc(Cl)c4)n3n2)CC1 ZINC000419007622 566229694 /nfs/dbraw/zinc/22/96/94/566229694.db2.gz JWPRKMXZWLTYKQ-UHFFFAOYSA-N 0 3 377.279 3.026 10 0 GGAEHN CN1CCC(N(Cc2cncnc2)Cc2ccccc2Br)CC1 ZINC000368198856 566233434 /nfs/dbraw/zinc/23/34/34/566233434.db2.gz DJHWYKVFZRAGPN-UHFFFAOYSA-N 0 3 375.314 3.336 10 0 GGAEHN CN1CCN(c2ncc(CN[C@@H]3CCCc4sc(Cl)cc43)cn2)CC1 ZINC000291779512 566234682 /nfs/dbraw/zinc/23/46/82/566234682.db2.gz UQZWNXSIIBMNSJ-OAHLLOKOSA-N 0 3 377.945 3.111 10 0 GGAEHN OC[C@H](CN[C@H]1CCCOc2ccc(Br)cc21)c1cccnc1 ZINC000368577434 566241935 /nfs/dbraw/zinc/24/19/35/566241935.db2.gz WIBNSYRTKHGZRR-YOEHRIQHSA-N 0 3 377.282 3.424 10 0 GGAEHN OC[C@H](CN[C@@H]1CCCOc2ccc(Br)cc21)c1cccnc1 ZINC000368577422 566242017 /nfs/dbraw/zinc/24/20/17/566242017.db2.gz WIBNSYRTKHGZRR-WMLDXEAASA-N 0 3 377.282 3.424 10 0 GGAEHN CN1CCC[C@H](NCc2ccc(S(N)(=O)=O)c(Cl)c2)c2ccccc21 ZINC000419705264 566242307 /nfs/dbraw/zinc/24/23/07/566242307.db2.gz AEAMCYRCJGDEGP-INIZCTEOSA-N 0 3 379.913 3.048 10 0 GGAEHN CN(C)C(=O)[C@@H]1CC[C@@H](CN[C@@H](c2ccc(Br)cc2)C2CC2)O1 ZINC000183458323 566247378 /nfs/dbraw/zinc/24/73/78/566247378.db2.gz IHEADJAEFOTVQA-YESZJQIVSA-N 0 3 381.314 3.126 10 0 GGAEHN C[C@]1(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCCS1 ZINC000369084130 566249814 /nfs/dbraw/zinc/24/98/14/566249814.db2.gz LEVBZZVNIWSIOC-ZBCRRDGASA-N 0 3 379.492 3.377 10 0 GGAEHN Cc1cncn1C1CCN(C(=O)c2[nH]nc3ccc(Br)cc32)CC1 ZINC000369160885 566250022 /nfs/dbraw/zinc/25/00/22/566250022.db2.gz CYZLHWIPBYFYJO-UHFFFAOYSA-N 0 3 388.269 3.308 10 0 GGAEHN Cc1ccccc1[C@H](CC(F)(F)F)NC[C@@H]1CCCN(S(C)(=O)=O)C1 ZINC000444784784 566251889 /nfs/dbraw/zinc/25/18/89/566251889.db2.gz OULNECMEDCQHCI-HOCLYGCPSA-N 0 3 378.460 3.250 10 0 GGAEHN COc1cc(C(=O)NCCN2CCCC[C@H]2C)cc(Br)c1OC ZINC000555816270 566252704 /nfs/dbraw/zinc/25/27/04/566252704.db2.gz FCZBMWPXVNXACL-GFCCVEGCSA-N 0 3 385.302 3.071 10 0 GGAEHN OC[C@@H](CNCc1cnc(-c2ccc(Br)cc2)s1)[C@@H]1CCOC1 ZINC000481811488 566253802 /nfs/dbraw/zinc/25/38/02/566253802.db2.gz BMHZLKLZYJCUIW-ZIAGYGMSSA-N 0 3 397.338 3.307 10 0 GGAEHN OC[C@H](CNCc1cnc(-c2ccc(Br)cc2)s1)[C@@H]1CCOC1 ZINC000481811484 566254326 /nfs/dbraw/zinc/25/43/26/566254326.db2.gz BMHZLKLZYJCUIW-KGLIPLIRSA-N 0 3 397.338 3.307 10 0 GGAEHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)c1[nH]nc2ccc(Br)cc21 ZINC000599352004 566254547 /nfs/dbraw/zinc/25/45/47/566254547.db2.gz HXAPGNYLYOWFOZ-RYUDHWBXSA-N 0 3 379.302 3.176 10 0 GGAEHN CN(C)CC[C@@](C)(O)CNC(=O)c1ccc2scc(Br)c2c1 ZINC000419969845 566255652 /nfs/dbraw/zinc/25/56/52/566255652.db2.gz ANZFJZIVLBQURE-MRXNPFEDSA-N 0 3 385.327 3.096 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000668670418 566256128 /nfs/dbraw/zinc/25/61/28/566256128.db2.gz LNGGULAUXHESHF-UHFFFAOYSA-N 0 3 392.297 3.482 10 0 GGAEHN C[C@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)N1CCC(C)CC1 ZINC000599360139 566257268 /nfs/dbraw/zinc/25/72/68/566257268.db2.gz CKQYYKQBRODQRB-GFCCVEGCSA-N 0 3 379.302 3.176 10 0 GGAEHN Brc1cncc(Br)c1CN1CC[C@@H]2COC[C@H]2C1 ZINC000668704661 566257598 /nfs/dbraw/zinc/25/75/98/566257598.db2.gz BWXZIUACVRONRJ-NXEZZACHSA-N 0 3 376.092 3.075 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1CC[C@H]2COC[C@@H]2C1 ZINC000668705043 566258052 /nfs/dbraw/zinc/25/80/52/566258052.db2.gz FPJTTWSISWHAKR-HOCLYGCPSA-N 0 3 376.298 3.412 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1CC[C@@H]2COC[C@H]2C1 ZINC000668706571 566258675 /nfs/dbraw/zinc/25/86/75/566258675.db2.gz UZZQKBRALSNIPD-GDBMZVCRSA-N 0 3 376.298 3.412 10 0 GGAEHN Brc1cncc(Br)c1CN1CC[C@H]2COC[C@@H]2C1 ZINC000668704662 566259092 /nfs/dbraw/zinc/25/90/92/566259092.db2.gz BWXZIUACVRONRJ-UWVGGRQHSA-N 0 3 376.092 3.075 10 0 GGAEHN CN1CCN(C)[C@@H](CN[C@@H]2CCC(C)(C)c3ccc(Br)cc32)C1 ZINC000481923012 566265893 /nfs/dbraw/zinc/26/58/93/566265893.db2.gz JRHRRFBPVXEKNB-MAUKXSAKSA-N 0 3 380.374 3.397 10 0 GGAEHN COC(=O)[C@@H]1CCCC[C@@H]1N[C@@H]1CCc2cc(Br)ccc2NC1=O ZINC000599433466 566266474 /nfs/dbraw/zinc/26/64/74/566266474.db2.gz SLASJHVEZYXZHP-VNQPRFMTSA-N 0 3 395.297 3.024 10 0 GGAEHN CN(Cc1cc(Br)cc(Br)c1)C1(CO)CCOCC1 ZINC000668804689 566268550 /nfs/dbraw/zinc/26/85/50/566268550.db2.gz GRFCRSGWMUIIAO-UHFFFAOYSA-N 0 3 393.119 3.185 10 0 GGAEHN COc1ccc(CCC(=O)N(C)C[C@@H]2CCCN(C)C2)c(Br)c1 ZINC000668800227 566268636 /nfs/dbraw/zinc/26/86/36/566268636.db2.gz ZCQRENAIAKUOHD-CQSZACIVSA-N 0 3 383.330 3.191 10 0 GGAEHN CN(C[C@H]1CCCN(C)C1)C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000668800399 566269470 /nfs/dbraw/zinc/26/94/70/566269470.db2.gz NWFDGQGKHUFMAH-HNNXBMFYSA-N 0 3 394.357 3.463 10 0 GGAEHN NC(C(=O)NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)C(F)(F)F ZINC000575398281 566270492 /nfs/dbraw/zinc/27/04/92/566270492.db2.gz FPLDCZQASOECNB-SNVBAGLBSA-N 0 3 383.317 3.335 10 0 GGAEHN COc1cc(I)c(Cl)cc1CN[C@H]1CCCOC1 ZINC000482001169 566275114 /nfs/dbraw/zinc/27/51/14/566275114.db2.gz MJAOCXQEHMNZIX-JTQLQIEISA-N 0 3 381.641 3.222 10 0 GGAEHN CCc1ccccc1[C@H](N)CNS(=O)(=O)Cc1ccc(Br)cc1 ZINC000420457792 566278677 /nfs/dbraw/zinc/27/86/77/566278677.db2.gz IFRGLBXMWNTUFV-QGZVFWFLSA-N 0 3 397.338 3.131 10 0 GGAEHN CN(Cc1c(Br)cncc1Br)[C@@H]1CCN(C2CC2)C1 ZINC000575632265 566279455 /nfs/dbraw/zinc/27/94/55/566279455.db2.gz TXOJFSMBEQATLX-LLVKDONJSA-N 0 3 389.135 3.275 10 0 GGAEHN CC[N@@H+]1CCC[C@@H](C[N-]S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000509221560 566279524 /nfs/dbraw/zinc/27/95/24/566279524.db2.gz BZFKVESHXOODQC-NSHDSACASA-N 0 3 395.750 3.113 10 0 GGAEHN CC[N@H+]1CCC[C@@H](C[N-]S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000509221560 566279531 /nfs/dbraw/zinc/27/95/31/566279531.db2.gz BZFKVESHXOODQC-NSHDSACASA-N 0 3 395.750 3.113 10 0 GGAEHN COc1cc2c(cc1F)CC[C@@H]2N[C@H](C)Cn1cc(Br)ccc1=O ZINC000556260590 566280462 /nfs/dbraw/zinc/28/04/62/566280462.db2.gz MAAKLCNKBRJLQE-BZNIZROVSA-N 0 3 395.272 3.424 10 0 GGAEHN O=C([C@H]1CCCN(CCCc2c(Cl)cccc2Cl)C1)N1CCOCC1 ZINC000482078679 566280660 /nfs/dbraw/zinc/28/06/60/566280660.db2.gz GSUTUZAVLSKLTN-HNNXBMFYSA-N 0 3 385.335 3.497 10 0 GGAEHN COc1cc(C[NH2+]CCc2cnc(C3CC3)nc2)cc(Br)c1[O-] ZINC000535186491 566284685 /nfs/dbraw/zinc/28/46/85/566284685.db2.gz PCKQUUGBFLPCBM-UHFFFAOYSA-N 0 3 378.270 3.163 10 0 GGAEHN CN(C)C1(CNC(=O)Cc2cscc2Br)Cc2ccccc2C1 ZINC000556325369 566285819 /nfs/dbraw/zinc/28/58/19/566285819.db2.gz PESVOKDQEYGFSN-UHFFFAOYSA-N 0 3 393.350 3.269 10 0 GGAEHN COc1ccc(CCC(=O)N(C)[C@H]2CCN(C)C[C@@H]2C)c(Br)c1 ZINC000669119720 566285921 /nfs/dbraw/zinc/28/59/21/566285921.db2.gz GDAZMIGFSJDDPO-GUYCJALGSA-N 0 3 383.330 3.189 10 0 GGAEHN CCN1CC[C@H](N(C)C(=O)c2nn(C(C)(C)C)cc2Br)[C@H](C)C1 ZINC000669126236 566286180 /nfs/dbraw/zinc/28/61/80/566286180.db2.gz VGAWDLVDJANINC-OCCSQVGLSA-N 0 3 385.350 3.203 10 0 GGAEHN COC(=O)[C@@H]1C[C@@H](C)N(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)[C@@H](C)C1 ZINC000599703536 566287829 /nfs/dbraw/zinc/28/78/29/566287829.db2.gz CLVZCSZLLZXWMA-XJFOESAGSA-N 0 3 390.307 3.395 10 0 GGAEHN Cc1cc(Br)cc(C)c1S(=O)(=O)N(C)[C@@H]1CCN(C)C[C@@H]1C ZINC000462354542 566289810 /nfs/dbraw/zinc/28/98/10/566289810.db2.gz DKXLWYCEHSMSJH-DZGCQCFKSA-N 0 3 389.359 3.027 10 0 GGAEHN C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)N(C)[C@@H]1CN2CCC1CC2 ZINC000482181316 566290413 /nfs/dbraw/zinc/29/04/13/566290413.db2.gz QYEDNGNRIXOLEV-YVEFUNNKSA-N 0 3 383.305 3.319 10 0 GGAEHN C[C@H]1C[C@@H](NC(=O)c2cc(Br)cc(N3CCCC3)c2)CCN1C ZINC000669184435 566290846 /nfs/dbraw/zinc/29/08/46/566290846.db2.gz ZFLQPRGJEOLIRK-BBRMVZONSA-N 0 3 380.330 3.262 10 0 GGAEHN CCCN(C)CC(=O)N1CCC[C@@H]1c1ccc(I)cc1 ZINC000535285946 566292385 /nfs/dbraw/zinc/29/23/85/566292385.db2.gz NKEXMHOPWKSZQX-OAHLLOKOSA-N 0 3 386.277 3.297 10 0 GGAEHN CS[C@@H]1CN(C(=O)[C@@H]2[C@@H]3Cc4c(cccc4Cl)[C@@H]32)C[C@@H]1N1CCCC1 ZINC000599761922 566293148 /nfs/dbraw/zinc/29/31/48/566293148.db2.gz LKHFVSOHXPQTNU-LZBKUMLDSA-N 0 3 376.953 3.264 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(Cl)ccc2OC(F)F)[C@@H](C)C1 ZINC000420678499 566298728 /nfs/dbraw/zinc/29/87/28/566298728.db2.gz SXTXMEPGFSRKMT-AAEUAGOBSA-N 0 3 396.887 3.292 10 0 GGAEHN O=C1Nc2ccc(Br)cc2CC[C@@H]1N1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000625261587 566300324 /nfs/dbraw/zinc/30/03/24/566300324.db2.gz HRHDRRXNBSDTLO-VKJFTORMSA-N 0 3 393.325 3.451 10 0 GGAEHN CC[NH+]1CCC(CC[N-]S(=O)(=O)c2sc(C)cc2Br)CC1 ZINC000462423907 566300690 /nfs/dbraw/zinc/30/06/90/566300690.db2.gz ZAMPEXDBJSEUHW-UHFFFAOYSA-N 0 3 395.388 3.219 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)[C@H]1COc2ccc(Br)cc21 ZINC000535389158 566301932 /nfs/dbraw/zinc/30/19/32/566301932.db2.gz KUPJNDRVYOLBCM-ZENOOKHLSA-N 0 3 381.314 3.304 10 0 GGAEHN O=C([C@@H]1CCc2cc(Br)ccc21)N1CCN(c2ccncc2)CC1 ZINC000648718517 566303658 /nfs/dbraw/zinc/30/36/58/566303658.db2.gz OFWGGNSGUVCRBT-GOSISDBHSA-N 0 3 386.293 3.223 10 0 GGAEHN C[C@@H]1CN(CCCOc2cccc(I)c2)[C@H](C)CN1C ZINC000509462902 566307434 /nfs/dbraw/zinc/30/74/34/566307434.db2.gz KNJWDSPQEMGTAY-ZIAGYGMSSA-N 0 3 388.293 3.085 10 0 GGAEHN CCN(C(=O)c1cc(C)ccc1I)C1CCN(C)CC1 ZINC000599985235 566307771 /nfs/dbraw/zinc/30/77/71/566307771.db2.gz AKWVZHIIAZXHKU-UHFFFAOYSA-N 0 3 386.277 3.156 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2cc(C(=O)OC)ccc2Cl)n1 ZINC000482438542 566307857 /nfs/dbraw/zinc/30/78/57/566307857.db2.gz MGJASHREVSLUNS-UHFFFAOYSA-N 0 3 382.869 3.092 10 0 GGAEHN Cc1ccc(C(=O)N2CCCC[C@@H]2CN(C)C)cc1I ZINC000556503119 566308461 /nfs/dbraw/zinc/30/84/61/566308461.db2.gz FAOZIBISFNOCDL-CQSZACIVSA-N 0 3 386.277 3.156 10 0 GGAEHN Cc1cc(Br)c(F)c(C(=O)N(CCN(C)C)Cc2ccccn2)c1 ZINC000625346957 566311321 /nfs/dbraw/zinc/31/13/21/566311321.db2.gz FOEZCGRMCOUFKI-UHFFFAOYSA-N 0 3 394.288 3.496 10 0 GGAEHN CC1(C)COCCN1CCN[C@@H]1CCCOc2ccc(Br)cc21 ZINC000482535992 566316155 /nfs/dbraw/zinc/31/61/55/566316155.db2.gz PSHZWXYDVCQTQK-MRXNPFEDSA-N 0 3 383.330 3.363 10 0 GGAEHN O=C1CC[C@@H](N2CCN(Cc3c(Cl)ccc(Cl)c3Cl)CC2)CCN1 ZINC000648819245 566317037 /nfs/dbraw/zinc/31/70/37/566317037.db2.gz YPTFNMBGNMPCMW-GFCCVEGCSA-N 0 3 390.742 3.433 10 0 GGAEHN O=C(N[C@@H]1CCN(CC2CC2)C1)N[C@@H]1CCOc2c(Br)cccc21 ZINC000669649753 566316964 /nfs/dbraw/zinc/31/69/64/566316964.db2.gz YQNFQVUVESVLKN-CZUORRHYSA-N 0 3 394.313 3.056 10 0 GGAEHN CCOC(=O)c1cccc(CNCCc2ccc(F)c(Br)c2)n1 ZINC000600130522 566317400 /nfs/dbraw/zinc/31/74/00/566317400.db2.gz NYJHWEZBWZXUNT-UHFFFAOYSA-N 0 3 381.245 3.492 10 0 GGAEHN CS(=O)(=O)NC[C@H]1CCC[C@@H]1NCc1c(Cl)ccc(Cl)c1Cl ZINC000669686511 566320278 /nfs/dbraw/zinc/32/02/78/566320278.db2.gz HXGNWJCKXJHANU-RNCFNFMXSA-N 0 3 385.744 3.454 10 0 GGAEHN C[N@@H+]1CCCC[C@H](C[N-]S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000625426191 566321573 /nfs/dbraw/zinc/32/15/73/566321573.db2.gz VTPJUJSUKFMECE-LLVKDONJSA-N 0 3 395.750 3.113 10 0 GGAEHN C[N@H+]1CCCC[C@H](C[N-]S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000625426191 566321578 /nfs/dbraw/zinc/32/15/78/566321578.db2.gz VTPJUJSUKFMECE-LLVKDONJSA-N 0 3 395.750 3.113 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N(C)C[C@@H]1CCCN1C ZINC000420832334 566322355 /nfs/dbraw/zinc/32/23/55/566322355.db2.gz KKIPSQYSHBUEHP-JSGCOSHPSA-N 0 3 384.318 3.254 10 0 GGAEHN CN1Cc2ccccc2[C@H](NC(=O)c2cc(Br)cc3nc[nH]c32)C1 ZINC000669713303 566324596 /nfs/dbraw/zinc/32/45/96/566324596.db2.gz PHRYPJHDFBDQMF-MRXNPFEDSA-N 0 3 385.265 3.242 10 0 GGAEHN O=C1Nc2ccc(Br)cc2CC[C@@H]1N1CCC[C@]2(CCOC2)C1 ZINC000625461672 566325834 /nfs/dbraw/zinc/32/58/34/566325834.db2.gz KZOLYNOZBDBBMD-WMZOPIPTSA-N 0 3 379.298 3.205 10 0 GGAEHN COC[C@H]1CCCN([C@@H]2CCc3cc(Br)ccc3NC2=O)CC1 ZINC000625466084 566327246 /nfs/dbraw/zinc/32/72/46/566327246.db2.gz WIYAEEFXCUKAME-SUMWQHHRSA-N 0 3 381.314 3.451 10 0 GGAEHN O=C(N[C@@H]1CCN(CC2CC2)C1)c1c(Cl)cc(F)cc1Br ZINC000648922079 566330285 /nfs/dbraw/zinc/33/02/85/566330285.db2.gz GSPDTDWYHJFRLY-LLVKDONJSA-N 0 3 375.669 3.456 10 0 GGAEHN CN(C(=O)NCCSCC(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000535823288 566330457 /nfs/dbraw/zinc/33/04/57/566330457.db2.gz RMRMCNAJQKQSKE-OAHLLOKOSA-N 0 3 375.460 3.198 10 0 GGAEHN CN1C[C@@H]2CCCN(C(=O)c3cc4c(cncc4Br)s3)[C@@H]2C1 ZINC000648934335 566332287 /nfs/dbraw/zinc/33/22/87/566332287.db2.gz SHTXHILPBVYZEZ-GXFFZTMASA-N 0 3 380.311 3.225 10 0 GGAEHN CN(CCOc1c(Br)cccc1Br)CC1(CO)CC1 ZINC000482843305 566337350 /nfs/dbraw/zinc/33/73/50/566337350.db2.gz WWJDQUBKLSDGCL-UHFFFAOYSA-N 0 3 393.119 3.295 10 0 GGAEHN CCCN(C(=O)c1cc(=O)[nH]c2ccc(Br)cc21)[C@H]1CCN(C)C1 ZINC000649000132 566338277 /nfs/dbraw/zinc/33/82/77/566338277.db2.gz PFDSMGPQBNQZOJ-ZDUSSCGKSA-N 0 3 392.297 3.259 10 0 GGAEHN C[C@]12C[C@H]1CCC[C@H]2[NH2+]CC[N-]S(=O)(=O)c1cccc(Cl)c1Cl ZINC000556911019 566342607 /nfs/dbraw/zinc/34/26/07/566342607.db2.gz IURYNMYFXIITQG-XFJVYGCCSA-N 0 3 377.337 3.440 10 0 GGAEHN CN(C(=O)c1cc2c(cc(Br)cc2F)[nH]1)[C@@H]1CN2CCC1CC2 ZINC000600516919 566342845 /nfs/dbraw/zinc/34/28/45/566342845.db2.gz SONROLJCWPTMGU-MRXNPFEDSA-N 0 3 380.261 3.236 10 0 GGAEHN CN(C(=O)CCCOc1cccc(Br)c1)[C@@H]1CN2CCC1CC2 ZINC000600514512 566342895 /nfs/dbraw/zinc/34/28/95/566342895.db2.gz DZXVDSRQNUNICT-QGZVFWFLSA-N 0 3 381.314 3.161 10 0 GGAEHN C[C@H](NCCn1ccc2cc(Cl)ccc21)c1ccc(S(N)(=O)=O)cc1 ZINC000556914110 566343469 /nfs/dbraw/zinc/34/34/69/566343469.db2.gz DNQIGJOHXOZCPZ-ZDUSSCGKSA-N 0 3 377.897 3.293 10 0 GGAEHN O=C(N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)N1CCN2CCC1CC2 ZINC000576416409 566343917 /nfs/dbraw/zinc/34/39/17/566343917.db2.gz BHDOVVSLGUOKEZ-CYBMUJFWSA-N 0 3 383.323 3.062 10 0 GGAEHN C[C@@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1cccc(OC(F)(F)F)c1 ZINC000556921579 566344390 /nfs/dbraw/zinc/34/43/90/566344390.db2.gz PSRJIFWIEHSRMU-TZMCWYRMSA-N 0 3 380.432 3.050 10 0 GGAEHN COc1ccc([C@@H](C)N[C@@H](C)C2(S(C)(=O)=O)CC2)cc1Br ZINC000556920559 566344732 /nfs/dbraw/zinc/34/47/32/566344732.db2.gz JWDGMBZOPBDABA-MNOVXSKESA-N 0 3 376.316 3.074 10 0 GGAEHN Cc1cc(Cl)c2c(c1)[C@@H](NC[C@H]1CCCCN1S(C)(=O)=O)CCCO2 ZINC000556920585 566344884 /nfs/dbraw/zinc/34/48/84/566344884.db2.gz NHIJFHXCTPOAEB-PBHICJAKSA-N 0 3 386.945 3.266 10 0 GGAEHN Cc1cc(C(=O)N2CC[C@@H](OCCN3CCCCC3)C2)ccc1Br ZINC000536047302 566346799 /nfs/dbraw/zinc/34/67/99/566346799.db2.gz IANDPIIBMZHLLB-QGZVFWFLSA-N 0 3 395.341 3.475 10 0 GGAEHN C[C@@H](N[C@@H](C)Cc1ccc(Br)c(F)c1)C1(S(C)(=O)=O)CC1 ZINC000556924592 566346861 /nfs/dbraw/zinc/34/68/61/566346861.db2.gz SHKOVDIYMVPCFL-WDEREUQCSA-N 0 3 378.307 3.075 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)c1ccc(Cl)cc1Br)CCO2 ZINC000649131594 566347207 /nfs/dbraw/zinc/34/72/07/566347207.db2.gz STQRRQUJSHFQAR-UHFFFAOYSA-N 0 3 387.705 3.039 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)c1ccc(Cl)c(Br)c1)CCO2 ZINC000649131169 566347472 /nfs/dbraw/zinc/34/74/72/566347472.db2.gz AQAQHNZMSGMRQO-UHFFFAOYSA-N 0 3 387.705 3.039 10 0 GGAEHN CC1(C)NC(=O)CC[C@@H]1NCc1cccc(Br)c1OC(F)F ZINC000670103366 566349361 /nfs/dbraw/zinc/34/93/61/566349361.db2.gz KEVXVMHIHBUYEL-NSHDSACASA-N 0 3 377.229 3.197 10 0 GGAEHN CC[C@H](CN1CCCC1)NC(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000625671435 566349393 /nfs/dbraw/zinc/34/93/93/566349393.db2.gz JGQKVTFVEDTRLL-UOAMXJAYSA-N 0 3 377.326 3.325 10 0 GGAEHN CC1(C)NC(=O)CC[C@H]1NCc1cccc(Br)c1OC(F)F ZINC000670103365 566349947 /nfs/dbraw/zinc/34/99/47/566349947.db2.gz KEVXVMHIHBUYEL-LLVKDONJSA-N 0 3 377.229 3.197 10 0 GGAEHN CN(C)C[C@H](NC(=O)CN(C)c1ccc(Cl)cn1)c1ccc(Cl)cc1 ZINC000670173173 566352126 /nfs/dbraw/zinc/35/21/26/566352126.db2.gz IQMXQGYEYJDZPU-INIZCTEOSA-N 0 3 381.307 3.244 10 0 GGAEHN CC(C)CC[C@H](NCc1ccc(S(=O)(=O)N2CCOCC2)s1)C1CC1 ZINC000670153823 566352459 /nfs/dbraw/zinc/35/24/59/566352459.db2.gz CHQYBXRYYJEKGL-KRWDZBQOSA-N 0 3 386.583 3.073 10 0 GGAEHN O[C@@H](CN1CC[C@H](Sc2ccc(Br)cc2)C1)CC1(O)CCC1 ZINC000625701163 566353356 /nfs/dbraw/zinc/35/33/56/566353356.db2.gz NQPSEFFWMAFAFH-ZBFHGGJFSA-N 0 3 386.355 3.282 10 0 GGAEHN CCn1c(CNC(=O)[C@@H](C(C)C)N(C)C)nc2cc(Br)ccc21 ZINC000483053100 566355802 /nfs/dbraw/zinc/35/58/02/566355802.db2.gz UJUZSNKSMJHULD-MRXNPFEDSA-N 0 3 381.318 3.021 10 0 GGAEHN CCn1c(CNC(=O)CN2[C@H](C)CC[C@H]2C)nc2cc(Br)ccc21 ZINC000483063555 566356935 /nfs/dbraw/zinc/35/69/35/566356935.db2.gz OEKUAOKENNYDPN-CHWSQXEVSA-N 0 3 393.329 3.308 10 0 GGAEHN CSCCCN(c1cccnc1)S(=O)(=O)c1ccc(CN(C)C)cc1 ZINC000600667776 566357029 /nfs/dbraw/zinc/35/70/29/566357029.db2.gz LKJWMXFEEDSIFE-UHFFFAOYSA-N 0 3 379.551 3.092 10 0 GGAEHN CN(Cc1ccccc1Br)C(=O)CN1CC[C@H]2CC[C@@H](C1)S2 ZINC000625771634 566357298 /nfs/dbraw/zinc/35/72/98/566357298.db2.gz OOXVIMLDFMZACO-CABCVRRESA-N 0 3 383.355 3.377 10 0 GGAEHN CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1 ZINC000510024567 566357480 /nfs/dbraw/zinc/35/74/80/566357480.db2.gz VZENNTJAZYNCAF-DVOMOZLQSA-N 0 3 385.961 3.097 10 0 GGAEHN COc1ccc(CNC(=O)NCCN2CCCC[C@H]2C)cc1Br ZINC000510044213 566358795 /nfs/dbraw/zinc/35/87/95/566358795.db2.gz WFWVSXVFMSABOB-CYBMUJFWSA-N 0 3 384.318 3.131 10 0 GGAEHN COC1CCN(CCNc2ncc(Br)cc2C(F)(F)F)CC1 ZINC000649294744 566359418 /nfs/dbraw/zinc/35/94/18/566359418.db2.gz XLCSRNKCXDSDKW-UHFFFAOYSA-N 0 3 382.224 3.386 10 0 GGAEHN CCc1noc(C)c1CN[C@]1(CO)CCc2cc(Br)ccc2C1 ZINC000625794556 566359423 /nfs/dbraw/zinc/35/94/23/566359423.db2.gz KJJMYAVMXAONFH-GOSISDBHSA-N 0 3 379.298 3.318 10 0 GGAEHN CN(Cc1nc(-c2cc(Br)cs2)no1)[C@@H]1CCN(C2CC2)C1 ZINC000600727998 566360600 /nfs/dbraw/zinc/36/06/00/566360600.db2.gz PUTJQEPUQOCRPE-GFCCVEGCSA-N 0 3 383.315 3.229 10 0 GGAEHN OC[C@]1(NCc2cc(C3CC3)no2)CCc2cc(Br)ccc2C1 ZINC000625796315 566360730 /nfs/dbraw/zinc/36/07/30/566360730.db2.gz JODAIZGKNYFGPO-SFHVURJKSA-N 0 3 377.282 3.324 10 0 GGAEHN CCc1ccc(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)nc1 ZINC000625797163 566360831 /nfs/dbraw/zinc/36/08/31/566360831.db2.gz RBZQATXADXSZKD-IBGZPJMESA-N 0 3 375.310 3.416 10 0 GGAEHN CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)Nc1cc(Cl)ccc1Cl ZINC000510129777 566365612 /nfs/dbraw/zinc/36/56/12/566365612.db2.gz FWGUXRQNWVLEMW-OAHLLOKOSA-N 0 3 387.311 3.058 10 0 GGAEHN COc1cnccc1N1CCN(Cc2cc(F)cc(Br)c2)CC1 ZINC000483224006 566365948 /nfs/dbraw/zinc/36/59/48/566365948.db2.gz DVKOIPMOWSLSKB-UHFFFAOYSA-N 0 3 380.261 3.314 10 0 GGAEHN C[C@@H](Oc1cccc(Br)c1)C(=O)N1CCc2ccccc2[C@H]1CN ZINC000576637990 566366168 /nfs/dbraw/zinc/36/61/68/566366168.db2.gz NDNNDERWMYSEME-FZKQIMNGSA-N 0 3 389.293 3.301 10 0 GGAEHN Ic1cnc(CNC[C@H]2CC23CCSCC3)s1 ZINC000421369015 566368205 /nfs/dbraw/zinc/36/82/05/566368205.db2.gz CHEMJLUGOPKHPL-SECBINFHSA-N 0 3 380.320 3.371 10 0 GGAEHN Cc1cc(Br)ccc1[C@@H]1CCCN1C(=O)N[C@H](CN)C(F)(F)F ZINC000625899364 566368203 /nfs/dbraw/zinc/36/82/03/566368203.db2.gz RUPNZTJCARHVEY-QWHCGFSZSA-N 0 3 394.235 3.494 10 0 GGAEHN C[C@@H]1C[C@H](c2ccc(Br)cc2)CN1C(=O)N[C@H](CN)C(F)(F)F ZINC000625898886 566368481 /nfs/dbraw/zinc/36/84/81/566368481.db2.gz FMYIXGALESOWFZ-SUZMYJTESA-N 0 3 394.235 3.226 10 0 GGAEHN Cc1cc(Br)ccc1[C@H]1CCCN1C(=O)N[C@H](CN)C(F)(F)F ZINC000625899362 566368545 /nfs/dbraw/zinc/36/85/45/566368545.db2.gz RUPNZTJCARHVEY-CHWSQXEVSA-N 0 3 394.235 3.494 10 0 GGAEHN NC(=O)[C@H]1CC[C@H](CNCc2nc(-c3ccc(Br)cc3)c[nH]2)CC1 ZINC000421358440 566368610 /nfs/dbraw/zinc/36/86/10/566368610.db2.gz BVQUFGAMRBHGEY-MQMHXKEQSA-N 0 3 391.313 3.221 10 0 GGAEHN C[C@H](N[C@@H]1CN(C2CC2)C[C@H]1C)c1ccc(Br)cc1OCCCO ZINC000462951978 566371357 /nfs/dbraw/zinc/37/13/57/566371357.db2.gz HOIPLXUXUQMBAJ-QWQRMKEZSA-N 0 3 397.357 3.344 10 0 GGAEHN Cc1cc(Br)c(F)c(C(=O)NC[C@]2(N(C)C)CCSC2)c1 ZINC000625985069 566373021 /nfs/dbraw/zinc/37/30/21/566373021.db2.gz ATXPMYZLXAPFSJ-OAHLLOKOSA-N 0 3 375.307 3.064 10 0 GGAEHN COCC[C@H](N[C@H](C)Cn1cc(Br)ccc1=O)c1ccc(C)o1 ZINC000576731492 566373115 /nfs/dbraw/zinc/37/31/15/566373115.db2.gz DQKYPRRHBSOFJP-DOMZBBRYSA-N 0 3 383.286 3.268 10 0 GGAEHN CC(C)S(=O)(=O)CCCN[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000625983190 566373138 /nfs/dbraw/zinc/37/31/38/566373138.db2.gz IOXNQFQJNKGTMS-INIZCTEOSA-N 0 3 381.369 3.399 10 0 GGAEHN CC(C)N(Cc1cnc(-c2ccc(Br)cc2)s1)C[C@H](O)CO ZINC000421408058 566373462 /nfs/dbraw/zinc/37/34/62/566373462.db2.gz JYGOBZHJFSNDNV-AWEZNQCLSA-N 0 3 385.327 3.136 10 0 GGAEHN Cc1cc(Br)ccc1[C@@H]1CCCN1C[C@@H](O)COC[C@@H]1CCCO1 ZINC000626009180 566375143 /nfs/dbraw/zinc/37/51/43/566375143.db2.gz ANDLJYOCQYIGTQ-AOIWGVFYSA-N 0 3 398.341 3.451 10 0 GGAEHN CCN(Cc1cc(Br)cc(Br)c1N)[C@H]1CCOC1 ZINC000463022667 566377115 /nfs/dbraw/zinc/37/71/15/566377115.db2.gz FPOWUNRWQMKEDY-NSHDSACASA-N 0 3 378.108 3.405 10 0 GGAEHN CS[C@@H]1CN(C(=O)Cc2ccc(Br)cc2C)C[C@@H]1N1CCCC1 ZINC000483389000 566379216 /nfs/dbraw/zinc/37/92/16/566379216.db2.gz BTGFHLLNCJXFNT-DLBZAZTESA-N 0 3 397.382 3.338 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2F)C[C@@H]1N1CCCC1 ZINC000483392373 566379324 /nfs/dbraw/zinc/37/93/24/566379324.db2.gz GBOGCLXNZOGRFW-GJZGRUSLSA-N 0 3 376.419 3.496 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cccc(C)c2Br)C[C@H]1N1CCCC1 ZINC000483400133 566379405 /nfs/dbraw/zinc/37/94/05/566379405.db2.gz CSJJGPNBQADFMI-CABCVRRESA-N 0 3 383.355 3.409 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cc(C)cc(Br)c2)C[C@@H]1N1CCCC1 ZINC000483400705 566380312 /nfs/dbraw/zinc/38/03/12/566380312.db2.gz DISBMKIGIZZQJQ-HOTGVXAUSA-N 0 3 383.355 3.409 10 0 GGAEHN C[C@@H]1C[C@H](c2ccc(Br)cc2)CN1C[C@@H]1CCCS(=O)(=O)C1 ZINC000626041336 566381489 /nfs/dbraw/zinc/38/14/89/566381489.db2.gz VRIPBHBCYSMMSY-YCPHGPKFSA-N 0 3 386.355 3.452 10 0 GGAEHN COC(C)(C)CS(=O)(=O)[N-]c1ccc(SCC[NH+]2CCCCC2)cc1 ZINC000576822701 566381899 /nfs/dbraw/zinc/38/18/99/566381899.db2.gz IACLEVICPIMVOR-UHFFFAOYSA-N 0 3 386.583 3.431 10 0 GGAEHN NS(=O)(=O)c1ccc(OCCNC2(c3ccccc3Cl)CCC2)cc1 ZINC000649642668 566382143 /nfs/dbraw/zinc/38/21/43/566382143.db2.gz ITNLLPJMPYUUIQ-UHFFFAOYSA-N 0 3 380.897 3.035 10 0 GGAEHN CCCCN1CCCC[C@H]1CNS(=O)(=O)c1cccnc1C(F)(F)F ZINC000576847015 566382823 /nfs/dbraw/zinc/38/28/23/566382823.db2.gz PMPPQQGBRQHZBT-ZDUSSCGKSA-N 0 3 379.448 3.033 10 0 GGAEHN CC[C@@H]1C[C@H](CN[C@H]2CCN(c3cccc(Br)c3)C2=O)CCO1 ZINC000447066891 566383479 /nfs/dbraw/zinc/38/34/79/566383479.db2.gz HRTDFSOTLUBAJK-XYPHTWIQSA-N 0 3 381.314 3.349 10 0 GGAEHN O=C(c1csc(C(F)(F)F)c1)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000626090960 566384753 /nfs/dbraw/zinc/38/47/53/566384753.db2.gz ADNWZBCMTAPAME-CQSZACIVSA-N 0 3 376.444 3.484 10 0 GGAEHN CCn1c(CNC2CCC(NC(C)=O)CC2)nc2cc(Br)ccc21 ZINC000483487211 566386088 /nfs/dbraw/zinc/38/60/88/566386088.db2.gz GMCLZZLNQUMACK-UHFFFAOYSA-N 0 3 393.329 3.356 10 0 GGAEHN COC1(C[C@@H](C)N[C@H]2CCN(c3cccc(Br)c3)C2=O)CCC1 ZINC000447095849 566386318 /nfs/dbraw/zinc/38/63/18/566386318.db2.gz ZYNVBDVPTKTMMN-CJNGLKHVSA-N 0 3 381.314 3.492 10 0 GGAEHN CN(C)CCOc1cccc(NC(=O)C(=O)c2ccc(Br)cc2)c1 ZINC000510488169 566388347 /nfs/dbraw/zinc/38/83/47/566388347.db2.gz GOLHXXXIECNICL-UHFFFAOYSA-N 0 3 391.265 3.211 10 0 GGAEHN Cc1noc([C@@H]2OCC[C@@H]2NCCC(=O)Nc2c(Cl)cccc2Cl)n1 ZINC000626144648 566389055 /nfs/dbraw/zinc/38/90/55/566389055.db2.gz MHWBEOSQKCJBOD-SWLSCSKDSA-N 0 3 385.251 3.133 10 0 GGAEHN Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(C[C@H]1CCCO1)C(F)(F)F ZINC000649730490 566389011 /nfs/dbraw/zinc/38/90/11/566389011.db2.gz SCZAQLACSWXMPG-YPMHNXCESA-N 0 3 379.400 3.085 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1ccc(Cl)c(Br)c1 ZINC000447135567 566389571 /nfs/dbraw/zinc/38/95/71/566389571.db2.gz FBCSIMJKDQWFKP-LBPRGKRZSA-N 0 3 390.709 3.335 10 0 GGAEHN CNS(=O)(=O)C[C@H]1CCCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1 ZINC000626165944 566389652 /nfs/dbraw/zinc/38/96/52/566389652.db2.gz JXHGHYZTKNTKPI-HIFRSBDPSA-N 0 3 378.460 3.114 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1ccc(F)c(Br)c1 ZINC000463193986 566389872 /nfs/dbraw/zinc/38/98/72/566389872.db2.gz XFWHWSXFYNEEFE-OAHLLOKOSA-N 0 3 379.273 3.491 10 0 GGAEHN CNS(=O)(=O)C[C@@H]1CCCN(C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000626166592 566390153 /nfs/dbraw/zinc/39/01/53/566390153.db2.gz ARCFCFGMXFPXHV-UONOGXRCSA-N 0 3 378.460 3.070 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2CCOc3ccc(Br)cc32)CCN1C ZINC000649765565 566390583 /nfs/dbraw/zinc/39/05/83/566390583.db2.gz ZTGZDRLMPPVUIZ-BPLDGKMQSA-N 0 3 381.314 3.256 10 0 GGAEHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000649764440 566390636 /nfs/dbraw/zinc/39/06/36/566390636.db2.gz CHMXPOQJLUODDI-XNRPHZJLSA-N 0 3 381.314 3.114 10 0 GGAEHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000649764439 566390704 /nfs/dbraw/zinc/39/07/04/566390704.db2.gz CHMXPOQJLUODDI-IVMMDQJWSA-N 0 3 381.314 3.114 10 0 GGAEHN O=C(CCCN1CCC(Cn2cnnc2)CC1)c1ccc(Br)cc1 ZINC000649785120 566392389 /nfs/dbraw/zinc/39/23/89/566392389.db2.gz XNXULFVZEYLCTG-UHFFFAOYSA-N 0 3 391.313 3.416 10 0 GGAEHN O=C(NC[C@H](O)CN1CCCCC1)c1cc2cc(Br)ccc2s1 ZINC000626201169 566393296 /nfs/dbraw/zinc/39/32/96/566393296.db2.gz UTIVCDIEIPSQGH-AWEZNQCLSA-N 0 3 397.338 3.240 10 0 GGAEHN CC(C)N(C[C@H](O)COc1ccc(Cl)cc1Br)[C@@H]1CCOC1 ZINC000463228590 566393360 /nfs/dbraw/zinc/39/33/60/566393360.db2.gz CULMLHBCWRYSLM-KGLIPLIRSA-N 0 3 392.721 3.342 10 0 GGAEHN CN1CCC(n2cc(NCc3ccc(I)cc3)cn2)CC1 ZINC000601149364 566393890 /nfs/dbraw/zinc/39/38/90/566393890.db2.gz MEYJDTURDQOGLV-UHFFFAOYSA-N 0 3 396.276 3.367 10 0 GGAEHN Fc1ccc2c(c1)C[C@H](NCc1cnc3ccc(Br)cn13)CO2 ZINC000577022171 566397915 /nfs/dbraw/zinc/39/79/15/566397915.db2.gz PLOXJNJZXZSJCT-AWEZNQCLSA-N 0 3 376.229 3.329 10 0 GGAEHN Cc1cc(Br)cc(C)c1CNC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000601290370 566398856 /nfs/dbraw/zinc/39/88/56/566398856.db2.gz JEHHQIUVRHJEOW-INIZCTEOSA-N 0 3 380.330 3.444 10 0 GGAEHN Cc1cc(C(=O)N(C)C[C@H]2CCCN2C)nn1-c1ccc(Br)cc1 ZINC000421715994 566402709 /nfs/dbraw/zinc/40/27/09/566402709.db2.gz ZLJHNOKUSWNMSK-MRXNPFEDSA-N 0 3 391.313 3.109 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2C[C@@H](N3CCCC3)C[C@@H]2C)c1 ZINC000557640571 566405044 /nfs/dbraw/zinc/40/50/44/566405044.db2.gz KNVVRRWQILFNBI-KBPBESRZSA-N 0 3 398.288 3.298 10 0 GGAEHN O[C@@H](COc1cc(F)cc(Br)c1)CN1CC[C@]2(CC2(F)F)C1 ZINC000649908215 566405359 /nfs/dbraw/zinc/40/53/59/566405359.db2.gz JOCNMZRXIXCRLO-OCCSQVGLSA-N 0 3 380.204 3.059 10 0 GGAEHN CCn1nccc1CCN[C@H](C)c1ccc(Br)cc1OCCCO ZINC000463373655 566405541 /nfs/dbraw/zinc/40/55/41/566405541.db2.gz DAPPPEIKAYINOF-CQSZACIVSA-N 0 3 396.329 3.320 10 0 GGAEHN CN1CCC2(CCCN2C(=O)[C@@H]2CCOc3ccc(Br)cc32)CC1 ZINC000649934809 566406666 /nfs/dbraw/zinc/40/66/66/566406666.db2.gz BRKUNWCNHYYSPJ-OAHLLOKOSA-N 0 3 393.325 3.402 10 0 GGAEHN CCNC(=O)N1CC[C@@H](N[C@@H]2CCc3c2cc(Br)cc3Cl)C1 ZINC000536854435 566406780 /nfs/dbraw/zinc/40/67/80/566406780.db2.gz XQTUNPVGTZQLSW-IAQYHMDHSA-N 0 3 386.721 3.483 10 0 GGAEHN CCNC(=O)N1CC[C@@H](N[C@H]2CCc3c2cc(Br)cc3Cl)C1 ZINC000536854419 566407280 /nfs/dbraw/zinc/40/72/80/566407280.db2.gz XQTUNPVGTZQLSW-ABAIWWIYSA-N 0 3 386.721 3.483 10 0 GGAEHN O=C(NC1CCN(CCOc2ccc(Br)cc2)CC1)[C@H]1CC12CC2 ZINC000421773671 566407989 /nfs/dbraw/zinc/40/79/89/566407989.db2.gz RAYSGASICXAVDC-QGZVFWFLSA-N 0 3 393.325 3.209 10 0 GGAEHN COC[C@](C)(CO)NCc1cc(Br)c(C)c(Br)c1 ZINC000671190912 566408096 /nfs/dbraw/zinc/40/80/96/566408096.db2.gz LUYONKRHBXHITG-ZDUSSCGKSA-N 0 3 381.108 3.007 10 0 GGAEHN CN(CCc1nnnn1-c1ccccc1)CCc1cccc(Br)c1 ZINC000463419851 566408429 /nfs/dbraw/zinc/40/84/29/566408429.db2.gz NDDOVGGJGLBBMJ-UHFFFAOYSA-N 0 3 386.297 3.142 10 0 GGAEHN C[C@H](NC(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12)C1=CCN(C)CC1 ZINC000626408856 566408566 /nfs/dbraw/zinc/40/85/66/566408566.db2.gz MEEWRNQWFFJVNC-DRCJMICCSA-N 0 3 375.310 3.101 10 0 GGAEHN CN(CCC(=O)NCc1cc(F)c(F)cc1Br)c1ccncc1 ZINC000557685133 566409258 /nfs/dbraw/zinc/40/92/58/566409258.db2.gz SWPNJQRPBXHQDB-UHFFFAOYSA-N 0 3 384.224 3.265 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@@H](C)OCC1CC1)c1ccc(Br)cn1 ZINC000649988972 566412121 /nfs/dbraw/zinc/41/21/21/566412121.db2.gz VQPGHIJTSHDNKZ-CQSZACIVSA-N 0 3 398.345 3.334 10 0 GGAEHN CCC[C@@H](OC)C(=O)N(CCN(CC)CC)c1ccc(Br)cn1 ZINC000649989064 566412326 /nfs/dbraw/zinc/41/23/26/566412326.db2.gz ZHHVKPYTIHGAON-OAHLLOKOSA-N 0 3 386.334 3.334 10 0 GGAEHN CN(Cc1cc(Br)cs1)C(=O)CN1CCCCC[C@H]1CCO ZINC000671248453 566412895 /nfs/dbraw/zinc/41/28/95/566412895.db2.gz WCGAOOZJAMGYMA-AWEZNQCLSA-N 0 3 389.359 3.096 10 0 GGAEHN C[C@@H](NC(=O)CN1CCCCC[C@H]1CCO)c1ccc(Br)cc1 ZINC000671248364 566412984 /nfs/dbraw/zinc/41/29/84/566412984.db2.gz RKLQMUOKHVXCBX-PBHICJAKSA-N 0 3 383.330 3.253 10 0 GGAEHN Cn1nnnc1CCN[C@@H](c1sccc1Br)C1CCCCC1 ZINC000671296833 566414332 /nfs/dbraw/zinc/41/43/32/566414332.db2.gz FAYRQYPFZLVGOL-CQSZACIVSA-N 0 3 384.347 3.488 10 0 GGAEHN CC(C)N1CCC[C@H](NC(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)C1 ZINC000626483342 566414466 /nfs/dbraw/zinc/41/44/66/566414466.db2.gz SPEGYKIFSUJOOL-PWUKJLEFSA-N 0 3 377.326 3.324 10 0 GGAEHN COc1ccc([C@@H](CN(C)C)NC(=O)Cc2ccc(Br)s2)cc1 ZINC000671293404 566415029 /nfs/dbraw/zinc/41/50/29/566415029.db2.gz BKEJKZULIQMKLJ-OAHLLOKOSA-N 0 3 397.338 3.481 10 0 GGAEHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000650024283 566415896 /nfs/dbraw/zinc/41/58/96/566415896.db2.gz GQGXXBBTGFVFLN-VNQPRFMTSA-N 0 3 393.325 3.400 10 0 GGAEHN COCC1(CCN[C@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)CC1 ZINC000577220868 566416489 /nfs/dbraw/zinc/41/64/89/566416489.db2.gz ZGCLZBKQRRXAAR-SNVBAGLBSA-N 0 3 381.325 3.108 10 0 GGAEHN Cc1ccc(I)c(C(=O)NCCN2CCC[C@H](C)C2)c1 ZINC000510851587 566416864 /nfs/dbraw/zinc/41/68/64/566416864.db2.gz HNMGXNOYYKZRPK-ZDUSSCGKSA-N 0 3 386.277 3.061 10 0 GGAEHN C[C@@H](NCCOc1cccc(Cl)c1Cl)c1ccc(S(N)(=O)=O)cc1 ZINC000537014504 566417720 /nfs/dbraw/zinc/41/77/20/566417720.db2.gz QTNQQSGRXVNEPE-LLVKDONJSA-N 0 3 389.304 3.370 10 0 GGAEHN Brc1ccc2c(c1)[C@@H](NCC1(N3CCOCC3)CC1)CCCO2 ZINC000447592626 566418077 /nfs/dbraw/zinc/41/80/77/566418077.db2.gz MTSJKCZCAVRPPI-INIZCTEOSA-N 0 3 381.314 3.117 10 0 GGAEHN C[C@H](NCCOc1cccc(Cl)c1Cl)c1ccc(S(N)(=O)=O)cc1 ZINC000537014505 566418140 /nfs/dbraw/zinc/41/81/40/566418140.db2.gz QTNQQSGRXVNEPE-NSHDSACASA-N 0 3 389.304 3.370 10 0 GGAEHN CCO[C@H]1C[C@@H](NCc2ccc(S(=O)(=O)N(C)C)s2)C12CCCCC2 ZINC000557792530 566420009 /nfs/dbraw/zinc/42/00/09/566420009.db2.gz UYGUQWLUBDGFGL-CVEARBPZSA-N 0 3 386.583 3.216 10 0 GGAEHN Cc1cc(Br)cc(C)c1N1CCC[C@H](N(CCO)CC2CC2)C1=O ZINC000510935198 566420790 /nfs/dbraw/zinc/42/07/90/566420790.db2.gz ISMATXRQZZYBEH-KRWDZBQOSA-N 0 3 395.341 3.266 10 0 GGAEHN CC(C)N1CC[C@@H](N(C)C(=O)[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000650085759 566421587 /nfs/dbraw/zinc/42/15/87/566421587.db2.gz XRIJEQZLJFLNGL-HUUCEWRRSA-N 0 3 381.314 3.256 10 0 GGAEHN Clc1ccc2c(c1)OCCC[C@H]2NC[C@]1(N2CCOCC2)CCSC1 ZINC000537105141 566422408 /nfs/dbraw/zinc/42/24/08/566422408.db2.gz PMNLLNIJCYUHEV-IEBWSBKVSA-N 0 3 382.957 3.351 10 0 GGAEHN Clc1ccc2c(c1)OCCC[C@@H]2NC[C@@]1(N2CCOCC2)CCSC1 ZINC000537105140 566422563 /nfs/dbraw/zinc/42/25/63/566422563.db2.gz PMNLLNIJCYUHEV-HKUYNNGSSA-N 0 3 382.957 3.351 10 0 GGAEHN C[C@H](NCCc1nnnn1-c1ccccc1)c1ccc(F)c(Br)c1 ZINC000510957441 566422701 /nfs/dbraw/zinc/42/27/01/566422701.db2.gz GPPMRWABVNXKKQ-LBPRGKRZSA-N 0 3 390.260 3.457 10 0 GGAEHN CC(C)[C@H](NCCNS(=O)(=O)c1ccc(F)cc1Cl)c1cccnc1 ZINC000510944740 566422723 /nfs/dbraw/zinc/42/27/23/566422723.db2.gz KSZAJDJRHQAYKY-KRWDZBQOSA-N 0 3 385.892 3.139 10 0 GGAEHN COC(=O)CCN(Cc1cccc(Br)c1)C[C@H](O)CC(F)(F)F ZINC000484305487 566425240 /nfs/dbraw/zinc/42/52/40/566425240.db2.gz VIRPVAAEQSOOGO-CYBMUJFWSA-N 0 3 398.219 3.128 10 0 GGAEHN C[C@H](NCCc1nnnn1-c1ccccc1)c1ccc(Br)cc1F ZINC000511015211 566428044 /nfs/dbraw/zinc/42/80/44/566428044.db2.gz KWTMLEVNHKTBNE-LBPRGKRZSA-N 0 3 390.260 3.457 10 0 GGAEHN CN(C)C(=O)CCN1CCN(c2ccc3ccc(Cl)c(Cl)c3n2)CC1 ZINC000537195848 566430385 /nfs/dbraw/zinc/43/03/85/566430385.db2.gz ANQGHKVWZJNDFQ-UHFFFAOYSA-N 0 3 381.307 3.142 10 0 GGAEHN C[C@@H](CN1CCC[C@@H](S(=O)(=O)N(C)C)C1)c1ccc(C(F)(F)F)cc1 ZINC000511127270 566438626 /nfs/dbraw/zinc/43/86/26/566438626.db2.gz SNSHGIORLMWUHI-XJKSGUPXSA-N 0 3 378.460 3.165 10 0 GGAEHN COC(=O)[C@H](c1c(F)cccc1Cl)N1C[C@@H](SC)[C@H](N2CCCC2)C1 ZINC000484609445 566440270 /nfs/dbraw/zinc/44/02/70/566440270.db2.gz APOHTXLDLUBQCP-INMHGKMJSA-N 0 3 386.920 3.205 10 0 GGAEHN CSc1nnc(CNC(=O)NCCN2CCC3(CCCCC3)CC2)s1 ZINC000577503573 566440601 /nfs/dbraw/zinc/44/06/01/566440601.db2.gz HJNMGQLMHNRYAO-UHFFFAOYSA-N 0 3 383.587 3.106 10 0 GGAEHN Cn1nccc1[C@@H]1CCCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000511134556 566440805 /nfs/dbraw/zinc/44/08/05/566440805.db2.gz GBCHCFFPWGSVCU-KGLIPLIRSA-N 0 3 384.307 3.346 10 0 GGAEHN O=C(NC[C@@H]1CCCCN1C1CC1)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000626669990 566441000 /nfs/dbraw/zinc/44/10/00/566441000.db2.gz LDFPPABLNOIQNC-KRDRHDLTSA-N 0 3 389.337 3.468 10 0 GGAEHN CS[C@@H]1CN([C@@H](C)C(=O)Nc2cc(Cl)ccc2F)C[C@@H]1N1CCCC1 ZINC000484631198 566442057 /nfs/dbraw/zinc/44/20/57/566442057.db2.gz HZEWAECZTPFLMO-AFAVFJNCSA-N 0 3 385.936 3.318 10 0 GGAEHN Cc1ccc(I)c(C(=O)N[C@H](C)CN2CCCCC2)c1 ZINC000511199149 566443280 /nfs/dbraw/zinc/44/32/80/566443280.db2.gz NUGQPRVWJZCLGV-CYBMUJFWSA-N 0 3 386.277 3.204 10 0 GGAEHN O=C(NCCNCc1ccnn1-c1ccccc1)c1ccc(Br)cc1 ZINC000447934909 566447041 /nfs/dbraw/zinc/44/70/41/566447041.db2.gz BZCJTXSICOSMBW-UHFFFAOYSA-N 0 3 399.292 3.154 10 0 GGAEHN O=C(c1ccc(C(F)(F)F)s1)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000671772971 566449698 /nfs/dbraw/zinc/44/96/98/566449698.db2.gz PAWJSTLYQRFCAP-CYBMUJFWSA-N 0 3 376.444 3.484 10 0 GGAEHN OC[C@@H](CNCc1ccc(OC(F)F)c(Br)c1)c1cccnc1 ZINC000558117617 566450322 /nfs/dbraw/zinc/45/03/22/566450322.db2.gz CBTDXCRMWVYZHM-CYBMUJFWSA-N 0 3 387.224 3.311 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1F)NC[C@](C)(O)C(=O)OC(C)(C)C ZINC000484733948 566450366 /nfs/dbraw/zinc/45/03/66/566450366.db2.gz CCZYOSMGLBXNPG-GTNSWQLSSA-N 0 3 390.293 3.202 10 0 GGAEHN Cc1ccc(NC(=O)c2ncsc2Br)c(OCCN(C)C)c1 ZINC000558117922 566450901 /nfs/dbraw/zinc/45/09/01/566450901.db2.gz GAVDSDHVPXUJNI-UHFFFAOYSA-N 0 3 384.299 3.407 10 0 GGAEHN CCCOc1c(Cl)cc(C(=O)N[C@H]2CNCCC2(F)F)cc1OCC ZINC000577632629 566451411 /nfs/dbraw/zinc/45/14/11/566451411.db2.gz VQUTYMRCKIZHOR-AWEZNQCLSA-N 0 3 376.831 3.255 10 0 GGAEHN Cc1nc([C@H]2CCCN(C[C@H](O)COc3c(Cl)cccc3Cl)C2)n[nH]1 ZINC000537562220 566452405 /nfs/dbraw/zinc/45/24/05/566452405.db2.gz MARYLLDHMGKWCZ-STQMWFEESA-N 0 3 385.295 3.039 10 0 GGAEHN Cc1n[nH]c([C@H]2CCCN(C[C@H](O)COc3c(Cl)cccc3Cl)C2)n1 ZINC000537562220 566452410 /nfs/dbraw/zinc/45/24/10/566452410.db2.gz MARYLLDHMGKWCZ-STQMWFEESA-N 0 3 385.295 3.039 10 0 GGAEHN Cc1nnc([C@H]2CCCN(C[C@H](O)COc3c(Cl)cccc3Cl)C2)[nH]1 ZINC000537562220 566452415 /nfs/dbraw/zinc/45/24/15/566452415.db2.gz MARYLLDHMGKWCZ-STQMWFEESA-N 0 3 385.295 3.039 10 0 GGAEHN CN(C(=O)NCc1cc(F)c(F)cc1Br)[C@H]1CCN(C2CC2)C1 ZINC000511384931 566459356 /nfs/dbraw/zinc/45/93/56/566459356.db2.gz VTYZZHKTLMIQPE-LBPRGKRZSA-N 0 3 388.256 3.105 10 0 GGAEHN C[C@H](NC(=O)C(=O)c1ccc(Br)cc1)[C@@H]1CCCN(C2CCC2)C1 ZINC000511381440 566459375 /nfs/dbraw/zinc/45/93/75/566459375.db2.gz RKLSMXHCXZBITR-DZGCQCFKSA-N 0 3 393.325 3.401 10 0 GGAEHN NC(=O)c1c(F)cc(Br)cc1N[C@H]1CCN(Cc2ccccc2)C1 ZINC000537641014 566459881 /nfs/dbraw/zinc/45/98/81/566459881.db2.gz HUPZDBATRABDEQ-AWEZNQCLSA-N 0 3 392.272 3.374 10 0 GGAEHN COCC1(CCN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)CC1 ZINC000577750843 566461152 /nfs/dbraw/zinc/46/11/52/566461152.db2.gz ZZFIRUSMUMBQKN-CQSZACIVSA-N 0 3 388.327 3.074 10 0 GGAEHN N[C@@H](CNC(=O)N1CCc2cc(F)cc(Br)c2C1)c1ccccc1 ZINC000627078273 566463244 /nfs/dbraw/zinc/46/32/44/566463244.db2.gz MQTOXCFSLHYHFO-KRWDZBQOSA-N 0 3 392.272 3.356 10 0 GGAEHN FC(F)Oc1c(Cl)cc(Cl)cc1CN[C@@H](C1CC1)[C@@H]1CNCCO1 ZINC000422876880 566465483 /nfs/dbraw/zinc/46/54/83/566465483.db2.gz QVXSFRBIJGVUNW-KBPBESRZSA-N 0 3 381.250 3.451 10 0 GGAEHN C[C@H](NC[C@H]1CCN(c2ccc(Br)cc2)C1)c1cnccc1N ZINC000422941503 566466589 /nfs/dbraw/zinc/46/65/89/566466589.db2.gz JIVYPNYJTBXJBG-UONOGXRCSA-N 0 3 375.314 3.434 10 0 GGAEHN O[C@H](CNc1ccc(Br)c(C(F)(F)F)n1)CN1CCCCC1 ZINC000672164104 566468798 /nfs/dbraw/zinc/46/87/98/566468798.db2.gz WEUPQRITSLQBHS-SNVBAGLBSA-N 0 3 382.224 3.122 10 0 GGAEHN FC(F)(F)c1cc(Br)ccc1CN[C@@H](C1CC1)[C@@H]1CNCCO1 ZINC000423020660 566468900 /nfs/dbraw/zinc/46/89/00/566468900.db2.gz CMWHWLLVDVIQRX-GJZGRUSLSA-N 0 3 393.247 3.325 10 0 GGAEHN CN(C)[C@]1(CNC(=O)N2CC[C@H](C(F)(F)F)C3(CCC3)C2)CCSC1 ZINC000511534360 566470249 /nfs/dbraw/zinc/47/02/49/566470249.db2.gz YKWGDCKHYKLSPI-BBRMVZONSA-N 0 3 379.492 3.188 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)N2CC[C@@H](C(F)(F)F)C3(CCC3)C2)CCSC1 ZINC000511534362 566470272 /nfs/dbraw/zinc/47/02/72/566470272.db2.gz YKWGDCKHYKLSPI-CZUORRHYSA-N 0 3 379.492 3.188 10 0 GGAEHN Cc1nccc(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c1Br ZINC000558425359 566470969 /nfs/dbraw/zinc/47/09/69/566470969.db2.gz BECRYCJCHKPGDP-SUMWQHHRSA-N 0 3 391.313 3.387 10 0 GGAEHN C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)C(=O)c1ccc(Br)cc1 ZINC000511554926 566471136 /nfs/dbraw/zinc/47/11/36/566471136.db2.gz ASWKALLKGXNEHN-MCIONIFRSA-N 0 3 381.314 3.114 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N1CCc2c(Br)ccc(Cl)c2C1 ZINC000464380261 566471211 /nfs/dbraw/zinc/47/12/11/566471211.db2.gz XPNQFSSPIYLGOP-NSHDSACASA-N 0 3 386.721 3.264 10 0 GGAEHN COCCN1CCC[C@@H](Nc2ccc(Br)c(C(F)(F)F)n2)C1 ZINC000672210107 566472686 /nfs/dbraw/zinc/47/26/86/566472686.db2.gz VIDJQFKBJGKIQP-SNVBAGLBSA-N 0 3 382.224 3.386 10 0 GGAEHN CC1(C)CCCN[C@H]1C(=O)N1CCO[C@H](c2ccc(Br)cc2)C1 ZINC000423073182 566472674 /nfs/dbraw/zinc/47/26/74/566472674.db2.gz QWNKSYAVDKZLHR-HOTGVXAUSA-N 0 3 381.314 3.127 10 0 GGAEHN CC1(C)CCCN[C@@H]1C(=O)N1CCO[C@H](c2ccc(Br)cc2)C1 ZINC000423073184 566472859 /nfs/dbraw/zinc/47/28/59/566472859.db2.gz QWNKSYAVDKZLHR-JKSUJKDBSA-N 0 3 381.314 3.127 10 0 GGAEHN COc1ccc(CN2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)c(Br)c1[O-] ZINC000650723291 566473276 /nfs/dbraw/zinc/47/32/76/566473276.db2.gz KUZOUIGNHDOARZ-IIAWOOMASA-N 0 3 399.329 3.024 10 0 GGAEHN CC1(C)CCCN[C@@H]1C(=O)N1CCO[C@@H](c2ccc(Br)cc2)C1 ZINC000423073183 566473285 /nfs/dbraw/zinc/47/32/85/566473285.db2.gz QWNKSYAVDKZLHR-HZPDHXFCSA-N 0 3 381.314 3.127 10 0 GGAEHN COCCN1CCC[C@H](Nc2ccc(Br)c(C(F)(F)F)n2)C1 ZINC000672210106 566473330 /nfs/dbraw/zinc/47/33/30/566473330.db2.gz VIDJQFKBJGKIQP-JTQLQIEISA-N 0 3 382.224 3.386 10 0 GGAEHN CN(CCN1CCCCC1)C(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000650730125 566474123 /nfs/dbraw/zinc/47/41/23/566474123.db2.gz NARKTUYSXMZGRN-MRXNPFEDSA-N 0 3 396.329 3.400 10 0 GGAEHN CN(CCN1CCCCC1)C(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000650730124 566474530 /nfs/dbraw/zinc/47/45/30/566474530.db2.gz NARKTUYSXMZGRN-INIZCTEOSA-N 0 3 396.329 3.400 10 0 GGAEHN C[C@@](CO)(NC[C@H](O)CCc1ccccc1)c1ccc(Br)cc1 ZINC000511589133 566474838 /nfs/dbraw/zinc/47/48/38/566474838.db2.gz VSFQDOXCVSBPSH-MOPGFXCFSA-N 0 3 378.310 3.240 10 0 GGAEHN C[C@](CO)(NCCOCC(F)(F)C(F)F)c1ccc(Br)cc1 ZINC000511596659 566475269 /nfs/dbraw/zinc/47/52/69/566475269.db2.gz SQUZWCLHAOTQAV-CYBMUJFWSA-N 0 3 388.199 3.163 10 0 GGAEHN C[C@@H]1[C@H](C)N(CCCOc2cccc(I)c2)CCN1C ZINC000537851712 566476159 /nfs/dbraw/zinc/47/61/59/566476159.db2.gz QGIUFQKOXNXZCO-KGLIPLIRSA-N 0 3 388.293 3.085 10 0 GGAEHN C[C@@H](N[C@@H](C)c1ccc(Br)cc1OCCCO)c1cnccc1N ZINC000423122773 566477405 /nfs/dbraw/zinc/47/74/05/566477405.db2.gz CWYIGXHOOXHQJV-QWHCGFSZSA-N 0 3 394.313 3.430 10 0 GGAEHN Cc1c(Br)cccc1C[C@@H](CO)CN[C@@H](C)c1cnccc1N ZINC000423149043 566479054 /nfs/dbraw/zinc/47/90/54/566479054.db2.gz AESRZJSPQTZSNG-UONOGXRCSA-N 0 3 378.314 3.067 10 0 GGAEHN O=C(N[C@@H]1CCN(C2CC2)C1)NC1(c2ccccc2Br)CCC1 ZINC000650876777 566482406 /nfs/dbraw/zinc/48/24/06/566482406.db2.gz GDQTTWIVWQKUBU-CYBMUJFWSA-N 0 3 378.314 3.364 10 0 GGAEHN COc1ccc([C@H](C)Nc2ccc(N3CCNCC3)cn2)c(Br)c1 ZINC000423233732 566482519 /nfs/dbraw/zinc/48/25/19/566482519.db2.gz ONGHJEQURQZIAU-ZDUSSCGKSA-N 0 3 391.313 3.435 10 0 GGAEHN Fc1cc(Br)cc2c1CC[C@H]2Nc1ccc(N2CCNCC2)cn1 ZINC000423235712 566483028 /nfs/dbraw/zinc/48/30/28/566483028.db2.gz RHWQKIIIIFSVDB-QGZVFWFLSA-N 0 3 391.288 3.492 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)c3c(F)ccc(C(F)(F)F)c3Br)[C@@H]2C1 ZINC000627487824 566483037 /nfs/dbraw/zinc/48/30/37/566483037.db2.gz LKSIHIUDGMVIAE-GZMMTYOYSA-N 0 3 395.194 3.383 10 0 GGAEHN CCSc1ccc(CC(=O)N2CC[C@@H]3CN(C)C[C@@H]32)c(Br)c1 ZINC000627488476 566483866 /nfs/dbraw/zinc/48/38/66/566483866.db2.gz ZSCFSZNCIAFIHS-CJNGLKHVSA-N 0 3 383.355 3.266 10 0 GGAEHN C[C@H](N[C@@H]1CN(C2CC2)C[C@H]1C)c1cc2c(cc1Br)OCCO2 ZINC000537989431 566483946 /nfs/dbraw/zinc/48/39/46/566483946.db2.gz BKUQYDGFTKSDFM-BFQNTYOBSA-N 0 3 381.314 3.354 10 0 GGAEHN C[C@H](N[C@H]1CN(C2CC2)C[C@H]1C)c1cc2c(cc1Br)OCCO2 ZINC000537989450 566484448 /nfs/dbraw/zinc/48/44/48/566484448.db2.gz BKUQYDGFTKSDFM-WQGACYEGSA-N 0 3 381.314 3.354 10 0 GGAEHN Cc1cc(N2CCC[C@H](N[C@H](C)c3cncc(Br)c3)C2)n(C)n1 ZINC000578027421 566484639 /nfs/dbraw/zinc/48/46/39/566484639.db2.gz ZQOMLVJDJSTPSX-CJNGLKHVSA-N 0 3 378.318 3.206 10 0 GGAEHN Brc1cc2c(s1)CC[C@@H]2Nc1ccc(N2CCNCC2)cn1 ZINC000423242611 566484633 /nfs/dbraw/zinc/48/46/33/566484633.db2.gz YZPAVPXKJQXLCV-ZDUSSCGKSA-N 0 3 379.327 3.415 10 0 GGAEHN C[C@H](N[C@H]1CN(C2CC2)C[C@@H]1C)c1cc2c(cc1Br)OCCO2 ZINC000537989442 566484798 /nfs/dbraw/zinc/48/47/98/566484798.db2.gz BKUQYDGFTKSDFM-MKBNYLNASA-N 0 3 381.314 3.354 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)c1cc(C(F)(F)F)ccc1Cl ZINC000627518632 566485626 /nfs/dbraw/zinc/48/56/26/566485626.db2.gz PCGREDFNVVEMSD-GJZGRUSLSA-N 0 3 376.806 3.294 10 0 GGAEHN COC(=O)[C@@](C)(O)CN(Cc1ccccc1)Cc1ccc(Br)cc1 ZINC000578095978 566491104 /nfs/dbraw/zinc/49/11/04/566491104.db2.gz OXGPCUZFEJNGNU-IBGZPJMESA-N 0 3 392.293 3.375 10 0 GGAEHN CCN(C(=O)Cc1noc2ccc(Br)cc21)C1CCN(C)CC1 ZINC000627615301 566492086 /nfs/dbraw/zinc/49/20/86/566492086.db2.gz SWQACMAIFSAWIB-UHFFFAOYSA-N 0 3 380.286 3.076 10 0 GGAEHN CCN(C(=O)[C@H]1CCOc2ccc(Br)cc21)C1CCN(C)CC1 ZINC000627615286 566492130 /nfs/dbraw/zinc/49/21/30/566492130.db2.gz SFFLKDUPSXSDQW-HNNXBMFYSA-N 0 3 381.314 3.258 10 0 GGAEHN O=C(NC1CCN(C2CC2)CC1)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651044857 566492497 /nfs/dbraw/zinc/49/24/97/566492497.db2.gz ZQUFAGQADQQAOO-OAHLLOKOSA-N 0 3 379.298 3.058 10 0 GGAEHN O=C(NC1CCN(C2CC2)CC1)[C@H]1CCOc2ccc(Br)cc21 ZINC000651044856 566492528 /nfs/dbraw/zinc/49/25/28/566492528.db2.gz ZQUFAGQADQQAOO-HNNXBMFYSA-N 0 3 379.298 3.058 10 0 GGAEHN CCN(C(=O)CCc1ccc(OC)cc1Br)C1CCN(C)CC1 ZINC000627615234 566492621 /nfs/dbraw/zinc/49/26/21/566492621.db2.gz QVHKUVUJXJTIFS-UHFFFAOYSA-N 0 3 383.330 3.333 10 0 GGAEHN CCN(C(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12)C1CCN(C)CC1 ZINC000627615317 566492649 /nfs/dbraw/zinc/49/26/49/566492649.db2.gz UMFQKMUKYBFSPE-CGTJXYLNSA-N 0 3 377.326 3.278 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)Cc1sccc1Br ZINC000448755743 566492808 /nfs/dbraw/zinc/49/28/08/566492808.db2.gz HRAGVJOCDIPRDM-AWEZNQCLSA-N 0 3 381.339 3.342 10 0 GGAEHN CCSc1ccc(CC(=O)N2C[C@@H]3CCN(C)[C@@H]3C2)c(Br)c1 ZINC000627632408 566493987 /nfs/dbraw/zinc/49/39/87/566493987.db2.gz GMMDLCGCSNKOLZ-XJKSGUPXSA-N 0 3 383.355 3.266 10 0 GGAEHN CCC(=O)Nc1cccc(CN[C@@H](C)Cn2cc(Br)ccc2=O)c1 ZINC000578165371 566496496 /nfs/dbraw/zinc/49/64/96/566496496.db2.gz PBLJWFDIUFUORM-ZDUSSCGKSA-N 0 3 392.297 3.138 10 0 GGAEHN COC(=O)c1cc(NC(=O)[C@@H]2NCCCC2(C)C)cc(Br)c1F ZINC000423908774 566496734 /nfs/dbraw/zinc/49/67/34/566496734.db2.gz COZANZURWVPDTM-ZDUSSCGKSA-N 0 3 387.249 3.092 10 0 GGAEHN CCc1ccccc1[C@H](N)CNC(=O)c1[nH]nc(C(C)C)c1Br ZINC000423970939 566499211 /nfs/dbraw/zinc/49/92/11/566499211.db2.gz GQPYDMFAEXYGCB-CYBMUJFWSA-N 0 3 379.302 3.288 10 0 GGAEHN COc1ccc(CNC[C@@H](Cc2ccc(F)cc2)C(N)=O)c(Br)c1 ZINC000511955215 566499878 /nfs/dbraw/zinc/49/98/78/566499878.db2.gz DZQHQTANSBCIPU-CQSZACIVSA-N 0 3 395.272 3.031 10 0 GGAEHN O=C(COc1ccc(Cl)c(Cl)c1)N1CCC(N2CCCOCC2)CC1 ZINC000627738613 566502782 /nfs/dbraw/zinc/50/27/82/566502782.db2.gz MYHYUHLHLPPBSE-UHFFFAOYSA-N 0 3 387.307 3.086 10 0 GGAEHN Cc1c(Br)scc1C(=O)N1CCC(N2CCCOCC2)CC1 ZINC000627741094 566503127 /nfs/dbraw/zinc/50/31/27/566503127.db2.gz RDGCEFBPTBEWBQ-UHFFFAOYSA-N 0 3 387.343 3.146 10 0 GGAEHN Cc1ccc(Br)cc1C(=O)N1CCC(N2CCCOCC2)CC1 ZINC000627739735 566503522 /nfs/dbraw/zinc/50/35/22/566503522.db2.gz OGVJVAUUHTYZNN-UHFFFAOYSA-N 0 3 381.314 3.084 10 0 GGAEHN O=C(CCc1ccccc1Br)N1CCC(N2CCCOCC2)CC1 ZINC000627738852 566503757 /nfs/dbraw/zinc/50/37/57/566503757.db2.gz IKSAHGQGNMSKLG-UHFFFAOYSA-N 0 3 395.341 3.095 10 0 GGAEHN CC(C)N1CCCN(C(=O)[C@H]2CCOc3ccc(Br)cc32)CC1 ZINC000651240981 566503816 /nfs/dbraw/zinc/50/38/16/566503816.db2.gz ROIOVAZFKKTSEO-HNNXBMFYSA-N 0 3 381.314 3.258 10 0 GGAEHN CCN1CCC(N(C)C(=O)[C@H]2CCOc3ccc(Br)cc32)CC1 ZINC000651235237 566504705 /nfs/dbraw/zinc/50/47/05/566504705.db2.gz NFEKTINUEGQGMN-HNNXBMFYSA-N 0 3 381.314 3.258 10 0 GGAEHN CN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651256980 566505823 /nfs/dbraw/zinc/50/58/23/566505823.db2.gz STZHFXIWQHDXNY-HUUCEWRRSA-N 0 3 381.314 3.258 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1ccc(Br)c(OC(C)C)c1 ZINC000651261484 566506118 /nfs/dbraw/zinc/50/61/18/566506118.db2.gz JNPMCAKNWMFMQO-OAHLLOKOSA-N 0 3 399.329 3.077 10 0 GGAEHN C[C@H](NC(=O)CN1CCC[C@@H]2COCC[C@H]21)c1ccc(Br)cc1 ZINC000464848547 566507318 /nfs/dbraw/zinc/50/73/18/566507318.db2.gz GKUWHJKLLSZKBZ-YSVLISHTSA-N 0 3 381.314 3.127 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)NCC1=CCN(C)CC1 ZINC000538340321 566508531 /nfs/dbraw/zinc/50/85/31/566508531.db2.gz ZDIZNWLAHQIMJA-UHFFFAOYSA-N 0 3 376.298 3.090 10 0 GGAEHN O=C(CCN1CCC[C@@H]2COCC[C@@H]21)Nc1ccc(Br)cc1F ZINC000464859895 566508560 /nfs/dbraw/zinc/50/85/60/566508560.db2.gz RJCDJVPREYMXCP-WBMJQRKESA-N 0 3 385.277 3.418 10 0 GGAEHN O[C@H]1CCC[C@@H]1N1CCN(c2ncc(Br)c3ccc(F)cc32)CC1 ZINC000651306147 566509462 /nfs/dbraw/zinc/50/94/62/566509462.db2.gz UFIJMRFAGXSVAL-IRXDYDNUSA-N 0 3 394.288 3.172 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)COc1ccc(Br)cc1Cl ZINC000464921543 566509955 /nfs/dbraw/zinc/50/99/55/566509955.db2.gz GQOYNAPDEMFBCB-GFCCVEGCSA-N 0 3 375.694 3.034 10 0 GGAEHN Cc1cc(C(=O)N2CCC[C@@H]2CN(C)C)nn1-c1ccc(Br)cc1 ZINC000464923981 566509995 /nfs/dbraw/zinc/50/99/95/566509995.db2.gz BABGLFLNAAKAQQ-MRXNPFEDSA-N 0 3 391.313 3.109 10 0 GGAEHN O=C(CCN1CC[C@H](OC(F)F)C1)Nc1ccc(Br)cc1F ZINC000558864525 566511262 /nfs/dbraw/zinc/51/12/62/566511262.db2.gz WXRGOYUHYKHTAT-JTQLQIEISA-N 0 3 381.192 3.230 10 0 GGAEHN Fc1ccc2c(Br)cnc(N3CCN(C[C@@H]4CCOC4)CC3)c2c1 ZINC000651324728 566511870 /nfs/dbraw/zinc/51/18/70/566511870.db2.gz OAAHJPMMYVPDGP-ZDUSSCGKSA-N 0 3 394.288 3.295 10 0 GGAEHN CC[C@@H](CO)N1CCN(c2ncc(Br)c3ccc(F)cc32)CC1 ZINC000651322596 566512206 /nfs/dbraw/zinc/51/22/06/566512206.db2.gz XROPOIVDWIRINE-ZDUSSCGKSA-N 0 3 382.277 3.029 10 0 GGAEHN CN(C)CCN(Cc1ccccn1)C(=O)Cc1sccc1Br ZINC000448928985 566512455 /nfs/dbraw/zinc/51/24/55/566512455.db2.gz PELDEDSHUBPQPA-UHFFFAOYSA-N 0 3 382.327 3.039 10 0 GGAEHN Fc1ccc2c(Br)cnc(N3CCN(C4CCOCC4)CC3)c2c1 ZINC000651323681 566512513 /nfs/dbraw/zinc/51/25/13/566512513.db2.gz FXXJNSIUUWCVOD-UHFFFAOYSA-N 0 3 394.288 3.437 10 0 GGAEHN COc1cc(Br)c(C(=O)NCCN2[C@H](C)CCC[C@@H]2C)cc1OC ZINC000448934292 566513323 /nfs/dbraw/zinc/51/33/23/566513323.db2.gz UWEXUZJRZMYGPY-BETUJISGSA-N 0 3 399.329 3.459 10 0 GGAEHN C[C@H](O)CN1CCN(c2ncc(Br)c3ccc(F)cc32)[C@@H](C)C1 ZINC000651342836 566513362 /nfs/dbraw/zinc/51/33/62/566513362.db2.gz QKRGVIRWEWZASD-RYUDHWBXSA-N 0 3 382.277 3.028 10 0 GGAEHN COc1cc(Br)c(C(=O)NCCN2[C@@H](C)CCC[C@@H]2C)cc1OC ZINC000448934294 566514128 /nfs/dbraw/zinc/51/41/28/566514128.db2.gz UWEXUZJRZMYGPY-STQMWFEESA-N 0 3 399.329 3.459 10 0 GGAEHN CN(C(=O)c1cc2c(ccc(F)c2Br)[nH]1)[C@@H]1CCN(C2CC2)C1 ZINC000448962790 566515731 /nfs/dbraw/zinc/51/57/31/566515731.db2.gz RDDARTXPPPBMHS-LLVKDONJSA-N 0 3 380.261 3.378 10 0 GGAEHN CN1CC[C@@H](CNCc2cc(Br)ccc2OC(F)F)CC1=O ZINC000424196134 566517311 /nfs/dbraw/zinc/51/73/11/566517311.db2.gz ZDWIPNYVPKSFSD-SNVBAGLBSA-N 0 3 377.229 3.009 10 0 GGAEHN CC(C)n1cncc1CNC[C@H](CO)Cc1ccc(F)c(Br)c1 ZINC000424180439 566517863 /nfs/dbraw/zinc/51/78/63/566517863.db2.gz OILAWZKUWQCQEV-CQSZACIVSA-N 0 3 384.293 3.306 10 0 GGAEHN OCCN1CCCC[C@@H]1CN[C@@H](c1ccc(Br)cc1)[C@H]1CCCO1 ZINC000651379974 566519267 /nfs/dbraw/zinc/51/92/67/566519267.db2.gz IUJRJOGDMIKJPY-QRVBRYPASA-N 0 3 397.357 3.106 10 0 GGAEHN CC(C)C[C@H](N[C@H](C)c1ccccc1Br)C(=O)NCCN(C)C ZINC000538545927 566520405 /nfs/dbraw/zinc/52/04/05/566520405.db2.gz BSFFQVBFEYHWHM-PBHICJAKSA-N 0 3 384.362 3.192 10 0 GGAEHN O=C(NC[C@@H]1CCCCN1CCO)N[C@H]1CCSc2ccc(Cl)cc21 ZINC000578417625 566520817 /nfs/dbraw/zinc/52/08/17/566520817.db2.gz LFQMEFXSXGTGRZ-HOCLYGCPSA-N 0 3 383.945 3.023 10 0 GGAEHN CN(CCN1CCCCC1)C(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000628010788 566523056 /nfs/dbraw/zinc/52/30/56/566523056.db2.gz APKWOQYLPASZKU-CGTJXYLNSA-N 0 3 377.326 3.279 10 0 GGAEHN CN(Cc1cc2c(cc1Br)OCCCO2)[C@@H]1CCN(C2CC2)C1 ZINC000538619227 566523478 /nfs/dbraw/zinc/52/34/78/566523478.db2.gz LJELRMWTVZXOOB-OAHLLOKOSA-N 0 3 381.314 3.279 10 0 GGAEHN C[C@@H]1C[C@@H](NC(=O)[C@H]2CCOc3ccc(Br)cc32)CN1C1CC1 ZINC000651467185 566524226 /nfs/dbraw/zinc/52/42/26/566524226.db2.gz YAARTJYJTMIHDX-KYOSRNDESA-N 0 3 379.298 3.057 10 0 GGAEHN CO[C@H]1C[C@H]2C[C@H](N[C@@H]3CCN(c4cccc(Br)c4)C3=O)C[C@H]2C1 ZINC000424280791 566525471 /nfs/dbraw/zinc/52/54/71/566525471.db2.gz MGEREYMPGXVKRI-VFOQYASISA-N 0 3 393.325 3.348 10 0 GGAEHN CO[C@H]1C[C@H]2C[C@@H](N[C@@H]3CCN(c4cccc(Br)c4)C3=O)C[C@H]2C1 ZINC000424280785 566525654 /nfs/dbraw/zinc/52/56/54/566525654.db2.gz MGEREYMPGXVKRI-IPUKNANDSA-N 0 3 393.325 3.348 10 0 GGAEHN O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1sccc1Cl ZINC000512322210 566525672 /nfs/dbraw/zinc/52/56/72/566525672.db2.gz KHLJBNYUZJISQD-UHFFFAOYSA-N 0 3 377.897 3.479 10 0 GGAEHN CC[C@@H](Cn1cncn1)NCc1cc(Cl)cc(I)c1 ZINC000424292420 566527312 /nfs/dbraw/zinc/52/73/12/566527312.db2.gz MPRZZOFXURVVQU-ZDUSSCGKSA-N 0 3 390.656 3.105 10 0 GGAEHN Cn1ncc(Br)c1C(=O)NCc1ccccc1CN1CCCCC1 ZINC000449116701 566529485 /nfs/dbraw/zinc/52/94/85/566529485.db2.gz QOAJQYCTIINSRB-UHFFFAOYSA-N 0 3 391.313 3.099 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNS(=O)(=O)Cc1ccccc1C(F)(F)F ZINC000603504272 566530138 /nfs/dbraw/zinc/53/01/38/566530138.db2.gz ZBKQVMRISZJFRR-OKILXGFUSA-N 0 3 378.460 3.388 10 0 GGAEHN C[C@H](COc1ccc(Cl)c(Cl)c1)N[C@H]1CCN(C2CCOCC2)C1=O ZINC000449178341 566533917 /nfs/dbraw/zinc/53/39/17/566533917.db2.gz SISUJZZAXZFYEN-PXAZEXFGSA-N 0 3 387.307 3.130 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCN=c1[nH]cc(Cn2cc(Br)cn2)s1 ZINC000485873558 566535722 /nfs/dbraw/zinc/53/57/22/566535722.db2.gz NRQDKQHDOCIXBW-BETUJISGSA-N 0 3 398.374 3.247 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2sc(Br)cc2C)[C@@H](C)C1 ZINC000651576692 566537059 /nfs/dbraw/zinc/53/70/59/566537059.db2.gz NWMUNBXIJJYQCK-RYUDHWBXSA-N 0 3 395.388 3.170 10 0 GGAEHN CN1CC[C@H](NCc2cccc(S(C)(=O)=O)c2)[C@H]1c1ccc(Cl)cc1 ZINC000449212993 566537261 /nfs/dbraw/zinc/53/72/61/566537261.db2.gz JSGZONPRYDVRGI-RBUKOAKNSA-N 0 3 378.925 3.279 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)C(=O)Nc2cc(Cl)c(Cl)c(Cl)c2)CCN1C ZINC000651588170 566539008 /nfs/dbraw/zinc/53/90/08/566539008.db2.gz JUEUJZQBJQKVOS-RKDXNWHRSA-N 0 3 378.687 3.184 10 0 GGAEHN COc1ccc(Br)c(CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1 ZINC000465657385 566539852 /nfs/dbraw/zinc/53/98/52/566539852.db2.gz IUDMUQZOYATRIW-OCCSQVGLSA-N 0 3 384.318 3.082 10 0 GGAEHN Cc1cc(Br)c(CN[C@H](CC(N)=O)C2CCOCC2)cc1Cl ZINC000449241158 566541413 /nfs/dbraw/zinc/54/14/13/566541413.db2.gz RONLQUKTUYXXOO-OAHLLOKOSA-N 0 3 389.721 3.171 10 0 GGAEHN C[C@H](CN1CCCCC1)NC(=O)Cc1noc2ccc(Br)cc21 ZINC000424582562 566541812 /nfs/dbraw/zinc/54/18/12/566541812.db2.gz JEYMCNWXYSVCGQ-GFCCVEGCSA-N 0 3 380.286 3.123 10 0 GGAEHN CNC(=O)[C@H](C)Oc1ccc(Br)cc1CNC[C@@H]1CCC(C)(C)O1 ZINC000449259670 566542454 /nfs/dbraw/zinc/54/24/54/566542454.db2.gz RYPVSCQFZNKPDU-WFASDCNBSA-N 0 3 399.329 3.010 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)C1(c2cccc(Br)c2)CC(=O)C1 ZINC000485948380 566542499 /nfs/dbraw/zinc/54/24/99/566542499.db2.gz AAHXCEYLZVRUNS-INIZCTEOSA-N 0 3 395.341 3.142 10 0 GGAEHN CNC(=O)[C@H](C)Oc1ccc(Br)cc1CNC[C@H]1CCC(C)(C)O1 ZINC000449259668 566543082 /nfs/dbraw/zinc/54/30/82/566543082.db2.gz RYPVSCQFZNKPDU-SWLSCSKDSA-N 0 3 399.329 3.010 10 0 GGAEHN Cc1cc(N2CCC[C@@H](NCc3cc(F)cc(Br)c3)C2)n(C)n1 ZINC000449285805 566544588 /nfs/dbraw/zinc/54/45/88/566544588.db2.gz SSRDSQPGKSIMBJ-MRXNPFEDSA-N 0 3 381.293 3.389 10 0 GGAEHN Cc1cc(N2CCC[C@H](NCc3cccc(Br)c3F)C2)n(C)n1 ZINC000449282879 566544716 /nfs/dbraw/zinc/54/47/16/566544716.db2.gz JNQSMRBSESTVPL-AWEZNQCLSA-N 0 3 381.293 3.389 10 0 GGAEHN CN(Cc1cccc(Br)c1F)C1CCN(c2cnccn2)CC1 ZINC000449293568 566546541 /nfs/dbraw/zinc/54/65/41/566546541.db2.gz VSPQYNZSPOWQKL-UHFFFAOYSA-N 0 3 379.277 3.479 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)Cc1noc2ccc(Br)cc21 ZINC000424611167 566547211 /nfs/dbraw/zinc/54/72/11/566547211.db2.gz DVCVSXVZLHMVRI-ZDUSSCGKSA-N 0 3 382.302 3.225 10 0 GGAEHN CC(C)(C)[C@@H](O)C[C@H](CO)NCc1ccnc2c(Br)cccc12 ZINC000449309699 566547839 /nfs/dbraw/zinc/54/78/39/566547839.db2.gz FDQCXWYBNUPVDG-CJNGLKHVSA-N 0 3 381.314 3.245 10 0 GGAEHN C[C@@H](Cc1ccoc1)NCC(=O)Nc1ccc(I)cc1 ZINC000449310083 566548182 /nfs/dbraw/zinc/54/81/82/566548182.db2.gz GHLPWPCFWNZIJD-NSHDSACASA-N 0 3 384.217 3.044 10 0 GGAEHN COc1ncc(C(=O)Nc2cccc(OCCN(C)C)c2)cc1Br ZINC000424623542 566548816 /nfs/dbraw/zinc/54/88/16/566548816.db2.gz DNKAZLJPBXGAOJ-UHFFFAOYSA-N 0 3 394.269 3.045 10 0 GGAEHN CNC(=O)[C@@H](C)Oc1ccc(Br)cc1CNCCC1(F)CCC1 ZINC000449328007 566550161 /nfs/dbraw/zinc/55/01/61/566550161.db2.gz DNGVRGFYLUMGSK-GFCCVEGCSA-N 0 3 387.293 3.334 10 0 GGAEHN CC(C)N1CCCN(C(=O)Cc2noc3ccc(Br)cc32)CC1 ZINC000424635796 566550703 /nfs/dbraw/zinc/55/07/03/566550703.db2.gz GNXXIRGEMWMGDA-UHFFFAOYSA-N 0 3 380.286 3.076 10 0 GGAEHN Cc1ccnc([C@@H]2CCN(Cc3cc(=O)n4cc(Br)ccc4n3)C2)c1 ZINC000578761282 566552307 /nfs/dbraw/zinc/55/23/07/566552307.db2.gz AMOKAFWFIMWOMM-CQSZACIVSA-N 0 3 399.292 3.150 10 0 GGAEHN Cc1ccc(CNC[C@H]2CS(=O)(=O)c3ccccc32)cc1Br ZINC000449357300 566552686 /nfs/dbraw/zinc/55/26/86/566552686.db2.gz KWIROWKOWCORFN-AWEZNQCLSA-N 0 3 380.307 3.418 10 0 GGAEHN Cc1cc(Br)ccc1CNC[C@H]1CS(=O)(=O)c2ccccc21 ZINC000449361149 566552932 /nfs/dbraw/zinc/55/29/32/566552932.db2.gz WVDQUJFPOMLEHS-AWEZNQCLSA-N 0 3 380.307 3.418 10 0 GGAEHN O=S1(=O)C[C@H](CNCc2cc(F)cc(Br)c2)c2ccccc21 ZINC000449361761 566553118 /nfs/dbraw/zinc/55/31/18/566553118.db2.gz YNDYFXIFSOQLOR-LBPRGKRZSA-N 0 3 384.270 3.249 10 0 GGAEHN C[C@H]1[C@H](N2CCCC2)CCN1S(=O)(=O)Cc1cc(Cl)sc1Cl ZINC000651705027 566553810 /nfs/dbraw/zinc/55/38/10/566553810.db2.gz DTBRPXSSNRORAU-CMPLNLGQSA-N 0 3 383.366 3.443 10 0 GGAEHN Cc1nc2ccc(CNCCn3cc(Br)ccc3=O)cc2s1 ZINC000449378995 566554301 /nfs/dbraw/zinc/55/43/01/566554301.db2.gz SBJQNFQWWAYNCE-UHFFFAOYSA-N 0 3 378.295 3.319 10 0 GGAEHN CCN1CCCC[C@H]1CNC(=O)Cc1noc2ccc(Br)cc21 ZINC000424666719 566555239 /nfs/dbraw/zinc/55/52/39/566555239.db2.gz PQEXGJIPAMRJRM-ZDUSSCGKSA-N 0 3 380.286 3.123 10 0 GGAEHN COC[C@](C)(O)CCNCc1cc(Br)cc(Br)c1 ZINC000449383502 566555700 /nfs/dbraw/zinc/55/57/00/566555700.db2.gz HTPSQVFRJCGGQO-CYBMUJFWSA-N 0 3 381.108 3.089 10 0 GGAEHN COC[C@](C)(O)CCNCc1ccc(Br)c(Br)c1 ZINC000449386327 566556109 /nfs/dbraw/zinc/55/61/09/566556109.db2.gz TVBWHBSEPBXHJL-CYBMUJFWSA-N 0 3 381.108 3.089 10 0 GGAEHN C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000486084598 566556267 /nfs/dbraw/zinc/55/62/67/566556267.db2.gz CTRGODSAHVTGFN-IUODEOHRSA-N 0 3 398.320 3.397 10 0 GGAEHN C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000486084595 566556441 /nfs/dbraw/zinc/55/64/41/566556441.db2.gz CTRGODSAHVTGFN-DOMZBBRYSA-N 0 3 398.320 3.397 10 0 GGAEHN C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000486084601 566556675 /nfs/dbraw/zinc/55/66/75/566556675.db2.gz CTRGODSAHVTGFN-SWLSCSKDSA-N 0 3 398.320 3.397 10 0 GGAEHN Cn1cc(CN2CC[C@H](Cc3cccc(I)c3)C2)cn1 ZINC000449395355 566556710 /nfs/dbraw/zinc/55/67/10/566556710.db2.gz POPFIXAYQVBOHS-CQSZACIVSA-N 0 3 381.261 3.089 10 0 GGAEHN Cc1cnc(CN2CC[C@@H](Cc3cccc(I)c3)C2)cn1 ZINC000449388746 566557143 /nfs/dbraw/zinc/55/71/43/566557143.db2.gz BBNUJZNIFNQYJX-HNNXBMFYSA-N 0 3 393.272 3.454 10 0 GGAEHN Cc1n[nH]cc1CN1CC[C@H](Cc2cccc(I)c2)C1 ZINC000449397217 566558259 /nfs/dbraw/zinc/55/82/59/566558259.db2.gz UPSQCFNQNSMUFT-CQSZACIVSA-N 0 3 381.261 3.387 10 0 GGAEHN CC(C)N1CCC[C@@H](NC(=O)[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000651751656 566558433 /nfs/dbraw/zinc/55/84/33/566558433.db2.gz CEHNZJNYKUDDLO-HUUCEWRRSA-N 0 3 381.314 3.304 10 0 GGAEHN Cc1nc(CNC2CCN(Cc3ccccn3)CC2)sc1Br ZINC000449399841 566559176 /nfs/dbraw/zinc/55/91/76/566559176.db2.gz DUDVDLQVGCMRQB-UHFFFAOYSA-N 0 3 381.343 3.363 10 0 GGAEHN COc1cc(C(=O)NCCN2[C@H](C)CCC[C@@H]2C)cc(Br)c1OC ZINC000559569889 566559724 /nfs/dbraw/zinc/55/97/24/566559724.db2.gz LHOKZOFHPZPBFY-BETUJISGSA-N 0 3 399.329 3.459 10 0 GGAEHN CCOc1cc(CN[C@@H](CC)[C@H](O)C(F)F)cc(Br)c1OC ZINC000449426523 566560031 /nfs/dbraw/zinc/56/00/31/566560031.db2.gz VEDKVQJWQCGOPX-AAEUAGOBSA-N 0 3 382.245 3.351 10 0 GGAEHN CC[C@H](N[C@H](C)CC(=O)Nc1ccc(Br)cc1)[C@H](O)C(F)F ZINC000449427199 566560200 /nfs/dbraw/zinc/56/02/00/566560200.db2.gz WLLZUVIWNRJLFM-LQJRIPTKSA-N 0 3 379.245 3.160 10 0 GGAEHN CC1(C)OCC[C@H]1NCc1cc(Br)cc(Br)c1N ZINC000449415982 566561192 /nfs/dbraw/zinc/56/11/92/566561192.db2.gz QSJKFKFHQNGDJY-LLVKDONJSA-N 0 3 378.108 3.451 10 0 GGAEHN COC(=O)[C@@H]1CCCCC[C@@H]1NCc1cnc2ccc(Br)cn12 ZINC000449417225 566561211 /nfs/dbraw/zinc/56/12/11/566561211.db2.gz XJPGSXRMFQMBCW-CABCVRRESA-N 0 3 380.286 3.308 10 0 GGAEHN CC[C@H](N[C@@H](C)CC(=O)Nc1ccc(Br)cc1)[C@@H](O)C(F)F ZINC000449427197 566561324 /nfs/dbraw/zinc/56/13/24/566561324.db2.gz WLLZUVIWNRJLFM-DUFXMDAXSA-N 0 3 379.245 3.160 10 0 GGAEHN O[C@@H]1C[C@@H]([C@H]2CCCOC2)N(CC2=Cc3cc(Br)ccc3OC2)C1 ZINC000449434738 566561736 /nfs/dbraw/zinc/56/17/36/566561736.db2.gz SHVFQELOUORYGK-QGTPRVQTSA-N 0 3 394.309 3.087 10 0 GGAEHN O[C@@H]1C[C@H]([C@H]2CCCOC2)N(Cc2ccnc3c(Br)cccc23)C1 ZINC000449433576 566561784 /nfs/dbraw/zinc/56/17/84/566561784.db2.gz MXJSXROGGVIUKO-HDMKZQKVSA-N 0 3 391.309 3.359 10 0 GGAEHN CCOc1c(Br)cc(CN[C@H](CC)[C@@H](O)C(F)F)cc1OC ZINC000449428406 566562385 /nfs/dbraw/zinc/56/23/85/566562385.db2.gz YIDGATVTOCMFGJ-DGCLKSJQSA-N 0 3 382.245 3.351 10 0 GGAEHN CCOc1c(Br)cc(CN[C@@H](CC)[C@H](O)C(F)F)cc1OC ZINC000449428405 566562423 /nfs/dbraw/zinc/56/24/23/566562423.db2.gz YIDGATVTOCMFGJ-AAEUAGOBSA-N 0 3 382.245 3.351 10 0 GGAEHN Cc1oc(Br)cc1C(=O)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000424727089 566563351 /nfs/dbraw/zinc/56/33/51/566563351.db2.gz YGHCUUQXIYNYLJ-CQSZACIVSA-N 0 3 385.302 3.068 10 0 GGAEHN C[C@H](NC(=O)Nc1cnn(CCN(C)C)c1)c1ccc(Br)cc1 ZINC000673868220 566563548 /nfs/dbraw/zinc/56/35/48/566563548.db2.gz ZQHBXXTXSDCMKD-LBPRGKRZSA-N 0 3 380.290 3.090 10 0 GGAEHN CN(C)CCn1cc(NC(=O)N[C@@H]2CCSc3ccc(Cl)cc32)cn1 ZINC000673871753 566563629 /nfs/dbraw/zinc/56/36/29/566563629.db2.gz PGPRAMAYZLLXAQ-OAHLLOKOSA-N 0 3 379.917 3.457 10 0 GGAEHN C[C@@](CO)(NCc1ccc(-n2cncn2)cc1)c1ccc(Br)cc1 ZINC000512865667 566564339 /nfs/dbraw/zinc/56/43/39/566564339.db2.gz VJQORCOKWXWSOT-SFHVURJKSA-N 0 3 387.281 3.027 10 0 GGAEHN C[C@](CO)(NCc1ccc(-n2cncn2)cc1)c1ccc(Br)cc1 ZINC000512865666 566564483 /nfs/dbraw/zinc/56/44/83/566564483.db2.gz VJQORCOKWXWSOT-GOSISDBHSA-N 0 3 387.281 3.027 10 0 GGAEHN C[C@@H](CC(=O)NC[C@H]1CCN1C1CCCCC1)n1cc(Br)cn1 ZINC000628543916 566565291 /nfs/dbraw/zinc/56/52/91/566565291.db2.gz VYZLQCPZOTUAQV-XJKSGUPXSA-N 0 3 383.334 3.120 10 0 GGAEHN C[C@@H](CC(=O)NC[C@@H]1CCN1C1CCCCC1)n1cc(Br)cn1 ZINC000628543913 566565553 /nfs/dbraw/zinc/56/55/53/566565553.db2.gz VYZLQCPZOTUAQV-BBRMVZONSA-N 0 3 383.334 3.120 10 0 GGAEHN COc1cc(CNCCOC(C)(C)C)cc(I)c1OC ZINC000604502663 566567065 /nfs/dbraw/zinc/56/70/65/566567065.db2.gz MIWUOADVTJFCCU-UHFFFAOYSA-N 0 3 393.265 3.213 10 0 GGAEHN CS(=O)(=O)N[C@@H]1CCCC[C@H]1CNCc1csc(-c2ccccc2)n1 ZINC000512904667 566567448 /nfs/dbraw/zinc/56/74/48/566567448.db2.gz ZXPPHKCPKKDGOY-DOTOQJQBSA-N 0 3 379.551 3.008 10 0 GGAEHN COc1cc(Br)ccc1CN[C@@H]1CCCN(C(=O)N2CCCC2)C1 ZINC000512894295 566568091 /nfs/dbraw/zinc/56/80/91/566568091.db2.gz JAPKOIPMYVCFNY-MRXNPFEDSA-N 0 3 396.329 3.228 10 0 GGAEHN Cn1cc(N2CCC[C@@H](N[C@H]3CCc4sc(Br)cc43)C2)cn1 ZINC000559767261 566568463 /nfs/dbraw/zinc/56/84/63/566568463.db2.gz QMFZRJWLAOKCPR-RISCZKNCSA-N 0 3 381.343 3.490 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cc(Br)c(C)s2)C[C@H]1N1CCCC1 ZINC000424773902 566568781 /nfs/dbraw/zinc/56/87/81/566568781.db2.gz GSMOZNKLKDLCNA-TZMCWYRMSA-N 0 3 389.384 3.471 10 0 GGAEHN COc1cc(Br)c(CNCC2(CF)CCOCC2)cc1OC ZINC000449485450 566569147 /nfs/dbraw/zinc/56/91/47/566569147.db2.gz MUQMNTUICYCGAH-UHFFFAOYSA-N 0 3 376.266 3.322 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)N[C@@H]1CCN(C)[C@@H](C)C1)CC2 ZINC000539227827 566568946 /nfs/dbraw/zinc/56/89/46/566568946.db2.gz ZIACMAHRVSRNDW-XJKSGUPXSA-N 0 3 380.330 3.308 10 0 GGAEHN CC(C)[C@@H]1C[C@@H](CNCc2ncc(I)s2)CCO1 ZINC000449491448 566569390 /nfs/dbraw/zinc/56/93/90/566569390.db2.gz GWXUFLXJRSSQCA-QWRGUYRKSA-N 0 3 380.295 3.289 10 0 GGAEHN FCC1(CNCc2c(F)ccc(I)c2F)CCOCC1 ZINC000449489401 566569681 /nfs/dbraw/zinc/56/96/81/566569681.db2.gz RIGQZIYEQNJGCP-UHFFFAOYSA-N 0 3 399.194 3.425 10 0 GGAEHN CC(C)[C@H]1C[C@@H](CNCc2ncc(I)s2)CCO1 ZINC000449491449 566569893 /nfs/dbraw/zinc/56/98/93/566569893.db2.gz GWXUFLXJRSSQCA-WDEREUQCSA-N 0 3 380.295 3.289 10 0 GGAEHN CC(C)N1CC[C@H](NC(=O)[C@H](N)CC(F)F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000578985824 566569940 /nfs/dbraw/zinc/56/99/40/566569940.db2.gz VSWICSRNCHJGCF-YCPHGPKFSA-N 0 3 377.838 3.102 10 0 GGAEHN C[C@H](CNC(=O)N(C)[C@H]1CCN(C2CC2)C1)Oc1ccc(Br)cc1 ZINC000466376881 566570217 /nfs/dbraw/zinc/57/02/17/566570217.db2.gz PGDRROAGCKWEGH-CJNGLKHVSA-N 0 3 396.329 3.095 10 0 GGAEHN C[C@@H](CNC(=O)N(C)[C@@H]1CCN(C2CC2)C1)Oc1ccc(Br)cc1 ZINC000466376883 566570871 /nfs/dbraw/zinc/57/08/71/566570871.db2.gz PGDRROAGCKWEGH-XJKSGUPXSA-N 0 3 396.329 3.095 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@@H]1CNCc1ccc(-c2ccccc2F)s1 ZINC000512976835 566571036 /nfs/dbraw/zinc/57/10/36/566571036.db2.gz BAZPJEGJXLEDES-CQSZACIVSA-N 0 3 382.526 3.458 10 0 GGAEHN COc1ncc(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1Br ZINC000424785955 566571355 /nfs/dbraw/zinc/57/13/55/566571355.db2.gz SPAYLEUMGPKNKB-LRDDRELGSA-N 0 3 392.297 3.274 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@@H]1CNCc1cc(Cl)cc(C(F)(F)F)c1 ZINC000512995607 566572935 /nfs/dbraw/zinc/57/29/35/566572935.db2.gz FNYQCIAJORAUBG-CQSZACIVSA-N 0 3 384.851 3.263 10 0 GGAEHN COc1cc(C[NH2+]C[C@@]2(CO)CCc3ccccc32)cc(Br)c1[O-] ZINC000651885858 566573075 /nfs/dbraw/zinc/57/30/75/566573075.db2.gz ZWCNZWZZBIMTHY-LJQANCHMSA-N 0 3 392.293 3.129 10 0 GGAEHN O=C(NC[C@H]1CCCCN1C1CC1)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651897176 566573106 /nfs/dbraw/zinc/57/31/06/566573106.db2.gz QPFXXFUMUACWSY-HZPDHXFCSA-N 0 3 393.325 3.448 10 0 GGAEHN COc1sc(CNC[C@@]2(CO)CCc3ccccc32)cc1Br ZINC000651884519 566573487 /nfs/dbraw/zinc/57/34/87/566573487.db2.gz KAKZQMUOGSTLRS-QGZVFWFLSA-N 0 3 382.323 3.485 10 0 GGAEHN COc1cc(C[NH2+]C[C@]2(CO)CCc3ccccc32)cc(Br)c1[O-] ZINC000651885857 566573572 /nfs/dbraw/zinc/57/35/72/566573572.db2.gz ZWCNZWZZBIMTHY-IBGZPJMESA-N 0 3 392.293 3.129 10 0 GGAEHN CC1(C)CCCN(CCNC(=O)Cc2noc3ccc(Br)cc32)C1 ZINC000424809026 566573701 /nfs/dbraw/zinc/57/37/01/566573701.db2.gz LUMHFGGXQFHECV-UHFFFAOYSA-N 0 3 394.313 3.371 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2cc(Br)c(C)s2)CC1 ZINC000424815690 566574040 /nfs/dbraw/zinc/57/40/40/566574040.db2.gz XRCTXHQAMQDVHU-UHFFFAOYSA-N 0 3 396.310 3.185 10 0 GGAEHN C[C@H](COc1cccc(F)c1)N[C@@H](C)Cn1cc(Br)ccc1=O ZINC000559892855 566574401 /nfs/dbraw/zinc/57/44/01/566574401.db2.gz ARLQFMXNHDQKDX-QWHCGFSZSA-N 0 3 383.261 3.196 10 0 GGAEHN COc1cc(Br)ccc1CN[C@@H]1CCO[C@H](c2ccnn2C)C1 ZINC000449589302 566576451 /nfs/dbraw/zinc/57/64/51/566576451.db2.gz JTCCLFRBSYHCBG-PBHICJAKSA-N 0 3 380.286 3.201 10 0 GGAEHN COc1c(Br)ccc(C)c1C(=O)N1C[C@@H](N2CCCC2)C[C@@H]1C ZINC000424833266 566576614 /nfs/dbraw/zinc/57/66/14/566576614.db2.gz JQKHVETUNFRBMY-KBPBESRZSA-N 0 3 381.314 3.465 10 0 GGAEHN COc1cc(Br)ccc1[C@@H]1CCCN1C(=O)CN1CC[C@@H](C)C1 ZINC000628679238 566576963 /nfs/dbraw/zinc/57/69/63/566576963.db2.gz FEQOQWCKOUTVAN-CJNGLKHVSA-N 0 3 381.314 3.463 10 0 GGAEHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)Cc1noc2ccc(Br)cc21 ZINC000424828189 566576971 /nfs/dbraw/zinc/57/69/71/566576971.db2.gz FYVIALRCKNQICS-OCCSQVGLSA-N 0 3 392.297 3.218 10 0 GGAEHN CNC(=O)COc1cccc(CNCc2ccc(Br)c(F)c2)c1 ZINC000513067096 566577280 /nfs/dbraw/zinc/57/72/80/566577280.db2.gz CGGRPQCFRQSALS-UHFFFAOYSA-N 0 3 381.245 3.003 10 0 GGAEHN COc1c(Br)ccc(C)c1C(=O)N1CC[C@@]2(C1)CCCN(C)C2 ZINC000424850702 566578081 /nfs/dbraw/zinc/57/80/81/566578081.db2.gz QVVXEPUCKPHZJE-SFHVURJKSA-N 0 3 381.314 3.324 10 0 GGAEHN CN1CCCC(C)(C)[C@H]1CNC(=O)Cc1noc2ccc(Br)cc21 ZINC000424849700 566578212 /nfs/dbraw/zinc/57/82/12/566578212.db2.gz ILWZDYCYMDMWQQ-MRXNPFEDSA-N 0 3 394.313 3.369 10 0 GGAEHN COc1c(Br)ccc(C)c1C(=O)N1CC[C@]2(C1)CCCN(C)C2 ZINC000424850701 566578319 /nfs/dbraw/zinc/57/83/19/566578319.db2.gz QVVXEPUCKPHZJE-GOSISDBHSA-N 0 3 381.314 3.324 10 0 GGAEHN O[C@]1(CCNCc2cnc(-c3ccc(Br)cc3)s2)CCOC1 ZINC000651943319 566578975 /nfs/dbraw/zinc/57/89/75/566578975.db2.gz NVNPRFMHTXCWPZ-MRXNPFEDSA-N 0 3 383.311 3.204 10 0 GGAEHN COc1cc(CNCc2ccc(C[S@@](C)=O)cc2)cc(Br)c1O ZINC000513111353 566579288 /nfs/dbraw/zinc/57/92/88/566579288.db2.gz CWVWCBWMIFMELG-HSZRJFAPSA-N 0 3 398.322 3.332 10 0 GGAEHN COc1ncc(C(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1Br ZINC000424852225 566579460 /nfs/dbraw/zinc/57/94/60/566579460.db2.gz PIKWMNVEPMYXCZ-HNNXBMFYSA-N 0 3 396.260 3.025 10 0 GGAEHN Cc1c(Br)cc(CNCC[C@]2(O)CCOC2)cc1Br ZINC000651944641 566579801 /nfs/dbraw/zinc/57/98/01/566579801.db2.gz BJFDUIIORUJOAI-AWEZNQCLSA-N 0 3 393.119 3.151 10 0 GGAEHN COc1c(O)cccc1CNC[C@@H](CO)Cc1ccc(C)c(Br)c1 ZINC000449600563 566580195 /nfs/dbraw/zinc/58/01/95/566580195.db2.gz OIYHYNDXPXNBTH-HNNXBMFYSA-N 0 3 394.309 3.413 10 0 GGAEHN CC(C)N1CC[C@@H](N(C)C(=O)Cc2noc3ccc(Br)cc32)C1 ZINC000424867446 566581307 /nfs/dbraw/zinc/58/13/07/566581307.db2.gz QWRLRGCXMUAEEV-CYBMUJFWSA-N 0 3 380.286 3.074 10 0 GGAEHN CC1(C)CCCN1CCNC(=O)Cc1noc2ccc(Br)cc21 ZINC000424868651 566581349 /nfs/dbraw/zinc/58/13/49/566581349.db2.gz UILIUOGTERLRTL-UHFFFAOYSA-N 0 3 380.286 3.123 10 0 GGAEHN COC(=O)C[C@@](C)(NCCc1cccnc1)c1ccc(Br)cc1 ZINC000513133543 566582951 /nfs/dbraw/zinc/58/29/51/566582951.db2.gz KEZXPVYDDGOCRM-GOSISDBHSA-N 0 3 377.282 3.455 10 0 GGAEHN COC(=O)C[C@](C)(NCCCc1nc(C)no1)c1ccc(Br)cc1 ZINC000513133623 566583437 /nfs/dbraw/zinc/58/34/37/566583437.db2.gz LUEBVWSUGJXBRP-KRWDZBQOSA-N 0 3 396.285 3.141 10 0 GGAEHN COC(=O)C[C@@](C)(NCCCn1ccnc1)c1ccc(Br)cc1 ZINC000513133729 566583492 /nfs/dbraw/zinc/58/34/92/566583492.db2.gz NJRUBIZSLDEXNL-QGZVFWFLSA-N 0 3 380.286 3.104 10 0 GGAEHN COC(=O)C[C@@](C)(NCC1(CC(=O)OC)CC1)c1ccc(Br)cc1 ZINC000513149957 566585042 /nfs/dbraw/zinc/58/50/42/566585042.db2.gz NOFOFCBUGVNOBN-QGZVFWFLSA-N 0 3 398.297 3.160 10 0 GGAEHN CCn1cc(CCN[C@](C)(CC(=O)OC)c2ccc(Br)cc2)cn1 ZINC000513150736 566585527 /nfs/dbraw/zinc/58/55/27/566585527.db2.gz SGMCQHDPRJYURD-GOSISDBHSA-N 0 3 394.313 3.276 10 0 GGAEHN COC(=O)C[C@](C)(NCCC(=O)OC(C)C)c1ccc(Br)cc1 ZINC000513159870 566585536 /nfs/dbraw/zinc/58/55/36/566585536.db2.gz MZSGPHXXVOQZJZ-KRWDZBQOSA-N 0 3 386.286 3.159 10 0 GGAEHN CC1(C)COC[C@@H]1NCc1cc(Br)cc(Br)c1N ZINC000449627144 566585630 /nfs/dbraw/zinc/58/56/30/566585630.db2.gz YWGGVGSFEMGISQ-NSHDSACASA-N 0 3 378.108 3.308 10 0 GGAEHN COC(=O)C[C@](C)(NCCOCC(F)F)c1ccc(Br)cc1 ZINC000513150317 566585612 /nfs/dbraw/zinc/58/56/12/566585612.db2.gz PIUDGWQEDIKFMG-HNNXBMFYSA-N 0 3 380.229 3.099 10 0 GGAEHN C[C@@H](NC(=O)c1cccc(CN2CCCC2)c1)c1ncc(Br)cn1 ZINC000486411868 566585978 /nfs/dbraw/zinc/58/59/78/566585978.db2.gz XQLCHWGAXKPPDR-CYBMUJFWSA-N 0 3 389.297 3.326 10 0 GGAEHN Cn1c(=O)ccc2c1CCC[C@@H]2NCc1cc(Br)cc2c1OCC2 ZINC000652048054 566586134 /nfs/dbraw/zinc/58/61/34/566586134.db2.gz DQNBPVDXMCTTJD-INIZCTEOSA-N 0 3 389.293 3.250 10 0 GGAEHN Cn1c(=O)ccc2c1CCC[C@H]2NCc1cc2c(c(Br)c1)OCO2 ZINC000652044997 566586424 /nfs/dbraw/zinc/58/64/24/566586424.db2.gz XNNRABJFNGFYET-CQSZACIVSA-N 0 3 391.265 3.044 10 0 GGAEHN COc1sc(CN[C@H]2CCCc3c2ccc(=O)n3C)cc1Br ZINC000652048810 566586454 /nfs/dbraw/zinc/58/64/54/566586454.db2.gz VOOGHLIGBMKZBF-ZDUSSCGKSA-N 0 3 383.311 3.385 10 0 GGAEHN CN(c1nnc(CSc2ccc(Cl)cc2)n1C)[C@H]1CCN(C2CC2)C1 ZINC000579175948 566586820 /nfs/dbraw/zinc/58/68/20/566586820.db2.gz XVGFXBSPYHPCNY-HNNXBMFYSA-N 0 3 377.945 3.434 10 0 GGAEHN CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)NCCN1CCCC[C@@H]1C ZINC000513191390 566588799 /nfs/dbraw/zinc/58/87/99/566588799.db2.gz LKMPNHRBMBWLDW-XJKSGUPXSA-N 0 3 385.961 3.147 10 0 GGAEHN C[C@@H]([N-]S(=O)(=O)c1cccc(Br)c1Cl)C(C)(C)C[NH+](C)C ZINC000560042483 566590018 /nfs/dbraw/zinc/59/00/18/566590018.db2.gz RKXOKANMJKATLF-SNVBAGLBSA-N 0 3 397.766 3.357 10 0 GGAEHN C[C@H]1OCC[C@H]1N(CCO)Cc1ccc(Br)cc1C(F)(F)F ZINC000449684269 566591019 /nfs/dbraw/zinc/59/10/19/566591019.db2.gz ZVVSHFLGDFKFBS-QMTHXVAHSA-N 0 3 382.220 3.440 10 0 GGAEHN CCCn1cc(CNC[C@H](CO)Cc2ccc(F)c(Br)c2)cn1 ZINC000449685400 566592966 /nfs/dbraw/zinc/59/29/66/566592966.db2.gz UJGCLOPOLBPFJU-CQSZACIVSA-N 0 3 384.293 3.136 10 0 GGAEHN CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)N1CCN2CCC1CC2 ZINC000560105412 566597632 /nfs/dbraw/zinc/59/76/32/566597632.db2.gz OSWBFCOVQWBNJW-DYVFJYSZSA-N 0 3 396.329 3.015 10 0 GGAEHN CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)N1CCN2CCC1CC2 ZINC000560105413 566598061 /nfs/dbraw/zinc/59/80/61/566598061.db2.gz OSWBFCOVQWBNJW-GUYCJALGSA-N 0 3 396.329 3.015 10 0 GGAEHN CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)N1CCN2CCC1CC2 ZINC000560105411 566598119 /nfs/dbraw/zinc/59/81/19/566598119.db2.gz OSWBFCOVQWBNJW-CXAGYDPISA-N 0 3 396.329 3.015 10 0 GGAEHN CO[C@@H](C(=O)NC[C@@H]1CCN1C1CCCC1)c1ccccc1Br ZINC000628966455 566598980 /nfs/dbraw/zinc/59/89/80/566598980.db2.gz UVWIVSMOUGGVMB-WMLDXEAASA-N 0 3 381.314 3.270 10 0 GGAEHN CO[C@@H](C(=O)NC[C@H]1CCN1C1CCCC1)c1ccccc1Br ZINC000628966454 566599410 /nfs/dbraw/zinc/59/94/10/566599410.db2.gz UVWIVSMOUGGVMB-RHSMWYFYSA-N 0 3 381.314 3.270 10 0 GGAEHN O=C(NCc1cnc(-c2ccc(Cl)cc2)s1)N1CCN2CCC1CC2 ZINC000560121918 566599707 /nfs/dbraw/zinc/59/97/07/566599707.db2.gz ZXBUIHWWMYYYQW-UHFFFAOYSA-N 0 3 376.913 3.453 10 0 GGAEHN C[C@H](N[C@H]1C[C@@H](C(N)=O)C1)c1ccc(Br)cc1Br ZINC000652256510 566599780 /nfs/dbraw/zinc/59/97/80/566599780.db2.gz YMVINOVVOHCMHK-OYNCUSHFSA-N 0 3 376.092 3.126 10 0 GGAEHN CN(C)CCN(C)c1ccc(Br)cc1NC(=O)C1CCC(=O)CC1 ZINC000425096540 566603478 /nfs/dbraw/zinc/60/34/78/566603478.db2.gz FPESNIHAAXLLAN-UHFFFAOYSA-N 0 3 396.329 3.145 10 0 GGAEHN C[C@@H]1COCC[C@H]1C(=O)Nc1cc(Br)ccc1N(C)CCN(C)C ZINC000425097550 566603497 /nfs/dbraw/zinc/60/34/97/566603497.db2.gz IHHNCXWKPBZNBV-UKRRQHHQSA-N 0 3 398.345 3.058 10 0 GGAEHN O=C(CC1(N2CCOCC2)CCCC1)NCCc1ccccc1Br ZINC000579405063 566606039 /nfs/dbraw/zinc/60/60/39/566606039.db2.gz YZCDCCVRMYZSCL-UHFFFAOYSA-N 0 3 395.341 3.143 10 0 GGAEHN COc1c(Br)cc(CN(C)[C@H]2CCOC2)cc1Br ZINC000539839491 566606871 /nfs/dbraw/zinc/60/68/71/566606871.db2.gz BKAKXZUQQFLPRH-JTQLQIEISA-N 0 3 379.092 3.441 10 0 GGAEHN O=C1C[C@H]([C@@H]2CCCCN2Cc2nc3ccc(Br)cc3o2)CN1 ZINC000579421481 566607569 /nfs/dbraw/zinc/60/75/69/566607569.db2.gz JTBWSXMVEREXSF-FZMZJTMJSA-N 0 3 378.270 3.081 10 0 GGAEHN O=C1C[C@@H]([C@H]2CCCCN2Cc2nc3ccc(Br)cc3o2)CN1 ZINC000579421479 566608238 /nfs/dbraw/zinc/60/82/38/566608238.db2.gz JTBWSXMVEREXSF-BXUZGUMPSA-N 0 3 378.270 3.081 10 0 GGAEHN CNC(=O)[C@@H](C)CN(C)Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000539858880 566608278 /nfs/dbraw/zinc/60/82/78/566608278.db2.gz MPUDZTLNWRWFDF-NSHDSACASA-N 0 3 382.327 3.387 10 0 GGAEHN Cc1cc(NC(=O)c2nscc2Br)ccc1OCCN(C)C ZINC000652434108 566610727 /nfs/dbraw/zinc/61/07/27/566610727.db2.gz RBKNJKCSBIISBW-UHFFFAOYSA-N 0 3 384.299 3.407 10 0 GGAEHN COC(=O)c1ccc(CNCCc2cn3ccccc3n2)c(Br)c1 ZINC000560259691 566611328 /nfs/dbraw/zinc/61/13/28/566611328.db2.gz BSFVSGHVGDZLQE-UHFFFAOYSA-N 0 3 388.265 3.216 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CCC[C@@H]2CN2CCCC2)c1 ZINC000513605317 566612724 /nfs/dbraw/zinc/61/27/24/566612724.db2.gz RDOAVVBUFCFOPH-CQSZACIVSA-N 0 3 398.288 3.300 10 0 GGAEHN CCC[C@@H](C)[C@@H](CO)NCC(=O)Nc1c(Cl)cc(Cl)cc1C(=O)OC ZINC000579480398 566613112 /nfs/dbraw/zinc/61/31/12/566613112.db2.gz RZYFXERPNWXCPF-QMTHXVAHSA-N 0 3 391.295 3.105 10 0 GGAEHN CN1CCC[C@H](NC(=O)NCc2cc(Cl)cc(Cl)c2OC(F)F)C1 ZINC000674929367 566618338 /nfs/dbraw/zinc/61/83/38/566618338.db2.gz RFEUUHKWJASTFM-NSHDSACASA-N 0 3 382.238 3.488 10 0 GGAEHN CC[C@H](CNC(=O)N[C@@H]1CCCN(C)C1)Cc1cccc(Br)c1 ZINC000605961578 566621983 /nfs/dbraw/zinc/62/19/83/566621983.db2.gz RYEGUHNOLUMTDD-WMLDXEAASA-N 0 3 382.346 3.411 10 0 GGAEHN CN(C)C1(CNC(=O)Cc2sccc2Br)Cc2ccccc2C1 ZINC000449985469 566622339 /nfs/dbraw/zinc/62/23/39/566622339.db2.gz MJTYHNKYGFTPPR-UHFFFAOYSA-N 0 3 393.350 3.269 10 0 GGAEHN CNC(=O)[C@@H](NCc1ccc(Br)c(Br)c1)C(C)C ZINC000486791964 566622690 /nfs/dbraw/zinc/62/26/90/566622690.db2.gz BPZBGQTWVWFBBD-LBPRGKRZSA-N 0 3 378.108 3.072 10 0 GGAEHN CN(C(=O)c1cc(=O)[nH]c2ccc(Br)cc21)[C@@H]1CCN(C2CC2)C1 ZINC000606198180 566626115 /nfs/dbraw/zinc/62/61/15/566626115.db2.gz IUQWZOPTKJUFIJ-CYBMUJFWSA-N 0 3 390.281 3.012 10 0 GGAEHN Cc1nc2ccc(Br)cc2c(NC[C@H]2CCN(C)C(=O)C2)c1C ZINC000425269142 566626139 /nfs/dbraw/zinc/62/61/39/566626139.db2.gz RWLHYKBSLLXCPO-ZDUSSCGKSA-N 0 3 376.298 3.316 10 0 GGAEHN CN(C(=O)c1cc(=O)[nH]c2ccc(Br)cc21)[C@H]1CCN(C2CC2)C1 ZINC000606198181 566626438 /nfs/dbraw/zinc/62/64/38/566626438.db2.gz IUQWZOPTKJUFIJ-ZDUSSCGKSA-N 0 3 390.281 3.012 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)CCc2cccc(F)c2Br)CCSC1 ZINC000450039600 566627039 /nfs/dbraw/zinc/62/70/39/566627039.db2.gz FSWBURNPSCLCCA-MRXNPFEDSA-N 0 3 389.334 3.074 10 0 GGAEHN Cc1nc(-c2cc3c(s2)CCN(C(=O)NC[C@@H]2CCCN2C)C3)cs1 ZINC000540074150 566628073 /nfs/dbraw/zinc/62/80/73/566628073.db2.gz VRKHZCKDNHNWQV-AWEZNQCLSA-N 0 3 376.551 3.342 10 0 GGAEHN CN1C[C@@H]2CCCN(c3cnn(-c4ccc(Cl)cc4)c(=O)c3Cl)[C@@H]2C1 ZINC000425281851 566628083 /nfs/dbraw/zinc/62/80/83/566628083.db2.gz JLJOWWMGRCPXKW-BLLLJJGKSA-N 0 3 379.291 3.070 10 0 GGAEHN CC[C@H](CN1CCCC1)NC(=O)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000606372883 566629275 /nfs/dbraw/zinc/62/92/75/566629275.db2.gz HDLUAPYZVOARGJ-CYBMUJFWSA-N 0 3 392.297 3.307 10 0 GGAEHN O=C1c2ccccc2C(=O)N1CCN[C@H]1CCc2c1cccc2Br ZINC000513870312 566630920 /nfs/dbraw/zinc/63/09/20/566630920.db2.gz XRPKDHYVZAUUEN-KRWDZBQOSA-N 0 3 385.261 3.322 10 0 GGAEHN OC[C@H](NC1CCC(O)(C(F)(F)F)CC1)c1cccc(Br)c1 ZINC000540164531 566632677 /nfs/dbraw/zinc/63/26/77/566632677.db2.gz SKUUQRKFUNPTBT-MOKVOYLWSA-N 0 3 382.220 3.308 10 0 GGAEHN OC1(CNCc2cnn(-c3ccc(Br)cc3)c2)Cc2ccccc2C1 ZINC000606472671 566632432 /nfs/dbraw/zinc/63/24/32/566632432.db2.gz IXHZQSDLQUQCDU-UHFFFAOYSA-N 0 3 398.304 3.254 10 0 GGAEHN COC[C@H](NCCC1CCS(=O)(=O)CC1)c1cccc(C(F)(F)F)c1 ZINC000540154643 566632583 /nfs/dbraw/zinc/63/25/83/566632583.db2.gz WSUFORBRUIDTHE-INIZCTEOSA-N 0 3 379.444 3.197 10 0 GGAEHN CCCOc1c(Br)cc(CN2CC[C@@H](c3nc[nH]n3)C2)cc1OC ZINC000425347150 566632620 /nfs/dbraw/zinc/63/26/20/566632620.db2.gz AHADECDBGOUXFL-CYBMUJFWSA-N 0 3 395.301 3.354 10 0 GGAEHN OC1(CNCc2nc(-c3cccc(Br)c3)c[nH]2)Cc2ccccc2C1 ZINC000606472770 566634550 /nfs/dbraw/zinc/63/45/50/566634550.db2.gz VMRWBUJBTRJRBC-UHFFFAOYSA-N 0 3 398.304 3.459 10 0 GGAEHN Cc1ccc(CC(=O)NCCCCN2C[C@H](C)O[C@@H](C)C2)c(Br)c1 ZINC000450121093 566635057 /nfs/dbraw/zinc/63/50/57/566635057.db2.gz HVWFKRCWAHQYBA-HOTGVXAUSA-N 0 3 397.357 3.306 10 0 GGAEHN C[C@@H]1CN(CCCCNC(=O)Cc2sccc2Br)C[C@H](C)O1 ZINC000450121978 566636337 /nfs/dbraw/zinc/63/63/37/566636337.db2.gz LXUMWJXOWHJWRF-BETUJISGSA-N 0 3 389.359 3.059 10 0 GGAEHN C[C@@H](c1nc2ccccc2s1)[C@H](C)NC[C@@H]1CCCCN1S(C)(=O)=O ZINC000560585619 566641029 /nfs/dbraw/zinc/64/10/29/566641029.db2.gz FGOGCGDIIXDFRN-ILXRZTDVSA-N 0 3 381.567 3.192 10 0 GGAEHN C[C@@H](c1nc2ccccc2s1)[C@H](C)NC[C@H]1CCCCN1S(C)(=O)=O ZINC000560585622 566641110 /nfs/dbraw/zinc/64/11/10/566641110.db2.gz FGOGCGDIIXDFRN-QLFBSQMISA-N 0 3 381.567 3.192 10 0 GGAEHN CS(=O)(=O)C1(CN[C@@H]2CCCc3ncc(C(F)(F)F)cc32)CCCC1 ZINC000560580915 566641168 /nfs/dbraw/zinc/64/11/68/566641168.db2.gz LFZUQZRBYQWHJZ-OAHLLOKOSA-N 0 3 376.444 3.425 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N[C@H](CO)c1cccc(Br)c1 ZINC000486995651 566641344 /nfs/dbraw/zinc/64/13/44/566641344.db2.gz JXFDRAYDJFYOJW-CKEIUWERSA-N 0 3 398.345 3.045 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N[C@@H](CO)c1cccc(Br)c1 ZINC000486995653 566641560 /nfs/dbraw/zinc/64/15/60/566641560.db2.gz JXFDRAYDJFYOJW-CPUCHLNUSA-N 0 3 398.345 3.045 10 0 GGAEHN CC[C@H]1C[C@@H](CN2CCCN(c3nnc(C(F)(F)F)s3)CC2)CCO1 ZINC000467365368 566641632 /nfs/dbraw/zinc/64/16/32/566641632.db2.gz PLEUVTBIYIKBMD-STQMWFEESA-N 0 3 378.464 3.274 10 0 GGAEHN Cn1ncc(Br)c1CNCC(C)(C)c1ccc2c(c1)OCCO2 ZINC000486983700 566642028 /nfs/dbraw/zinc/64/20/28/566642028.db2.gz DXIMQBPJCXAAPG-UHFFFAOYSA-N 0 3 380.286 3.021 10 0 GGAEHN O=C(NCC1(N2CCSCC2)CCCCC1)N1CC(CC(F)(F)F)C1 ZINC000675422648 566643284 /nfs/dbraw/zinc/64/32/84/566643284.db2.gz LVGCOXOVWSKVNC-UHFFFAOYSA-N 0 3 379.492 3.332 10 0 GGAEHN C[C@@H]1CCN(CC(=O)N2CCC[C@H]2c2ccc(I)cc2)C1 ZINC000579851483 566644491 /nfs/dbraw/zinc/64/44/91/566644491.db2.gz PBURIBVEKWVBPS-CJNGLKHVSA-N 0 3 398.288 3.297 10 0 GGAEHN CN(C)CCn1cc(NC(=O)CCCc2cccc(Br)c2)cn1 ZINC000675447690 566644485 /nfs/dbraw/zinc/64/44/85/566644485.db2.gz WMSQGUNJTNDLCI-UHFFFAOYSA-N 0 3 379.302 3.169 10 0 GGAEHN CN(CCN1CCCCC1)C(=O)Cc1noc2ccc(Br)cc21 ZINC000652993062 566644934 /nfs/dbraw/zinc/64/49/34/566644934.db2.gz YGWMUAPPPZTSCA-UHFFFAOYSA-N 0 3 380.286 3.077 10 0 GGAEHN Cc1c(Cl)cccc1S(=O)(=O)N1C[C@H](CN(C)C)Oc2ccccc21 ZINC000675473313 566647221 /nfs/dbraw/zinc/64/72/21/566647221.db2.gz YIYDNIUHXITHCS-AWEZNQCLSA-N 0 3 380.897 3.166 10 0 GGAEHN N[C@H](CNC(=O)[C@H]1CCOc2ccc(Br)cc21)c1ccccc1 ZINC000653049045 566648026 /nfs/dbraw/zinc/64/80/26/566648026.db2.gz OEBISCLYPNBOGB-GOEBONIOSA-N 0 3 375.266 3.131 10 0 GGAEHN O=C(NC[C@H](O)CN1CCCCC1)c1cc2ccc(Br)cc2s1 ZINC000450235424 566648299 /nfs/dbraw/zinc/64/82/99/566648299.db2.gz XKXDCQCLMSYIKD-AWEZNQCLSA-N 0 3 397.338 3.240 10 0 GGAEHN N[C@@H](CNC(=O)[C@@H]1CCOc2ccc(Br)cc21)c1ccccc1 ZINC000653049047 566648265 /nfs/dbraw/zinc/64/82/65/566648265.db2.gz OEBISCLYPNBOGB-ZBFHGGJFSA-N 0 3 375.266 3.131 10 0 GGAEHN CN(C)CCN1CCC(Nc2ncc(Br)cc2C(F)(F)F)CC1 ZINC000450250932 566649851 /nfs/dbraw/zinc/64/98/51/566649851.db2.gz PHPLJQOZJBPBRU-UHFFFAOYSA-N 0 3 395.267 3.301 10 0 GGAEHN CCc1ccc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)s1 ZINC000487126775 566651051 /nfs/dbraw/zinc/65/10/51/566651051.db2.gz BFZVJEPPSXQTFY-YJBOKZPZSA-N 0 3 378.563 3.499 10 0 GGAEHN CCc1ccc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)s1 ZINC000487126771 566651076 /nfs/dbraw/zinc/65/10/76/566651076.db2.gz BFZVJEPPSXQTFY-MAUKXSAKSA-N 0 3 378.563 3.499 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)Nc1cnc2c(c1)CNCC2 ZINC000653127970 566652491 /nfs/dbraw/zinc/65/24/91/566652491.db2.gz DOCLQFAMBPQDKI-UHFFFAOYSA-N 0 3 399.292 3.392 10 0 GGAEHN CCN1CC[C@@H](NCC2(CS(C)(=O)=O)CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000579932115 566652662 /nfs/dbraw/zinc/65/26/62/566652662.db2.gz PCPNRDMRISZABS-SJORKVTESA-N 0 3 388.936 3.029 10 0 GGAEHN O=C(NCc1ccc2c(c1)CNC2)[C@@H]1CCOc2ccc(Br)cc21 ZINC000653132916 566652904 /nfs/dbraw/zinc/65/29/04/566652904.db2.gz LVRKCUKSGGNSJJ-MRXNPFEDSA-N 0 3 387.277 3.235 10 0 GGAEHN COc1ncc(Br)cc1Cc1noc([C@H]2CCN(C)[C@@H](C)C2)n1 ZINC000579934443 566652893 /nfs/dbraw/zinc/65/28/93/566652893.db2.gz HYYMYECYKWDKSM-QWRGUYRKSA-N 0 3 381.274 3.024 10 0 GGAEHN O=C(CCNC[C@@H](O)COc1c(Cl)cccc1Cl)NC1CCCCC1 ZINC000514600796 566654750 /nfs/dbraw/zinc/65/47/50/566654750.db2.gz ZOQKNNKHUAZPEV-CQSZACIVSA-N 0 3 389.323 3.162 10 0 GGAEHN COc1c(Br)ccc(C)c1C(=O)N1CCC[C@H]2CN(C)CC[C@H]21 ZINC000425552795 566654840 /nfs/dbraw/zinc/65/48/40/566654840.db2.gz RATLXQJFFQRYOL-DZGCQCFKSA-N 0 3 381.314 3.322 10 0 GGAEHN O=C(CCNC[C@H](O)COc1c(Cl)cccc1Cl)NC1CCCCC1 ZINC000514600795 566654966 /nfs/dbraw/zinc/65/49/66/566654966.db2.gz ZOQKNNKHUAZPEV-AWEZNQCLSA-N 0 3 389.323 3.162 10 0 GGAEHN OCCN1CCCN(c2ccc3c(Cl)ccc(Br)c3n2)CC1 ZINC000450310943 566657616 /nfs/dbraw/zinc/65/76/16/566657616.db2.gz CGKGORFNEOIMGY-UHFFFAOYSA-N 0 3 384.705 3.155 10 0 GGAEHN CCN1CC[C@H](N(C)C(=O)c2n[nH]c3ccc(Br)cc32)C[C@H]1C ZINC000607128301 566658141 /nfs/dbraw/zinc/65/81/41/566658141.db2.gz YXPXXAKBSZRNEF-YPMHNXCESA-N 0 3 379.302 3.270 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N[C@@H]1CN(C2CC2)C[C@H]1C ZINC000467716919 566659126 /nfs/dbraw/zinc/65/91/26/566659126.db2.gz ZVTOGLCZTRQATA-MLGOLLRUSA-N 0 3 390.325 3.311 10 0 GGAEHN Cn1ncc(Br)c1CNC[C@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000487264053 566660792 /nfs/dbraw/zinc/66/07/92/566660792.db2.gz FZWFONJQNMMPFF-WBMJQRKESA-N 0 3 383.359 3.417 10 0 GGAEHN FC(F)(F)c1cc(Br)cnc1N1CCN(C2CCOCC2)CC1 ZINC000450360995 566662654 /nfs/dbraw/zinc/66/26/54/566662654.db2.gz BLVYXNVHVFANFE-UHFFFAOYSA-N 0 3 394.235 3.164 10 0 GGAEHN CN1C[C@@H]2CCCN(C(=O)N[C@H]3CCOc4ccc(Br)cc43)[C@@H]2C1 ZINC000425654658 566662747 /nfs/dbraw/zinc/66/27/47/566662747.db2.gz DQAWIAJTHDWXGU-VBNZEHGJSA-N 0 3 394.313 3.008 10 0 GGAEHN Cc1ccc(-c2nsc(NC(=O)[C@]3(N)[C@H]4CCCO[C@@H]4C3(C)C)n2)s1 ZINC000580071536 566663164 /nfs/dbraw/zinc/66/31/64/566663164.db2.gz WDJUSUHSIRUEMS-QAGHZCBJSA-N 0 3 378.523 3.046 10 0 GGAEHN FC(F)(F)c1cc(Br)cnc1N1CCN(C[C@@H]2CCOC2)CC1 ZINC000450369634 566663555 /nfs/dbraw/zinc/66/35/55/566663555.db2.gz QXADSTSIKIBAHL-NSHDSACASA-N 0 3 394.235 3.021 10 0 GGAEHN O[C@@H](CN[C@@H]1CCN(c2ccccc2)C1)COc1ccccc1Br ZINC000675762989 566663654 /nfs/dbraw/zinc/66/36/54/566663654.db2.gz AMZMSNPNBKDKGB-WBVHZDCISA-N 0 3 391.309 3.057 10 0 GGAEHN CN(C)CCN(C(=O)Nc1cnc2c(Br)cccn12)C1CCCC1 ZINC000425671531 566665890 /nfs/dbraw/zinc/66/58/90/566665890.db2.gz IESJVHHVZKWVDY-UHFFFAOYSA-N 0 3 394.317 3.435 10 0 GGAEHN C[C@H]1C[C@H](c2ccc(Br)cc2)CN1Cc1nc(C(C)(C)N)no1 ZINC000629581681 566667143 /nfs/dbraw/zinc/66/71/43/566667143.db2.gz FVHQVFWJBQBYPM-AAEUAGOBSA-N 0 3 379.302 3.404 10 0 GGAEHN O=C1CC[C@H](CN2CCC[C@H]2c2ccccc2I)CCN1 ZINC000450403828 566669000 /nfs/dbraw/zinc/66/90/00/566669000.db2.gz MYUAOUZQNUGERD-BBRMVZONSA-N 0 3 398.288 3.344 10 0 GGAEHN Cc1nc2cc(Br)cc(NC(=O)N[C@@H]3CNCCC3(F)F)c2o1 ZINC000561010012 566668867 /nfs/dbraw/zinc/66/88/67/566668867.db2.gz UQRCATNVZVWZDC-LLVKDONJSA-N 0 3 389.200 3.017 10 0 GGAEHN COC(=O)C1(CN2CCC[C@H]2c2ccccc2I)CC1 ZINC000450410392 566668976 /nfs/dbraw/zinc/66/89/76/566668976.db2.gz YWAFBRFICZGJMH-AWEZNQCLSA-N 0 3 385.245 3.381 10 0 GGAEHN O[C@H](CNC[C@@H]1Cc2ccccc2CO1)COc1cc(Cl)ccc1Cl ZINC000629587374 566669123 /nfs/dbraw/zinc/66/91/23/566669123.db2.gz JAQJRWMWUKXBSB-SJORKVTESA-N 0 3 382.287 3.464 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1cc(Cl)ccc1OC(F)F ZINC000425688634 566669106 /nfs/dbraw/zinc/66/91/06/566669106.db2.gz CKQZRSGJXVLXPH-LBPRGKRZSA-N 0 3 377.819 3.174 10 0 GGAEHN Cc1nc2cc(Br)cc(NC(=O)N[C@H]3CNCCC3(F)F)c2o1 ZINC000561010013 566669385 /nfs/dbraw/zinc/66/93/85/566669385.db2.gz UQRCATNVZVWZDC-NSHDSACASA-N 0 3 389.200 3.017 10 0 GGAEHN O[C@H](CNC[C@@H]1Cc2ccccc2CO1)COc1c(Cl)cccc1Cl ZINC000629587799 566669587 /nfs/dbraw/zinc/66/95/87/566669587.db2.gz UTMHQVNMWBYBEG-CVEARBPZSA-N 0 3 382.287 3.464 10 0 GGAEHN COc1cc(C)nc(CNCCCNC(=O)c2cccc(Br)c2)c1 ZINC000540811522 566673992 /nfs/dbraw/zinc/67/39/92/566673992.db2.gz QQKWSIKTGUSNNW-UHFFFAOYSA-N 0 3 392.297 3.071 10 0 GGAEHN CN(C)C1(CNC(=O)c2csc(Br)c2)Cc2ccccc2C1 ZINC000607535227 566674933 /nfs/dbraw/zinc/67/49/33/566674933.db2.gz FYJHHCXOSHGGFS-UHFFFAOYSA-N 0 3 379.323 3.340 10 0 GGAEHN CN1CCN(CCNc2ncc(Br)cc2C(F)(F)F)CC1(C)C ZINC000450501414 566678004 /nfs/dbraw/zinc/67/80/04/566678004.db2.gz QHKKHIVRLCBTMV-UHFFFAOYSA-N 0 3 395.267 3.301 10 0 GGAEHN CCN(CC)CCN(C(=O)CC[C@@H](C)OC)c1ccc(Br)cn1 ZINC000580272998 566679056 /nfs/dbraw/zinc/67/90/56/566679056.db2.gz RTHLILXFWPLTLP-CQSZACIVSA-N 0 3 386.334 3.334 10 0 GGAEHN O=C(c1ccccc1)N1C[C@H](CNCc2sccc2Cl)N2CC[C@H]1C2 ZINC000487557263 566679969 /nfs/dbraw/zinc/67/99/69/566679969.db2.gz YEWANVXROPDFMD-HOTGVXAUSA-N 0 3 375.925 3.090 10 0 GGAEHN O=C(c1ccccc1)N1C[C@H](CNCc2cc(Cl)cs2)N2CC[C@H]1C2 ZINC000487552993 566680465 /nfs/dbraw/zinc/68/04/65/566680465.db2.gz QRZRVASFSNOBFB-IRXDYDNUSA-N 0 3 375.925 3.090 10 0 GGAEHN CNS(=O)(=O)CCCN1CCC(COc2cc(Cl)cc(Cl)c2)CC1 ZINC000607743458 566680500 /nfs/dbraw/zinc/68/05/00/566680500.db2.gz QMFCSBLVYKSWCG-UHFFFAOYSA-N 0 3 395.352 3.024 10 0 GGAEHN C[C@H](CNC(=O)CCN(C)c1ccncc1)Oc1ccc(Br)cc1 ZINC000540926097 566680780 /nfs/dbraw/zinc/68/07/80/566680780.db2.gz MWZWDOHWUOITDA-CQSZACIVSA-N 0 3 392.297 3.254 10 0 GGAEHN CCCOc1ccc(Br)cc1CNC[C@@H](CO)c1cccnc1 ZINC000514964693 566681510 /nfs/dbraw/zinc/68/15/10/566681510.db2.gz CMJHUWFBKNBLIN-INIZCTEOSA-N 0 3 379.298 3.499 10 0 GGAEHN C[C@@H]1CC[C@H](C)N1CC(=O)NC1(c2ccc(Br)cc2)CCOCC1 ZINC000468110432 566683535 /nfs/dbraw/zinc/68/35/35/566683535.db2.gz WADUJGSVBCXHAF-GASCZTMLSA-N 0 3 395.341 3.444 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)Cc1csc(Cc2cccc(Cl)c2)n1 ZINC000425979683 566684131 /nfs/dbraw/zinc/68/41/31/566684131.db2.gz LMBBIQADXAIKAV-QGZVFWFLSA-N 0 3 377.941 3.482 10 0 GGAEHN COCCN(Cc1ccc(Br)s1)C(=O)CC1CCN(C)CC1 ZINC000487638102 566685518 /nfs/dbraw/zinc/68/55/18/566685518.db2.gz QHRFLVWZQDDRNZ-UHFFFAOYSA-N 0 3 389.359 3.218 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)N(C)Cc1cc(Br)cn1C ZINC000468160552 566686107 /nfs/dbraw/zinc/68/61/07/566686107.db2.gz REQDFIIOVNOXBO-KBPBESRZSA-N 0 3 385.350 3.192 10 0 GGAEHN NC(=O)[C@@H](N[C@@H]1CCOC2(CCSCC2)C1)c1ccc(Br)cc1 ZINC000676348543 566686912 /nfs/dbraw/zinc/68/69/12/566686912.db2.gz NRNYJULCGFLOGG-CABCVRRESA-N 0 3 399.354 3.010 10 0 GGAEHN CC(=O)Nc1ccc(CNC[C@H](O)COc2c(Cl)cccc2Cl)cc1 ZINC000515054864 566687078 /nfs/dbraw/zinc/68/70/78/566687078.db2.gz PGBQDCJKAJGUCK-HNNXBMFYSA-N 0 3 383.275 3.481 10 0 GGAEHN CC[C@H](O)CC(=O)N(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000515038107 566688247 /nfs/dbraw/zinc/68/82/47/566688247.db2.gz KBPFRZPPRXVWRJ-INIZCTEOSA-N 0 3 383.330 3.033 10 0 GGAEHN O[C@H](COc1ccc(F)c(Br)c1)CN1CCc2ccccc2C1 ZINC000561263421 566690285 /nfs/dbraw/zinc/69/02/85/566690285.db2.gz VEPMEUAVPPCNOG-HNNXBMFYSA-N 0 3 380.257 3.386 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2c(C)cccc2Br)CC1 ZINC000515102324 566692615 /nfs/dbraw/zinc/69/26/15/566692615.db2.gz WOFPJRSLYRFZDX-UHFFFAOYSA-N 0 3 390.281 3.124 10 0 GGAEHN CC[C@H]1CN(Cc2c(Br)cnn2C)CCN1Cc1ccccc1 ZINC000426163168 566696319 /nfs/dbraw/zinc/69/63/19/566696319.db2.gz RNGZXRFZTNNUJS-INIZCTEOSA-N 0 3 377.330 3.279 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)NCCN1CCCC[C@H]1C ZINC000487940280 566697177 /nfs/dbraw/zinc/69/71/77/566697177.db2.gz CWUDLFPUWFXPNY-CYBMUJFWSA-N 0 3 384.318 3.131 10 0 GGAEHN O=C(NCCNc1ccncc1)c1ccc(Br)c(C(F)(F)F)c1 ZINC000426195599 566698915 /nfs/dbraw/zinc/69/89/15/566698915.db2.gz VDPRPQMQFDGRBI-UHFFFAOYSA-N 0 3 388.187 3.127 10 0 GGAEHN C[C@H](NCc1ccc(S(=O)(=O)N2CCCC2)o1)C1CCC(F)(F)CC1 ZINC000653868641 566699333 /nfs/dbraw/zinc/69/93/33/566699333.db2.gz DWIVQAGKOOIVAB-ZDUSSCGKSA-N 0 3 376.469 3.368 10 0 GGAEHN CC[C@H](NCCS(=O)(=O)c1cccc(Br)c1)[C@@H]1CCCCO1 ZINC000653877336 566700655 /nfs/dbraw/zinc/70/06/55/566700655.db2.gz NJQJNARPFABINE-HOTGVXAUSA-N 0 3 390.343 3.160 10 0 GGAEHN Cc1cc(Br)cc(C)c1N1CCC[C@H](N[C@H](C)[C@H](C)CO)C1=O ZINC000450737398 566700774 /nfs/dbraw/zinc/70/07/74/566700774.db2.gz JAEKHPIGBMOFQC-FMKPAKJESA-N 0 3 383.330 3.168 10 0 GGAEHN CC[C@H](NCC(=O)N(C)Cc1ccccc1Br)[C@H]1CCCCO1 ZINC000653881769 566700686 /nfs/dbraw/zinc/70/06/86/566700686.db2.gz QJKZQNIFIRZCIV-DLBZAZTESA-N 0 3 383.330 3.345 10 0 GGAEHN CN(C)CCN(Cc1ccsc1)C(=O)c1ccc(OCC(F)(F)F)o1 ZINC000653878953 566700806 /nfs/dbraw/zinc/70/08/06/566700806.db2.gz IHIIWVSTJARULM-UHFFFAOYSA-N 0 3 376.400 3.486 10 0 GGAEHN CC[C@H](NCC(=O)N(C)Cc1cc(Br)cs1)[C@H]1CCCCO1 ZINC000653876867 566701185 /nfs/dbraw/zinc/70/11/85/566701185.db2.gz JAAHMEZRKXIZFS-LSDHHAIUSA-N 0 3 389.359 3.406 10 0 GGAEHN CC[C@H](NCCS(=O)(=O)c1ccc(Br)cc1)[C@@H]1CCCCO1 ZINC000653881961 566701203 /nfs/dbraw/zinc/70/12/03/566701203.db2.gz WYZNXBMBOOUMDR-HOTGVXAUSA-N 0 3 390.343 3.160 10 0 GGAEHN O=C1NCC[C@H]1CCN1CCN(c2cc(Cl)c(Cl)c(Cl)c2)CC1 ZINC000653882595 566701495 /nfs/dbraw/zinc/70/14/95/566701495.db2.gz MHDFVYLLIAZETN-NSHDSACASA-N 0 3 376.715 3.295 10 0 GGAEHN Cc1nc2ccc(Br)cc2c(N(C)C[C@@H]2CCS(=O)(=O)C2)c1C ZINC000608086722 566702167 /nfs/dbraw/zinc/70/21/67/566702167.db2.gz BBZFPCSCCHCJFO-ZDUSSCGKSA-N 0 3 397.338 3.485 10 0 GGAEHN CC[C@H](CO)N1CCN(c2cc(C)nc3c(F)cc(Br)cc23)CC1 ZINC000608093566 566702659 /nfs/dbraw/zinc/70/26/59/566702659.db2.gz MKSUOCYKRAQRHX-CQSZACIVSA-N 0 3 396.304 3.338 10 0 GGAEHN COC[C@@H](C)CNCc1cc(Cl)c(I)cc1OC ZINC000515267906 566702904 /nfs/dbraw/zinc/70/29/04/566702904.db2.gz RDLUJABXHIZAFK-VIFPVBQESA-N 0 3 383.657 3.325 10 0 GGAEHN CN(Cc1ccccc1)C1CN(c2cc(Br)cc(F)c2C(N)=O)C1 ZINC000561416323 566702839 /nfs/dbraw/zinc/70/28/39/566702839.db2.gz DSCNWSYBZDLRKF-UHFFFAOYSA-N 0 3 392.272 3.008 10 0 GGAEHN Cc1cc(S(=O)(=O)NCCN[C@@H]2C[C@@H](c3ccccc3)[C@H]2C)c(C)s1 ZINC000541239708 566706083 /nfs/dbraw/zinc/70/60/83/566706083.db2.gz NWFNDTMLFLVFAI-ZTFGCOKTSA-N 0 3 378.563 3.425 10 0 GGAEHN C[NH+](C)C1(C[N-]S(=O)(=O)c2cccnc2C(F)(F)F)CCCCCC1 ZINC000561477970 566708807 /nfs/dbraw/zinc/70/88/07/566708807.db2.gz SOMUNBYAQCGRJM-UHFFFAOYSA-N 0 3 379.448 3.033 10 0 GGAEHN CS[C@@H]1CN(C(=O)Cc2sccc2Br)C[C@H]1N1CCCC1 ZINC000450837335 566709924 /nfs/dbraw/zinc/70/99/24/566709924.db2.gz CDTWMYQTBMTFMU-TZMCWYRMSA-N 0 3 389.384 3.091 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNS(=O)(=O)Cc1ccccc1Br ZINC000561505454 566710598 /nfs/dbraw/zinc/71/05/98/566710598.db2.gz VZJHXPOXJNIVQY-ZIAGYGMSSA-N 0 3 389.359 3.131 10 0 GGAEHN O=C(CCNC[C@@H](O)COc1c(Cl)cccc1Cl)N1CCCCCC1 ZINC000515415963 566711692 /nfs/dbraw/zinc/71/16/92/566711692.db2.gz ZUDRPWHGSCDBMK-CQSZACIVSA-N 0 3 389.323 3.115 10 0 GGAEHN C[C@@H](c1ccccc1)[C@@H](O)CN(CCO)Cc1cc(Br)cs1 ZINC000450846417 566712051 /nfs/dbraw/zinc/71/20/51/566712051.db2.gz MPTOPNSCAALBFK-GUYCJALGSA-N 0 3 384.339 3.470 10 0 GGAEHN C[C@H](c1ccccc1)[C@@H](O)CN(CCO)Cc1cc(Br)cs1 ZINC000450846416 566712162 /nfs/dbraw/zinc/71/21/62/566712162.db2.gz MPTOPNSCAALBFK-DYVFJYSZSA-N 0 3 384.339 3.470 10 0 GGAEHN O=C(Nc1cnc2c(Br)cccn12)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000654084444 566714973 /nfs/dbraw/zinc/71/49/73/566714973.db2.gz SNYCUTABIPPAGO-ZIAGYGMSSA-N 0 3 392.301 3.235 10 0 GGAEHN CO[C@@H](CCNCc1c(Cl)cccc1N1CCN(C)CC1)C(F)(F)F ZINC000468616306 566715732 /nfs/dbraw/zinc/71/57/32/566715732.db2.gz XTYUPWMAWPHZTO-INIZCTEOSA-N 0 3 379.854 3.149 10 0 GGAEHN COCCN1CC[C@@H](NCc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000676902236 566715754 /nfs/dbraw/zinc/71/57/54/566715754.db2.gz NPFQRVHYWYNQAJ-OAHLLOKOSA-N 0 3 396.354 3.383 10 0 GGAEHN C[C@H]1[C@H](N2CCCC2)CCN1S(=O)(=O)Cc1ccc(Cl)cc1Cl ZINC000561552176 566718010 /nfs/dbraw/zinc/71/80/10/566718010.db2.gz GMPQMAGSTSNCRP-BLLLJJGKSA-N 0 3 377.337 3.382 10 0 GGAEHN C[C@@H]1[C@H](N2CCCC2)CCN1S(=O)(=O)Cc1ccc(Cl)cc1Cl ZINC000561552178 566718123 /nfs/dbraw/zinc/71/81/23/566718123.db2.gz GMPQMAGSTSNCRP-MLGOLLRUSA-N 0 3 377.337 3.382 10 0 GGAEHN C[C@H]1[C@@H](N2CCCC2)CCN1S(=O)(=O)Cc1ccc(Cl)cc1Cl ZINC000561552177 566718141 /nfs/dbraw/zinc/71/81/41/566718141.db2.gz GMPQMAGSTSNCRP-LRDDRELGSA-N 0 3 377.337 3.382 10 0 GGAEHN COC(=O)C1(CN[C@@H](CO)c2ccc(Br)cc2C(F)(F)F)CC1 ZINC000450901084 566718887 /nfs/dbraw/zinc/71/88/87/566718887.db2.gz VOJVYOCGILUBGP-LBPRGKRZSA-N 0 3 396.203 3.044 10 0 GGAEHN COc1cc(Br)ccc1CN1CCN(C2CCOCC2)C[C@H]1C ZINC000426568988 566719092 /nfs/dbraw/zinc/71/90/92/566719092.db2.gz VRCDMSHVXFNMFG-CQSZACIVSA-N 0 3 383.330 3.143 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000468745912 566725111 /nfs/dbraw/zinc/72/51/11/566725111.db2.gz WNUOSGDGTZRIQT-OLZOCXBDSA-N 0 3 396.329 3.468 10 0 GGAEHN Cc1csc(CCNC(=O)NC[C@H]2CCCN(C)[C@@H]2c2cccs2)n1 ZINC000608638881 566727058 /nfs/dbraw/zinc/72/70/58/566727058.db2.gz HLEFUJRQLYRWBC-PBHICJAKSA-N 0 3 378.567 3.438 10 0 GGAEHN CC(C)[C@@H]1C[C@H](NCc2ccccc2CS(=O)(=O)N2CCCC2)CS1 ZINC000488432134 566727256 /nfs/dbraw/zinc/72/72/56/566727256.db2.gz GPVDLIGEPGQYIO-OALUTQOASA-N 0 3 382.595 3.232 10 0 GGAEHN O=C(Cc1c(F)ccc(Br)c1F)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000654315860 566727251 /nfs/dbraw/zinc/72/72/51/566727251.db2.gz XCBSQGLPXWFRPK-HUUCEWRRSA-N 0 3 387.268 3.403 10 0 GGAEHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)N[C@H]1[C@@H]2CCC[C@@H]21 ZINC000426756936 566727751 /nfs/dbraw/zinc/72/77/51/566727751.db2.gz AZNUPMUDKJBDAH-FVQHAEBGSA-N 0 3 380.330 3.321 10 0 GGAEHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)[C@H]1CCOc2ccc(Br)cc21 ZINC000654314675 566727991 /nfs/dbraw/zinc/72/79/91/566727991.db2.gz OLZMMRZGMXRTBP-USXIJHARSA-N 0 3 393.325 3.448 10 0 GGAEHN O=C(NCCCc1cccc(Br)c1)N1CC[C@H](N2CC=CC2)C1 ZINC000608675918 566728650 /nfs/dbraw/zinc/72/86/50/566728650.db2.gz XZCWGYYPFOXWLH-KRWDZBQOSA-N 0 3 378.314 3.037 10 0 GGAEHN Cc1c(Br)ccc(C(=O)N(CCN(C)C)C[C@H]2CCCO2)c1F ZINC000468778239 566728733 /nfs/dbraw/zinc/72/87/33/566728733.db2.gz BGAPGIPFJPWBSU-CYBMUJFWSA-N 0 3 387.293 3.079 10 0 GGAEHN C[C@H](c1ccccc1)[C@@H](O)CN[C@@](C)(CO)c1ccc(Br)cc1 ZINC000450977979 566728774 /nfs/dbraw/zinc/72/87/74/566728774.db2.gz CJZOVAOXRVBOEJ-CCKFTAQKSA-N 0 3 378.310 3.411 10 0 GGAEHN C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NCc1ccc(S(C)(=O)=O)s1 ZINC000468786021 566730027 /nfs/dbraw/zinc/73/00/27/566730027.db2.gz BGDAXTMLVKLNQP-CRAIPNDOSA-N 0 3 378.563 3.152 10 0 GGAEHN Cc1c([C@H](C)NCC[C@H]2CCOC2)nnn1-c1cccc(Br)c1 ZINC000541559157 566733467 /nfs/dbraw/zinc/73/34/67/566733467.db2.gz WGRPFNHTVFLLEM-JSGCOSHPSA-N 0 3 379.302 3.415 10 0 GGAEHN CCCN1CCC[C@@H]1C(=O)NCCc1c[nH]c2cccc(Br)c12 ZINC000426843584 566734339 /nfs/dbraw/zinc/73/43/39/566734339.db2.gz RCZKGFMQBBDJGO-MRXNPFEDSA-N 0 3 378.314 3.464 10 0 GGAEHN CO[C@H](CCN[C@@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1)C(F)(F)F ZINC000468840449 566735628 /nfs/dbraw/zinc/73/56/28/566735628.db2.gz DBZQCVHEWCVIHC-OAGGEKHMSA-N 0 3 380.838 3.269 10 0 GGAEHN CO[C@H](CCN[C@@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1)C(F)(F)F ZINC000468840702 566736009 /nfs/dbraw/zinc/73/60/09/566736009.db2.gz DBZQCVHEWCVIHC-XHSDSOJGSA-N 0 3 380.838 3.269 10 0 GGAEHN CN(C(=O)N[C@H]1CSc2ccc(Br)cc21)[C@H]1CCN(C2CC2)C1 ZINC000426857235 566736192 /nfs/dbraw/zinc/73/61/92/566736192.db2.gz GQJHFVVCKIQJKZ-ZFWWWQNUSA-N 0 3 396.354 3.474 10 0 GGAEHN O=C(COc1ccc(Cl)c(Br)c1)NC1CCN(C2CC2)CC1 ZINC000451012502 566736178 /nfs/dbraw/zinc/73/61/78/566736178.db2.gz XBNJKRBZIGZZJE-UHFFFAOYSA-N 0 3 387.705 3.224 10 0 GGAEHN C[C@H](NC(=O)N1CCOc2cccc(Br)c2C1)C1=CCN(C)CC1 ZINC000654524316 566738344 /nfs/dbraw/zinc/73/83/44/566738344.db2.gz XTHXTLJODLLNGT-ZDUSSCGKSA-N 0 3 394.313 3.004 10 0 GGAEHN O=C([C@H]1[C@@H]2c3ccc(Br)cc3C[C@H]12)N1CCN(c2ccncc2)CC1 ZINC000630567513 566742963 /nfs/dbraw/zinc/74/29/63/566742963.db2.gz NOOJWJGPTGCFKJ-IPMKNSEASA-N 0 3 398.304 3.079 10 0 GGAEHN COCCCN1CCC(NC(=O)[C@@H]2CCc3cc(Br)ccc32)CC1 ZINC000581014511 566743196 /nfs/dbraw/zinc/74/31/96/566743196.db2.gz NEDOOOBMUBHFNV-GOSISDBHSA-N 0 3 395.341 3.096 10 0 GGAEHN C[C@@H]1CCN(CC(=O)N2CCc3[nH]c4c(cccc4Br)c3C2)C1 ZINC000654592241 566745256 /nfs/dbraw/zinc/74/52/56/566745256.db2.gz KATKHLRLHBDABE-GFCCVEGCSA-N 0 3 376.298 3.157 10 0 GGAEHN NC(=O)[C@@H](Cc1ccc(Cl)cc1)NCCc1ccccc1Br ZINC000581043669 566745605 /nfs/dbraw/zinc/74/56/05/566745605.db2.gz VROKGDXSPWVMFH-MRXNPFEDSA-N 0 3 381.701 3.331 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)c1ccc(Cl)c(I)c1 ZINC000609030500 566747765 /nfs/dbraw/zinc/74/77/65/566747765.db2.gz SWJQUWQRYIDPFW-LLVKDONJSA-N 0 3 392.668 3.111 10 0 GGAEHN Cc1ccc(C(=O)NCCN2CCC[C@@H](C)C2)cc1I ZINC000609070564 566749033 /nfs/dbraw/zinc/74/90/33/566749033.db2.gz CFFIESYXKHCMFC-GFCCVEGCSA-N 0 3 386.277 3.061 10 0 GGAEHN CC1(C)CN(CCC(=O)Nc2cccc(Br)c2)C[C@@]2(CCOC2)O1 ZINC000581106896 566749108 /nfs/dbraw/zinc/74/91/08/566749108.db2.gz SIBBOBMWZJMQRA-GOSISDBHSA-N 0 3 397.313 3.048 10 0 GGAEHN CCN1CCCN(C(=O)N[C@H](C)c2ccc(Br)cc2OC)CC1 ZINC000469006096 566751609 /nfs/dbraw/zinc/75/16/09/566751609.db2.gz OQMMCKSETFDAOI-CYBMUJFWSA-N 0 3 384.318 3.256 10 0 GGAEHN Cc1ccc(Br)c(C(=O)N2CC[C@@H](OCCN3CCCCC3)C2)c1 ZINC000427157863 566751919 /nfs/dbraw/zinc/75/19/19/566751919.db2.gz NSEBEKJBICHRGX-MRXNPFEDSA-N 0 3 395.341 3.475 10 0 GGAEHN COc1ccc(NC(=O)CCN2CC[C@@H](n3cc(Cl)cn3)C2)cc1Cl ZINC000516217163 566753258 /nfs/dbraw/zinc/75/32/58/566753258.db2.gz AKVJDIFSRWVJTG-CQSZACIVSA-N 0 3 383.279 3.474 10 0 GGAEHN CN1CCC[C@H](NC(=O)NCCc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000677562657 566753317 /nfs/dbraw/zinc/75/33/17/566753317.db2.gz IWVZXUKEMYZHOZ-HNNXBMFYSA-N 0 3 378.929 3.399 10 0 GGAEHN COc1ccc(NC(=O)CCN2CC[C@H](n3cc(Cl)cn3)C2)cc1Cl ZINC000516217162 566753849 /nfs/dbraw/zinc/75/38/49/566753849.db2.gz AKVJDIFSRWVJTG-AWEZNQCLSA-N 0 3 383.279 3.474 10 0 GGAEHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)Cc1csc(CCC(F)(F)F)n1 ZINC000630811185 566753895 /nfs/dbraw/zinc/75/38/95/566753895.db2.gz MHVWUYLTVLWCMG-CHWSQXEVSA-N 0 3 377.476 3.417 10 0 GGAEHN CN(Cc1cc(Br)ccc1F)C(=O)CCN(C)c1ccncc1 ZINC000541856231 566756341 /nfs/dbraw/zinc/75/63/41/566756341.db2.gz XNGQNOPDNMSMTE-UHFFFAOYSA-N 0 3 380.261 3.468 10 0 GGAEHN C[C@H](CNC(=O)CCN(C)c1ccncc1)Oc1cccc(Br)c1 ZINC000541855292 566756369 /nfs/dbraw/zinc/75/63/69/566756369.db2.gz SMBWTJLTKMNGEW-CQSZACIVSA-N 0 3 392.297 3.254 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000469047644 566756328 /nfs/dbraw/zinc/75/63/28/566756328.db2.gz RENISFGLGJQLQB-WFASDCNBSA-N 0 3 396.329 3.397 10 0 GGAEHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)[C@@H]1CCC(C)(C)O1 ZINC000469041079 566756593 /nfs/dbraw/zinc/75/65/93/566756593.db2.gz UBRGFYQNHDEVJZ-INIZCTEOSA-N 0 3 383.330 3.297 10 0 GGAEHN CCN1CCC(N(C)C(=O)[C@@H]2[C@@H]3Cc4cc(Br)ccc4[C@@H]32)CC1 ZINC000630896057 566761706 /nfs/dbraw/zinc/76/17/06/566761706.db2.gz ADFXTGXMDWIINO-FGTMMUONSA-N 0 3 377.326 3.278 10 0 GGAEHN Cc1cc(C)cc(OC[C@@H](O)CN[C@H](CO)c2cccc(Br)c2)c1 ZINC000541981261 566765762 /nfs/dbraw/zinc/76/57/62/566765762.db2.gz OVDRHSXFGXGCBO-PKOBYXMFSA-N 0 3 394.309 3.129 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@H]1CCN(C)[C@H](C)C1 ZINC000469189198 566768837 /nfs/dbraw/zinc/76/88/37/566768837.db2.gz ZQNVNRARPZVDGN-DYEKYZERSA-N 0 3 384.318 3.301 10 0 GGAEHN CN(C(=O)CSCc1ccc(Br)cc1)[C@@H]1CCN(C2CC2)C1 ZINC000609509000 566768972 /nfs/dbraw/zinc/76/89/72/566768972.db2.gz DGCZBCJXCIKBJE-MRXNPFEDSA-N 0 3 383.355 3.377 10 0 GGAEHN CNC(=O)[C@@H](NCc1cc(Br)cc(Br)c1)C(C)C ZINC000581392037 566773331 /nfs/dbraw/zinc/77/33/31/566773331.db2.gz FQIRNIQWZZGQNS-LBPRGKRZSA-N 0 3 378.108 3.072 10 0 GGAEHN CC(C)(CNCc1cn(C[C@@H]2CCOC2)nn1)c1ccc(Br)cc1 ZINC000631043463 566774072 /nfs/dbraw/zinc/77/40/72/566774072.db2.gz XIQJOTCAXAXXQO-AWEZNQCLSA-N 0 3 393.329 3.145 10 0 GGAEHN C[C@@H](CCc1ccc(Br)cc1)NCc1cn(C[C@H]2CCOC2)nn1 ZINC000631049555 566774397 /nfs/dbraw/zinc/77/43/97/566774397.db2.gz JKGMOSTUJWWZCZ-GOEBONIOSA-N 0 3 393.329 3.188 10 0 GGAEHN C[C@@H](CCc1ccc(Br)cc1)NCc1cn(C[C@@H]2CCOC2)nn1 ZINC000631049556 566774738 /nfs/dbraw/zinc/77/47/38/566774738.db2.gz JKGMOSTUJWWZCZ-HOCLYGCPSA-N 0 3 393.329 3.188 10 0 GGAEHN COc1cc(Br)ccc1CCC(=O)NCCN1CCCC[C@H]1C ZINC000542098714 566775364 /nfs/dbraw/zinc/77/53/64/566775364.db2.gz MVRWWMMOTIYSKY-CQSZACIVSA-N 0 3 383.330 3.381 10 0 GGAEHN COC1CCN(C(C)(C)CNCc2ncc(Br)cc2Cl)CC1 ZINC000631069585 566776016 /nfs/dbraw/zinc/77/60/16/566776016.db2.gz VYYUIFUCIQSSCV-UHFFFAOYSA-N 0 3 390.753 3.477 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)N[C@H](C)c1ccc(Br)cc1OC ZINC000469265222 566776637 /nfs/dbraw/zinc/77/66/37/566776637.db2.gz CPFMDFRUDALWQV-OCCSQVGLSA-N 0 3 384.318 3.302 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)N[C@@H](C)c1ccc(Br)cc1OC ZINC000469265211 566776785 /nfs/dbraw/zinc/77/67/85/566776785.db2.gz CPFMDFRUDALWQV-JSGCOSHPSA-N 0 3 384.318 3.302 10 0 GGAEHN O[C@H](CNCc1ccc(C(F)F)nc1)COc1ccccc1Br ZINC000631092373 566778082 /nfs/dbraw/zinc/77/80/82/566778082.db2.gz XOXHSXYTVDOHQF-GFCCVEGCSA-N 0 3 387.224 3.311 10 0 GGAEHN Cc1nc2ccc(S(=O)(=O)N(C)CCN(C)C3CCCCC3)cc2s1 ZINC000489265004 566779104 /nfs/dbraw/zinc/77/91/04/566779104.db2.gz YJYDONNRGXPOHD-UHFFFAOYSA-N 0 3 381.567 3.490 10 0 GGAEHN COC(=O)[C@@H]1CCCCC[C@@H]1NCC(=O)Nc1ccc(Br)cc1C ZINC000451229708 566779646 /nfs/dbraw/zinc/77/96/46/566779646.db2.gz NDAXJPJLYAVSIR-ZBFHGGJFSA-N 0 3 397.313 3.408 10 0 GGAEHN CC(C)OCC[C@@H](O)CNCc1ccc(I)cc1Cl ZINC000581484323 566781135 /nfs/dbraw/zinc/78/11/35/566781135.db2.gz CWPFRKDZKNELNV-CYBMUJFWSA-N 0 3 397.684 3.210 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cccc3c(Cl)ccnc32)[C@@H](C)C1 ZINC000451245777 566781849 /nfs/dbraw/zinc/78/18/49/566781849.db2.gz UGCRGRVKKSZHGI-BBRMVZONSA-N 0 3 381.929 3.239 10 0 GGAEHN CC(C)OCC[C@H](O)CNCc1ccc(I)cc1Cl ZINC000581484324 566781962 /nfs/dbraw/zinc/78/19/62/566781962.db2.gz CWPFRKDZKNELNV-ZDUSSCGKSA-N 0 3 397.684 3.210 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cccc3c(Cl)ccnc32)[C@H](C)C1 ZINC000451245779 566782215 /nfs/dbraw/zinc/78/22/15/566782215.db2.gz UGCRGRVKKSZHGI-CZUORRHYSA-N 0 3 381.929 3.239 10 0 GGAEHN CC[C@H]1[C@@H](CO)CCN1Cc1ccnc(-c2ccc(Br)cc2)n1 ZINC000451247836 566783067 /nfs/dbraw/zinc/78/30/67/566783067.db2.gz AJPKGJRRTYHODB-PBHICJAKSA-N 0 3 376.298 3.499 10 0 GGAEHN C[NH+](C)[C@H]1CCC[C@@H]([N-]S(=O)(=O)c2cccc(Br)c2Cl)C1 ZINC000516792250 566783272 /nfs/dbraw/zinc/78/32/72/566783272.db2.gz QQPZTBYNDWEONU-MNOVXSKESA-N 0 3 395.750 3.254 10 0 GGAEHN Cc1ccc(CC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)c(Br)c1 ZINC000451250311 566783935 /nfs/dbraw/zinc/78/39/35/566783935.db2.gz WMUZZMIDNIBVLA-HNNXBMFYSA-N 0 3 395.341 3.012 10 0 GGAEHN C[NH+](C)[C@@H]1CCC[C@H]([N-]S(=O)(=O)c2cccc(Br)c2Cl)C1 ZINC000516792252 566783816 /nfs/dbraw/zinc/78/38/16/566783816.db2.gz QQPZTBYNDWEONU-WDEREUQCSA-N 0 3 395.750 3.254 10 0 GGAEHN CN1CCC[C@@H](CNc2c(F)cccc2S(N)(=O)=O)[C@@H]1c1cccs1 ZINC000631128472 566783860 /nfs/dbraw/zinc/78/38/60/566783860.db2.gz MSTSBIISFGDVEY-YVEFUNNKSA-N 0 3 383.514 3.030 10 0 GGAEHN Cc1nc2ccc(CNCCN(C)S(=O)(=O)c3cccs3)cc2s1 ZINC000562361770 566784485 /nfs/dbraw/zinc/78/44/85/566784485.db2.gz BXISDJLLTAPLGX-UHFFFAOYSA-N 0 3 381.548 3.077 10 0 GGAEHN Cc1ccsc1CNC(=O)CN[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000581517555 566784629 /nfs/dbraw/zinc/78/46/29/566784629.db2.gz LDJOREOAYHXXCY-QFBILLFUSA-N 0 3 377.941 3.361 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N(C)CCN1CCCC1 ZINC000469357034 566784884 /nfs/dbraw/zinc/78/48/84/566784884.db2.gz SHLOJYXYGIESRQ-ZDUSSCGKSA-N 0 3 384.318 3.256 10 0 GGAEHN Cc1ccsc1CNC(=O)CN[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000581517553 566785088 /nfs/dbraw/zinc/78/50/88/566785088.db2.gz LDJOREOAYHXXCY-APWZRJJASA-N 0 3 377.941 3.361 10 0 GGAEHN O=C(Cc1csc(CCC(F)(F)F)n1)N1CC[C@H](N2CCCCC2)C1 ZINC000631149670 566785993 /nfs/dbraw/zinc/78/59/93/566785993.db2.gz NQLVQKLKZWPBPZ-AWEZNQCLSA-N 0 3 375.460 3.267 10 0 GGAEHN O=c1cc(CN2CCC(c3cccnc3)CC2)nc2ccc(Br)cn12 ZINC000678170808 566786346 /nfs/dbraw/zinc/78/63/46/566786346.db2.gz UPBLUKXILXSOFX-UHFFFAOYSA-N 0 3 399.292 3.232 10 0 GGAEHN CS(=O)(=O)CC1(CCNCc2cccc(Br)c2Cl)CC1 ZINC000631173136 566787793 /nfs/dbraw/zinc/78/77/93/566787793.db2.gz VIOZWVOGURTQDX-UHFFFAOYSA-N 0 3 380.735 3.407 10 0 GGAEHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)C(=O)Nc1cc(Cl)c(Cl)c(Cl)c1 ZINC000581552844 566788255 /nfs/dbraw/zinc/78/82/55/566788255.db2.gz QRJMTNAPKJLWSW-NOZJJQNGSA-N 0 3 392.714 3.384 10 0 GGAEHN Brc1cccc2c1C[C@@H]1[C@@H](NCc3cnc(N4CCCC4)nc3)[C@H]21 ZINC000631194981 566789270 /nfs/dbraw/zinc/78/92/70/566789270.db2.gz YHIKEYVBCKENGX-CGTJXYLNSA-N 0 3 385.309 3.267 10 0 GGAEHN C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(Br)c2c1OCCC2 ZINC000469437811 566790570 /nfs/dbraw/zinc/79/05/70/566790570.db2.gz CQUVLUVRIRUTIZ-CHWSQXEVSA-N 0 3 379.298 3.083 10 0 GGAEHN CCN(CC)CCN(CCC(F)(F)F)S(=O)(=O)C[C@H]1CCCC1(F)F ZINC000451304667 566791836 /nfs/dbraw/zinc/79/18/36/566791836.db2.gz PCJWVPBPNUIVAF-CYBMUJFWSA-N 0 3 394.450 3.348 10 0 GGAEHN COc1cc(CNCC[C@@H](O)C(F)F)cc(Br)c1OC(F)F ZINC000631215925 566792627 /nfs/dbraw/zinc/79/26/27/566792627.db2.gz CGVOYLGQKLSJMD-SECBINFHSA-N 0 3 390.171 3.165 10 0 GGAEHN CCN(CC)CCN(C(=O)C[C@H]1CCCO1)c1ccc(Br)cn1 ZINC000562451199 566792817 /nfs/dbraw/zinc/79/28/17/566792817.db2.gz BSCIQFZVMWBIKN-OAHLLOKOSA-N 0 3 384.318 3.088 10 0 GGAEHN CN1CCC(n2cc(NCc3cc4c(c(Br)c3)OCO4)cn2)CC1 ZINC000631227489 566792769 /nfs/dbraw/zinc/79/27/69/566792769.db2.gz XZFWHLJRIQMNGW-UHFFFAOYSA-N 0 3 393.285 3.253 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)N1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000581657172 566795955 /nfs/dbraw/zinc/79/59/55/566795955.db2.gz JEPPARNQRDCUMU-KGLIPLIRSA-N 0 3 394.249 3.074 10 0 GGAEHN O[C@H](COC[C@H]1CCCO1)CN1CCC(c2cccc(Br)c2)CC1 ZINC000562498939 566796214 /nfs/dbraw/zinc/79/62/14/566796214.db2.gz GYCOYSDBZYNHRD-RBUKOAKNSA-N 0 3 398.341 3.185 10 0 GGAEHN CC(C)N1C[C@H](NC(=O)c2ccc(Br)c3c2OCCC3)[C@@H](C)C1 ZINC000469599945 566802649 /nfs/dbraw/zinc/80/26/49/566802649.db2.gz BPNSDEFMYLNMPF-LRDDRELGSA-N 0 3 381.314 3.233 10 0 GGAEHN Cc1cc(C(C)(C)NCCn2nc3ccccn3c2=O)ccc1Br ZINC000581754795 566805304 /nfs/dbraw/zinc/80/53/04/566805304.db2.gz FXWGVCNLXWKSSF-UHFFFAOYSA-N 0 3 389.297 3.092 10 0 GGAEHN N[C@H](CC(=O)N1CCOc2cccc(Br)c2C1)c1ccccc1 ZINC000655503476 566805459 /nfs/dbraw/zinc/80/54/59/566805459.db2.gz GZURHIHVUUOZJU-MRXNPFEDSA-N 0 3 375.266 3.260 10 0 GGAEHN O=C([C@@H]1CNCc2ccccc21)N1CCOc2cccc(Br)c2C1 ZINC000655502910 566805502 /nfs/dbraw/zinc/80/55/02/566805502.db2.gz CMSPTNIKWLTVDB-OAHLLOKOSA-N 0 3 387.277 3.057 10 0 GGAEHN CCN(CC)[C@H](C)CNS(=O)(=O)c1ccc(Cl)cc1Br ZINC000542487231 566805625 /nfs/dbraw/zinc/80/56/25/566805625.db2.gz YWVDDJBCJHFEJQ-SNVBAGLBSA-N 0 3 383.739 3.111 10 0 GGAEHN COc1ccc(Cl)cc1[C@@H](CC(C)C)NCCCN1CCCS1(=O)=O ZINC000678582264 566805955 /nfs/dbraw/zinc/80/59/55/566805955.db2.gz HYYKFHBVJSIXAT-QGZVFWFLSA-N 0 3 388.961 3.451 10 0 GGAEHN O=S1(=O)CCCN1CCCN[C@@H]1CCCOc2c(Cl)c(Cl)ccc21 ZINC000678582216 566806018 /nfs/dbraw/zinc/80/60/18/566806018.db2.gz HDRXGBHLJPUTRU-CQSZACIVSA-N 0 3 393.336 3.222 10 0 GGAEHN C[C@H](NCCCN1CCCS1(=O)=O)c1cc(Cl)ccc1OC(F)F ZINC000678582212 566806154 /nfs/dbraw/zinc/80/61/54/566806154.db2.gz HCCPYVHOGJDAKV-NSHDSACASA-N 0 3 382.860 3.018 10 0 GGAEHN NC[C@H](NC(=O)CCCCOc1ccc(Br)cc1)C(F)(F)F ZINC000655512160 566806187 /nfs/dbraw/zinc/80/61/87/566806187.db2.gz SAFPCEQCATVBGI-LBPRGKRZSA-N 0 3 383.208 3.004 10 0 GGAEHN CCC1(N(C)C)CCN(c2c(Br)cccc2S(C)(=O)=O)CC1 ZINC000631477735 566806237 /nfs/dbraw/zinc/80/62/37/566806237.db2.gz PUSPHYICWOWLJF-UHFFFAOYSA-N 0 3 389.359 3.163 10 0 GGAEHN Cc1cc(SCC(=O)N[C@@H](CN)C(F)(F)F)c(C)cc1Br ZINC000655504560 566806389 /nfs/dbraw/zinc/80/63/89/566806389.db2.gz FILHMUYIADDRTI-NSHDSACASA-N 0 3 385.249 3.164 10 0 GGAEHN NC[C@@H](NC(=O)CCCCOc1ccc(Br)cc1)C(F)(F)F ZINC000655512159 566806705 /nfs/dbraw/zinc/80/67/05/566806705.db2.gz SAFPCEQCATVBGI-GFCCVEGCSA-N 0 3 383.208 3.004 10 0 GGAEHN COc1cc(C(=O)N[C@@H](CN)C(F)(F)F)cc(Cl)c1OCCC(C)C ZINC000655506495 566806757 /nfs/dbraw/zinc/80/67/57/566806757.db2.gz AGMGYSJGGFVIMX-ZDUSSCGKSA-N 0 3 382.810 3.393 10 0 GGAEHN NC[C@@H](NC(=O)CCc1nc2cc(C(F)(F)F)ccc2s1)C(F)(F)F ZINC000655511837 566806911 /nfs/dbraw/zinc/80/69/11/566806911.db2.gz MHKHLHYIZMIHSL-SNVBAGLBSA-N 0 3 385.333 3.254 10 0 GGAEHN NC[C@@H](NC(=O)CCCSc1ccc(Br)cc1)C(F)(F)F ZINC000655511767 566807047 /nfs/dbraw/zinc/80/70/47/566807047.db2.gz KXOQWNBNHSVYDJ-LLVKDONJSA-N 0 3 385.249 3.327 10 0 GGAEHN NC[C@@H](NC(=O)c1cnc(-c2ccc(C(F)(F)F)cc2)s1)C(F)(F)F ZINC000655512361 566807202 /nfs/dbraw/zinc/80/72/02/566807202.db2.gz FCTWJEZKCNYAKE-SNVBAGLBSA-N 0 3 383.317 3.448 10 0 GGAEHN Cc1c(Br)cccc1CS(=O)(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000655524136 566808487 /nfs/dbraw/zinc/80/84/87/566808487.db2.gz UFNFOOYHIXGPAK-SWLSCSKDSA-N 0 3 389.359 3.002 10 0 GGAEHN Cc1c(Br)cccc1CS(=O)(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000655524137 566808814 /nfs/dbraw/zinc/80/88/14/566808814.db2.gz UFNFOOYHIXGPAK-WFASDCNBSA-N 0 3 389.359 3.002 10 0 GGAEHN COC(=O)c1ccc(C(=O)NC[C@H]2CCCN(C)[C@@H]2c2cccs2)s1 ZINC000610180618 566811735 /nfs/dbraw/zinc/81/17/35/566811735.db2.gz HRIWTCGPEOKXTE-WBMJQRKESA-N 0 3 378.519 3.409 10 0 GGAEHN COc1ccc([C@H](C)NC(=O)N2C[C@H]3CCC[C@@H](C2)N3)cc1Br ZINC000581873716 566812036 /nfs/dbraw/zinc/81/20/36/566812036.db2.gz YLDZJFJTFMPBJM-FPMFFAJLSA-N 0 3 382.302 3.055 10 0 GGAEHN Cc1c2cc(Br)cc(C)c2oc1C(=O)NCCOCCN(C)C ZINC000428045653 566812247 /nfs/dbraw/zinc/81/22/47/566812247.db2.gz BRMVEXQCEKUIOY-UHFFFAOYSA-N 0 3 383.286 3.120 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@@H]1CCO[C@H]1c1ccccc1 ZINC000631653529 566812713 /nfs/dbraw/zinc/81/27/13/566812713.db2.gz LFMYRSLITNZYMK-XCRHUMRWSA-N 0 3 377.282 3.119 10 0 GGAEHN COC(=O)c1ccc(C(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)s1 ZINC000610180617 566812624 /nfs/dbraw/zinc/81/26/24/566812624.db2.gz HRIWTCGPEOKXTE-LRDDRELGSA-N 0 3 378.519 3.409 10 0 GGAEHN CN1CCC[C@H](CNC(=O)c2ccc([S@](C)=O)cc2)[C@@H]1c1cccs1 ZINC000610200281 566815723 /nfs/dbraw/zinc/81/57/23/566815723.db2.gz WZCGYANDERJUIQ-JTJQLJSMSA-N 0 3 376.547 3.298 10 0 GGAEHN CN1CCC[C@H](CNC(=O)c2ccc([S@](C)=O)cc2)[C@H]1c1cccs1 ZINC000610200279 566815751 /nfs/dbraw/zinc/81/57/51/566815751.db2.gz WZCGYANDERJUIQ-DZQNVJDRSA-N 0 3 376.547 3.298 10 0 GGAEHN Cc1c(Br)cccc1CS(=O)(=O)N(C)CCCN1CCCC1 ZINC000655582854 566815872 /nfs/dbraw/zinc/81/58/72/566815872.db2.gz QVAAIZVLBYLGEH-UHFFFAOYSA-N 0 3 389.359 3.005 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)[NH2+]Cc1nnc(C2CCOCC2)[n-]1 ZINC000631693962 566816440 /nfs/dbraw/zinc/81/64/40/566816440.db2.gz OCQBRWUCDBADNP-LBPRGKRZSA-N 0 3 379.302 3.182 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NCc1nnc(C2CCOCC2)[nH]1 ZINC000631693962 566816445 /nfs/dbraw/zinc/81/64/45/566816445.db2.gz OCQBRWUCDBADNP-LBPRGKRZSA-N 0 3 379.302 3.182 10 0 GGAEHN COc1cc(C[NH2+][C@@H]2COc3ccc(F)cc3C2)cc(Br)c1[O-] ZINC000517259826 566816551 /nfs/dbraw/zinc/81/65/51/566816551.db2.gz RXWOGIDRTZWKPX-ZDUSSCGKSA-N 0 3 382.229 3.396 10 0 GGAEHN CN(C)Cc1ccc(NC(=O)[C@@H](CN)c2ccccc2)cc1Br ZINC000581942229 566816740 /nfs/dbraw/zinc/81/67/40/566816740.db2.gz FPDYLJHRQQUJEA-INIZCTEOSA-N 0 3 376.298 3.192 10 0 GGAEHN CS(=O)(=O)[C@H]1CCCC[C@@H]1N[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]12 ZINC000631702465 566818419 /nfs/dbraw/zinc/81/84/19/566818419.db2.gz OPPUEFHNVDKMCN-SMLCLMEVSA-N 0 3 384.339 3.033 10 0 GGAEHN C[C@H](NCc1cc(Cl)cc2cccnc21)c1ccc(S(N)(=O)=O)cc1 ZINC000678805385 566818393 /nfs/dbraw/zinc/81/83/93/566818393.db2.gz MOFZJHDHVUDEPO-LBPRGKRZSA-N 0 3 375.881 3.386 10 0 GGAEHN C[C@@H](N[C@@H](C)Cn1cc(Br)ccc1=O)c1ccc2[nH]c(=O)oc2c1 ZINC000631736962 566822406 /nfs/dbraw/zinc/82/24/06/566822406.db2.gz CNKPVDCKPQJGMR-WDEREUQCSA-N 0 3 392.253 3.197 10 0 GGAEHN C[C@@H]1CC[C@H](C)N1[C@@H]1CCCN(S(=O)(=O)c2onc(C3CC3)c2Cl)C1 ZINC000631785163 566825864 /nfs/dbraw/zinc/82/58/64/566825864.db2.gz MFAPHMIUXZLUJK-MBNYWOFBSA-N 0 3 387.933 3.231 10 0 GGAEHN CN(CCC(=O)NCCc1ccc(F)c(Br)c1)c1ccncc1 ZINC000542784998 566826891 /nfs/dbraw/zinc/82/68/91/566826891.db2.gz LJBBRTOUVKYPGH-UHFFFAOYSA-N 0 3 380.261 3.168 10 0 GGAEHN COC(=O)c1cc(CNC(C)(C)COc2ncccc2Br)c(C)o1 ZINC000542783816 566827373 /nfs/dbraw/zinc/82/73/73/566827373.db2.gz LZAYMIGTOQMXFK-UHFFFAOYSA-N 0 3 397.269 3.479 10 0 GGAEHN COCCN(CCOc1ccc(Cl)cc1Br)[C@@H]1CCOC1 ZINC000490059023 566827600 /nfs/dbraw/zinc/82/76/00/566827600.db2.gz VNMZBRPUDGNRRH-CYBMUJFWSA-N 0 3 378.694 3.219 10 0 GGAEHN O=C(c1ccccc1Br)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000469925338 566828037 /nfs/dbraw/zinc/82/80/37/566828037.db2.gz RNLVGKRBWJOERJ-OAHLLOKOSA-N 0 3 381.314 3.166 10 0 GGAEHN O=C(c1ccccc1Br)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000469925337 566828059 /nfs/dbraw/zinc/82/80/59/566828059.db2.gz RNLVGKRBWJOERJ-HNNXBMFYSA-N 0 3 381.314 3.166 10 0 GGAEHN O=C(Cc1ccccc1Br)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000469932226 566828066 /nfs/dbraw/zinc/82/80/66/566828066.db2.gz FWOINOWGRLRIOR-QGZVFWFLSA-N 0 3 395.341 3.095 10 0 GGAEHN O=C(c1cc(F)cc(Br)c1)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000469932560 566829013 /nfs/dbraw/zinc/82/90/13/566829013.db2.gz KPJPTLVAWWSTBV-QGZVFWFLSA-N 0 3 399.304 3.305 10 0 GGAEHN C[C@H](CC(=O)Nc1cccc(Br)c1)N[C@H]1CCCn2nccc21 ZINC000631809528 566829326 /nfs/dbraw/zinc/82/93/26/566829326.db2.gz QHAFHCCMRFYLBB-DOMZBBRYSA-N 0 3 377.286 3.487 10 0 GGAEHN O=C([C@@H]1SCCc2sccc21)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000469943745 566829454 /nfs/dbraw/zinc/82/94/54/566829454.db2.gz ITOSTPUUVULWEZ-MAUKXSAKSA-N 0 3 380.579 3.182 10 0 GGAEHN C[C@@H](Cc1ccc(F)cc1Br)N[C@@H](C)C1(S(C)(=O)=O)CC1 ZINC000582144554 566834837 /nfs/dbraw/zinc/83/48/37/566834837.db2.gz QDNHDQBTNMOFGF-QWRGUYRKSA-N 0 3 378.307 3.075 10 0 GGAEHN CN(CC(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1)[C@@H]1CCSC1 ZINC000490182808 566835111 /nfs/dbraw/zinc/83/51/11/566835111.db2.gz RKKSQORXZSHEKP-CJNGLKHVSA-N 0 3 378.929 3.317 10 0 GGAEHN CCC(CC)(C[N-]S(=O)(=O)c1c[nH]c(=O)s1)[NH2+][C@@H](C)c1ccccc1 ZINC000631941204 566836072 /nfs/dbraw/zinc/83/60/72/566836072.db2.gz QPNYJXRQIPEUFN-ZDUSSCGKSA-N 0 3 383.539 3.037 10 0 GGAEHN CN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2csc(CCC(F)(F)F)n2)C1 ZINC000631951222 566837342 /nfs/dbraw/zinc/83/73/42/566837342.db2.gz ZOFVLYPPPKJCCL-TZMCWYRMSA-N 0 3 375.460 3.123 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CC[C@]2(CCN(C)C2)C1 ZINC000490223497 566837575 /nfs/dbraw/zinc/83/75/75/566837575.db2.gz OJNQNQBSAJNUQY-UGSOOPFHSA-N 0 3 396.329 3.256 10 0 GGAEHN C[C@H]1CC[C@H]([NH2+]CC[N-]S(=O)(=O)c2cccc(Cl)c2Cl)CS1 ZINC000655766272 566845418 /nfs/dbraw/zinc/84/54/18/566845418.db2.gz CCEOGSMKWVMVPP-QWRGUYRKSA-N 0 3 383.366 3.145 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NCCOc1ccccc1Cl ZINC000428447525 566845618 /nfs/dbraw/zinc/84/56/18/566845618.db2.gz MJUQXLTWXVYGJI-LBPRGKRZSA-N 0 3 385.689 3.321 10 0 GGAEHN Brc1cccc2c1OCC[C@@H]2NC1CCN([C@H]2CCOC2)CC1 ZINC000655763545 566845799 /nfs/dbraw/zinc/84/57/99/566845799.db2.gz PRSILKIXACWSJJ-YOEHRIQHSA-N 0 3 381.314 3.116 10 0 GGAEHN C[C@H]1CC[C@@H]([NH2+]CC[N-]S(=O)(=O)c2cccc(Cl)c2Cl)CS1 ZINC000655766273 566845909 /nfs/dbraw/zinc/84/59/09/566845909.db2.gz CCEOGSMKWVMVPP-WDEREUQCSA-N 0 3 383.366 3.145 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC1CCN([C@H]2CCOC2)CC1 ZINC000655757750 566845937 /nfs/dbraw/zinc/84/59/37/566845937.db2.gz KQIXVLNLYPWJCQ-CJNGLKHVSA-N 0 3 383.330 3.362 10 0 GGAEHN CCOc1cc(C)ccc1CN[C@H](C)Cn1cc(Br)ccc1=O ZINC000428484251 566847550 /nfs/dbraw/zinc/84/75/50/566847550.db2.gz LDVFGLSSUHQQNF-CQSZACIVSA-N 0 3 379.298 3.496 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@H]1CCO[C@@H](C)C1)c1ccc(Br)cn1 ZINC000517804250 566848942 /nfs/dbraw/zinc/84/89/42/566848942.db2.gz LDNCUWSUYLNIHN-GJZGRUSLSA-N 0 3 398.345 3.334 10 0 GGAEHN COCCN1CCC[C@@H]1CN[C@@H](c1ccc(Br)cc1)[C@@H]1CCCO1 ZINC000679336586 566849260 /nfs/dbraw/zinc/84/92/60/566849260.db2.gz AJVGPDLZGZBUMA-QYZOEREBSA-N 0 3 397.357 3.370 10 0 GGAEHN Cn1nnnc1CCN[C@@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000679351628 566851113 /nfs/dbraw/zinc/85/11/13/566851113.db2.gz MDGNANSWRMUPBI-QGZVFWFLSA-N 0 3 390.260 3.033 10 0 GGAEHN Cc1cc(S(=O)(=O)NCCNC2CC(c3ccc(F)cc3)C2)c(C)s1 ZINC000543073155 566851319 /nfs/dbraw/zinc/85/13/19/566851319.db2.gz SZWJFRBHJFZCIR-UHFFFAOYSA-N 0 3 382.526 3.318 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NC[C@H]1CCCCN1C1CC1 ZINC000470166478 566853705 /nfs/dbraw/zinc/85/37/05/566853705.db2.gz VMTHRFKVRVDAJF-MRXNPFEDSA-N 0 3 381.314 3.133 10 0 GGAEHN CN(CCC(=O)N1CCc2sc(Br)cc2C1)c1ccncc1 ZINC000679410193 566855499 /nfs/dbraw/zinc/85/54/99/566855499.db2.gz SLCWIQQVVYEJDY-UHFFFAOYSA-N 0 3 380.311 3.317 10 0 GGAEHN Cc1cc(CNCCNC(=O)c2cccc(Br)c2)cc(C)c1O ZINC000582387319 566856299 /nfs/dbraw/zinc/85/62/99/566856299.db2.gz RQTSYCYCTYDZJU-UHFFFAOYSA-N 0 3 377.282 3.291 10 0 GGAEHN CCCN(Cc1ccccc1Br)C(=O)N[C@H](CN)C(F)(F)F ZINC000655914589 566858497 /nfs/dbraw/zinc/85/84/97/566858497.db2.gz MRXIUQFFSGRNNQ-GFCCVEGCSA-N 0 3 382.224 3.260 10 0 GGAEHN NC[C@H](NC(=O)NCC1(c2cccc(Br)c2)CCC1)C(F)(F)F ZINC000655913246 566858886 /nfs/dbraw/zinc/85/88/86/566858886.db2.gz FJJKNRLEODELKG-LBPRGKRZSA-N 0 3 394.235 3.060 10 0 GGAEHN CC[C@H](NC(=O)N[C@@H](CN)C(F)(F)F)c1cc(F)cc(Br)c1 ZINC000655923639 566858972 /nfs/dbraw/zinc/85/89/72/566858972.db2.gz ATDXGBCWSVWMCU-QWRGUYRKSA-N 0 3 386.187 3.228 10 0 GGAEHN NC[C@H](NC(=O)N[C@@H](c1cc(F)cc(Br)c1)C1CC1)C(F)(F)F ZINC000655924249 566858988 /nfs/dbraw/zinc/85/89/88/566858988.db2.gz IYPYAWKUKZKMKO-NWDGAFQWSA-N 0 3 398.198 3.228 10 0 GGAEHN Cc1sc(CNC(=O)N[C@H](CN)C(F)(F)F)nc1-c1ccc(Cl)cc1 ZINC000655914810 566859167 /nfs/dbraw/zinc/85/91/67/566859167.db2.gz OXXUZVHYVMEUHQ-LLVKDONJSA-N 0 3 392.834 3.461 10 0 GGAEHN NC[C@@H](NC(=O)NCCc1csc(-c2ccc(Cl)cc2)n1)C(F)(F)F ZINC000655923349 566859545 /nfs/dbraw/zinc/85/95/45/566859545.db2.gz WKTGSOUEVMQVOI-GFCCVEGCSA-N 0 3 392.834 3.195 10 0 GGAEHN NC[C@@H](NC(=O)NC1(c2ccc(Br)cc2)CCC1)C(F)(F)F ZINC000655912720 566859795 /nfs/dbraw/zinc/85/97/95/566859795.db2.gz BRJDGCIPKSKQBC-LLVKDONJSA-N 0 3 380.208 3.017 10 0 GGAEHN Brc1cccc(OCCNCc2cnnn2Cc2ccccc2)c1 ZINC000490514886 566860222 /nfs/dbraw/zinc/86/02/22/566860222.db2.gz XFBLYTWOHUCCRI-UHFFFAOYSA-N 0 3 387.281 3.258 10 0 GGAEHN Cc1cc(C(C)(C)NC(=O)N[C@H](CN)C(F)(F)F)ccc1Br ZINC000655928066 566860614 /nfs/dbraw/zinc/86/06/14/566860614.db2.gz PSMUTVRQXWREHZ-LLVKDONJSA-N 0 3 382.224 3.181 10 0 GGAEHN C[C@@H](CN(C)C(=O)N[C@@H](CN)C(F)(F)F)Oc1ccc(Cl)c(Cl)c1 ZINC000655927957 566860751 /nfs/dbraw/zinc/86/07/51/566860751.db2.gz JVWFXHNITTWUTE-UFBFGSQYSA-N 0 3 388.217 3.292 10 0 GGAEHN Cc1cc([C@@H]2CCCN2C(=O)N[C@@H](CN)C(F)(F)F)ccc1Br ZINC000655928484 566860779 /nfs/dbraw/zinc/86/07/79/566860779.db2.gz MVRAKNBNDDZFBH-STQMWFEESA-N 0 3 394.235 3.494 10 0 GGAEHN COCC[C@H](NC(=O)N[C@@H](CN)C(F)(F)F)c1ccc(Cl)c(Cl)c1 ZINC000655930311 566860988 /nfs/dbraw/zinc/86/09/88/566860988.db2.gz MTJYNOJDFWCMLO-RYUDHWBXSA-N 0 3 388.217 3.260 10 0 GGAEHN CN1CCC[C@H](NC(=O)Nc2ccc(Cl)cc2I)C1 ZINC000610767965 566861279 /nfs/dbraw/zinc/86/12/79/566861279.db2.gz IYXZVXHPSLKIKZ-JTQLQIEISA-N 0 3 393.656 3.160 10 0 GGAEHN NC[C@H](NC(=O)N1CCC(F)(Cc2ccc(Cl)cc2)CC1)C(F)(F)F ZINC000655930994 566861421 /nfs/dbraw/zinc/86/14/21/566861421.db2.gz DYNNFGLQZZOLHQ-ZDUSSCGKSA-N 0 3 381.801 3.286 10 0 GGAEHN CC[C@@H]1Cc2c(Br)cccc2CN1C(=O)N[C@H](CN)C(F)(F)F ZINC000655926016 566861436 /nfs/dbraw/zinc/86/14/36/566861436.db2.gz CGXQZJGWAPQGCM-ZWNOBZJWSA-N 0 3 394.235 3.185 10 0 GGAEHN COCCC[C@@H](CNC(=O)N[C@H](CN)C(F)(F)F)c1ccc(Cl)cc1 ZINC000655927771 566861457 /nfs/dbraw/zinc/86/14/57/566861457.db2.gz INTQBUSCSHBLQL-GXTWGEPZSA-N 0 3 381.826 3.039 10 0 GGAEHN NC[C@@H](NC(=O)N[C@H]1C[C@H](c2ccc(F)c(Br)c2)C1)C(F)(F)F ZINC000655926394 566861858 /nfs/dbraw/zinc/86/18/58/566861858.db2.gz FAOHRYDHBYBFSF-KBVBSXBZSA-N 0 3 398.198 3.023 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NCCN1CCCC(C)(C)C1 ZINC000470299517 566861827 /nfs/dbraw/zinc/86/18/27/566861827.db2.gz UUEGJZFQHUBAPP-UHFFFAOYSA-N 0 3 383.330 3.238 10 0 GGAEHN COCC[C@@H](NC(=O)N[C@H](CN)C(F)(F)F)c1ccc(Cl)c(Cl)c1 ZINC000655930312 566861902 /nfs/dbraw/zinc/86/19/02/566861902.db2.gz MTJYNOJDFWCMLO-VXGBXAGGSA-N 0 3 388.217 3.260 10 0 GGAEHN CN(C)[C@]1(CNC(=O)Nc2cc(F)cc(Br)c2F)CCSC1 ZINC000490535060 566862604 /nfs/dbraw/zinc/86/26/04/566862604.db2.gz OBDDOINPHUDDMG-AWEZNQCLSA-N 0 3 394.285 3.286 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNS(=O)(=O)Cc1cccc(C(F)(F)F)c1 ZINC000518088754 566865733 /nfs/dbraw/zinc/86/57/33/566865733.db2.gz ATPDFQVWHZJLOD-OKILXGFUSA-N 0 3 378.460 3.388 10 0 GGAEHN O=S(=O)(c1ccc(Br)cc1)N1CCCC[C@@H](N2CCCC2)C1 ZINC000518089962 566867357 /nfs/dbraw/zinc/86/73/57/566867357.db2.gz OJEJASIUBSRYDB-OAHLLOKOSA-N 0 3 387.343 3.088 10 0 GGAEHN O=C(CCN1CCC[C@H](OC(F)F)C1)Nc1ccc(Br)cc1 ZINC000679682892 566868288 /nfs/dbraw/zinc/86/82/88/566868288.db2.gz LDMHCLCXKLVTAO-ZDUSSCGKSA-N 0 3 377.229 3.481 10 0 GGAEHN O=C(CCN1CCC[C@@H](OC(F)F)C1)Nc1ccc(Br)cc1 ZINC000679682891 566868644 /nfs/dbraw/zinc/86/86/44/566868644.db2.gz LDMHCLCXKLVTAO-CYBMUJFWSA-N 0 3 377.229 3.481 10 0 GGAEHN O=C(NCC1CCN(c2ccncc2)CC1)c1c(F)cncc1Br ZINC000632284660 566870727 /nfs/dbraw/zinc/87/07/27/566870727.db2.gz RWQNSRRXEYSPME-UHFFFAOYSA-N 0 3 393.260 3.025 10 0 GGAEHN CCN1CCN(CCCC(=O)Nc2c(C)cc(Br)cc2C)CC1 ZINC000679817146 566875168 /nfs/dbraw/zinc/87/51/68/566875168.db2.gz LPBUKBMJUNLYMM-UHFFFAOYSA-N 0 3 382.346 3.422 10 0 GGAEHN COc1ccc(COCCN[C@@H](CO)c2cccc(Br)c2)cc1 ZINC000679833616 566876600 /nfs/dbraw/zinc/87/66/00/566876600.db2.gz YESYHUQHFGTUBC-SFHVURJKSA-N 0 3 380.282 3.298 10 0 GGAEHN Cc1cccc(C)c1OC[C@@H](O)CN[C@H](CO)c1cccc(Br)c1 ZINC000679831111 566876604 /nfs/dbraw/zinc/87/66/04/566876604.db2.gz HHTDURIWHSSESR-ZWKOTPCHSA-N 0 3 394.309 3.129 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1S(=O)(=O)c1ccc(C(F)(F)F)s1 ZINC000518373964 566879079 /nfs/dbraw/zinc/87/90/79/566879079.db2.gz KWGTXNSVQARCCY-LBPRGKRZSA-N 0 3 376.425 3.014 10 0 GGAEHN CC[C@@H]1CCC[C@@H](CNCc2ccc(S(=O)(=O)N3CCOCC3)s2)C1 ZINC000543413261 566879281 /nfs/dbraw/zinc/87/92/81/566879281.db2.gz CHSIILDNWQSQSP-HZPDHXFCSA-N 0 3 386.583 3.075 10 0 GGAEHN COc1ccc(Br)c2[nH]c(C(=O)N(C)[C@H]3CCN(C4CC4)C3)cc21 ZINC000518428814 566882628 /nfs/dbraw/zinc/88/26/28/566882628.db2.gz XYOQLGZFHCNTTG-LBPRGKRZSA-N 0 3 392.297 3.248 10 0 GGAEHN CS(=O)(=O)N[C@H]1CCCC[C@@H]1CNCc1ncc(-c2ccccc2)s1 ZINC000518411698 566883140 /nfs/dbraw/zinc/88/31/40/566883140.db2.gz WGKVBUHYNALRIZ-CVEARBPZSA-N 0 3 379.551 3.008 10 0 GGAEHN CN(C)CCN(Cc1ccsc1)C(=O)NC1CCC(OC(F)F)CC1 ZINC000656237433 566887851 /nfs/dbraw/zinc/88/78/51/566887851.db2.gz LIVWJCHYYRKWTN-UHFFFAOYSA-N 0 3 375.485 3.372 10 0 GGAEHN C[C@H](NC(=O)N1CCc2ccccc2[C@@H]1CN)c1ccc(Br)cn1 ZINC000582723986 566889114 /nfs/dbraw/zinc/88/91/14/566889114.db2.gz XBQHNVBYAZRPMR-SJCJKPOMSA-N 0 3 389.297 3.173 10 0 GGAEHN C[C@H](NC(=O)N1CCc2ccccc2[C@H]1CN)c1ccc(Br)cn1 ZINC000582723988 566889476 /nfs/dbraw/zinc/88/94/76/566889476.db2.gz XBQHNVBYAZRPMR-YVEFUNNKSA-N 0 3 389.297 3.173 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1CC[C@H]2CN(C)C[C@@H]21 ZINC000656260054 566892457 /nfs/dbraw/zinc/89/24/57/566892457.db2.gz IHLWLLPJHPTWLX-KSSFIOAISA-N 0 3 375.314 3.079 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)c1cc2c(c(Br)c1)OCO2 ZINC000518597865 566893028 /nfs/dbraw/zinc/89/30/28/566893028.db2.gz URDKKEUGIYZRJG-VXGBXAGGSA-N 0 3 383.286 3.171 10 0 GGAEHN Cc1cc(Br)cc(C)c1CNC(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000428969418 566893606 /nfs/dbraw/zinc/89/36/06/566893606.db2.gz RKJHAOCOOWXASG-UKRRQHHQSA-N 0 3 380.330 3.490 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CC[C@H](N3CCCCC3)C2)c1 ZINC000518618384 566895325 /nfs/dbraw/zinc/89/53/25/566895325.db2.gz NXEDQIYFZJMGKQ-AWEZNQCLSA-N 0 3 398.288 3.300 10 0 GGAEHN CC(C)Sc1cc(Br)ccc1CN1CCN2C[C@H](O)C[C@H]2C1 ZINC000656273879 566897697 /nfs/dbraw/zinc/89/76/97/566897697.db2.gz RBBYYGAFLUXEDM-JKSUJKDBSA-N 0 3 385.371 3.200 10 0 GGAEHN C[C@H]1CN(CCC(=O)Nc2ccccc2Cl)CCN(CC(F)(F)F)C1 ZINC000451876044 566898364 /nfs/dbraw/zinc/89/83/64/566898364.db2.gz XIXGZXPOEXRBBD-ZDUSSCGKSA-N 0 3 377.838 3.485 10 0 GGAEHN C[C@@H](C1CCN(C)CC1)N(C)S(=O)(=O)Cc1ccc(Cl)cc1Cl ZINC000543674133 566900370 /nfs/dbraw/zinc/90/03/70/566900370.db2.gz HEPBXOJANDJYOC-LBPRGKRZSA-N 0 3 379.353 3.485 10 0 GGAEHN C[C@H](C1CCN(C)CC1)N(C)S(=O)(=O)Cc1ccc(Cl)cc1Cl ZINC000543674128 566900590 /nfs/dbraw/zinc/90/05/90/566900590.db2.gz HEPBXOJANDJYOC-GFCCVEGCSA-N 0 3 379.353 3.485 10 0 GGAEHN CN1CCC(CC(=O)Nc2ccnn2Cc2ccc(Br)cc2)CC1 ZINC000680359085 566902132 /nfs/dbraw/zinc/90/21/32/566902132.db2.gz GQQXDQFFJPQQOY-UHFFFAOYSA-N 0 3 391.313 3.364 10 0 GGAEHN Cc1ccc(Br)c(S(=O)(=O)N2CCc3ccccc3[C@@H]2CN)c1 ZINC000518769411 566902309 /nfs/dbraw/zinc/90/23/09/566902309.db2.gz TYAXCENEGCDXGL-INIZCTEOSA-N 0 3 395.322 3.004 10 0 GGAEHN CC1(N2CCCC2)CCN(S(=O)(=O)c2sccc2Br)CC1 ZINC000632639587 566902453 /nfs/dbraw/zinc/90/24/53/566902453.db2.gz GYFMBAFAQZYHKU-UHFFFAOYSA-N 0 3 393.372 3.150 10 0 GGAEHN Cc1cccc2c1CC[C@@H]2NCc1ccc(S(N)(=O)=O)c(Br)c1 ZINC000582892378 566903532 /nfs/dbraw/zinc/90/35/32/566903532.db2.gz RXMBSZFNEJOUKH-INIZCTEOSA-N 0 3 395.322 3.182 10 0 GGAEHN CCOc1cc(CN[C@H](C(=O)N2CCCC2)C(C)C)cc(Br)c1O ZINC000656501192 566905334 /nfs/dbraw/zinc/90/53/34/566905334.db2.gz ZMQSRMBQBHQGLD-INIZCTEOSA-N 0 3 399.329 3.290 10 0 GGAEHN C[C@H](Cc1ccccc1Br)NC(=O)CCN(C)c1ccncc1 ZINC000543713994 566905593 /nfs/dbraw/zinc/90/55/93/566905593.db2.gz ACSBLAJRCZBJBB-CQSZACIVSA-N 0 3 376.298 3.418 10 0 GGAEHN COc1ccc2c(c1)[C@@H](N[C@@H](C)Cn1cc(Br)ccc1=O)CCO2 ZINC000563670401 566905984 /nfs/dbraw/zinc/90/59/84/566905984.db2.gz IOPNUSDWELBNHO-LRDDRELGSA-N 0 3 393.281 3.121 10 0 GGAEHN O=C1CC[C@H](N2CCN(CCCSc3ccccc3Cl)CC2)CCN1 ZINC000451919993 566907887 /nfs/dbraw/zinc/90/78/87/566907887.db2.gz VFBLDBSJULUAAA-INIZCTEOSA-N 0 3 381.973 3.109 10 0 GGAEHN CS(=O)(=O)N1CCC[C@@H](CN2CC[C@@H](Sc3cccc(Cl)c3)C2)C1 ZINC000429126980 566909967 /nfs/dbraw/zinc/90/99/67/566909967.db2.gz ATVPZZZVEQUZER-WMLDXEAASA-N 0 3 388.986 3.178 10 0 GGAEHN COc1cccc(CNC(=O)C(C)S(=O)(=O)Cc2ccsc2Cl)c1 ZINC000656533329 566912537 /nfs/dbraw/zinc/91/25/37/566912537.db2.gz VKMNPYJYDFSAQW-LLVKDONJSA-N 0 3 387.910 3.030 10 0 GGAEHN C[C@H]1CN(CCCNC(=O)c2oc3ccccc3c2Br)CCCO1 ZINC000632764938 566913177 /nfs/dbraw/zinc/91/31/77/566913177.db2.gz XZEAIZWTGKTXCF-ZDUSSCGKSA-N 0 3 395.297 3.426 10 0 GGAEHN Cc1cc(CC(C)(C)NCC(=O)Nc2ccncc2)ccc1Br ZINC000429236252 566916636 /nfs/dbraw/zinc/91/66/36/566916636.db2.gz TWJHIVLRINKIST-UHFFFAOYSA-N 0 3 376.298 3.124 10 0 GGAEHN COc1cc(Br)ccc1CCC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000543858693 566917930 /nfs/dbraw/zinc/91/79/30/566917930.db2.gz ROMPBGVMNSRVJZ-CZUORRHYSA-N 0 3 383.330 3.331 10 0 GGAEHN O=C(N[C@H]1[C@@H]2Cc3cc(Br)ccc3[C@@H]21)NC1CCN(C2CC2)CC1 ZINC000632843256 566918889 /nfs/dbraw/zinc/91/88/89/566918889.db2.gz KVXBUIHHIPIUPJ-SQNIBIBYSA-N 0 3 390.325 3.013 10 0 GGAEHN O=S(=O)(CCN[C@@H]1C[C@H]1c1ccccc1)c1cccc(Br)c1 ZINC000583061465 566919020 /nfs/dbraw/zinc/91/90/20/566919020.db2.gz KNBJBLHIJCEYKS-DLBZAZTESA-N 0 3 380.307 3.369 10 0 GGAEHN C[C@@H](N[C@H]1Cc2cccc(O)c2C1)C(=O)Nc1ccccc1Br ZINC000429304565 566922638 /nfs/dbraw/zinc/92/26/38/566922638.db2.gz GZMXPEIVILTWRA-YPMHNXCESA-N 0 3 375.266 3.239 10 0 GGAEHN CNC(=O)[C@H](C)Oc1ccc(Br)cc1CN[C@H]1CC12CCCC2 ZINC000583184699 566928844 /nfs/dbraw/zinc/92/88/44/566928844.db2.gz MXHKXJJMCBSBTL-LRDDRELGSA-N 0 3 381.314 3.385 10 0 GGAEHN COC[C@@H](N[C@H](C)C(=O)Nc1ccc(C)cc1Br)C1CCOCC1 ZINC000656676708 566932247 /nfs/dbraw/zinc/93/22/47/566932247.db2.gz CPOMVJIUZKNXME-CXAGYDPISA-N 0 3 399.329 3.116 10 0 GGAEHN COC[C@H](N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)C1CCOCC1 ZINC000656680623 566933373 /nfs/dbraw/zinc/93/33/73/566933373.db2.gz YXZZFTMHEFTZCK-HOTGVXAUSA-N 0 3 387.307 3.130 10 0 GGAEHN CC1(C)CCCN[C@@H]1C(=O)NC[C@H]1CCN(c2ccc(Br)cc2)C1 ZINC000563959244 566933398 /nfs/dbraw/zinc/93/33/98/566933398.db2.gz FCEWUKQSUCKSMR-RHSMWYFYSA-N 0 3 394.357 3.170 10 0 GGAEHN COC[C@H](N[C@H](C)C(=O)Nc1cccc(Cl)c1Cl)C1CCOCC1 ZINC000656680670 566933836 /nfs/dbraw/zinc/93/38/36/566933836.db2.gz SHLVIONHGISLNV-ABAIWWIYSA-N 0 3 375.296 3.352 10 0 GGAEHN Cc1cc(Br)ccc1C(=O)N[C@H]1CC[C@@H](N2CCN(C)CC2)CC1 ZINC000680841410 566934991 /nfs/dbraw/zinc/93/49/91/566934991.db2.gz DLUCFBPVMZKIKM-CALCHBBNSA-N 0 3 394.357 3.046 10 0 GGAEHN CN1CCN([C@H]2CC[C@@H](NC(=O)c3cc(Cl)sc3Cl)CC2)CC1 ZINC000680841552 566935055 /nfs/dbraw/zinc/93/50/55/566935055.db2.gz GNCDFYWQUDGVCM-TXEJJXNPSA-N 0 3 376.353 3.343 10 0 GGAEHN C[C@@H](c1ccc(Br)cc1)N1CCN(CC2(O)CCSCC2)CC1 ZINC000656698616 566935241 /nfs/dbraw/zinc/93/52/41/566935241.db2.gz MZKFFLGVNFCKOA-HNNXBMFYSA-N 0 3 399.398 3.386 10 0 GGAEHN Cc1cc(Br)cc(C)c1CN[C@H](Cc1ccc(F)cc1)C(N)=O ZINC000544093977 566937008 /nfs/dbraw/zinc/93/70/08/566937008.db2.gz POXAUYUBMRBSCM-QGZVFWFLSA-N 0 3 379.273 3.391 10 0 GGAEHN C[C@H]1CCN(CCNC(=O)c2c(F)c(F)c(Br)c(F)c2F)C1 ZINC000611750993 566937678 /nfs/dbraw/zinc/93/76/78/566937678.db2.gz SYPXQUGHBJSTIY-ZETCQYMHSA-N 0 3 383.183 3.077 10 0 GGAEHN COC[C@H]1CCCN([C@H]2CCN(c3cccc(Br)c3)C2=O)CC1 ZINC000452103096 566937966 /nfs/dbraw/zinc/93/79/66/566937966.db2.gz LROWTHWCZAGFQM-YOEHRIQHSA-N 0 3 381.314 3.303 10 0 GGAEHN CN1CC[C@]2(CCN(C(=O)[C@@H]3C[C@]3(C)c3cccc(Br)c3)C2)C1 ZINC000633186435 566940060 /nfs/dbraw/zinc/94/00/60/566940060.db2.gz SGWULSCKJREXDH-UHOSZYNNSA-N 0 3 377.326 3.281 10 0 GGAEHN O[C@H](COc1ccc(Br)cc1)CN1CC[C@H](Cc2ccncc2)C1 ZINC000680888932 566940184 /nfs/dbraw/zinc/94/01/84/566940184.db2.gz MCMFURXNXYPIQS-AEFFLSMTSA-N 0 3 391.309 3.148 10 0 GGAEHN CN1CCC(N(Cc2ccccc2Br)C(=O)[C@@H](O)C2CCC2)CC1 ZINC000452143975 566942868 /nfs/dbraw/zinc/94/28/68/566942868.db2.gz BAAXVVDNAMLIFF-SFHVURJKSA-N 0 3 395.341 3.033 10 0 GGAEHN C[C@@H]1CN(C(=O)CCc2cccc(F)c2Br)CCN(C2CC2)C1 ZINC000452160258 566944692 /nfs/dbraw/zinc/94/46/92/566944692.db2.gz CJAZKHMBEIFWNG-ZDUSSCGKSA-N 0 3 383.305 3.464 10 0 GGAEHN COc1ccc(CN2CCC[C@H](C3CC[NH2+]CC3)C2)c(Br)c1[O-] ZINC000656783373 566949875 /nfs/dbraw/zinc/94/98/75/566949875.db2.gz QKIHPUXBXYXBIG-AWEZNQCLSA-N 0 3 383.330 3.375 10 0 GGAEHN CCN(C(=O)[C@@H]1[C@@H]2Cc3cc(Br)ccc3[C@@H]21)C1CCN(C)CC1 ZINC000633305511 566949892 /nfs/dbraw/zinc/94/98/92/566949892.db2.gz PWPUQMCLZWYYHO-FGTMMUONSA-N 0 3 377.326 3.278 10 0 GGAEHN COc1ccc(Br)c2[nH]c(C(=O)N3CCC[C@H]3CN(C)C)cc21 ZINC000519616570 566951812 /nfs/dbraw/zinc/95/18/12/566951812.db2.gz XXHNIBJNKQTZQT-NSHDSACASA-N 0 3 380.286 3.105 10 0 GGAEHN CN1C(=O)N(C[C@@H]2CCN2C(C)(C)C)C(=O)[C@@H]1c1cccc(Br)c1 ZINC000656821435 566954315 /nfs/dbraw/zinc/95/43/15/566954315.db2.gz IOUNYTMJWBLYIA-GJZGRUSLSA-N 0 3 394.313 3.257 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CN1C(=O)N[C@@H](Cc2cc(Cl)cc(Cl)c2)C1=O ZINC000656820180 566954679 /nfs/dbraw/zinc/95/46/79/566954679.db2.gz BJORCPLZDOWSFY-GJZGRUSLSA-N 0 3 384.307 3.329 10 0 GGAEHN C[C@@H](CC(F)(F)F)CS(=O)(=O)NCc1ccccc1CN1CCCC1 ZINC000656867847 566961006 /nfs/dbraw/zinc/96/10/06/566961006.db2.gz WCKVQUOCSFOEGY-AWEZNQCLSA-N 0 3 378.460 3.290 10 0 GGAEHN C[C@H](Cc1ccccc1Br)NC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000471561249 566961346 /nfs/dbraw/zinc/96/13/46/566961346.db2.gz XCYVENDMPGRSMX-CJNGLKHVSA-N 0 3 380.330 3.258 10 0 GGAEHN C[C@@H](Cc1ccccc1Br)NC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000471561251 566961616 /nfs/dbraw/zinc/96/16/16/566961616.db2.gz XCYVENDMPGRSMX-XJKSGUPXSA-N 0 3 380.330 3.258 10 0 GGAEHN CN1C(=O)C[C@@H](NCCCOCC(F)(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000493936852 566962366 /nfs/dbraw/zinc/96/23/66/566962366.db2.gz LUWRNGNUXIKKSB-UKRRQHHQSA-N 0 3 382.785 3.310 10 0 GGAEHN CN1C(=O)C[C@H](NCCCOCC(F)(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000493936850 566962455 /nfs/dbraw/zinc/96/24/55/566962455.db2.gz LUWRNGNUXIKKSB-DZGCQCFKSA-N 0 3 382.785 3.310 10 0 GGAEHN CN1C(=O)C[C@H](NCCCOCC(F)(F)F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000493936853 566962702 /nfs/dbraw/zinc/96/27/02/566962702.db2.gz LUWRNGNUXIKKSB-ZFWWWQNUSA-N 0 3 382.785 3.310 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)N1CCc2c(Cl)cc(Cl)cc2C1 ZINC000583563098 566963468 /nfs/dbraw/zinc/96/34/68/566963468.db2.gz CIIPSZYQFMOPPE-ZSZQSSIHSA-N 0 3 383.319 3.411 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)N1CCc2c(Cl)cc(Cl)cc2C1 ZINC000583563095 566963588 /nfs/dbraw/zinc/96/35/88/566963588.db2.gz CIIPSZYQFMOPPE-GMBSWORKSA-N 0 3 383.319 3.411 10 0 GGAEHN COc1ccc(N(C)C(=O)C(C[C@@H]2COCCO2)C(F)(F)F)cc1Cl ZINC000612301560 566963887 /nfs/dbraw/zinc/96/38/87/566963887.db2.gz RWNLFVIVFYNZFZ-NEPJUHHUSA-N 0 3 381.778 3.295 10 0 GGAEHN O=C(NC[C@@H]1CCCN1CCCO)c1ccc2scc(Br)c2c1 ZINC000452347005 566967037 /nfs/dbraw/zinc/96/70/37/566967037.db2.gz YKSGVSAJANDWLS-ZDUSSCGKSA-N 0 3 397.338 3.240 10 0 GGAEHN CCO[C@H](CN[C@H](C)Cn1cc(Br)ccc1=O)c1ccccc1 ZINC000519775087 566967388 /nfs/dbraw/zinc/96/73/88/566967388.db2.gz PQKGFXCTPHITMU-RHSMWYFYSA-N 0 3 379.298 3.367 10 0 GGAEHN COc1ccc(CNC[C@H](O)COc2ccc(C)cc2)cc1Br ZINC000583626468 566968874 /nfs/dbraw/zinc/96/88/74/566968874.db2.gz SWXSHJLAEHDMLK-HNNXBMFYSA-N 0 3 380.282 3.296 10 0 GGAEHN CS(=O)(=O)N1CC[C@@H](CN[C@H](c2c(Cl)cccc2Cl)C2CC2)C1 ZINC000564379031 566969157 /nfs/dbraw/zinc/96/91/57/566969157.db2.gz MDFOOTKPPZWKJV-ZBEGNZNMSA-N 0 3 377.337 3.316 10 0 GGAEHN Cc1cc(Br)cc2c(C(=O)NC[C@H]3CCCCN3CCO)coc21 ZINC000452369379 566969837 /nfs/dbraw/zinc/96/98/37/566969837.db2.gz DPOYTWKXBBTDMS-CQSZACIVSA-N 0 3 395.297 3.080 10 0 GGAEHN O=C(CCN1CCc2cc[nH]c(=O)c2C1)Nc1ccc(Br)cc1F ZINC000494154412 566972243 /nfs/dbraw/zinc/97/22/43/566972243.db2.gz UAJZMJADTUNLQS-UHFFFAOYSA-N 0 3 394.244 3.076 10 0 GGAEHN C[C@H]1CN(C)CC[C@@H]1N(C)S(=O)(=O)c1cc(Cl)cc(Br)c1 ZINC000656915904 566973797 /nfs/dbraw/zinc/97/37/97/566973797.db2.gz OXPXUZSXBHWQST-HZMBPMFUSA-N 0 3 395.750 3.063 10 0 GGAEHN C[C@H]1CN(C)CC[C@H]1N(C)S(=O)(=O)c1cc(Cl)cc(Br)c1 ZINC000656915906 566973809 /nfs/dbraw/zinc/97/38/09/566973809.db2.gz OXPXUZSXBHWQST-IINYFYTJSA-N 0 3 395.750 3.063 10 0 GGAEHN CC(C)N1C(=O)C[C@H](NCCOCC(F)F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000494217010 566975961 /nfs/dbraw/zinc/97/59/61/566975961.db2.gz SHLFSNMPYMQBER-YOEHRIQHSA-N 0 3 378.822 3.401 10 0 GGAEHN Cc1c(I)cccc1C(=O)N[C@@H](CC(C)C)CN(C)C ZINC000471802487 566978153 /nfs/dbraw/zinc/97/81/53/566978153.db2.gz BIVSCFQILCBOGW-ZDUSSCGKSA-N 0 3 388.293 3.306 10 0 GGAEHN COc1cc(Cl)c(Br)cc1C(=O)N1CCC[C@@H]1CN(C)C ZINC000430042680 566978172 /nfs/dbraw/zinc/97/81/72/566978172.db2.gz BWWIHWBPPNPDRK-SNVBAGLBSA-N 0 3 375.694 3.277 10 0 GGAEHN OCCN(Cc1cc(Br)cs1)C[C@@H](O)CCc1ccccc1 ZINC000494278048 566981450 /nfs/dbraw/zinc/98/14/50/566981450.db2.gz WSSWDRNNGDDDLG-INIZCTEOSA-N 0 3 384.339 3.299 10 0 GGAEHN CS[C@@H]1CN(C(=O)Cc2csc(-c3cccs3)n2)C[C@@H]1N1CCCC1 ZINC000544684731 566982075 /nfs/dbraw/zinc/98/20/75/566982075.db2.gz DGOQFBFGUJWQBQ-GOEBONIOSA-N 0 3 393.603 3.452 10 0 GGAEHN CCOC(=O)CC1(NCc2cn3ccc(Br)cc3n2)CCCC1 ZINC000564536397 566983754 /nfs/dbraw/zinc/98/37/54/566983754.db2.gz GBZMRRMYFFKOQD-UHFFFAOYSA-N 0 3 380.286 3.452 10 0 GGAEHN CC(C)Cc1ncc(CN[C@@H](C)CCNS(=O)(=O)c2ccccc2)s1 ZINC000583818722 566985482 /nfs/dbraw/zinc/98/54/82/566985482.db2.gz RWSFPYLIVMRRNK-HNNXBMFYSA-N 0 3 381.567 3.188 10 0 GGAEHN CCCn1cc(CNCCc2cn3cc(Br)cc(C)c3n2)cn1 ZINC000544709923 566985590 /nfs/dbraw/zinc/98/55/90/566985590.db2.gz NECCWAABOGHHNK-UHFFFAOYSA-N 0 3 376.302 3.344 10 0 GGAEHN Cc1ncc(CNCC2(c3cccc(Br)c3)CCOCC2)cn1 ZINC000520201813 566989827 /nfs/dbraw/zinc/98/98/27/566989827.db2.gz QNPQFYVRGAEXIL-UHFFFAOYSA-N 0 3 376.298 3.386 10 0 GGAEHN Cc1nnc([C@H](C)NC(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)s1 ZINC000544761620 566990151 /nfs/dbraw/zinc/99/01/51/566990151.db2.gz BJAUAWRDHSGXJZ-CORIIIEPSA-N 0 3 379.555 3.351 10 0 GGAEHN OC[C@@H](N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)c(F)c1 ZINC000430148902 566992826 /nfs/dbraw/zinc/99/28/26/566992826.db2.gz UJROSXYMHAFFPM-QFBILLFUSA-N 0 3 393.300 3.486 10 0 GGAEHN CCN(C[C@H]1CCCN1CC)C(=O)c1cc(OC)c(OC)cc1Br ZINC000564631703 566993692 /nfs/dbraw/zinc/99/36/92/566993692.db2.gz GPTFFGOLNGXRIN-CYBMUJFWSA-N 0 3 399.329 3.413 10 0 GGAEHN CN(C(=O)CCCOc1cccc(Br)c1)[C@@H]1CCN(C2CC2)C1 ZINC000520317754 566997087 /nfs/dbraw/zinc/99/70/87/566997087.db2.gz LLUNARUDXAIDFF-MRXNPFEDSA-N 0 3 381.314 3.303 10 0 GGAEHN CN1CCC(C(=O)N2CC3(CCOCC3)c3ccc(Br)cc32)CC1 ZINC000633847130 566998025 /nfs/dbraw/zinc/99/80/25/566998025.db2.gz FJIJHJBXHNQXFD-UHFFFAOYSA-N 0 3 393.325 3.186 10 0 GGAEHN CC(C)c1noc(CCCNCc2cn3ccc(Br)cc3n2)n1 ZINC000583964156 566999797 /nfs/dbraw/zinc/99/97/97/566999797.db2.gz WKSZNIQINYOXPG-UHFFFAOYSA-N 0 3 378.274 3.326 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)c1c[nH]c2ncc(Br)cc12 ZINC000472089566 567000135 /nfs/dbraw/zinc/00/01/35/567000135.db2.gz GXBLGJUTDAJFAU-TXEJJXNPSA-N 0 3 379.302 3.318 10 0 GGAEHN Cc1ccsc1[C@H](CO)NC[C@@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000681695695 567001944 /nfs/dbraw/zinc/00/19/44/567001944.db2.gz KMKAOUKXIARVGP-ABAIWWIYSA-N 0 3 376.305 3.426 10 0 GGAEHN Cc1ccsc1[C@@H](CO)NC[C@@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000681695696 567002061 /nfs/dbraw/zinc/00/20/61/567002061.db2.gz KMKAOUKXIARVGP-IAQYHMDHSA-N 0 3 376.305 3.426 10 0 GGAEHN CN1CCC[C@H](NC(=O)Nc2ccnn2Cc2cccc(Cl)c2Cl)C1 ZINC000681777607 567004512 /nfs/dbraw/zinc/00/45/12/567004512.db2.gz RYIOGNZVYIKOND-ZDUSSCGKSA-N 0 3 382.295 3.454 10 0 GGAEHN O=C(NC[C@H]1CCCCS1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472152402 567005422 /nfs/dbraw/zinc/00/54/22/567005422.db2.gz GPARIYMKABRTRM-YMAMQOFZSA-N 0 3 379.492 3.377 10 0 GGAEHN CC[C@@H](CN1CCCC1)NC(=O)NCc1ccc(Br)cc1OC ZINC000681797594 567006820 /nfs/dbraw/zinc/00/68/20/567006820.db2.gz RXIMLJGJJCNJOP-HNNXBMFYSA-N 0 3 384.318 3.131 10 0 GGAEHN CC[C@@H](Cc1cccc(Br)c1)C(=O)N[C@@H]1CNCCC1(F)F ZINC000564798245 567009172 /nfs/dbraw/zinc/00/91/72/567009172.db2.gz QSZUEYCNCUDIQG-GXTWGEPZSA-N 0 3 375.257 3.131 10 0 GGAEHN CC[C@H](Cc1cccc(Br)c1)C(=O)N[C@@H]1CNCCC1(F)F ZINC000564798249 567009646 /nfs/dbraw/zinc/00/96/46/567009646.db2.gz QSZUEYCNCUDIQG-TZMCWYRMSA-N 0 3 375.257 3.131 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1ccc(I)c(F)c1 ZINC000520513630 567010725 /nfs/dbraw/zinc/01/07/25/567010725.db2.gz JHCDORFESRHGKG-NSHDSACASA-N 0 3 390.240 3.035 10 0 GGAEHN C[C@](O)(CN[C@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1)C(F)(F)F ZINC000564850111 567013075 /nfs/dbraw/zinc/01/30/75/567013075.db2.gz QDNJSECIMRXMDR-CABZTGNLSA-N 0 3 391.743 3.235 10 0 GGAEHN O=C(C[C@H]1CSCCN1)NCc1ccc(Br)cc1C(F)(F)F ZINC000564838539 567013222 /nfs/dbraw/zinc/01/32/22/567013222.db2.gz OTWHSNIDDJNOEM-NSHDSACASA-N 0 3 397.260 3.179 10 0 GGAEHN CCSCCNCc1cccc(S(=O)(=O)NCc2cccc(F)c2)c1 ZINC000545015257 567013818 /nfs/dbraw/zinc/01/38/18/567013818.db2.gz OJQAZLQBZRWZBE-UHFFFAOYSA-N 0 3 382.526 3.147 10 0 GGAEHN CC(C)C[C@H](N[C@@H](C)c1cc(Br)cs1)C(=O)NCCN(C)C ZINC000494649679 567015787 /nfs/dbraw/zinc/01/57/87/567015787.db2.gz RGAYGQOCIDPNSX-JSGCOSHPSA-N 0 3 390.391 3.254 10 0 GGAEHN COc1ccc(Br)cc1C(=O)Nc1cnn(C2CCN(C)CC2)c1 ZINC000634091293 567016790 /nfs/dbraw/zinc/01/67/90/567016790.db2.gz GJIJICUWRNMALL-UHFFFAOYSA-N 0 3 393.285 3.173 10 0 GGAEHN CCc1nn(C)c(CC)c1CNC[C@@H](O)COc1c(Cl)cccc1Cl ZINC000584167799 567019147 /nfs/dbraw/zinc/01/91/47/567019147.db2.gz HOQGJFGJACZYBH-GFCCVEGCSA-N 0 3 386.323 3.381 10 0 GGAEHN CCN(CC)CCN(Cc1ccc(Cl)cc1)S(=O)(=O)c1cscn1 ZINC000657121995 567019241 /nfs/dbraw/zinc/01/92/41/567019241.db2.gz DHDYDIHNWGRGJF-UHFFFAOYSA-N 0 3 387.958 3.329 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)c1cnc2ncc(Br)cc2c1 ZINC000681991779 567019566 /nfs/dbraw/zinc/01/95/66/567019566.db2.gz BSMFPRQPYJOAGS-CHWSQXEVSA-N 0 3 391.313 3.385 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)c1cnc2ncc(Br)cc2c1 ZINC000681991780 567019790 /nfs/dbraw/zinc/01/97/90/567019790.db2.gz BSMFPRQPYJOAGS-STQMWFEESA-N 0 3 391.313 3.385 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)N[C@H]1C[C@H]1c1cccc(Br)c1 ZINC000520781022 567023341 /nfs/dbraw/zinc/02/33/41/567023341.db2.gz JHGQPYZNNSUADH-COXVUDFISA-N 0 3 380.330 3.479 10 0 GGAEHN C[C@H](Nc1ncnc2cccc(I)c21)C1=CCN(C)CC1 ZINC000545165567 567025662 /nfs/dbraw/zinc/02/56/62/567025662.db2.gz MAHIXFLZXLOGHM-NSHDSACASA-N 0 3 394.260 3.297 10 0 GGAEHN CCc1cccc(OC[C@H](O)CN[C@H](CO)c2cccc(Br)c2)c1 ZINC000520783225 567025744 /nfs/dbraw/zinc/02/57/44/567025744.db2.gz WFPRAXYJJANZGG-IEBWSBKVSA-N 0 3 394.309 3.074 10 0 GGAEHN O=C(NC[C@@H]1NCCc2ccccc21)[C@H]1CCc2cc(Br)ccc21 ZINC000564994163 567027778 /nfs/dbraw/zinc/02/77/78/567027778.db2.gz OHNQCEHVGPQTKS-OALUTQOASA-N 0 3 385.305 3.482 10 0 GGAEHN O=C(NC[C@H]1NCCc2ccccc21)[C@H]1CCc2cc(Br)ccc21 ZINC000564994164 567028417 /nfs/dbraw/zinc/02/84/17/567028417.db2.gz OHNQCEHVGPQTKS-RBUKOAKNSA-N 0 3 385.305 3.482 10 0 GGAEHN CCO[C@H]1C[C@@](N)(C(=O)NCc2c(Cl)cccc2OC(F)F)C1(C)C ZINC000634298991 567028833 /nfs/dbraw/zinc/02/88/33/567028833.db2.gz DPAKKFNNJSXKCG-SUMWQHHRSA-N 0 3 376.831 3.090 10 0 GGAEHN NC(=O)c1ncc(Br)cc1N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000472490060 567029486 /nfs/dbraw/zinc/02/94/86/567029486.db2.gz WROOSKSKGPEWGF-OAHLLOKOSA-N 0 3 389.297 3.020 10 0 GGAEHN CCCC1(CN[C@@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)CC1 ZINC000430709012 567031025 /nfs/dbraw/zinc/03/10/25/567031025.db2.gz VZVZKIKBJWJITQ-NSHDSACASA-N 0 3 375.332 3.327 10 0 GGAEHN Cc1ccc(CCN[C@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)cc1 ZINC000430711963 567031461 /nfs/dbraw/zinc/03/14/61/567031461.db2.gz GKDWHUOUBSRTCF-CYBMUJFWSA-N 0 3 397.338 3.298 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1cc(C)c(Br)c(C)c1 ZINC000494878217 567032151 /nfs/dbraw/zinc/03/21/51/567032151.db2.gz MYQAFEFQDRQMKA-OAHLLOKOSA-N 0 3 384.318 3.298 10 0 GGAEHN O=C(NCCCNCc1cnn2ccccc12)c1ccc(Br)cc1 ZINC000520963300 567032142 /nfs/dbraw/zinc/03/21/42/567032142.db2.gz AQSYUNCJGQDZFM-UHFFFAOYSA-N 0 3 387.281 3.007 10 0 GGAEHN O=C(N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1)N1CC[C@H](N2CC=CC2)C1 ZINC000472529778 567033959 /nfs/dbraw/zinc/03/39/59/567033959.db2.gz QJUCPILRTZYOCX-GRDNDAEWSA-N 0 3 394.288 3.100 10 0 GGAEHN CCNC(=O)c1cc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)c(C)s1 ZINC000634419740 567034158 /nfs/dbraw/zinc/03/41/58/567034158.db2.gz MEMGFHRMMYXWPX-MNOVXSKESA-N 0 3 378.416 3.492 10 0 GGAEHN CN(C(=O)N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1)[C@H]1CCN(C2CC2)C1 ZINC000472527338 567034634 /nfs/dbraw/zinc/03/46/34/567034634.db2.gz HLHBYCOVDARLJK-GRDNDAEWSA-N 0 3 396.304 3.322 10 0 GGAEHN C[C@H]1CN(Cc2ccccc2)[C@@H](C)CN1Cc1c(Br)cnn1C ZINC000494998243 567037827 /nfs/dbraw/zinc/03/78/27/567037827.db2.gz RCUBCYSUUPTHIP-GJZGRUSLSA-N 0 3 377.330 3.277 10 0 GGAEHN C[C@@]1(F)CNCCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000521045585 567037834 /nfs/dbraw/zinc/03/78/34/567037834.db2.gz XJBCXYGIVARNRK-QGZVFWFLSA-N 0 3 379.277 3.040 10 0 GGAEHN COc1ccc(C(=O)N2CCc3ccccc3[C@@H]2CN)c(Br)c1 ZINC000584412901 567039579 /nfs/dbraw/zinc/03/95/79/567039579.db2.gz QTVOTNBZUGQESG-KRWDZBQOSA-N 0 3 375.266 3.156 10 0 GGAEHN C[C@H](Oc1ccc(F)cc1Br)C(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000521081973 567040425 /nfs/dbraw/zinc/04/04/25/567040425.db2.gz FTSLAZZPQGIEHS-SMDDNHRTSA-N 0 3 385.277 3.051 10 0 GGAEHN COC(=O)c1cccc(NC(=O)NCCN2CCCC[C@H]2C)c1Br ZINC000495040297 567041463 /nfs/dbraw/zinc/04/14/63/567041463.db2.gz CJSOZTDEBYXMRA-GFCCVEGCSA-N 0 3 398.301 3.232 10 0 GGAEHN O=C1NCCC[C@H]1CNCc1cnc(-c2ccc(Br)cc2)s1 ZINC000657283739 567045175 /nfs/dbraw/zinc/04/51/75/567045175.db2.gz HRYHZEVAKLESFZ-LBPRGKRZSA-N 0 3 380.311 3.188 10 0 GGAEHN Brc1ccc(N2CC[C@@H](CNCc3cc4n(n3)CCC4)C2)cc1 ZINC000657326319 567045900 /nfs/dbraw/zinc/04/59/00/567045900.db2.gz LOUZREXSBSRPHR-AWEZNQCLSA-N 0 3 375.314 3.208 10 0 GGAEHN Cc1cc(C(=O)N2CCC[C@@H](N(C)C)C2)nn1-c1ccc(Br)cc1 ZINC000431017683 567046782 /nfs/dbraw/zinc/04/67/82/567046782.db2.gz BQDKIPQNNWUJCL-MRXNPFEDSA-N 0 3 391.313 3.109 10 0 GGAEHN Cn1ncc(C(F)(F)F)c1CNCCOc1cccc(Br)c1 ZINC000657324126 567046874 /nfs/dbraw/zinc/04/68/74/567046874.db2.gz UIGHIYTVXNGODE-UHFFFAOYSA-N 0 3 378.192 3.370 10 0 GGAEHN CCCCN(C)CCNC(=O)c1cc(C)n(-c2ccc(Br)cc2)n1 ZINC000431036951 567048244 /nfs/dbraw/zinc/04/82/44/567048244.db2.gz HXLFEEVDMQLEFP-UHFFFAOYSA-N 0 3 393.329 3.405 10 0 GGAEHN C[NH+](C)CCCC1CCN(C(=O)Cc2ccc(Br)cc2[O-])CC1 ZINC000495176576 567050046 /nfs/dbraw/zinc/05/00/46/567050046.db2.gz SKESNURQDBYDIU-UHFFFAOYSA-N 0 3 383.330 3.278 10 0 GGAEHN COc1ccc([C@H](NCCC2CS(=O)(=O)C2)c2ccccc2Cl)cc1 ZINC000682500788 567050913 /nfs/dbraw/zinc/05/09/13/567050913.db2.gz KTFBSFNFNXNNMS-IBGZPJMESA-N 0 3 379.909 3.462 10 0 GGAEHN C[C@@](O)(C[C@H](O)CNCc1cc(Br)ccc1OC(F)F)C1CC1 ZINC000634703068 567053402 /nfs/dbraw/zinc/05/34/02/567053402.db2.gz PBNOECUSVAJMGD-XJKSGUPXSA-N 0 3 394.256 3.052 10 0 GGAEHN Brc1ccc(CN2CCC(NCc3cc4n(n3)CCC4)CC2)cc1 ZINC000657400184 567053350 /nfs/dbraw/zinc/05/33/50/567053350.db2.gz FSWYVSAPIHNVFD-UHFFFAOYSA-N 0 3 389.341 3.346 10 0 GGAEHN C[C@](O)(C[C@@H](O)CNCc1cc(Br)ccc1OC(F)F)C1CC1 ZINC000634703066 567053735 /nfs/dbraw/zinc/05/37/35/567053735.db2.gz PBNOECUSVAJMGD-CJNGLKHVSA-N 0 3 394.256 3.052 10 0 GGAEHN O[C@H](CN[C@H]1CCCCc2cc(Br)ccc21)CC1(O)CCOCC1 ZINC000634722368 567055881 /nfs/dbraw/zinc/05/58/81/567055881.db2.gz NXVUUOXHNXTAJK-WMZOPIPTSA-N 0 3 398.341 3.099 10 0 GGAEHN CO[C@H](c1ccc(Br)cc1)[C@H](C)NC[C@@H](O)C[C@](C)(O)C1CC1 ZINC000634710004 567056236 /nfs/dbraw/zinc/05/62/36/567056236.db2.gz QXOKLBVUKFLFGR-JUKXBJQTSA-N 0 3 386.330 3.027 10 0 GGAEHN O[C@@H](CN[C@@H]1CCCCc2cc(Br)ccc21)CC1(O)CCOCC1 ZINC000634722367 567056881 /nfs/dbraw/zinc/05/68/81/567056881.db2.gz NXVUUOXHNXTAJK-SJLPKXTDSA-N 0 3 398.341 3.099 10 0 GGAEHN C[C@H](CCN[C@@H](C)c1ccc(F)c(I)c1)[S@@](C)=O ZINC000453167855 567059445 /nfs/dbraw/zinc/05/94/45/567059445.db2.gz UKJWBGRJGXAZTK-AUSHCKSDSA-N 0 3 383.270 3.238 10 0 GGAEHN CCN(CC)CCN(CCC(F)(F)F)C(=O)c1cccc([S@](C)=O)c1 ZINC000613802788 567062359 /nfs/dbraw/zinc/06/23/59/567062359.db2.gz GTDJFJODAAJMQU-VWLOTQADSA-N 0 3 378.460 3.160 10 0 GGAEHN CS[C@H]1CN(C(=O)CSCc2cc(-c3cccs3)on2)C[C@@H]1N(C)C ZINC000495635109 567064775 /nfs/dbraw/zinc/06/47/75/567064775.db2.gz JEBRCJSWNURNJA-BBRMVZONSA-N 0 3 397.591 3.140 10 0 GGAEHN CN(C(=O)N[C@@H]1C[C@H]1c1ccccc1Br)[C@@H]1CCN(C2CC2)C1 ZINC000431190911 567065046 /nfs/dbraw/zinc/06/50/46/567065046.db2.gz CGCLNXYJVFQFSB-UKPHBRMFSA-N 0 3 378.314 3.183 10 0 GGAEHN CO[C@H](CNCc1cc(Br)ccc1OC(F)F)[C@@H]1CCOC1 ZINC000657541209 567066470 /nfs/dbraw/zinc/06/64/70/567066470.db2.gz CUORAFGIOFJTGR-QMTHXVAHSA-N 0 3 380.229 3.192 10 0 GGAEHN CO[C@H](CNCc1ccc(OC(F)F)c(Br)c1)[C@@H]1CCOC1 ZINC000657541963 567066555 /nfs/dbraw/zinc/06/65/55/567066555.db2.gz MDGKCQNTUATQLO-BXUZGUMPSA-N 0 3 380.229 3.192 10 0 GGAEHN CO[C@H](CNCc1cc(Br)cc(Br)c1)[C@H]1CCOC1 ZINC000657542208 567066580 /nfs/dbraw/zinc/06/65/80/567066580.db2.gz OVJGUBWLUZXKRX-SMDDNHRTSA-N 0 3 393.119 3.353 10 0 GGAEHN CS[C@@H]1CN(C(=O)C[C@@H](C)c2ccc(Br)cc2)C[C@H]1N(C)C ZINC000495712222 567066556 /nfs/dbraw/zinc/06/65/56/567066556.db2.gz JJPVLURBDUYDKS-DAXOMENPSA-N 0 3 385.371 3.447 10 0 GGAEHN CO[C@@H](CNCc1cc(Br)ccc1OC(F)F)[C@H]1CCOC1 ZINC000657541203 567066710 /nfs/dbraw/zinc/06/67/10/567066710.db2.gz CUORAFGIOFJTGR-HZMBPMFUSA-N 0 3 380.229 3.192 10 0 GGAEHN CO[C@H](CNCc1cc(Br)ccc1OC(F)F)[C@H]1CCOC1 ZINC000657541205 567066780 /nfs/dbraw/zinc/06/67/80/567066780.db2.gz CUORAFGIOFJTGR-IINYFYTJSA-N 0 3 380.229 3.192 10 0 GGAEHN CO[C@H](CNCc1ccc(OC(F)F)c(Br)c1)[C@H]1CCOC1 ZINC000657541972 567067298 /nfs/dbraw/zinc/06/72/98/567067298.db2.gz MDGKCQNTUATQLO-SMDDNHRTSA-N 0 3 380.229 3.192 10 0 GGAEHN CO[C@@H](CNCc1cc(Br)ccc1OC(F)F)[C@@H]1CCOC1 ZINC000657541213 567067316 /nfs/dbraw/zinc/06/73/16/567067316.db2.gz CUORAFGIOFJTGR-YGRLFVJLSA-N 0 3 380.229 3.192 10 0 GGAEHN CO[C@H](CNCc1cn(-c2cccc(Br)c2)nc1C)[C@H]1CCOC1 ZINC000657541626 567067415 /nfs/dbraw/zinc/06/74/15/567067415.db2.gz QPLDJVKGWAZSOL-KBXCAEBGSA-N 0 3 394.313 3.084 10 0 GGAEHN Cc1ccc(NC(=O)CN2CCc3ccccc3[C@@H]2CN)c(Br)c1 ZINC000521624529 567068413 /nfs/dbraw/zinc/06/84/13/567068413.db2.gz KJMLJNNWGUNMHC-SFHVURJKSA-N 0 3 388.309 3.254 10 0 GGAEHN CS(=O)(=O)CC1(CCNCc2cnc(-c3c(F)cccc3F)s2)CC1 ZINC000657547488 567069206 /nfs/dbraw/zinc/06/92/06/567069206.db2.gz QUIZAWMZZBREGO-UHFFFAOYSA-N 0 3 386.489 3.393 10 0 GGAEHN COC[C@H](CCNCc1cn(-c2cccc(Br)c2)nc1C)OC ZINC000657553544 567069393 /nfs/dbraw/zinc/06/93/93/567069393.db2.gz LAYDKRXCGJKTEW-KRWDZBQOSA-N 0 3 382.302 3.084 10 0 GGAEHN CS(=O)(=O)CC1(CCNCc2cc(Br)c(Cl)s2)CC1 ZINC000657547647 567069472 /nfs/dbraw/zinc/06/94/72/567069472.db2.gz IPTFHULSVFUIML-UHFFFAOYSA-N 0 3 386.764 3.469 10 0 GGAEHN COCC[C@@H](COC)N[C@H](C)c1ccc(F)c(I)c1 ZINC000453257602 567069682 /nfs/dbraw/zinc/06/96/82/567069682.db2.gz SHYWVKQWTWWCMO-PWSUYJOCSA-N 0 3 381.229 3.132 10 0 GGAEHN OCCN1CCCC[C@@H]1CN[C@@H]1CCCOc2cc(Br)ccc21 ZINC000453267751 567069824 /nfs/dbraw/zinc/06/98/24/567069824.db2.gz PQOPGQGLUMCLQM-NVXWUHKLSA-N 0 3 383.330 3.099 10 0 GGAEHN OCCN1CCCC[C@@H]1CN[C@@H]1CCCOc2c(Br)cccc21 ZINC000453255290 567069939 /nfs/dbraw/zinc/06/99/39/567069939.db2.gz FKFKNHGAFYJRJT-RHSMWYFYSA-N 0 3 383.330 3.099 10 0 GGAEHN COc1sc(CN[C@H](CO)[C@@H]2CCC[C@H](OC)C2)cc1Br ZINC000657576227 567072402 /nfs/dbraw/zinc/07/24/02/567072402.db2.gz ITNQCXLNQUHKGR-UHIISALHSA-N 0 3 378.332 3.175 10 0 GGAEHN C[C@@H](NCCOc1ccc(Cl)c(Cl)c1)c1ccc(S(N)(=O)=O)cc1 ZINC000453298137 567072784 /nfs/dbraw/zinc/07/27/84/567072784.db2.gz UHVFTURJTYHFGD-LLVKDONJSA-N 0 3 389.304 3.370 10 0 GGAEHN Brc1ccc2c(c1)[C@@H](NCCN1C[C@H]3CC[C@@H](C1)O3)CCCO2 ZINC000453332747 567074480 /nfs/dbraw/zinc/07/44/80/567074480.db2.gz IIIQIAUENOOMTO-UXLLHSPISA-N 0 3 381.314 3.116 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)c1csc(I)c1 ZINC000521671415 567074730 /nfs/dbraw/zinc/07/47/30/567074730.db2.gz FUDSCFNKOATZMY-PHIMTYICSA-N 0 3 392.306 3.345 10 0 GGAEHN O[C@H]1CCN(Cc2ccc(CNCc3ccccc3Br)cc2)C1 ZINC000657596741 567074939 /nfs/dbraw/zinc/07/49/39/567074939.db2.gz YJTLZGRUMIQYFB-SFHVURJKSA-N 0 3 375.310 3.306 10 0 GGAEHN Cc1cc(C(=O)N[C@H]2CCN(C)[C@H](C)C2)nn1-c1ccc(Br)cc1 ZINC000431324242 567075117 /nfs/dbraw/zinc/07/51/17/567075117.db2.gz VHHDPVMYIOXUCO-DOMZBBRYSA-N 0 3 391.313 3.156 10 0 GGAEHN Cc1c(Br)cncc1CNCc1ccc(CN2CC[C@H](O)C2)cc1 ZINC000657594493 567075229 /nfs/dbraw/zinc/07/52/29/567075229.db2.gz AUEDBLXHJRXEOP-SFHVURJKSA-N 0 3 390.325 3.009 10 0 GGAEHN CCC(C)(C)[NH2+][C@@H](C)C(=O)Nc1cc(I)ccc1[O-] ZINC000614008329 567077435 /nfs/dbraw/zinc/07/74/35/567077435.db2.gz BUTMYMFRWOOCET-VIFPVBQESA-N 0 3 376.238 3.102 10 0 GGAEHN C[C@H](Cc1ccc(F)cc1Br)N[C@@H]1CC[C@@H](C)S(=O)(=O)C1 ZINC000657640234 567080828 /nfs/dbraw/zinc/08/08/28/567080828.db2.gz WRKQGQIHLXSGRW-JTNHKYCSSA-N 0 3 378.307 3.075 10 0 GGAEHN CN(C)C[C@]1(O)CCCN(C(=O)c2cc(Br)cc3ccccc32)C1 ZINC000614068443 567081163 /nfs/dbraw/zinc/08/11/63/567081163.db2.gz NFENAEZSBBWKDI-LJQANCHMSA-N 0 3 391.309 3.131 10 0 GGAEHN Cc1ccc(C(=O)NC2CCN([C@@H]3CCOC3)CC2)c(C)c1Br ZINC000682917980 567082505 /nfs/dbraw/zinc/08/25/05/567082505.db2.gz GPKRONOFERIIJA-OAHLLOKOSA-N 0 3 381.314 3.049 10 0 GGAEHN COc1cc(SC)ccc1NC(=O)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000614081856 567082740 /nfs/dbraw/zinc/08/27/40/567082740.db2.gz MYPQPCAPNFOOKT-PWSUYJOCSA-N 0 3 379.400 3.340 10 0 GGAEHN CNC(=O)[C@H](C)Oc1ccc(Br)cc1CNC[C@H]1CCC[C@H](C)O1 ZINC000657670295 567082916 /nfs/dbraw/zinc/08/29/16/567082916.db2.gz SQCUNHUPZSEYBB-HEHGZKQESA-N 0 3 399.329 3.010 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N(Cc1cccc(Br)c1)CC1CC1 ZINC000473480686 567083161 /nfs/dbraw/zinc/08/31/61/567083161.db2.gz MJTSNBITPYIOJL-KRWDZBQOSA-N 0 3 380.330 3.465 10 0 GGAEHN COc1cc(CN[C@H]2C[C@@H](O)C23CCC3)cc(Br)c1OC(F)F ZINC000657703562 567085587 /nfs/dbraw/zinc/08/55/87/567085587.db2.gz NOFIKVRYTZLRNH-QWHCGFSZSA-N 0 3 392.240 3.452 10 0 GGAEHN CC(C)(C)O[C@@H]1C[C@@H](NCc2ccc(S(N)(=O)=O)c(Cl)c2)C12CCC2 ZINC000657703138 567086112 /nfs/dbraw/zinc/08/61/12/567086112.db2.gz UTDMJUBTMKRSQF-HZPDHXFCSA-N 0 3 386.945 3.203 10 0 GGAEHN OC(CNCc1cnn(-c2ccc(Br)cc2)c1)(C1CC1)C1CC1 ZINC000657696706 567086159 /nfs/dbraw/zinc/08/61/59/567086159.db2.gz DTKITTSOCNHUBB-UHFFFAOYSA-N 0 3 376.298 3.276 10 0 GGAEHN COc1cc(CN[C@@H]2C[C@H](O)C23CCC3)cc(Br)c1OC(F)F ZINC000657703560 567086248 /nfs/dbraw/zinc/08/62/48/567086248.db2.gz NOFIKVRYTZLRNH-OLZOCXBDSA-N 0 3 392.240 3.452 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)NCc1cc(F)ccc1Br ZINC000565655231 567086954 /nfs/dbraw/zinc/08/69/54/567086954.db2.gz VXYVJQSFUNKUSJ-QGZVFWFLSA-N 0 3 392.272 3.356 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN[C@@H]1C[C@@H](O)C12CCC2 ZINC000657705331 567087201 /nfs/dbraw/zinc/08/72/01/567087201.db2.gz KEIHTGUPXOJPKW-IAGOWNOFSA-N 0 3 376.298 3.336 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN[C@@H]1C[C@H](O)C12CCC2 ZINC000657705333 567087908 /nfs/dbraw/zinc/08/79/08/567087908.db2.gz KEIHTGUPXOJPKW-SJORKVTESA-N 0 3 376.298 3.336 10 0 GGAEHN O=C(CCc1cc(Cl)ccc1Br)NCCNc1ccncc1 ZINC000431546270 567089256 /nfs/dbraw/zinc/08/92/56/567089256.db2.gz OWVSZCBQXKDZRT-UHFFFAOYSA-N 0 3 382.689 3.080 10 0 GGAEHN Cc1ccc(CN[C@@H]2C[C@@H](N3CCOCC3)C23CCC3)c(Br)c1 ZINC000657746595 567091695 /nfs/dbraw/zinc/09/16/95/567091695.db2.gz GRCVIHLVKWSSMZ-QZTJIDSGSA-N 0 3 379.342 3.491 10 0 GGAEHN CN(C)CCn1cc(NC(=O)N(C)Cc2ccc(F)cc2Br)cn1 ZINC000683032641 567092424 /nfs/dbraw/zinc/09/24/24/567092424.db2.gz WHNABKASLCCEHZ-UHFFFAOYSA-N 0 3 398.280 3.010 10 0 GGAEHN Fc1ccc(Br)cc1CN[C@@H]1C[C@@H](N2CCOCC2)C12CCC2 ZINC000657747878 567092983 /nfs/dbraw/zinc/09/29/83/567092983.db2.gz OIKNHFOPUKRYQP-IAGOWNOFSA-N 0 3 383.305 3.321 10 0 GGAEHN COc1ccc(Br)cc1CN[C@@H]1C[C@@H](N2CCOCC2)C12CCC2 ZINC000657748776 567093550 /nfs/dbraw/zinc/09/35/50/567093550.db2.gz XNMQOAYGCWKQPK-QZTJIDSGSA-N 0 3 395.341 3.191 10 0 GGAEHN OC1(CNCc2cc3c(cc2Br)OCO3)CCC(F)(F)CC1 ZINC000657775824 567094762 /nfs/dbraw/zinc/09/47/62/567094762.db2.gz LSDBTIUMMFAYJD-UHFFFAOYSA-N 0 3 378.213 3.208 10 0 GGAEHN O=S(=O)(c1ccccc1)N1CC[C@H](N[C@H]2CCc3c2cccc3Cl)C1 ZINC000522022938 567095434 /nfs/dbraw/zinc/09/54/34/567095434.db2.gz CGSSPAZQUWNKLC-LIRRHRJNSA-N 0 3 376.909 3.380 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N(C)[C@H]1CN2CCC1CC2 ZINC000522041905 567097038 /nfs/dbraw/zinc/09/70/38/567097038.db2.gz GBCVAVUZIBXONE-KRWDZBQOSA-N 0 3 390.325 3.265 10 0 GGAEHN CCOc1c(Br)cc(CNC2CC(CO)C2)cc1Br ZINC000657808985 567098262 /nfs/dbraw/zinc/09/82/62/567098262.db2.gz RIVYNONIJYMEFU-UHFFFAOYSA-N 0 3 393.119 3.471 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)NCCN1CCCCC1 ZINC000614267760 567098436 /nfs/dbraw/zinc/09/84/36/567098436.db2.gz GWZDTABWVAVDOZ-UHFFFAOYSA-N 0 3 378.314 3.314 10 0 GGAEHN COc1c(Br)cc(Br)cc1CNC1CC(CO)C1 ZINC000657808551 567098893 /nfs/dbraw/zinc/09/88/93/567098893.db2.gz KSYCEQHUCHRLQJ-UHFFFAOYSA-N 0 3 379.092 3.081 10 0 GGAEHN COc1cc(C[NH2+][C@H](CO)Cc2ccc(C)c(C)c2)cc(Br)c1[O-] ZINC000453639806 567100344 /nfs/dbraw/zinc/10/03/44/567100344.db2.gz WWDABGGBEPGHIP-INIZCTEOSA-N 0 3 394.309 3.473 10 0 GGAEHN CC[C@@H]1CN(C)CCCN1C(=O)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000614333649 567103295 /nfs/dbraw/zinc/10/32/95/567103295.db2.gz DTZQQBWDVCZNJF-CYBMUJFWSA-N 0 3 392.297 3.259 10 0 GGAEHN OC[C@H](CNCc1cn2cccc(F)c2n1)Cc1ccc(Br)cc1 ZINC000683205772 567105930 /nfs/dbraw/zinc/10/59/30/567105930.db2.gz IPJDBWJIUFMEBW-AWEZNQCLSA-N 0 3 392.272 3.177 10 0 GGAEHN OC[C@H](CNCc1cn2cccc(F)c2n1)Cc1cccc(Br)c1 ZINC000683206443 567106048 /nfs/dbraw/zinc/10/60/48/567106048.db2.gz QXAHVAGOFNVLMT-AWEZNQCLSA-N 0 3 392.272 3.177 10 0 GGAEHN COC[C@@H](CC1CCOCC1)NCc1cn2cc(Br)cc(C)c2n1 ZINC000657974381 567110082 /nfs/dbraw/zinc/11/00/82/567110082.db2.gz OOUWLRXAANSSGE-MRXNPFEDSA-N 0 3 396.329 3.327 10 0 GGAEHN COC[C@@H](CC1CCOCC1)N[C@H](CCO)c1ccccc1Br ZINC000657969583 567110699 /nfs/dbraw/zinc/11/06/99/567110699.db2.gz REFLDHVJSPXBHN-CRAIPNDOSA-N 0 3 386.330 3.294 10 0 GGAEHN CCN(CCNC(=O)CSCc1ccc(Br)cc1F)C1CC1 ZINC000522420290 567117089 /nfs/dbraw/zinc/11/70/89/567117089.db2.gz BDPPECYRIBLAMW-UHFFFAOYSA-N 0 3 389.334 3.422 10 0 GGAEHN CN1CC[C@H]2[C@H](CCCN2C(=O)NCCc2ccccc2Br)C1 ZINC000497691511 567117689 /nfs/dbraw/zinc/11/76/89/567117689.db2.gz PCXNEUXEVVACGP-WBVHZDCISA-N 0 3 380.330 3.117 10 0 GGAEHN CN1CC[C@@H]2[C@H](CCCN2C(=O)NCCc2ccccc2Br)C1 ZINC000497691508 567117791 /nfs/dbraw/zinc/11/77/91/567117791.db2.gz PCXNEUXEVVACGP-NVXWUHKLSA-N 0 3 380.330 3.117 10 0 GGAEHN C[C@H](CN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)c1ccccn1 ZINC000658065765 567118906 /nfs/dbraw/zinc/11/89/06/567118906.db2.gz FRJZQTXTXAVURY-MNOVXSKESA-N 0 3 388.320 3.490 10 0 GGAEHN C[C@H](NC[C@@H]1CCN1C(C)(C)C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000658060181 567118958 /nfs/dbraw/zinc/11/89/58/567118958.db2.gz KGVZBSUNOKEYBM-QWRGUYRKSA-N 0 3 394.368 3.164 10 0 GGAEHN COC1CC(CCN[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)C1 ZINC000658061051 567119276 /nfs/dbraw/zinc/11/92/76/567119276.db2.gz SAUXSSXQEBVRBC-WHXUTIOJSA-N 0 3 381.325 3.107 10 0 GGAEHN COC[C@H](NCCC1(CS(C)(=O)=O)CC1)c1cccc(C(F)(F)F)c1 ZINC000658079174 567120423 /nfs/dbraw/zinc/12/04/23/567120423.db2.gz WJTAYHWCKDKGHV-HNNXBMFYSA-N 0 3 379.444 3.197 10 0 GGAEHN C[C@H](NCCC1(CS(C)(=O)=O)CC1)c1ccc(Br)cc1F ZINC000658080637 567120468 /nfs/dbraw/zinc/12/04/68/567120468.db2.gz KCQKJTVMLHXDHP-NSHDSACASA-N 0 3 378.307 3.454 10 0 GGAEHN C[C@H](NCCC1(CS(C)(=O)=O)CC1)c1cc(Br)ccc1F ZINC000658078139 567120731 /nfs/dbraw/zinc/12/07/31/567120731.db2.gz OJEVNJHZIACKHP-NSHDSACASA-N 0 3 378.307 3.454 10 0 GGAEHN CO[C@H](CN[C@H](c1ccc(Br)cc1)[C@H]1CCCO1)[C@H]1CCOC1 ZINC000658079729 567120886 /nfs/dbraw/zinc/12/08/86/567120886.db2.gz XDGBDIDVKYZPBN-DZOHQFGASA-N 0 3 384.314 3.310 10 0 GGAEHN C[C@@H](NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1ccc(Br)cn1 ZINC000658141088 567123573 /nfs/dbraw/zinc/12/35/73/567123573.db2.gz WEWNCWNWZSWAHK-RDTXWAMCSA-N 0 3 390.325 3.262 10 0 GGAEHN C[C@@H](NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1ncc(Br)s1 ZINC000658136793 567123607 /nfs/dbraw/zinc/12/36/07/567123607.db2.gz IIUNHDLYOPEBOF-IUODEOHRSA-N 0 3 396.354 3.323 10 0 GGAEHN C[C@@H](NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1cncc(Br)c1 ZINC000658140619 567123809 /nfs/dbraw/zinc/12/38/09/567123809.db2.gz VNODHFDKAYLBER-AUUYWEPGSA-N 0 3 390.325 3.262 10 0 GGAEHN C[C@H](NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1cncc(Br)c1 ZINC000658140620 567124683 /nfs/dbraw/zinc/12/46/83/567124683.db2.gz VNODHFDKAYLBER-IFXJQAMLSA-N 0 3 390.325 3.262 10 0 GGAEHN C[N@@H+]1CCCC[C@@H]1CCC(=O)Nc1cc(I)ccc1[O-] ZINC000588351916 567128169 /nfs/dbraw/zinc/12/81/69/567128169.db2.gz NZKJIQSLOXNLOU-GFCCVEGCSA-N 0 3 388.249 3.200 10 0 GGAEHN C[N@H+]1CCCC[C@@H]1CCC(=O)Nc1cc(I)ccc1[O-] ZINC000588351916 567128172 /nfs/dbraw/zinc/12/81/72/567128172.db2.gz NZKJIQSLOXNLOU-GFCCVEGCSA-N 0 3 388.249 3.200 10 0 GGAEHN CN(Cc1csc(Br)c1)C[C@@H](O)CN(C)Cc1ccccc1 ZINC000588690505 567133105 /nfs/dbraw/zinc/13/31/05/567133105.db2.gz DSDYCBVPWSKMKU-INIZCTEOSA-N 0 3 383.355 3.435 10 0 GGAEHN CC(C)[C@@H](O)[C@@H](N[C@H](C)Cn1cc(Br)ccc1=O)c1ccccc1 ZINC000658288415 567133963 /nfs/dbraw/zinc/13/39/63/567133963.db2.gz OPQZDYNXCBRYDC-MDASCCDHSA-N 0 3 393.325 3.347 10 0 GGAEHN C[C@@H](N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2)c1ccc(Br)cn1 ZINC000658290817 567134160 /nfs/dbraw/zinc/13/41/60/567134160.db2.gz ONJKAIUKAIATPI-KBRIMQKVSA-N 0 3 380.330 3.138 10 0 GGAEHN CCS(=O)(=O)C1(CN[C@H](C)Cc2ccc(Br)c(F)c2)CC1 ZINC000658298246 567134539 /nfs/dbraw/zinc/13/45/39/567134539.db2.gz FEBSDGIJEQSPFI-LLVKDONJSA-N 0 3 378.307 3.076 10 0 GGAEHN O=C1N(CCN[C@@H]2CCc3cc(Br)ccc32)C[C@@H]2CCCCN12 ZINC000658305566 567136508 /nfs/dbraw/zinc/13/65/08/567136508.db2.gz ANOFYBLSJDQRJB-DOTOQJQBSA-N 0 3 378.314 3.316 10 0 GGAEHN O=C1N(CCN[C@H]2CCc3ccc(Br)cc32)C[C@H]2CCCCN12 ZINC000658304974 567136554 /nfs/dbraw/zinc/13/65/54/567136554.db2.gz IDMAGYYQJRPBOT-WBVHZDCISA-N 0 3 378.314 3.316 10 0 GGAEHN O=C1N(CCN[C@H]2CCc3c2cccc3Br)C[C@H]2CCCCN12 ZINC000658306468 567136560 /nfs/dbraw/zinc/13/65/60/567136560.db2.gz PWFUGUHNVWYBBJ-DYVFJYSZSA-N 0 3 378.314 3.316 10 0 GGAEHN COc1ccc([C@H](C)NCCN2C[C@@H]3CCCCN3C2=O)cc1Br ZINC000658309180 567136571 /nfs/dbraw/zinc/13/65/71/567136571.db2.gz NQSVUUUGZRMFMB-ZFWWWQNUSA-N 0 3 396.329 3.398 10 0 GGAEHN O=C1N(CCN[C@@H]2CCc3c2ccc(F)c3Br)C[C@H]2CCCCN12 ZINC000658305695 567136615 /nfs/dbraw/zinc/13/66/15/567136615.db2.gz LRQMOZFRZIHULH-MLGOLLRUSA-N 0 3 396.304 3.455 10 0 GGAEHN CN(Cc1ccc(F)cc1Br)C(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C ZINC000566195897 567137667 /nfs/dbraw/zinc/13/76/67/567137667.db2.gz SJFNMFASXAGDDO-DHSIGJKJSA-N 0 3 399.304 3.079 10 0 GGAEHN Cc1c2ccc(C(F)(F)F)nc2sc1C(=O)N[C@@H]1CNCCC1(F)F ZINC000566212778 567138388 /nfs/dbraw/zinc/13/83/88/567138388.db2.gz WCDYXNXYSDLRAT-SNVBAGLBSA-N 0 3 379.354 3.351 10 0 GGAEHN C[C@@H](NC[C@H]1CSc2ccccc2O1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000566220669 567138480 /nfs/dbraw/zinc/13/84/80/567138480.db2.gz LAJSBBDECOITLU-OCCSQVGLSA-N 0 3 381.494 3.433 10 0 GGAEHN O=S(=O)([N-][C@H]1CC[NH2+]C2(CCC2)C1)c1cccc(Br)c1Cl ZINC000658401251 567140809 /nfs/dbraw/zinc/14/08/09/567140809.db2.gz AYAPMAJTVBZFCO-JTQLQIEISA-N 0 3 393.734 3.056 10 0 GGAEHN O=C(CN1CCNC[C@H]1C(F)F)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000566243538 567142273 /nfs/dbraw/zinc/14/22/73/567142273.db2.gz WUWCYJWTROOVJL-GJZGRUSLSA-N 0 3 392.277 3.196 10 0 GGAEHN N[C@@H]1CN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC[C@H]1c1ccc(F)cc1 ZINC000658405578 567142588 /nfs/dbraw/zinc/14/25/88/567142588.db2.gz UKSPYUCUQYRJBH-WMLDXEAASA-N 0 3 386.851 3.124 10 0 GGAEHN Clc1cc(Cl)cc(-c2nnc3ccc(NCCN4CCCC4)nn32)c1 ZINC000588894978 567143158 /nfs/dbraw/zinc/14/31/58/567143158.db2.gz KZTKFZJAJRYZLI-UHFFFAOYSA-N 0 3 377.279 3.028 10 0 GGAEHN COCC[C@@H]1CCCCN(Cc2cc(=O)n3cc(Br)ccc3n2)C1 ZINC000546642693 567146581 /nfs/dbraw/zinc/14/65/81/567146581.db2.gz WKMLSSGOCGMGHU-AWEZNQCLSA-N 0 3 394.313 3.096 10 0 GGAEHN CN1CCC[C@@H](CNc2ncnc3c2NC(=O)CS3)[C@@H]1c1cccs1 ZINC000683752237 567151814 /nfs/dbraw/zinc/15/18/14/567151814.db2.gz KPHXVTRNBJCFIZ-XHDPSFHLSA-N 0 3 375.523 3.077 10 0 GGAEHN CN(C)CCn1cc(NC(=O)Nc2cc(F)cc(Br)c2F)cn1 ZINC000683811309 567155308 /nfs/dbraw/zinc/15/53/08/567155308.db2.gz QEBZYYATDSCIPT-UHFFFAOYSA-N 0 3 388.216 3.129 10 0 GGAEHN O=C(CNC1(CCO)CCCCC1)Nc1c(F)cc(F)cc1Br ZINC000474292000 567155937 /nfs/dbraw/zinc/15/59/37/567155937.db2.gz RXIOQBBZSUATNU-UHFFFAOYSA-N 0 3 391.256 3.341 10 0 GGAEHN O=S(=O)(CCNC1(CCO)CCCCC1)c1cc(Cl)ccc1Cl ZINC000474293834 567156192 /nfs/dbraw/zinc/15/61/92/567156192.db2.gz SFLLJTUOSPMHBK-UHFFFAOYSA-N 0 3 380.337 3.442 10 0 GGAEHN O=C(NC[C@@H]1CCCCN1CCO)Nc1ccc(Br)cc1Cl ZINC000454260260 567157377 /nfs/dbraw/zinc/15/73/77/567157377.db2.gz VZNGHALTMYXAHU-LBPRGKRZSA-N 0 3 390.709 3.071 10 0 GGAEHN C[C@@H]1CCC[C@@](CNC(=O)Cc2ccc(Br)cc2[O-])([NH+](C)C)C1 ZINC000432408608 567157876 /nfs/dbraw/zinc/15/78/76/567157876.db2.gz CLKJWTQKNZPDGT-FZKQIMNGSA-N 0 3 383.330 3.324 10 0 GGAEHN CN1CCN([C@H]2CC[C@@H](NC(=O)[C@@H]3C[C@H]3c3ccc(Cl)s3)CC2)CC1 ZINC000683871383 567159165 /nfs/dbraw/zinc/15/91/65/567159165.db2.gz YRNQOZMBISKEKS-QKPAOTATSA-N 0 3 381.973 3.180 10 0 GGAEHN CN(C)C[C@]1(O)CCCN(C(=O)CCCOc2ccc(Cl)cc2Cl)C1 ZINC000683910274 567160275 /nfs/dbraw/zinc/16/02/75/567160275.db2.gz SLUSZICTTYWODF-GOSISDBHSA-N 0 3 389.323 3.068 10 0 GGAEHN C[C@H](NC(=O)NCCN1[C@H](C)CCC[C@@H]1C)c1ccc(Br)cn1 ZINC000474334076 567160525 /nfs/dbraw/zinc/16/05/25/567160525.db2.gz TZGULLJGNRJRCK-MJBXVCDLSA-N 0 3 383.334 3.467 10 0 GGAEHN C[C@@H](NC(=O)NCCN1[C@H](C)CCC[C@@H]1C)c1ccc(Br)cn1 ZINC000474334073 567160605 /nfs/dbraw/zinc/16/06/05/567160605.db2.gz TZGULLJGNRJRCK-HZSPNIEDSA-N 0 3 383.334 3.467 10 0 GGAEHN CN(C)C[C@@]1(O)CCCN(C(=O)c2csc(-c3ccc(Cl)s3)n2)C1 ZINC000683913597 567161171 /nfs/dbraw/zinc/16/11/71/567161171.db2.gz YURSKIVLNFPRDV-INIZCTEOSA-N 0 3 385.942 3.054 10 0 GGAEHN CSc1cc(C(=O)N2CCC[C@](O)(CN(C)C)C2)c(Cl)cc1Cl ZINC000683915119 567161188 /nfs/dbraw/zinc/16/11/88/567161188.db2.gz WLQLRMOJLNTXEF-INIZCTEOSA-N 0 3 377.337 3.244 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)Nc2cc(Cl)c(Cl)cn2)CC1 ZINC000432462546 567161458 /nfs/dbraw/zinc/16/14/58/567161458.db2.gz KWPUPZTUJSVLJK-UHFFFAOYSA-N 0 3 382.251 3.146 10 0 GGAEHN CN(Cc1nc(Cc2cccc(Br)c2)no1)[C@H]1CCN(C2CC2)C1 ZINC000523582815 567163844 /nfs/dbraw/zinc/16/38/44/567163844.db2.gz IDCINTGHRDWGSP-INIZCTEOSA-N 0 3 391.313 3.091 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)NCc1cccc(Br)c1 ZINC000523617735 567163901 /nfs/dbraw/zinc/16/39/01/567163901.db2.gz YMZZARIDNIYSQA-SFHVURJKSA-N 0 3 390.325 3.421 10 0 GGAEHN COC(=O)CCCCCNCc1c(F)ccc(I)c1F ZINC000589190466 567165065 /nfs/dbraw/zinc/16/50/65/567165065.db2.gz PFPXNDGFJFAFEK-UHFFFAOYSA-N 0 3 397.203 3.392 10 0 GGAEHN C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NCCN1CCCC[C@H]1C ZINC000498320076 567166348 /nfs/dbraw/zinc/16/63/48/567166348.db2.gz CGJSNWIQUMFWOO-OLZOCXBDSA-N 0 3 386.323 3.102 10 0 GGAEHN COc1ccc(CCC(=O)N[C@@H](CC(C)C)CN(C)C)cc1Br ZINC000498331393 567167380 /nfs/dbraw/zinc/16/73/80/567167380.db2.gz AKURCUATTDMUAZ-HNNXBMFYSA-N 0 3 385.346 3.483 10 0 GGAEHN CN1CC[C@@H]2CN(C(=O)Nc3cc(Cl)ccc3OCC(F)(F)F)C[C@@H]21 ZINC000454386445 567169079 /nfs/dbraw/zinc/16/90/79/567169079.db2.gz SGMUMAPAINYBNX-MFKMUULPSA-N 0 3 377.794 3.449 10 0 GGAEHN C[C@H]1CN(CCCNC(=O)c2c[nH]c3cccc(Br)c23)CCCO1 ZINC000432545646 567169343 /nfs/dbraw/zinc/16/93/43/567169343.db2.gz JRCKNFJIXYEPDJ-ZDUSSCGKSA-N 0 3 394.313 3.161 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)CCOc1cccc(Cl)c1Cl ZINC000615263795 567173427 /nfs/dbraw/zinc/17/34/27/567173427.db2.gz JKLMXKMDPHSONQ-LSDHHAIUSA-N 0 3 387.307 3.084 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)c1ccc(Cl)cc1Br ZINC000615261598 567173472 /nfs/dbraw/zinc/17/34/72/567173472.db2.gz DMEJMJPHAPLISJ-GJZGRUSLSA-N 0 3 387.705 3.038 10 0 GGAEHN CSC1(CNS(=O)(=O)Cc2ccc3ccccc3c2)CCN(C)CC1 ZINC000589295343 567173787 /nfs/dbraw/zinc/17/37/87/567173787.db2.gz VUBJITMAYAHERA-UHFFFAOYSA-N 0 3 378.563 3.087 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)c1ccc(Cl)cc1Br ZINC000615261601 567173827 /nfs/dbraw/zinc/17/38/27/567173827.db2.gz DMEJMJPHAPLISJ-HUUCEWRRSA-N 0 3 387.705 3.038 10 0 GGAEHN CC(C)[C@H](N)C(=O)N1CCc2cc(Br)c(Br)cc2C1 ZINC000658968828 567174093 /nfs/dbraw/zinc/17/40/93/567174093.db2.gz CXZLSAZZZILQQM-ZDUSSCGKSA-N 0 3 390.119 3.080 10 0 GGAEHN COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)NC[C@@H]1CCCN1C ZINC000523876651 567174150 /nfs/dbraw/zinc/17/41/50/567174150.db2.gz NYQPRWSONQPNHI-HOCLYGCPSA-N 0 3 396.329 3.398 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)c1cc(Cl)cc(Br)c1 ZINC000615268228 567174353 /nfs/dbraw/zinc/17/43/53/567174353.db2.gz FVEXHQMMARHFMI-HUUCEWRRSA-N 0 3 387.705 3.038 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1ccc(Br)c(Cl)c1 ZINC000615271800 567174413 /nfs/dbraw/zinc/17/44/13/567174413.db2.gz YPBXMCPNDRUHHI-CABCVRRESA-N 0 3 387.705 3.038 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)c1cc(Cl)cc(Br)c1 ZINC000615268227 567174434 /nfs/dbraw/zinc/17/44/34/567174434.db2.gz FVEXHQMMARHFMI-GJZGRUSLSA-N 0 3 387.705 3.038 10 0 GGAEHN COc1ncc(C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)cc1Cl ZINC000566641028 567174502 /nfs/dbraw/zinc/17/45/02/567174502.db2.gz JLSBEIHVHABOTO-INIZCTEOSA-N 0 3 379.913 3.498 10 0 GGAEHN Cc1cc(C)c(Br)c(C(=O)N2CCOC[C@@H]2[C@@H]2CCCN2C)c1 ZINC000615268496 567174600 /nfs/dbraw/zinc/17/46/00/567174600.db2.gz HNWVWHSDYDWWOI-JKSUJKDBSA-N 0 3 381.314 3.001 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)CCCc1ccccc1Br ZINC000615268762 567174874 /nfs/dbraw/zinc/17/48/74/567174874.db2.gz IFGGNLOLHGZKHV-ZWKOTPCHSA-N 0 3 395.341 3.093 10 0 GGAEHN Cc1ccc(C(=O)N2CCOC[C@@H]2[C@H]2CCCN2C)c(C)c1Br ZINC000615270850 567174911 /nfs/dbraw/zinc/17/49/11/567174911.db2.gz SNRDJZIJAMTRBC-HZPDHXFCSA-N 0 3 381.314 3.001 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1ccc(Br)c(Cl)c1 ZINC000615271805 567175019 /nfs/dbraw/zinc/17/50/19/567175019.db2.gz YPBXMCPNDRUHHI-LSDHHAIUSA-N 0 3 387.705 3.038 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)CCCc1ccccc1Br ZINC000615268760 567175160 /nfs/dbraw/zinc/17/51/60/567175160.db2.gz IFGGNLOLHGZKHV-QZTJIDSGSA-N 0 3 395.341 3.093 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)CCCc1ccccc1Br ZINC000615268759 567175185 /nfs/dbraw/zinc/17/51/85/567175185.db2.gz IFGGNLOLHGZKHV-MSOLQXFVSA-N 0 3 395.341 3.093 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000615271764 567175479 /nfs/dbraw/zinc/17/54/79/567175479.db2.gz YIHSJROWKYAHKR-LSDHHAIUSA-N 0 3 376.806 3.294 10 0 GGAEHN Cc1ccc(CCC(=O)N2CCOC[C@@H]2[C@@H]2CCCN2C)c(Br)c1 ZINC000615270169 567175530 /nfs/dbraw/zinc/17/55/30/567175530.db2.gz OVIKQFGLFXCBJP-ZWKOTPCHSA-N 0 3 395.341 3.012 10 0 GGAEHN Cc1ccc(C(=O)N2CCOC[C@H]2[C@H]2CCCN2C)c(C)c1Br ZINC000615270848 567175741 /nfs/dbraw/zinc/17/57/41/567175741.db2.gz SNRDJZIJAMTRBC-CVEARBPZSA-N 0 3 381.314 3.001 10 0 GGAEHN Cc1ccc(CCC(=O)N2CCOC[C@@H]2[C@H]2CCCN2C)c(Br)c1 ZINC000615270167 567175773 /nfs/dbraw/zinc/17/57/73/567175773.db2.gz OVIKQFGLFXCBJP-QZTJIDSGSA-N 0 3 395.341 3.012 10 0 GGAEHN CCOc1c(Br)cc(Cl)cc1NC(=O)N1CC[C@@H](F)[C@H](N)C1 ZINC000658980867 567175816 /nfs/dbraw/zinc/17/58/16/567175816.db2.gz GVLDUHSVFALGQM-GHMZBOCLSA-N 0 3 394.672 3.404 10 0 GGAEHN O=C(NCc1ccc(Br)cc1)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659032387 567178954 /nfs/dbraw/zinc/17/89/54/567178954.db2.gz FQUIFUKDWKMYOG-KRWDZBQOSA-N 0 3 390.281 3.432 10 0 GGAEHN Cc1cc(C(=O)N(C)CCN(C)C2CC2)nn1-c1ccc(Br)cc1 ZINC000474569616 567179082 /nfs/dbraw/zinc/17/90/82/567179082.db2.gz CWPZVCZGUWLJOO-UHFFFAOYSA-N 0 3 391.313 3.109 10 0 GGAEHN O=C(NCc1ccsc1Br)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659046661 567179170 /nfs/dbraw/zinc/17/91/70/567179170.db2.gz NZLIDCUTLNQYHN-CQSZACIVSA-N 0 3 396.310 3.493 10 0 GGAEHN O=C(NCc1cccc(Br)c1)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659030732 567179278 /nfs/dbraw/zinc/17/92/78/567179278.db2.gz LZOIZNIZDCXJPH-KRWDZBQOSA-N 0 3 390.281 3.432 10 0 GGAEHN O=C(NCc1csc(Br)c1)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659032363 567179312 /nfs/dbraw/zinc/17/93/12/567179312.db2.gz QNRBUBPJXFIDNJ-CQSZACIVSA-N 0 3 396.310 3.493 10 0 GGAEHN O=C(Nc1ccc2c(c1)CNC2)N1CCOc2cc(Br)ccc2C1 ZINC000659023434 567179789 /nfs/dbraw/zinc/17/97/89/567179789.db2.gz WKSWDISMJCYCOM-UHFFFAOYSA-N 0 3 388.265 3.479 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Br)C(=O)N1CCC[C@@H]1CN(C)C ZINC000524103629 567181031 /nfs/dbraw/zinc/18/10/31/567181031.db2.gz OGDQVIDHFGNQQG-WCQYABFASA-N 0 3 389.721 3.422 10 0 GGAEHN Cc1c(C(=O)N2CCC[C@@H]2CN(C)C)cnn1-c1ccc(Br)cc1 ZINC000524103727 567181683 /nfs/dbraw/zinc/18/16/83/567181683.db2.gz WYDZRXIWYPIZFH-MRXNPFEDSA-N 0 3 391.313 3.109 10 0 GGAEHN C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)N1CCC[C@@H]1CN(C)C ZINC000524103628 567182118 /nfs/dbraw/zinc/18/21/18/567182118.db2.gz OGDQVIDHFGNQQG-DGCLKSJQSA-N 0 3 389.721 3.422 10 0 GGAEHN C[C@@H](CCc1ccc(I)cc1)NC[C@H](O)C(F)(F)F ZINC000474619676 567184012 /nfs/dbraw/zinc/18/40/12/567184012.db2.gz MDIZYRKFHUNISX-CABZTGNLSA-N 0 3 387.183 3.125 10 0 GGAEHN COc1ccc(CCC(=O)N2CCN(C3CC3)C[C@@H](C)C2)c(Br)c1 ZINC000615451705 567185289 /nfs/dbraw/zinc/18/52/89/567185289.db2.gz RSEACXJBRKDTCI-CQSZACIVSA-N 0 3 395.341 3.333 10 0 GGAEHN Cc1cc2cc(C(=O)N3CCC[C@](O)(CN(C)C)C3)oc2c(Br)c1 ZINC000684174702 567185322 /nfs/dbraw/zinc/18/53/22/567185322.db2.gz LRMPLPQKRVQGPT-SFHVURJKSA-N 0 3 395.297 3.032 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)c1ccn(-c2ccc(Br)cc2)n1 ZINC000432778873 567190588 /nfs/dbraw/zinc/19/05/88/567190588.db2.gz ATLAYSAIOXNZDF-HNNXBMFYSA-N 0 3 393.329 3.341 10 0 GGAEHN CC1=CCN(CCNCc2cc(Br)c3c(c2)OCCCO3)CC1 ZINC000547271799 567195104 /nfs/dbraw/zinc/19/51/04/567195104.db2.gz PEDJEXRDBHDMHG-UHFFFAOYSA-N 0 3 381.314 3.352 10 0 GGAEHN C[C@H]1CN(c2cc(C3CC3)nc3c(Br)cccc23)CCN1CCO ZINC000432847715 567196166 /nfs/dbraw/zinc/19/61/66/567196166.db2.gz VYLNWLNUKMLGGT-ZDUSSCGKSA-N 0 3 390.325 3.378 10 0 GGAEHN CN1CC[C@@]2(C1)CCCN(C(=O)c1c[nH]c3cccc(Br)c13)C2 ZINC000615611991 567196931 /nfs/dbraw/zinc/19/69/31/567196931.db2.gz NHFMRBOMBJSGPL-GOSISDBHSA-N 0 3 376.298 3.488 10 0 GGAEHN O=C(C[C@H]1NCc2ccccc21)NCCc1ccc(F)c(Br)c1 ZINC000659281190 567198769 /nfs/dbraw/zinc/19/87/69/567198769.db2.gz QUNOWSOINVEKJI-QGZVFWFLSA-N 0 3 377.257 3.482 10 0 GGAEHN CS[C@H]1CN(C(=O)c2ccc(Br)c(C)c2F)C[C@@H]1N(C)C ZINC000566894998 567199305 /nfs/dbraw/zinc/19/93/05/567199305.db2.gz CUFONXJPRLGIOD-STQMWFEESA-N 0 3 375.307 3.014 10 0 GGAEHN C[C@@H](CNC(=O)c1sc2c(c1Br)CNC2)N1CCCC[C@@H]1C ZINC000659292354 567199747 /nfs/dbraw/zinc/19/97/47/567199747.db2.gz OSDWOQLKBLYYNN-QWRGUYRKSA-N 0 3 386.359 3.107 10 0 GGAEHN Ic1cnc(N[C@@H](CN2CCCC2)c2ccccc2)nc1 ZINC000547328044 567200034 /nfs/dbraw/zinc/20/00/34/567200034.db2.gz SQZKBRWHTSUXDO-HNNXBMFYSA-N 0 3 394.260 3.330 10 0 GGAEHN OCC[C@]1(CNCc2ccc(Br)cc2C(F)(F)F)CCOC1 ZINC000474820188 567201972 /nfs/dbraw/zinc/20/19/72/567201972.db2.gz ZNYTWICJRMVYGO-CQSZACIVSA-N 0 3 382.220 3.347 10 0 GGAEHN Cc1cc(C[C@H](C)NCc2c(F)ccc(I)c2F)n[nH]1 ZINC000474819048 567202287 /nfs/dbraw/zinc/20/22/87/567202287.db2.gz NHCGQCXTZHXPIY-QMMMGPOBSA-N 0 3 391.203 3.322 10 0 GGAEHN Cc1cc(C[C@H](C)NCc2c(F)ccc(I)c2F)[nH]n1 ZINC000474819048 567202292 /nfs/dbraw/zinc/20/22/92/567202292.db2.gz NHCGQCXTZHXPIY-QMMMGPOBSA-N 0 3 391.203 3.322 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N1CCC[C@H]1CN(C)C ZINC000590001856 567202702 /nfs/dbraw/zinc/20/27/02/567202702.db2.gz OEIANPFZKYYFQO-AWEZNQCLSA-N 0 3 378.314 3.265 10 0 GGAEHN O[C@H](CCNCc1cc(Br)c2c(c1)OCCCO2)C(F)(F)F ZINC000566941176 567204937 /nfs/dbraw/zinc/20/49/37/567204937.db2.gz BMVHMHOTELEXFO-GFCCVEGCSA-N 0 3 384.192 3.013 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)Cc1ccccc1Br ZINC000524653482 567208233 /nfs/dbraw/zinc/20/82/33/567208233.db2.gz VNDAGFXWRSNLHE-KRWDZBQOSA-N 0 3 375.310 3.281 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)CCCOc1cccc(Cl)c1Cl ZINC000590117259 567209765 /nfs/dbraw/zinc/20/97/65/567209765.db2.gz LHIDFMSZEDYWGY-CQSZACIVSA-N 0 3 389.323 3.379 10 0 GGAEHN C[C@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1cc(Br)cs1 ZINC000567009580 567209951 /nfs/dbraw/zinc/20/99/51/567209951.db2.gz UBBTUFAXENHBPG-AAEUAGOBSA-N 0 3 397.342 3.086 10 0 GGAEHN CN(C(=O)CCSc1ccccc1Br)[C@@H]1CN2CCC1CC2 ZINC000524694425 567209912 /nfs/dbraw/zinc/20/99/12/567209912.db2.gz OQISKAWPEDDEHN-OAHLLOKOSA-N 0 3 383.355 3.484 10 0 GGAEHN C[C@@H](CCc1ccc(I)cc1)NCc1cc(C(N)=O)co1 ZINC000474923870 567210082 /nfs/dbraw/zinc/21/00/82/567210082.db2.gz FWCLVPRLUDCNAU-NSHDSACASA-N 0 3 398.244 3.094 10 0 GGAEHN COc1ccc(C(=O)Nc2ccc([C@@H]3CNCCO3)cc2)cc1Br ZINC000659371084 567210573 /nfs/dbraw/zinc/21/05/73/567210573.db2.gz YSYSIUFJQQFKLH-KRWDZBQOSA-N 0 3 391.265 3.371 10 0 GGAEHN Cc1ncc(Br)cc1NC(=O)C(C[C@H]1COCCO1)C(F)(F)F ZINC000615855035 567210859 /nfs/dbraw/zinc/21/08/59/567210859.db2.gz OAYQBMCNZIUWJW-QWRGUYRKSA-N 0 3 397.191 3.075 10 0 GGAEHN N[C@@H]1CN(C(=O)CCCSc2ccc(Br)cc2)CC[C@H]1F ZINC000659389673 567211016 /nfs/dbraw/zinc/21/10/16/567211016.db2.gz PBBCCVAKUJQQCB-ZIAGYGMSSA-N 0 3 375.307 3.219 10 0 GGAEHN Cc1ncc(Br)cc1NC(=O)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000615855033 567211699 /nfs/dbraw/zinc/21/16/99/567211699.db2.gz OAYQBMCNZIUWJW-GHMZBOCLSA-N 0 3 397.191 3.075 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2[C@H]3Cc4cc(Br)ccc4[C@@H]23)CCN1C ZINC000637650963 567211880 /nfs/dbraw/zinc/21/18/80/567211880.db2.gz RQFFLQMQHWMGRE-OZISYCDHSA-N 0 3 392.341 3.211 10 0 GGAEHN CC(C)[C@@H](Cc1ccc(F)cc1)NCc1ccc(S(=O)(=O)N(C)C)s1 ZINC000567053888 567213969 /nfs/dbraw/zinc/21/39/69/567213969.db2.gz REPVRSJVLQHNCB-QGZVFWFLSA-N 0 3 384.542 3.494 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2C[C@H]2c2cccc(Br)c2)CCN1C ZINC000524787403 567214744 /nfs/dbraw/zinc/21/47/44/567214744.db2.gz QKJRVULWHSNNHN-VDNDLQMASA-N 0 3 380.330 3.429 10 0 GGAEHN O=C(NCc1ccc([O-])c(Br)c1)N1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000659470926 567216417 /nfs/dbraw/zinc/21/64/17/567216417.db2.gz JMVDSPUYKPHUOW-HNNXBMFYSA-N 0 3 396.329 3.076 10 0 GGAEHN N[C@@H]1CN(C(=O)NCc2ccc(Br)cc2C(F)(F)F)CC[C@H]1F ZINC000659474977 567217036 /nfs/dbraw/zinc/21/70/36/567217036.db2.gz HSNWLAKSMVYDCN-VXGBXAGGSA-N 0 3 398.198 3.049 10 0 GGAEHN CC(C)(NCC(=O)N1CCO[C@@H]2CCCC[C@H]21)c1ccc(Br)cc1 ZINC000616010879 567220797 /nfs/dbraw/zinc/22/07/97/567220797.db2.gz QUQFENSZPXVTMO-IAGOWNOFSA-N 0 3 395.341 3.444 10 0 GGAEHN C[C@@H]1CCN(CC(=O)N2CCC[C@H]2c2ccccc2I)C1 ZINC000567121730 567220814 /nfs/dbraw/zinc/22/08/14/567220814.db2.gz NRRRAQSJCAWTGT-CJNGLKHVSA-N 0 3 398.288 3.297 10 0 GGAEHN CC(C)(NCC(=O)N1CCO[C@H]2CCCC[C@@H]21)c1ccc(Br)cc1 ZINC000616010880 567220883 /nfs/dbraw/zinc/22/08/83/567220883.db2.gz QUQFENSZPXVTMO-IRXDYDNUSA-N 0 3 395.341 3.444 10 0 GGAEHN O=C(NCCNc1ccncc1)c1cc(C(F)(F)F)ccc1Br ZINC000433099009 567222227 /nfs/dbraw/zinc/22/22/27/567222227.db2.gz ZBNZPRKYMFHQBH-UHFFFAOYSA-N 0 3 388.187 3.127 10 0 GGAEHN Cc1ncsc1CS(=O)(=O)C(C)C(=O)N(Cc1ccccc1)C(C)C ZINC000567156298 567223004 /nfs/dbraw/zinc/22/30/04/567223004.db2.gz LLBYHBVPLROVSH-HNNXBMFYSA-N 0 3 380.535 3.192 10 0 GGAEHN C[C@H]1COCC[C@@H]1NCC(=O)Nc1ccc(Br)c(C(F)(F)F)c1 ZINC000433136500 567225784 /nfs/dbraw/zinc/22/57/84/567225784.db2.gz MBYMXIHMYXQAAD-ZANVPECISA-N 0 3 395.219 3.421 10 0 GGAEHN COc1ccc(Br)c2[nH]c(C(=O)N(C)[C@@H]3CCN(C)[C@@H](C)C3)cc21 ZINC000525106713 567229012 /nfs/dbraw/zinc/22/90/12/567229012.db2.gz YJWFMVBQRNQUME-NWDGAFQWSA-N 0 3 394.313 3.494 10 0 GGAEHN O=C(Cc1noc2ccc(Br)cc21)NC[C@@H]1CCCCN1C1CC1 ZINC000567262802 567231666 /nfs/dbraw/zinc/23/16/66/567231666.db2.gz AQWYDJMZNGDMDP-AWEZNQCLSA-N 0 3 392.297 3.266 10 0 GGAEHN COc1cc(Br)c(CNCC2(CO)CC3(CCC3)C2)cc1OC ZINC000433207970 567233320 /nfs/dbraw/zinc/23/33/20/567233320.db2.gz MKJGHKGWIRDUPB-UHFFFAOYSA-N 0 3 384.314 3.499 10 0 GGAEHN CN1CC[C@H](NCC(=O)NCc2cccs2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000567283550 567233757 /nfs/dbraw/zinc/23/37/57/567233757.db2.gz LEYNDYZWWCCSHZ-WMZOPIPTSA-N 0 3 381.904 3.192 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N1CCCN(C(C)(C)C)CC1 ZINC000525239905 567237535 /nfs/dbraw/zinc/23/75/35/567237535.db2.gz TZYYIGIQOYYCBA-UHFFFAOYSA-N 0 3 383.330 3.333 10 0 GGAEHN O=C1[C@H](N2CCC[C@@H]([C@H]3CCOC3)C2)CCN1c1cccc(Br)c1 ZINC000433270234 567238370 /nfs/dbraw/zinc/23/83/70/567238370.db2.gz KAIXXXQNXRQYPH-RVKKMQEKSA-N 0 3 393.325 3.303 10 0 GGAEHN O=C1[C@H](N2CCC[C@H]([C@H]3CCOC3)C2)CCN1c1cccc(Br)c1 ZINC000433270231 567239160 /nfs/dbraw/zinc/23/91/60/567239160.db2.gz KAIXXXQNXRQYPH-RLFYNMQTSA-N 0 3 393.325 3.303 10 0 GGAEHN OC[C@H](CNCc1ccc(-c2cc[nH]n2)o1)Cc1cccc(Br)c1 ZINC000433333734 567242110 /nfs/dbraw/zinc/24/21/10/567242110.db2.gz FJQMBLRNNWKUQQ-AWEZNQCLSA-N 0 3 390.281 3.373 10 0 GGAEHN CN(C[C@@H]1CCCN1C)C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000616384328 567242675 /nfs/dbraw/zinc/24/26/75/567242675.db2.gz PRDCVNKWBBBZSE-INIZCTEOSA-N 0 3 380.330 3.216 10 0 GGAEHN CS[C@@H]1CN(C(=O)Cc2cscc2Br)C[C@@H]1N1CCCC1 ZINC000499400978 567243619 /nfs/dbraw/zinc/24/36/19/567243619.db2.gz SRAQYJPPBCDSBB-UONOGXRCSA-N 0 3 389.384 3.091 10 0 GGAEHN CO[C@@H]1CC[C@@H](C(=O)Nc2cc(Br)ccc2N(C)CCN(C)C)C1 ZINC000616422951 567244114 /nfs/dbraw/zinc/24/41/14/567244114.db2.gz USGQSRYJDUBAIX-UKRRQHHQSA-N 0 3 398.345 3.201 10 0 GGAEHN CO[C@H]1CC[C@H](C(=O)Nc2cc(Br)ccc2N(C)CCN(C)C)C1 ZINC000616422952 567244347 /nfs/dbraw/zinc/24/43/47/567244347.db2.gz USGQSRYJDUBAIX-ZFWWWQNUSA-N 0 3 398.345 3.201 10 0 GGAEHN CN1CCC[C@H](CNC(=O)N[C@H](CO)c2ccsc2)[C@H]1c1cccs1 ZINC000547775060 567244773 /nfs/dbraw/zinc/24/47/73/567244773.db2.gz MRNFCHULVYJUCZ-UNEWFSDZSA-N 0 3 379.551 3.225 10 0 GGAEHN CN(C)Cc1ccc(S(=O)(=O)N2CC[C@@H](C(F)(F)F)C(C)(C)C2)cc1 ZINC000433372675 567245518 /nfs/dbraw/zinc/24/55/18/567245518.db2.gz PMJGPFPQDBVOFD-OAHLLOKOSA-N 0 3 378.460 3.347 10 0 GGAEHN CN1CCC[C@H](CNC(=O)N[C@H](CO)c2ccsc2)[C@@H]1c1cccs1 ZINC000547775057 567245683 /nfs/dbraw/zinc/24/56/83/567245683.db2.gz MRNFCHULVYJUCZ-FRFSOERESA-N 0 3 379.551 3.225 10 0 GGAEHN COC(=O)c1cc(NC(=O)NCCN2CCCC[C@H]2C)ccc1Br ZINC000547754335 567245777 /nfs/dbraw/zinc/24/57/77/567245777.db2.gz UBRMBXXETNBZBG-GFCCVEGCSA-N 0 3 398.301 3.232 10 0 GGAEHN CCCN(C(=O)CCc1ccc(OC)cc1Br)[C@@H]1CCN(C)C1 ZINC000616468229 567247410 /nfs/dbraw/zinc/24/74/10/567247410.db2.gz VDXSLGIKLJLMRN-OAHLLOKOSA-N 0 3 383.330 3.333 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1F)NCC1(S(C)(=O)=O)CCC1 ZINC000475422786 567247388 /nfs/dbraw/zinc/24/73/88/567247388.db2.gz LREXRIHSRHPAON-NSHDSACASA-N 0 3 378.307 3.076 10 0 GGAEHN FC1(F)C[C@H]1OCCNC1(c2cccc(Br)c2)CCOCC1 ZINC000660037233 567250548 /nfs/dbraw/zinc/25/05/48/567250548.db2.gz WEVOEKMTHYRBLC-CQSZACIVSA-N 0 3 376.241 3.469 10 0 GGAEHN CN1CCC[C@@H](NC(=O)Nc2cc(Cl)ccc2I)C1 ZINC000590841934 567251454 /nfs/dbraw/zinc/25/14/54/567251454.db2.gz RJOHBVZIHRHYPW-SNVBAGLBSA-N 0 3 393.656 3.160 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)C2=Cc3cc(Br)ccc3OC2)CCN1C ZINC000525540960 567253973 /nfs/dbraw/zinc/25/39/73/567253973.db2.gz STVGBPXLRSVSAX-WBMJQRKESA-N 0 3 379.298 3.166 10 0 GGAEHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)CSCc1cc(-c2cccs2)on1 ZINC000525538329 567254033 /nfs/dbraw/zinc/25/40/33/567254033.db2.gz YWSOKRPIQPMVBB-UKRRQHHQSA-N 0 3 379.551 3.435 10 0 GGAEHN CN1CC[C@H](NCC(=O)NC2CCCC2)C[C@@H]1c1ccc(Br)cc1 ZINC000638527065 567255009 /nfs/dbraw/zinc/25/50/09/567255009.db2.gz JKFZILDDGVWEOF-ZWKOTPCHSA-N 0 3 394.357 3.233 10 0 GGAEHN CN1CC[C@H](NCC(=O)Nc2ccc(Br)cc2)[C@@H]1c1ccccc1 ZINC000567528468 567255346 /nfs/dbraw/zinc/25/53/46/567255346.db2.gz ZYHXGZSOJFBKPY-HKUYNNGSSA-N 0 3 388.309 3.423 10 0 GGAEHN C/C(=C/c1cccc(C(F)(F)F)c1)CN1CCC[C@@H](CS(N)(=O)=O)C1 ZINC000567546305 567256464 /nfs/dbraw/zinc/25/64/64/567256464.db2.gz IWWHCGUUWUVEHI-JEMSNHSXSA-N 0 3 376.444 3.109 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NC[C@@H](C)N1CCCC[C@H]1C ZINC000525657167 567256329 /nfs/dbraw/zinc/25/63/29/567256329.db2.gz KYWJHDHOXKWIDP-ZIAGYGMSSA-N 0 3 383.330 3.379 10 0 GGAEHN C/C(=C\c1cccc(C(F)(F)F)c1)CN1CCC[C@H](CS(N)(=O)=O)C1 ZINC000567546306 567256614 /nfs/dbraw/zinc/25/66/14/567256614.db2.gz IWWHCGUUWUVEHI-NRUITVPNSA-N 0 3 376.444 3.109 10 0 GGAEHN CN(C)Cc1ccc(NC(=O)[C@@H](CN)c2ccc(F)cc2)cc1Br ZINC000567586064 567259252 /nfs/dbraw/zinc/25/92/52/567259252.db2.gz FAHPJQPJYSPUKU-INIZCTEOSA-N 0 3 394.288 3.331 10 0 GGAEHN COCCn1cc(CNC2(c3ccc(Br)cc3)CCOCC2)cn1 ZINC000525697337 567259604 /nfs/dbraw/zinc/25/96/04/567259604.db2.gz MIYNMMSADGYHAU-UHFFFAOYSA-N 0 3 394.313 3.088 10 0 GGAEHN CN(C)Cc1cccc(C(=O)N[C@@](C)(CO)c2ccc(Br)cc2)c1 ZINC000616832618 567261023 /nfs/dbraw/zinc/26/10/23/567261023.db2.gz VHPDFEDUYAUWBZ-IBGZPJMESA-N 0 3 391.309 3.148 10 0 GGAEHN CN(C)Cc1cccc(C(=O)N[C@](C)(CO)c2ccc(Br)cc2)c1 ZINC000616832620 567261247 /nfs/dbraw/zinc/26/12/47/567261247.db2.gz VHPDFEDUYAUWBZ-LJQANCHMSA-N 0 3 391.309 3.148 10 0 GGAEHN COc1cnccc1N1CCN(Cc2cccc(Br)c2OC)CC1 ZINC000475618057 567263166 /nfs/dbraw/zinc/26/31/66/567263166.db2.gz AUTNRGMQOAJZRP-UHFFFAOYSA-N 0 3 392.297 3.184 10 0 GGAEHN CN(C)[C@]1(CNC(=O)N[C@H](c2cc(F)ccc2F)C(F)F)CCSC1 ZINC000433652169 567264927 /nfs/dbraw/zinc/26/49/27/567264927.db2.gz XBJWIQXFHNTCRQ-CJNGLKHVSA-N 0 3 379.423 3.008 10 0 GGAEHN CC[C@H]1CCCCN1CCNC(=O)c1[nH]nc2ccc(Br)cc21 ZINC000499697904 567265827 /nfs/dbraw/zinc/26/58/27/567265827.db2.gz KGHWWRZFYXQUCQ-ZDUSSCGKSA-N 0 3 379.302 3.320 10 0 GGAEHN Cc1nccc(NC(=O)NC[C@@H](C)N(C)Cc2ccccc2)c1Br ZINC000525848554 567269771 /nfs/dbraw/zinc/26/97/71/567269771.db2.gz LKDBHRROKWRNAH-CYBMUJFWSA-N 0 3 391.313 3.216 10 0 GGAEHN NC(=O)CC1(NCc2cc(Br)cc(Br)c2)CCC1 ZINC000685427608 567273195 /nfs/dbraw/zinc/27/31/95/567273195.db2.gz CEFLHPKRUAMTIL-UHFFFAOYSA-N 0 3 376.092 3.099 10 0 GGAEHN Cc1cc(CNC[C@H](O)COc2ccccc2Br)cc(C)c1O ZINC000685425785 567274361 /nfs/dbraw/zinc/27/43/61/567274361.db2.gz GIAPUBMKFZSJRN-HNNXBMFYSA-N 0 3 380.282 3.301 10 0 GGAEHN [NH3+]C1CCC(OCC(=O)N=c2cc(-c3cc(Cl)cc(Cl)c3)[n-][nH]2)CC1 ZINC000567764131 567275056 /nfs/dbraw/zinc/27/50/56/567275056.db2.gz JKZJEECOVVWQNW-UHFFFAOYSA-N 0 3 383.279 3.030 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O ZINC000617019721 567274950 /nfs/dbraw/zinc/27/49/50/567274950.db2.gz QQELNAYMIKENJQ-IUODEOHRSA-N 0 3 381.929 3.132 10 0 GGAEHN CCOc1c(Br)cc(C(=O)NC[C@H]2CCN2C(C)(C)C)cc1OC ZINC000617021215 567274980 /nfs/dbraw/zinc/27/49/80/567274980.db2.gz STLOQOBTEZEBQV-CYBMUJFWSA-N 0 3 399.329 3.459 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O ZINC000617019723 567275592 /nfs/dbraw/zinc/27/55/92/567275592.db2.gz QQELNAYMIKENJQ-WFASDCNBSA-N 0 3 381.929 3.132 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000617006224 567275800 /nfs/dbraw/zinc/27/58/00/567275800.db2.gz YFXMNXBHCHTTIK-ZIAGYGMSSA-N 0 3 381.314 3.304 10 0 GGAEHN COc1ccc(CCC(=O)NC[C@H]2CCN2C(C)(C)C)cc1Br ZINC000617019206 567275840 /nfs/dbraw/zinc/27/58/40/567275840.db2.gz GOYZIXMLXZDAEO-CQSZACIVSA-N 0 3 383.330 3.379 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)c1ccn(-c2cccc(Br)c2)n1 ZINC000617013535 567275910 /nfs/dbraw/zinc/27/59/10/567275910.db2.gz WFBNNWGWJGMSRS-HNNXBMFYSA-N 0 3 391.313 3.237 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)c1ccc(-n2cc(Br)cn2)cc1 ZINC000617016799 567276054 /nfs/dbraw/zinc/27/60/54/567276054.db2.gz NDMSYYQMNKBVDF-MRXNPFEDSA-N 0 3 391.313 3.237 10 0 GGAEHN Cc1nc2ccc(S(=O)(=O)NC[C@@H]3CCCN(CC4CC4)C3)cc2s1 ZINC000660180839 567276169 /nfs/dbraw/zinc/27/61/69/567276169.db2.gz XAXILIWKCLHFKA-HNNXBMFYSA-N 0 3 379.551 3.005 10 0 GGAEHN CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000617006579 567276256 /nfs/dbraw/zinc/27/62/56/567276256.db2.gz AUVLLXDYQRTVKJ-SWLSCSKDSA-N 0 3 385.961 3.145 10 0 GGAEHN COc1cc(Br)ccc1CCC(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000617010313 567276323 /nfs/dbraw/zinc/27/63/23/567276323.db2.gz NFAUQYNZZIMKMK-HNNXBMFYSA-N 0 3 383.330 3.379 10 0 GGAEHN C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NC[C@H]1CCN1C(C)(C)C ZINC000617017265 567276438 /nfs/dbraw/zinc/27/64/38/567276438.db2.gz VUPVJUXHSPSNPF-NWDGAFQWSA-N 0 3 386.323 3.101 10 0 GGAEHN COc1ccc(CCC(=O)NC[C@H]2CCN2C(C)(C)C)c(Br)c1 ZINC000617005600 567276830 /nfs/dbraw/zinc/27/68/30/567276830.db2.gz LBWHRCMCOOPODU-CQSZACIVSA-N 0 3 383.330 3.379 10 0 GGAEHN Brc1cnc2c(CN[C@H](c3ccccc3)[C@@H]3CCOC3)cnn2c1 ZINC000638856034 567276923 /nfs/dbraw/zinc/27/69/23/567276923.db2.gz SLNXRJMUPSTRTL-RHSMWYFYSA-N 0 3 387.281 3.359 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])NCCCCC[NH+]1CCCCC1 ZINC000548074015 567277777 /nfs/dbraw/zinc/27/77/77/567277777.db2.gz DBRYTSLHGPFQFZ-UHFFFAOYSA-N 0 3 383.330 3.470 10 0 GGAEHN NC(=O)C[C@H]1CCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000685475003 567278406 /nfs/dbraw/zinc/27/84/06/567278406.db2.gz YARUVQJWPCFZKR-LLVKDONJSA-N 0 3 380.311 3.270 10 0 GGAEHN CCN1C[C@H](C)N(c2nnc(-c3ccccc3Br)n2C)C[C@H]1C ZINC000685509591 567279438 /nfs/dbraw/zinc/27/94/38/567279438.db2.gz YOSYAJVPWHEWLT-OLZOCXBDSA-N 0 3 378.318 3.164 10 0 GGAEHN COC(=O)CC1(NCc2cc3c(cc2Br)OCCO3)CCCC1 ZINC000548097337 567280748 /nfs/dbraw/zinc/28/07/48/567280748.db2.gz FZOKMYKYJMQBGT-UHFFFAOYSA-N 0 3 384.270 3.186 10 0 GGAEHN CCN(C[C@@H]1CCCN1CC)C(=O)c1cc(Br)c2c(c1)OCCO2 ZINC000548125875 567281720 /nfs/dbraw/zinc/28/17/20/567281720.db2.gz DINBLNOHKQNSAE-AWEZNQCLSA-N 0 3 397.313 3.167 10 0 GGAEHN C[C@@H](NS(=O)(=O)c1ccc2ncsc2c1)[C@@H]1CCCN(C2CCC2)C1 ZINC000548123789 567281919 /nfs/dbraw/zinc/28/19/19/567281919.db2.gz KFSXEBYFONWOJB-ZIAGYGMSSA-N 0 3 379.551 3.228 10 0 GGAEHN CCN(C[C@H]1CCCN1CC)C(=O)c1cc(Br)c2c(c1)OCCO2 ZINC000548125876 567282205 /nfs/dbraw/zinc/28/22/05/567282205.db2.gz DINBLNOHKQNSAE-CQSZACIVSA-N 0 3 397.313 3.167 10 0 GGAEHN FC1(CNC[C@H]2CCCN2Cc2ccc(I)cc2)CC1 ZINC000526002125 567282199 /nfs/dbraw/zinc/28/21/99/567282199.db2.gz ZPEZZSRIVYZTRG-OAHLLOKOSA-N 0 3 388.268 3.347 10 0 GGAEHN CC(C)(C)C(=O)N1CCC[C@H](CN[C@@H](CO)c2cccc(Br)c2)C1 ZINC000660237279 567283414 /nfs/dbraw/zinc/28/34/14/567283414.db2.gz CFOUVOPVHAPVRI-PBHICJAKSA-N 0 3 397.357 3.357 10 0 GGAEHN CC(C)(CNC(=O)c1cc(Br)cc2[nH]cnc21)N1CCCCC1 ZINC000499937801 567285571 /nfs/dbraw/zinc/28/55/71/567285571.db2.gz VWFQCUPQGPDVQH-UHFFFAOYSA-N 0 3 379.302 3.320 10 0 GGAEHN CC(C)[C@@](C)(CO)NCC(=O)Nc1ccc(Br)c(C(F)(F)F)c1 ZINC000685598518 567286039 /nfs/dbraw/zinc/28/60/39/567286039.db2.gz CEXZFGDCBNIBBT-CQSZACIVSA-N 0 3 397.235 3.403 10 0 GGAEHN CN(C)[C@H]1CCCN(C(=O)N[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000591573538 567286508 /nfs/dbraw/zinc/28/65/08/567286508.db2.gz WMHUJHHAALSHFP-ZFWWWQNUSA-N 0 3 382.302 3.008 10 0 GGAEHN COc1ccc(C(=O)N2C[C@@H](SC)[C@@H](N3CCCC3)C2)c(Br)c1 ZINC000548188282 567286982 /nfs/dbraw/zinc/28/69/82/567286982.db2.gz CGZMSRKXTWQKKU-JKSUJKDBSA-N 0 3 399.354 3.110 10 0 GGAEHN Cc1cc(C)c(C(=O)N(C)[C@@H]2CCN(C3CC3)C2)cc1I ZINC000475928462 567288174 /nfs/dbraw/zinc/28/81/74/567288174.db2.gz CZGUXWKJTJVLMV-CQSZACIVSA-N 0 3 398.288 3.217 10 0 GGAEHN CN(C)CCOCCNC(=O)Nc1ccc(C(F)(F)F)c(Br)c1 ZINC000526065609 567288530 /nfs/dbraw/zinc/28/85/30/567288530.db2.gz RSSBJRATACFJFD-UHFFFAOYSA-N 0 3 398.223 3.168 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)N1CCO[C@@](C)(C(F)F)C1)c1ccsc1 ZINC000660340745 567288823 /nfs/dbraw/zinc/28/88/23/567288823.db2.gz YFBXANASXMHRPE-RHSMWYFYSA-N 0 3 375.485 3.197 10 0 GGAEHN COc1cc(C[NH2+]C[C@]2(CO)C[C@H]2c2ccccc2)cc(Br)c1[O-] ZINC000685627264 567289102 /nfs/dbraw/zinc/28/91/02/567289102.db2.gz UVJBRVONFKAQBA-KXBFYZLASA-N 0 3 392.293 3.419 10 0 GGAEHN COc1ccc(Br)c(CNC(=O)NC[C@H]2CCN2C(C)(C)C)c1 ZINC000660357983 567289208 /nfs/dbraw/zinc/28/92/08/567289208.db2.gz ASGCGMYRCSYNBI-CYBMUJFWSA-N 0 3 384.318 3.130 10 0 GGAEHN COc1ccc([C@H](NCCC2CS(=O)(=O)C2)C(C)C)c(Br)c1 ZINC000685654997 567289896 /nfs/dbraw/zinc/28/98/96/567289896.db2.gz SOJCYVLOFAXXRI-MRXNPFEDSA-N 0 3 390.343 3.179 10 0 GGAEHN CC(C)[C@@H](N[C@@H](C)C(=O)NC(=O)NCC(F)(F)F)c1ccc(Cl)cc1 ZINC000567933047 567291897 /nfs/dbraw/zinc/29/18/97/567291897.db2.gz GFFZKTAOIJPAER-GXFFZTMASA-N 0 3 379.810 3.403 10 0 GGAEHN C[S@](=O)c1ccc(CNC[C@@H](O)COc2c(Cl)cccc2Cl)cc1 ZINC000591749741 567295283 /nfs/dbraw/zinc/29/52/83/567295283.db2.gz JKPZFTXMHYEXTB-OZAJXLCCSA-N 0 3 388.316 3.260 10 0 GGAEHN COc1cnccc1N1CCN(Cc2ncc(Br)cc2Cl)CC1 ZINC000660453434 567297578 /nfs/dbraw/zinc/29/75/78/567297578.db2.gz MWDGPIFZTVJGCZ-UHFFFAOYSA-N 0 3 397.704 3.223 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)Cc1ccc(F)c(Br)c1 ZINC000617292186 567298081 /nfs/dbraw/zinc/29/80/81/567298081.db2.gz XVCWMKKHBJWHOD-INIZCTEOSA-N 0 3 393.300 3.420 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1ccc(Br)cc1F ZINC000617290042 567298173 /nfs/dbraw/zinc/29/81/73/567298173.db2.gz VMPVFUYJYUQXHM-OAHLLOKOSA-N 0 3 379.273 3.491 10 0 GGAEHN CCC(C)(C)[NH2+][C@@H](C)C(=O)NCc1nc(-c2ccc(Br)cc2)n[n-]1 ZINC000476121066 567298665 /nfs/dbraw/zinc/29/86/65/567298665.db2.gz WEQNBGVRXNHVCH-NSHDSACASA-N 0 3 394.317 3.017 10 0 GGAEHN CCC(C)(C)[NH2+][C@@H](C)C(=O)NCc1n[n-]c(-c2ccc(Br)cc2)n1 ZINC000476121066 567298671 /nfs/dbraw/zinc/29/86/71/567298671.db2.gz WEQNBGVRXNHVCH-NSHDSACASA-N 0 3 394.317 3.017 10 0 GGAEHN CCC(C)(C)[NH2+][C@H](C)C(=O)NCc1nc(-c2ccc(Br)cc2)n[n-]1 ZINC000476121065 567298775 /nfs/dbraw/zinc/29/87/75/567298775.db2.gz WEQNBGVRXNHVCH-LLVKDONJSA-N 0 3 394.317 3.017 10 0 GGAEHN CCC(C)(C)[NH2+][C@H](C)C(=O)NCc1n[n-]c(-c2ccc(Br)cc2)n1 ZINC000476121065 567298780 /nfs/dbraw/zinc/29/87/80/567298780.db2.gz WEQNBGVRXNHVCH-LLVKDONJSA-N 0 3 394.317 3.017 10 0 GGAEHN CC(C)(C)N1CC[C@@H](NC(=O)Cc2noc3ccc(Br)cc32)C1 ZINC000617341165 567299264 /nfs/dbraw/zinc/29/92/64/567299264.db2.gz MGZSNSIBSCTINW-GFCCVEGCSA-N 0 3 380.286 3.122 10 0 GGAEHN CC(C)(C)N1CC[C@H](NC(=O)[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000617341773 567299864 /nfs/dbraw/zinc/29/98/64/567299864.db2.gz YMDWKPXZUWHZAZ-KBPBESRZSA-N 0 3 381.314 3.304 10 0 GGAEHN Brc1ccc2[nH]c(CN3CCC[C@@H](N4CCOCC4)CC3)nc2c1 ZINC000660472884 567299905 /nfs/dbraw/zinc/29/99/05/567299905.db2.gz ATKYNCCAPUYSEL-OAHLLOKOSA-N 0 3 393.329 3.012 10 0 GGAEHN Brc1ccc2nc(CN3CCC[C@@H](N4CCOCC4)CC3)[nH]c2c1 ZINC000660472884 567299912 /nfs/dbraw/zinc/29/99/12/567299912.db2.gz ATKYNCCAPUYSEL-OAHLLOKOSA-N 0 3 393.329 3.012 10 0 GGAEHN CC(C)(C)N1CC[C@H](NC(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000617343176 567301333 /nfs/dbraw/zinc/30/13/33/567301333.db2.gz NDFBFGMJQLVUAB-JTQLQIEISA-N 0 3 375.257 3.259 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)CCNc1ncc(C(F)(F)F)cc1Cl ZINC000476170302 567301845 /nfs/dbraw/zinc/30/18/45/567301845.db2.gz QWQJEAWDUATBGA-GFCCVEGCSA-N 0 3 378.826 3.108 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000476184709 567303529 /nfs/dbraw/zinc/30/35/29/567303529.db2.gz VGWGOXLPFJBGNM-CXAGYDPISA-N 0 3 380.330 3.258 10 0 GGAEHN COc1cc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc(Br)c1OC ZINC000568090605 567304653 /nfs/dbraw/zinc/30/46/53/567304653.db2.gz QHKIYYPMHLKZTD-YPMHNXCESA-N 0 3 385.302 3.021 10 0 GGAEHN Cc1ncc(Br)cc1NC(=O)N[C@@H](Cc1ccccc1)CN(C)C ZINC000455792343 567305203 /nfs/dbraw/zinc/30/52/03/567305203.db2.gz CZLFPTXSOPFAEP-INIZCTEOSA-N 0 3 391.313 3.447 10 0 GGAEHN CS(=O)(=O)[C@@H]1CCC[C@@H](N[C@H]2CCCc3ncc(C(F)(F)F)cc32)C1 ZINC000548306283 567306072 /nfs/dbraw/zinc/30/60/72/567306072.db2.gz IOJKALJIWUQETC-IOASZLSFSA-N 0 3 376.444 3.423 10 0 GGAEHN COc1ccc(CNC(=O)NC[C@@H]2CCN2C(C)(C)C)cc1Br ZINC000660533032 567306708 /nfs/dbraw/zinc/30/67/08/567306708.db2.gz APQJXKYMHZXMAN-ZDUSSCGKSA-N 0 3 384.318 3.130 10 0 GGAEHN C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)NC[C@H](O)CN1CCCCC1 ZINC000434415716 567308289 /nfs/dbraw/zinc/30/82/89/567308289.db2.gz KKXBAWLMLOJJHZ-JSGCOSHPSA-N 0 3 391.364 3.437 10 0 GGAEHN C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)NC[C@H](O)CN1CCCCC1 ZINC000434415717 567308968 /nfs/dbraw/zinc/30/89/68/567308968.db2.gz KKXBAWLMLOJJHZ-OCCSQVGLSA-N 0 3 391.364 3.437 10 0 GGAEHN Nc1n[nH]c(C2CCN([C@H]3CCCc4ccc(Br)cc43)CC2)n1 ZINC000660566515 567309659 /nfs/dbraw/zinc/30/96/59/567309659.db2.gz FNVORQZXDRVNBM-HNNXBMFYSA-N 0 3 376.302 3.406 10 0 GGAEHN CN(C)CCN(Cc1ccco1)C(=O)NCCc1ccccc1Br ZINC000434463023 567310692 /nfs/dbraw/zinc/31/06/92/567310692.db2.gz KZZPBXTXSRBZDV-UHFFFAOYSA-N 0 3 394.313 3.358 10 0 GGAEHN CSc1nnc(CNC(=O)NC[C@H]2CCCN(C)[C@H]2c2cccs2)s1 ZINC000527081517 567310847 /nfs/dbraw/zinc/31/08/47/567310847.db2.gz ZPPSFQATPZPONJ-BXUZGUMPSA-N 0 3 397.595 3.204 10 0 GGAEHN Cc1nccc(NC(=O)N2CCN(CCC(C)(C)C)CC2)c1Br ZINC000527088330 567312744 /nfs/dbraw/zinc/31/27/44/567312744.db2.gz FNJVVCSPNWJHTO-UHFFFAOYSA-N 0 3 383.334 3.160 10 0 GGAEHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)c1cc(F)c(Br)cc1Cl ZINC000476303085 567312946 /nfs/dbraw/zinc/31/29/46/567312946.db2.gz DZJVVWJBFWVZEL-RTHLEPHNSA-N 0 3 375.669 3.454 10 0 GGAEHN COC(=O)CC1(NCC(=O)N[C@@H](C)c2ccc(Br)cc2)CCCC1 ZINC000548426777 567314911 /nfs/dbraw/zinc/31/49/11/567314911.db2.gz GQWQNNLULGYUFE-ZDUSSCGKSA-N 0 3 397.313 3.092 10 0 GGAEHN O[C@H](CNCC1(c2ccc(Br)cc2)CCOCC1)C(F)(F)F ZINC000568254695 567315889 /nfs/dbraw/zinc/31/58/89/567315889.db2.gz JCMGAGSRVZVBQD-CYBMUJFWSA-N 0 3 382.220 3.010 10 0 GGAEHN Cc1cnc(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)s1 ZINC000527158382 567317290 /nfs/dbraw/zinc/31/72/90/567317290.db2.gz ULIOPIZWWTUOML-UHFFFAOYSA-N 0 3 376.448 3.056 10 0 GGAEHN CCO[C@@H]1C[C@@H](NCC(=O)N(C)Cc2cc(Cl)cc(Cl)c2)[C@@H]1SC ZINC000592168075 567319475 /nfs/dbraw/zinc/31/94/75/567319475.db2.gz SXYPFMKFWPXEBR-INMHGKMJSA-N 0 3 391.364 3.450 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)N1CC[C@H]1c1ccc(Br)cc1 ZINC000660699786 567320257 /nfs/dbraw/zinc/32/02/57/567320257.db2.gz GGVROXFSGJQAIB-IRXDYDNUSA-N 0 3 396.329 3.016 10 0 GGAEHN CCN(C(=O)c1cc(C)n(-c2ccc(Br)cc2)n1)[C@@H]1CCN(C)C1 ZINC000617553960 567321297 /nfs/dbraw/zinc/32/12/97/567321297.db2.gz UEVVUXGNTGAXPI-MRXNPFEDSA-N 0 3 391.313 3.109 10 0 GGAEHN CCN(C(=O)c1cc(-c2ccc(Br)cc2)n[nH]1)[C@H]1CCN(C)C1 ZINC000617559344 567321512 /nfs/dbraw/zinc/32/15/12/567321512.db2.gz YNUOTKHRSAQYKI-AWEZNQCLSA-N 0 3 377.286 3.005 10 0 GGAEHN COc1ccc(CNC[C@H]2CS(=O)(=O)c3ccccc32)cc1Br ZINC000568355059 567321573 /nfs/dbraw/zinc/32/15/73/567321573.db2.gz HSNVYSREHXCUCG-ZDUSSCGKSA-N 0 3 396.306 3.118 10 0 GGAEHN CCN(C(=O)CCNc1ncc(C(F)(F)F)cc1Cl)[C@@H]1CCN(C)C1 ZINC000617554991 567321706 /nfs/dbraw/zinc/32/17/06/567321706.db2.gz OADCJELQLIUYFU-GFCCVEGCSA-N 0 3 378.826 3.108 10 0 GGAEHN CCN(C(=O)Cc1csc(Cc2cccc(Cl)c2)n1)[C@H]1CCN(C)C1 ZINC000617551214 567321736 /nfs/dbraw/zinc/32/17/36/567321736.db2.gz NHPDNFFDONOWKQ-KRWDZBQOSA-N 0 3 377.941 3.482 10 0 GGAEHN CCN(C(=O)c1[nH]nc(-c2ccccc2)c1Br)[C@H]1CCN(C)C1 ZINC000617556245 567321911 /nfs/dbraw/zinc/32/19/11/567321911.db2.gz MLFYUIGMRPOILN-ZDUSSCGKSA-N 0 3 377.286 3.005 10 0 GGAEHN CCN(C(=O)c1cc(Br)cc(Br)c1)[C@@H]1CCN(C)C1 ZINC000617552170 567322235 /nfs/dbraw/zinc/32/22/35/567322235.db2.gz IJOSDHLFBZCZNG-CYBMUJFWSA-N 0 3 390.119 3.378 10 0 GGAEHN CCN(C(=O)[C@@H](CCOC)Cc1cccc(Br)c1)[C@@H]1CCN(C)C1 ZINC000617555038 567322278 /nfs/dbraw/zinc/32/22/78/567322278.db2.gz OYWUGYQGSVULSK-FUHWJXTLSA-N 0 3 397.357 3.197 10 0 GGAEHN COC1(CNCc2ccc(I)cc2Cl)CCOCC1 ZINC000500446509 567322355 /nfs/dbraw/zinc/32/23/55/567322355.db2.gz FYOLRIVKCYHBJO-UHFFFAOYSA-N 0 3 395.668 3.230 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N(CC)[C@H]2CCN(C)C2)cc1OC ZINC000617560422 567323256 /nfs/dbraw/zinc/32/32/56/567323256.db2.gz ORCQBBSNOUNPFU-ZDUSSCGKSA-N 0 3 385.302 3.023 10 0 GGAEHN O=C1C[C@]2(CCN(Cc3ccc(-c4ccc(Br)cc4)o3)C2)CN1 ZINC000434747949 567323590 /nfs/dbraw/zinc/32/35/90/567323590.db2.gz NOPBIMUGBWJVSS-GOSISDBHSA-N 0 3 375.266 3.421 10 0 GGAEHN CS(=O)(=O)NC[C@@H]1CCC[C@H]1NCc1cc(C(F)(F)F)ccc1Cl ZINC000500476076 567326035 /nfs/dbraw/zinc/32/60/35/567326035.db2.gz QPWYUCAPIUQJCO-IINYFYTJSA-N 0 3 384.851 3.166 10 0 GGAEHN CS(=O)(=O)NC[C@H]1CCC[C@H]1NCc1ccc(-c2ccccc2Cl)o1 ZINC000500501042 567327509 /nfs/dbraw/zinc/32/75/09/567327509.db2.gz SUHLTUVIELSQCH-CXAGYDPISA-N 0 3 382.913 3.408 10 0 GGAEHN Brc1ccc(S[C@@H]2CCN(C[C@@H]3CCc4ncnn43)C2)cc1 ZINC000639889486 567328069 /nfs/dbraw/zinc/32/80/69/567328069.db2.gz FPCIGEWKKWZQKT-DZGCQCFKSA-N 0 3 379.327 3.395 10 0 GGAEHN CS[C@@H]1CN(C(=O)Nc2cnc(-c3ccc(Cl)s3)nc2)C[C@@H]1N(C)C ZINC000592278250 567328607 /nfs/dbraw/zinc/32/86/07/567328607.db2.gz ONHDQPCCQXGPSL-WCQYABFASA-N 0 3 397.957 3.368 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)c1cc(Br)cs1 ZINC000617700034 567328960 /nfs/dbraw/zinc/32/89/60/567328960.db2.gz ZDIFGGGFILSPBO-HNNXBMFYSA-N 0 3 395.322 3.007 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1csc(Br)c1 ZINC000617697560 567329013 /nfs/dbraw/zinc/32/90/13/567329013.db2.gz CAFXNZHZXDUWJD-OAHLLOKOSA-N 0 3 395.322 3.007 10 0 GGAEHN C[C@@H](C(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1ccc(Cl)s1 ZINC000617700768 567329060 /nfs/dbraw/zinc/32/90/60/567329060.db2.gz LASOWAIBXGEGKN-CZUORRHYSA-N 0 3 378.925 3.388 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)c1ccc(Cl)cc1Cl ZINC000617696344 567329473 /nfs/dbraw/zinc/32/94/73/567329473.db2.gz HHSLDDLTTJHBJX-INIZCTEOSA-N 0 3 379.287 3.490 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)c1c(Cl)cccc1Cl ZINC000617700548 567329761 /nfs/dbraw/zinc/32/97/61/567329761.db2.gz GWADTHUVSFCMOY-HNNXBMFYSA-N 0 3 379.287 3.490 10 0 GGAEHN Cc1cc(Br)c(CNC(=O)NC[C@@]2(N(C)C)CCSC2)s1 ZINC000660825495 567330055 /nfs/dbraw/zinc/33/00/55/567330055.db2.gz UZTXDSALAGLTFC-AWEZNQCLSA-N 0 3 392.388 3.056 10 0 GGAEHN O=C(CCc1ccc(Cl)s1)NCc1ccc(CN2CC[C@H](O)C2)cc1 ZINC000617699622 567330175 /nfs/dbraw/zinc/33/01/75/567330175.db2.gz PLKVHQDICXMXGT-INIZCTEOSA-N 0 3 378.925 3.217 10 0 GGAEHN CN1CCC[C@@H](CNC(=O)N[C@@H]2CSCc3ccc(Br)cc32)C1 ZINC000660847077 567330355 /nfs/dbraw/zinc/33/03/55/567330355.db2.gz NEDFAKMRTFBRBR-BLLLJJGKSA-N 0 3 398.370 3.378 10 0 GGAEHN O=C(CCc1ccc(Cl)s1)NCc1ccc(CN2CC[C@@H](O)C2)cc1 ZINC000617699623 567330378 /nfs/dbraw/zinc/33/03/78/567330378.db2.gz PLKVHQDICXMXGT-MRXNPFEDSA-N 0 3 378.925 3.217 10 0 GGAEHN CN1CCC[C@@H](NC(=O)N[C@@H]2CSCc3ccc(Br)cc32)C1 ZINC000660837885 567330379 /nfs/dbraw/zinc/33/03/79/567330379.db2.gz QGLUDXTYDRCGRD-UKRRQHHQSA-N 0 3 384.343 3.130 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(Br)cn1 ZINC000568518397 567334291 /nfs/dbraw/zinc/33/42/91/567334291.db2.gz BREFFXIPKJTPGJ-OAGGEKHMSA-N 0 3 396.329 3.086 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)c1cc(COc2ccc(Cl)cc2Cl)on1 ZINC000434998198 567337677 /nfs/dbraw/zinc/33/76/77/567337677.db2.gz CBADEJQIZWBLDQ-LBPRGKRZSA-N 0 3 384.263 3.384 10 0 GGAEHN OC[C@@H]1CN(CCc2nc(-c3ccc(Cl)cc3)no2)C[C@H]1C(F)(F)F ZINC000640042719 567339622 /nfs/dbraw/zinc/33/96/22/567339622.db2.gz YTNPNUXUVKGYCP-WCQYABFASA-N 0 3 375.778 3.035 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)Nc1ccnn1Cc1cccc(Cl)c1Cl ZINC000548648487 567340254 /nfs/dbraw/zinc/34/02/54/567340254.db2.gz KAHFQETZWBATDN-ZDUSSCGKSA-N 0 3 382.295 3.454 10 0 GGAEHN C[C@@H](NC(=O)N1CCOc2cc(Br)ccc2C1)C1=CCN(C)CC1 ZINC000661009338 567340451 /nfs/dbraw/zinc/34/04/51/567340451.db2.gz HQYIQODRQDVRQP-CYBMUJFWSA-N 0 3 394.313 3.004 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N1CCO[C@@H](c2cc(F)c(Cl)cc2Cl)C1 ZINC000592509710 567342278 /nfs/dbraw/zinc/34/22/78/567342278.db2.gz JPFMAMMFNJMDJH-MEDUHNTESA-N 0 3 390.286 3.310 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)NC[C@H]1CCN1C(C)(C)C ZINC000661040895 567343237 /nfs/dbraw/zinc/34/32/37/567343237.db2.gz BIHYACKWYIWKSX-CQSZACIVSA-N 0 3 384.318 3.130 10 0 GGAEHN CN(C)CCN(Cc1ccccn1)C(=O)COc1ccc(Cl)c(Cl)c1 ZINC000500772386 567343860 /nfs/dbraw/zinc/34/38/60/567343860.db2.gz GEOWVNRUGHJUKR-UHFFFAOYSA-N 0 3 382.291 3.358 10 0 GGAEHN CN(C(=O)NCc1cc(Cl)ccc1Br)[C@@H]1CCN(C2CC2)C1 ZINC000568625458 567345051 /nfs/dbraw/zinc/34/50/51/567345051.db2.gz LDWQHIUJBVSTQZ-CQSZACIVSA-N 0 3 386.721 3.481 10 0 GGAEHN CCN1CCC(NC(=O)N2CCc3ccc(F)c(Br)c3C2)CC1 ZINC000527592324 567345309 /nfs/dbraw/zinc/34/53/09/567345309.db2.gz GGUDHCSPRUSRGG-UHFFFAOYSA-N 0 3 384.293 3.140 10 0 GGAEHN CCN(C(=O)c1cnn(-c2cccc(Br)c2)c1)[C@H]1CCN(CC)C1 ZINC000617930201 567345936 /nfs/dbraw/zinc/34/59/36/567345936.db2.gz YOCNKDLCNROKGQ-KRWDZBQOSA-N 0 3 391.313 3.191 10 0 GGAEHN CCN(C(=O)c1cn(-c2ccc(Br)cc2)cn1)[C@H]1CCN(CC)C1 ZINC000617926313 567345963 /nfs/dbraw/zinc/34/59/63/567345963.db2.gz BFTBIBPFDJRIMW-INIZCTEOSA-N 0 3 391.313 3.191 10 0 GGAEHN CCN(C(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O)[C@H]1CCN(CC)C1 ZINC000617931790 567345994 /nfs/dbraw/zinc/34/59/94/567345994.db2.gz CZVFJIYCOUFBNS-BBRMVZONSA-N 0 3 381.929 3.086 10 0 GGAEHN CCN(C(=O)[C@H]1CCOc2ccc(Br)cc21)[C@@H]1CCN(CC)C1 ZINC000617922948 567346058 /nfs/dbraw/zinc/34/60/58/567346058.db2.gz WBCLDPQNCFAARB-CABCVRRESA-N 0 3 381.314 3.258 10 0 GGAEHN C[C@H]1C[C@@H](NC(=O)N2CCc3ccc(F)c(Br)c3C2)CCN1C ZINC000527594684 567346073 /nfs/dbraw/zinc/34/60/73/567346073.db2.gz QCZIGYCIUIUCOR-AAEUAGOBSA-N 0 3 384.293 3.139 10 0 GGAEHN C[C@@H](NC(=O)Cc1ccc(Br)cc1[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000548733968 567346179 /nfs/dbraw/zinc/34/61/79/567346179.db2.gz DBKPENJKGMFPQP-UKRRQHHQSA-N 0 3 395.341 3.466 10 0 GGAEHN C[C@@H](NC(=O)Cc1ccc(Br)cc1[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000548733968 567346186 /nfs/dbraw/zinc/34/61/86/567346186.db2.gz DBKPENJKGMFPQP-UKRRQHHQSA-N 0 3 395.341 3.466 10 0 GGAEHN CCN(C(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O)[C@H]1CCN(CC)C1 ZINC000617931793 567346138 /nfs/dbraw/zinc/34/61/38/567346138.db2.gz CZVFJIYCOUFBNS-XJKSGUPXSA-N 0 3 381.929 3.086 10 0 GGAEHN CCN(C(=O)CSc1ncnc2sc(C)c(C)c21)[C@@H]1CCN(CC)C1 ZINC000617933691 567346266 /nfs/dbraw/zinc/34/62/66/567346266.db2.gz WTXMVSYYYDBEIO-CQSZACIVSA-N 0 3 378.567 3.343 10 0 GGAEHN COC(=O)CC1(NCCS(=O)(=O)c2cc(Cl)ccc2Cl)CCCC1 ZINC000548754352 567346807 /nfs/dbraw/zinc/34/68/07/567346807.db2.gz ZCDJZVVYNVBNNA-UHFFFAOYSA-N 0 3 394.320 3.233 10 0 GGAEHN CCN(C(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O)[C@@H]1CCN(CC)C1 ZINC000617931791 567346889 /nfs/dbraw/zinc/34/68/89/567346889.db2.gz CZVFJIYCOUFBNS-CJNGLKHVSA-N 0 3 381.929 3.086 10 0 GGAEHN CCN(C(=O)c1ccn(-c2cccc(Br)c2)n1)[C@H]1CCN(CC)C1 ZINC000617929567 567347056 /nfs/dbraw/zinc/34/70/56/567347056.db2.gz MESMBAGLDRJEKQ-INIZCTEOSA-N 0 3 391.313 3.191 10 0 GGAEHN CCN(C(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O)[C@@H]1CCN(CC)C1 ZINC000617931792 567347320 /nfs/dbraw/zinc/34/73/20/567347320.db2.gz CZVFJIYCOUFBNS-CZUORRHYSA-N 0 3 381.929 3.086 10 0 GGAEHN CCN(C(=O)c1cc2c([nH]1)c(Br)ccc2OC)[C@H]1CCN(CC)C1 ZINC000617931029 567347357 /nfs/dbraw/zinc/34/73/57/567347357.db2.gz OFWVATFNQIFCOP-LBPRGKRZSA-N 0 3 394.313 3.495 10 0 GGAEHN CCCN1CC[C@H](NC(=O)N[C@@H]2CCOc3c(Br)cccc32)C1 ZINC000661127121 567350155 /nfs/dbraw/zinc/35/01/55/567350155.db2.gz HZCARYODKYNEQN-SWLSCSKDSA-N 0 3 382.302 3.056 10 0 GGAEHN CC(C)N1CCN(CCCN2CCc3ccc(F)c(Br)c3C2)CC1 ZINC000527625396 567352025 /nfs/dbraw/zinc/35/20/25/567352025.db2.gz SVJKSWGWEIAJSK-UHFFFAOYSA-N 0 3 398.364 3.362 10 0 GGAEHN Clc1ccc(OCCN2CC[C@H](Cn3ccnn3)C2)c(Br)c1 ZINC000661146092 567352981 /nfs/dbraw/zinc/35/29/81/567352981.db2.gz IIXDGCNOHVPXJQ-LBPRGKRZSA-N 0 3 385.693 3.095 10 0 GGAEHN COC[C@@H](NCC(=O)N[C@H](C)c1ccc(Cl)cc1Cl)C1CCOCC1 ZINC000661160086 567353490 /nfs/dbraw/zinc/35/34/90/567353490.db2.gz XLFGUGFRKPXORZ-SJKOYZFVSA-N 0 3 389.323 3.202 10 0 GGAEHN COC[C@H](NCC(=O)N[C@H](C)c1ccc(Cl)c(Cl)c1)C1CCOCC1 ZINC000661161080 567353579 /nfs/dbraw/zinc/35/35/79/567353579.db2.gz QTFCPYKNIRSQCS-PXAZEXFGSA-N 0 3 389.323 3.202 10 0 GGAEHN C[C@@H]1CCN(CC(=O)N2CCO[C@H](c3ccc(Br)cc3)[C@H]2C)C1 ZINC000618052461 567353947 /nfs/dbraw/zinc/35/39/47/567353947.db2.gz NXBGSZCYDAKWFL-LBTNJELSSA-N 0 3 381.314 3.079 10 0 GGAEHN CCC[C@H](C)[C@@H](CO)N[C@@H](CC)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000568758101 567355142 /nfs/dbraw/zinc/35/51/42/567355142.db2.gz PLZRPRFOMKZCKX-VBNZEHGJSA-N 0 3 376.950 3.086 10 0 GGAEHN CCC[C@H](C)[C@H](CO)N[C@@H](CC)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000568758100 567355176 /nfs/dbraw/zinc/35/51/76/567355176.db2.gz PLZRPRFOMKZCKX-RCBQFDQVSA-N 0 3 376.950 3.086 10 0 GGAEHN CS(=O)(=O)NC[C@@H]1CCC[C@H]1NCc1csc(-c2ccc(Cl)cc2)n1 ZINC000548847268 567355302 /nfs/dbraw/zinc/35/53/02/567355302.db2.gz ZQRANZBPXBIAGL-XJKSGUPXSA-N 0 3 399.969 3.271 10 0 GGAEHN Cc1cc(Br)c(CNC2(CO)CCOCC2)cc1Br ZINC000527662384 567356644 /nfs/dbraw/zinc/35/66/44/567356644.db2.gz PBRBWJHRTXZMGS-UHFFFAOYSA-N 0 3 393.119 3.151 10 0 GGAEHN CO[C@@H]1CCC[C@@H]([C@@H](CO)NCc2cc(Br)cc(F)c2F)C1 ZINC000661219559 567357253 /nfs/dbraw/zinc/35/72/53/567357253.db2.gz USJYIPNVHKWZOY-WDBKCZKBSA-N 0 3 378.257 3.383 10 0 GGAEHN CO[C@@H]1CCC[C@H]([C@@H](CO)NCC(=O)Nc2ccc(Cl)cc2Cl)C1 ZINC000661219368 567357661 /nfs/dbraw/zinc/35/76/61/567357661.db2.gz NFJCCSXDZZCTDJ-NORZTCDRSA-N 0 3 375.296 3.088 10 0 GGAEHN O=S1(=O)CCC(O)(CNCc2ccc(-c3ccccc3)c(Cl)c2)CC1 ZINC000527663682 567357981 /nfs/dbraw/zinc/35/79/81/567357981.db2.gz BMVCMPPVMDJVDI-UHFFFAOYSA-N 0 3 379.909 3.036 10 0 GGAEHN COc1ccc([C@H](CNC(=O)[C@H]2C[C@]2(C)Br)N2CCCC2)cc1 ZINC000527668091 567358345 /nfs/dbraw/zinc/35/83/45/567358345.db2.gz CPTVEGQJGYPZPT-RYRKJORJSA-N 0 3 381.314 3.122 10 0 GGAEHN O=C(NCc1cc(F)ccc1Br)NC[C@H]1CCN1C1CCCC1 ZINC000527669380 567358421 /nfs/dbraw/zinc/35/84/21/567358421.db2.gz FZETZBXKSJDDOR-OAHLLOKOSA-N 0 3 384.293 3.404 10 0 GGAEHN COc1ccc([C@H](CNC(=O)[C@@H]2C[C@]2(C)Br)N2CCCC2)cc1 ZINC000527668087 567358601 /nfs/dbraw/zinc/35/86/01/567358601.db2.gz CPTVEGQJGYPZPT-BQFCYCMXSA-N 0 3 381.314 3.122 10 0 GGAEHN OC[C@H]1CN(Cc2ccccc2)CC[C@@H]1NCc1ccsc1Br ZINC000527663897 567358633 /nfs/dbraw/zinc/35/86/33/567358633.db2.gz GJJCHRSACDWWNO-SJORKVTESA-N 0 3 395.366 3.483 10 0 GGAEHN Cn1cc(N2CCC[C@H](NCc3ccc(Br)c(F)c3F)C2)cn1 ZINC000527664366 567358949 /nfs/dbraw/zinc/35/89/49/567358949.db2.gz DGHAKWAOFWIQCL-LBPRGKRZSA-N 0 3 385.256 3.219 10 0 GGAEHN CO[C@@H]1CCC[C@@H]([C@@H](CO)NCC(=O)Nc2cccc(Cl)c2Cl)C1 ZINC000661221320 567359082 /nfs/dbraw/zinc/35/90/82/567359082.db2.gz RHLBCQVGGPJYNB-LALPHHSUSA-N 0 3 375.296 3.088 10 0 GGAEHN CO[C@@H]1CCC[C@@H]([C@H](CO)NCC(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000661221608 567359390 /nfs/dbraw/zinc/35/93/90/567359390.db2.gz WLRJPEVKUHRYAW-KFNAQCHYSA-N 0 3 375.296 3.088 10 0 GGAEHN O=C(NCc1cc(F)cc(Br)c1)NC[C@@H]1CCN1C1CCCC1 ZINC000527672716 567360492 /nfs/dbraw/zinc/36/04/92/567360492.db2.gz GMNQZIFUPIEXCZ-INIZCTEOSA-N 0 3 384.293 3.404 10 0 GGAEHN CC(C)(COc1ncccc1Br)NCC(=O)NC1CCCCC1 ZINC000501053013 567361203 /nfs/dbraw/zinc/36/12/03/567361203.db2.gz QRKINTMSTVUTRW-UHFFFAOYSA-N 0 3 384.318 3.040 10 0 GGAEHN N[C@@H]1CN(S(=O)(=O)Cc2ccccc2Cl)CC[C@H]1c1ccc(F)cc1 ZINC000568883908 567363172 /nfs/dbraw/zinc/36/31/72/567363172.db2.gz YEMPJKXURIGHJT-FUHWJXTLSA-N 0 3 382.888 3.126 10 0 GGAEHN Cc1cc(C)c(Br)c(C(=O)NCCCNCc2cccnc2)c1 ZINC000568878859 567363495 /nfs/dbraw/zinc/36/34/95/567363495.db2.gz FQCQTKVGTHPJPZ-UHFFFAOYSA-N 0 3 376.298 3.371 10 0 GGAEHN O=C(c1ccc(Br)c(F)c1F)N1CCN(c2ccncc2)CC1 ZINC000527712040 567367142 /nfs/dbraw/zinc/36/71/42/567367142.db2.gz DILREPSWQAEOIM-UHFFFAOYSA-N 0 3 382.208 3.085 10 0 GGAEHN O=c1cc(CN2CCC(C3CCC3)CC2)nc2ccc(Br)cn12 ZINC000661376354 567369201 /nfs/dbraw/zinc/36/92/01/567369201.db2.gz IWGPXGNMWAUTSQ-UHFFFAOYSA-N 0 3 376.298 3.469 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2c(Cl)cc(F)cc2Cl)[C@H](C)C1 ZINC000435443448 567369347 /nfs/dbraw/zinc/36/93/47/567369347.db2.gz NZDJSEWEVXQRRR-YGRLFVJLSA-N 0 3 383.316 3.483 10 0 GGAEHN CC(C)(CNCc1ccsc1Br)[C@H]1COCC12OCCO2 ZINC000527721793 567370009 /nfs/dbraw/zinc/37/00/09/567370009.db2.gz SVJMFPHODLQDSV-GFCCVEGCSA-N 0 3 376.316 3.016 10 0 GGAEHN COc1cc(C[NH2+]C[C@]2(C)COc3ccccc3O2)cc(Br)c1[O-] ZINC000527733354 567370677 /nfs/dbraw/zinc/37/06/77/567370677.db2.gz GGPYYTYXIXMVBD-GOSISDBHSA-N 0 3 394.265 3.483 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)N1CCc2c(ccc(Cl)c2Cl)C1 ZINC000477105225 567370966 /nfs/dbraw/zinc/37/09/66/567370966.db2.gz BAQUTCYVBIMIRO-CQSZACIVSA-N 0 3 386.323 3.172 10 0 GGAEHN Cc1c(Br)cc(CNC[C@H](O)[C@@H]2CCCO2)cc1Br ZINC000527753489 567371707 /nfs/dbraw/zinc/37/17/07/567371707.db2.gz AVCNZDLDOIJEOI-KBPBESRZSA-N 0 3 393.119 3.150 10 0 GGAEHN CCN(Cc1ccccc1Br)C(=O)NC[C@H]1CCCN1CCOC ZINC000477111703 567371749 /nfs/dbraw/zinc/37/17/49/567371749.db2.gz UKJNXVASHASLEG-MRXNPFEDSA-N 0 3 398.345 3.091 10 0 GGAEHN Cc1c(Br)cc(CNC[C@@H](O)[C@@H]2CCCO2)cc1Br ZINC000527753493 567371898 /nfs/dbraw/zinc/37/18/98/567371898.db2.gz AVCNZDLDOIJEOI-KGLIPLIRSA-N 0 3 393.119 3.150 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)N[C@@H](C)Cc1ccc(Cl)cc1Cl ZINC000477130958 567372387 /nfs/dbraw/zinc/37/23/87/567372387.db2.gz BNSIRBRUAJQUTO-BBRMVZONSA-N 0 3 388.339 3.334 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)NCC(=O)Nc1cc(Cl)ccc1Cl ZINC000661398930 567372949 /nfs/dbraw/zinc/37/29/49/567372949.db2.gz WWDQBNJLHLYEQT-GFCCVEGCSA-N 0 3 387.311 3.104 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)NCc2ccc(Br)c(F)c2F)CCN1C ZINC000527807553 567374620 /nfs/dbraw/zinc/37/46/20/567374620.db2.gz LCDRZXWKNLNAKF-MWLCHTKSSA-N 0 3 376.245 3.009 10 0 GGAEHN CCN1CCC(NC(=O)NCc2cc(F)c(Br)cc2F)CC1 ZINC000527795326 567375532 /nfs/dbraw/zinc/37/55/32/567375532.db2.gz LVLPWSAABOHWFY-UHFFFAOYSA-N 0 3 376.245 3.011 10 0 GGAEHN CC(C)(CNCc1cc(Br)cc2c1OCC2)C(=O)N1CCCC1 ZINC000527810578 567376310 /nfs/dbraw/zinc/37/63/10/567376310.db2.gz GSUZOIQXRUNWIE-UHFFFAOYSA-N 0 3 381.314 3.122 10 0 GGAEHN C[C@H]1c2ccccc2C[C@H]1NCc1cc(=O)n2cc(Br)ccc2n1 ZINC000661525560 567378752 /nfs/dbraw/zinc/37/87/52/567378752.db2.gz QKJIAOZAWVQBPB-YVEFUNNKSA-N 0 3 384.277 3.275 10 0 GGAEHN CN(C(=O)c1n[nH]c(-c2ccccc2)c1Br)[C@H]1CN2CCC1CC2 ZINC000569155649 567382506 /nfs/dbraw/zinc/38/25/06/567382506.db2.gz KKSDZACSUPOFGV-AWEZNQCLSA-N 0 3 389.297 3.005 10 0 GGAEHN C[C@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CCC[C@@](O)(C2CC2)C1 ZINC000661630873 567384254 /nfs/dbraw/zinc/38/42/54/567384254.db2.gz CYTFBSPBPZJZSJ-KUHUBIRLSA-N 0 3 395.341 3.033 10 0 GGAEHN CN1CCC2(CC1)C[C@H](NC(=O)[C@@H]1C[C@]1(C)Br)c1ccccc1O2 ZINC000527928950 567384865 /nfs/dbraw/zinc/38/48/65/567384865.db2.gz FBTGWCCJQKFXNZ-MPGHIAIKSA-N 0 3 393.325 3.264 10 0 GGAEHN Cc1ccc(I)cc1C(=O)NCCN1CCCC[C@H]1C ZINC000477304532 567386509 /nfs/dbraw/zinc/38/65/09/567386509.db2.gz CFXVFSZIYUJFSD-CYBMUJFWSA-N 0 3 386.277 3.204 10 0 GGAEHN Cc1c(Cl)cccc1S(=O)(=O)NCc1ccccc1OCCN(C)C ZINC000477296459 567387012 /nfs/dbraw/zinc/38/70/12/567387012.db2.gz HIXLSAGZWKHEQD-UHFFFAOYSA-N 0 3 382.913 3.067 10 0 GGAEHN C[C@H](NCc1cc(F)c(Br)cc1F)C1CCS(=O)(=O)CC1 ZINC000527979369 567387768 /nfs/dbraw/zinc/38/77/68/567387768.db2.gz JHJRKYCPKJIJSS-VIFPVBQESA-N 0 3 382.270 3.030 10 0 GGAEHN CS(=O)(=O)CC1CCC(NCc2cc(F)c(Br)cc2F)CC1 ZINC000527988913 567388668 /nfs/dbraw/zinc/38/86/68/567388668.db2.gz WDOBKJVNGHCQJY-UHFFFAOYSA-N 0 3 396.297 3.420 10 0 GGAEHN O=C(Cc1ccc(Br)cc1O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000477314010 567388836 /nfs/dbraw/zinc/38/88/36/567388836.db2.gz BZNXUOGTJDATPH-QGZVFWFLSA-N 0 3 389.293 3.088 10 0 GGAEHN CN(C(=O)C1(Cc2ccccc2Br)CC1)[C@H]1CCN(C2CC2)C1 ZINC000569244478 567389787 /nfs/dbraw/zinc/38/97/87/567389787.db2.gz UGZLJGUENHUMIE-INIZCTEOSA-N 0 3 377.326 3.467 10 0 GGAEHN O=S(=O)([N-][C@H]1CC[NH2+]C12CCC2)c1cc(Cl)ccc1OCC1CCC1 ZINC000528052783 567391684 /nfs/dbraw/zinc/39/16/84/567391684.db2.gz TVCWAXYRTOWYML-KRWDZBQOSA-N 0 3 384.929 3.082 10 0 GGAEHN O[C@@H](CN[C@H]1CCOc2c(Br)cccc21)COCc1ccco1 ZINC000501517388 567394414 /nfs/dbraw/zinc/39/44/14/567394414.db2.gz GSDJHQHKZDMORK-LRDDRELGSA-N 0 3 382.254 3.033 10 0 GGAEHN COc1cc(-c2noc([C@@H]3C[C@@]3(C)Br)n2)ccc1OCCN(C)C ZINC000528105220 567395502 /nfs/dbraw/zinc/39/55/02/567395502.db2.gz XOKTVYCVNHQFKH-YVEFUNNKSA-N 0 3 396.285 3.327 10 0 GGAEHN O[C@@H](CN[C@@H]1CCOc2c(Br)cccc21)COc1ccccc1F ZINC000501544500 567395700 /nfs/dbraw/zinc/39/57/00/567395700.db2.gz DRURIRAOQUFFJA-BLLLJJGKSA-N 0 3 396.256 3.441 10 0 GGAEHN CO[C@@H](CCNC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)C(F)(F)F ZINC000549576695 567398982 /nfs/dbraw/zinc/39/89/82/567398982.db2.gz URIGDKXBEDYMIH-KGLIPLIRSA-N 0 3 381.826 3.209 10 0 GGAEHN CN1CC[C@@H]2CN(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)C[C@@H]21 ZINC000661900605 567399263 /nfs/dbraw/zinc/39/92/63/567399263.db2.gz UXMBPDUPTHDXEN-PWSUYJOCSA-N 0 3 375.357 3.386 10 0 GGAEHN CO[C@H](CCNC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)C(F)(F)F ZINC000549576697 567399662 /nfs/dbraw/zinc/39/96/62/567399662.db2.gz URIGDKXBEDYMIH-ZIAGYGMSSA-N 0 3 381.826 3.209 10 0 GGAEHN CN1CCC[C@H](NC(=O)NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)C1 ZINC000618555773 567400559 /nfs/dbraw/zinc/40/05/59/567400559.db2.gz VTTAYOHPMHZBLF-DCAQKATOSA-N 0 3 375.357 3.289 10 0 GGAEHN CN(C)C[C@H](NC(=O)c1cc[nH]c(=O)c1Br)c1ccc(Cl)cc1 ZINC000549616988 567401654 /nfs/dbraw/zinc/40/16/54/567401654.db2.gz MNMLABDLYVDOID-ZDUSSCGKSA-N 0 3 398.688 3.236 10 0 GGAEHN O=C(NC1CCN([C@@H]2CCOC2)CC1)N[C@@H]1CCCc2sc(Cl)cc21 ZINC000661987295 567402847 /nfs/dbraw/zinc/40/28/47/567402847.db2.gz PIOCWSUJSHJEGK-UKRRQHHQSA-N 0 3 383.945 3.331 10 0 GGAEHN C[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)Cc2ccc(Br)cc2[O-])C1 ZINC000477620609 567405102 /nfs/dbraw/zinc/40/51/02/567405102.db2.gz HJLRRVZEWVVBEJ-ZDUSSCGKSA-N 0 3 383.330 3.324 10 0 GGAEHN C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)Cc2ccc(Br)cc2[O-])C1 ZINC000477620609 567405108 /nfs/dbraw/zinc/40/51/08/567405108.db2.gz HJLRRVZEWVVBEJ-ZDUSSCGKSA-N 0 3 383.330 3.324 10 0 GGAEHN CN1CCN(CCCOc2cccc(I)c2)C(C)(C)C1 ZINC000501783872 567405753 /nfs/dbraw/zinc/40/57/53/567405753.db2.gz BBLHWOWEZASIKQ-UHFFFAOYSA-N 0 3 388.293 3.086 10 0 GGAEHN CN1CCC[C@H](NC(=O)CCc2ncc(-c3ccccc3Br)o2)C1 ZINC000618666656 567406453 /nfs/dbraw/zinc/40/64/53/567406453.db2.gz MOCYIDDIYVVUES-ZDUSSCGKSA-N 0 3 392.297 3.247 10 0 GGAEHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)[C@H]1C[C@@]1(C)Br ZINC000528276174 567406825 /nfs/dbraw/zinc/40/68/25/567406825.db2.gz BFVHRRDKHSXREB-MLGOLLRUSA-N 0 3 375.257 3.029 10 0 GGAEHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)[C@@H]1C[C@@]1(C)Br ZINC000528276169 567407112 /nfs/dbraw/zinc/40/71/12/567407112.db2.gz BFVHRRDKHSXREB-BLLLJJGKSA-N 0 3 375.257 3.029 10 0 GGAEHN O=C(COc1ccc2cc(Br)ccc2c1)N[C@@H]1CNCCC1(F)F ZINC000569484040 567408369 /nfs/dbraw/zinc/40/83/69/567408369.db2.gz ZTATUZUKHZOKJM-OAHLLOKOSA-N 0 3 399.235 3.095 10 0 GGAEHN CN(C(=O)N[C@H]1CCc2c1cccc2Br)[C@H]1CCN(C2CC2)C1 ZINC000477689520 567409493 /nfs/dbraw/zinc/40/94/93/567409493.db2.gz JBZNZZQRZLARHQ-GUYCJALGSA-N 0 3 378.314 3.315 10 0 GGAEHN C[C@@]1(Br)C[C@H]1C(=O)N1CCCN(CCCc2ccccc2)CC1 ZINC000528348336 567413451 /nfs/dbraw/zinc/41/34/51/567413451.db2.gz FXAYUMAYVATTSX-PKOBYXMFSA-N 0 3 379.342 3.327 10 0 GGAEHN Cc1nc2ccc(Br)cc2c(NCCc2nnc3n2CCC3)c1C ZINC000436200011 567413713 /nfs/dbraw/zinc/41/37/13/567413713.db2.gz DLQBJAKSQIJCBS-UHFFFAOYSA-N 0 3 386.297 3.228 10 0 GGAEHN CC(C)(C)N1CC[C@@H](NCCCS(C)(=O)=O)[C@H]1c1ccc(Cl)c(F)c1 ZINC000569573901 567415808 /nfs/dbraw/zinc/41/58/08/567415808.db2.gz HKTFOBAXYOOYIY-IAGOWNOFSA-N 0 3 390.952 3.417 10 0 GGAEHN Cc1onc(-c2cccc(Br)c2)c1C(=O)NC[C@@H]1CCCN1C ZINC000502004004 567416188 /nfs/dbraw/zinc/41/61/88/567416188.db2.gz UJXVIIFVRXBXRU-AWEZNQCLSA-N 0 3 378.270 3.237 10 0 GGAEHN CC(C)Nc1cc(Br)ccc1NC(=O)c1ccn(CCN(C)C)n1 ZINC000618883873 567420870 /nfs/dbraw/zinc/42/08/70/567420870.db2.gz XUFXTHLATZOTOY-UHFFFAOYSA-N 0 3 394.317 3.280 10 0 GGAEHN CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)C[C@H]1CCC2(CNC2)O1 ZINC000662248900 567422097 /nfs/dbraw/zinc/42/20/97/567422097.db2.gz FDKLQEJCEPDFQZ-CQSZACIVSA-N 0 3 386.323 3.165 10 0 GGAEHN CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)C[C@@H]1CCC2(CNC2)O1 ZINC000662248899 567422463 /nfs/dbraw/zinc/42/24/63/567422463.db2.gz FDKLQEJCEPDFQZ-AWEZNQCLSA-N 0 3 386.323 3.165 10 0 GGAEHN COc1ccccc1[C@H]1[C@@H](N)CCCN1C(=O)c1cc(Br)c[nH]1 ZINC000569668506 567422606 /nfs/dbraw/zinc/42/26/06/567422606.db2.gz QAAIWPCBDNWSNA-BBRMVZONSA-N 0 3 378.270 3.090 10 0 GGAEHN CS[C@@H]1CN(c2nn3cc(C4CCCC4)nc3s2)C[C@H]1N1CCCC1 ZINC000436428109 567423556 /nfs/dbraw/zinc/42/35/56/567423556.db2.gz JIWNGBLJOVZIDE-HZPDHXFCSA-N 0 3 377.583 3.464 10 0 GGAEHN O=S(=O)(NC[C@H]1CCN1C1CCCCC1)C1CCC(C(F)(F)F)CC1 ZINC000528476903 567427624 /nfs/dbraw/zinc/42/76/24/567427624.db2.gz NOFQNQDDTYHCLX-OGVSOVDVSA-N 0 3 382.492 3.434 10 0 GGAEHN COCC1(NCC(=O)N(C)Cc2cc(Br)cs2)CCCCC1 ZINC000662342056 567428949 /nfs/dbraw/zinc/42/89/49/567428949.db2.gz VKTFWYYMXWEUHD-UHFFFAOYSA-N 0 3 389.359 3.408 10 0 GGAEHN C[C@H]1CN(C2CCOCC2)CCN1Cc1ccc(Br)c(F)c1F ZINC000528480968 567428953 /nfs/dbraw/zinc/42/89/53/567428953.db2.gz NLFADKNOIBCOHD-LBPRGKRZSA-N 0 3 389.284 3.412 10 0 GGAEHN CCN1CC[C@H]2OCCN(Cc3ccc(Br)c(F)c3F)[C@H]2C1 ZINC000528512220 567431768 /nfs/dbraw/zinc/43/17/68/567431768.db2.gz IPCSQEKWFQLXQS-UONOGXRCSA-N 0 3 375.257 3.022 10 0 GGAEHN C[C@H]1COCCN1C1CCN(Cc2ccc(Br)c(F)c2F)CC1 ZINC000528510822 567432353 /nfs/dbraw/zinc/43/23/53/567432353.db2.gz RBZLDDQQUQADLO-LBPRGKRZSA-N 0 3 389.284 3.412 10 0 GGAEHN CCOC(=O)CC1(NCc2cn3cc(Br)ccc3n2)CCCC1 ZINC000619060877 567432582 /nfs/dbraw/zinc/43/25/82/567432582.db2.gz LQZASWNQSYGJHJ-UHFFFAOYSA-N 0 3 380.286 3.452 10 0 GGAEHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)[C@@H]1C[C@]1(C)Br ZINC000528513157 567432678 /nfs/dbraw/zinc/43/26/78/567432678.db2.gz RLLZGHHBTSHWSJ-RYRKJORJSA-N 0 3 380.330 3.068 10 0 GGAEHN CNCc1cccc(NC(=O)[C@@H]2CCO[C@H]2c2cncc(Br)c2)c1 ZINC000662399464 567433776 /nfs/dbraw/zinc/43/37/76/567433776.db2.gz NRTKBZBNUKQIMP-SJORKVTESA-N 0 3 390.281 3.280 10 0 GGAEHN CC1(C)CCCN1CCNC(=O)c1c(F)cccc1I ZINC000457048090 567434627 /nfs/dbraw/zinc/43/46/27/567434627.db2.gz DKSWAOLEQQXHDR-UHFFFAOYSA-N 0 3 390.240 3.035 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)c1sc2c(c1Br)CNC2 ZINC000662450226 567438144 /nfs/dbraw/zinc/43/81/44/567438144.db2.gz LFXDIWBJZOBTOY-GHMZBOCLSA-N 0 3 386.359 3.107 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)CCc3ccc(Br)c(C)c3)[C@H]2C1 ZINC000502519840 567439741 /nfs/dbraw/zinc/43/97/41/567439741.db2.gz UENSIIAWOXZFPG-ZWKOTPCHSA-N 0 3 395.341 3.012 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@@H]3C[C@H]3c3cc(Cl)cc(Cl)c3)[C@H]2C1 ZINC000502516142 567439856 /nfs/dbraw/zinc/43/98/56/567439856.db2.gz JHMPMHOWRPNWOJ-XWTMOSNGSA-N 0 3 383.319 3.419 10 0 GGAEHN CN(C)CCOc1ccc(NC(=O)[C@H]2C[C@@]2(C)Br)cc1Cl ZINC000528590892 567441493 /nfs/dbraw/zinc/44/14/93/567441493.db2.gz IHNFHIXVFHJPHX-IAQYHMDHSA-N 0 3 375.694 3.392 10 0 GGAEHN O=C(c1cc2c(s1)CCNC2)N1CCc2cccc(Br)c2C1 ZINC000662497973 567441808 /nfs/dbraw/zinc/44/18/08/567441808.db2.gz KTOLMGBBNQXSQW-UHFFFAOYSA-N 0 3 377.307 3.355 10 0 GGAEHN CCO[C@@H]1C[C@@H](NCc2cc(Br)c(OC)s2)[C@@H]1n1cccn1 ZINC000550327226 567441824 /nfs/dbraw/zinc/44/18/24/567441824.db2.gz SHECLIHOFRQDNY-MCIONIFRSA-N 0 3 386.315 3.224 10 0 GGAEHN CS[C@H](C)C(=O)N1CCC(N2CCN(c3cccc(Cl)c3)CC2)CC1 ZINC000457119290 567442229 /nfs/dbraw/zinc/44/22/29/567442229.db2.gz RGZFBCYJELGQAK-OAHLLOKOSA-N 0 3 381.973 3.205 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)CCOc3ccc(Cl)c(Cl)c3)[C@H]2C1 ZINC000502570440 567443761 /nfs/dbraw/zinc/44/37/61/567443761.db2.gz OUJVXHUDZGLUSL-DLBZAZTESA-N 0 3 387.307 3.084 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@@H](C)Oc3cccc(Cl)c3Cl)[C@H]2C1 ZINC000502575198 567444328 /nfs/dbraw/zinc/44/43/28/567444328.db2.gz GBWBIZWCGFHEND-VHDGCEQUSA-N 0 3 387.307 3.082 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3cc(Cl)cc(Br)c3)[C@H]2C1 ZINC000502620116 567445118 /nfs/dbraw/zinc/44/51/18/567445118.db2.gz WNCRIHVUDHPNEY-LSDHHAIUSA-N 0 3 387.705 3.038 10 0 GGAEHN COCCN1CC[C@@H](NC(=O)c2cc(Br)cc3ccccc32)C1 ZINC000593915465 567446362 /nfs/dbraw/zinc/44/63/62/567446362.db2.gz NHCDDTVQAZTXSG-OAHLLOKOSA-N 0 3 377.282 3.053 10 0 GGAEHN NC1(C(=O)N2CCO[C@@H](c3ccc(Br)cc3)C2)CC2(CCC2)C1 ZINC000662527767 567446734 /nfs/dbraw/zinc/44/67/34/567446734.db2.gz HGVDCXJRGXMZAA-OAHLLOKOSA-N 0 3 379.298 3.011 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)C3(c4c(Cl)cccc4Cl)CC3)[C@H]2C1 ZINC000502677220 567446776 /nfs/dbraw/zinc/44/67/76/567446776.db2.gz GBIJCIRYZRAEMU-JKSUJKDBSA-N 0 3 383.319 3.347 10 0 GGAEHN O=C(N1CCO[C@@H](c2ccc(Br)cc2)C1)C1(NC2CC2)CCC1 ZINC000662528374 567446926 /nfs/dbraw/zinc/44/69/26/567446926.db2.gz NROBNQRQPDJKHN-MRXNPFEDSA-N 0 3 379.298 3.024 10 0 GGAEHN O=C(C[C@H]1NCc2ccccc21)N1CCOc2ccc(Br)cc2C1 ZINC000662545019 567448156 /nfs/dbraw/zinc/44/81/56/567448156.db2.gz KLKKUJFAMIIXIE-QGZVFWFLSA-N 0 3 387.277 3.405 10 0 GGAEHN CCCN1CCC(CNS(=O)(=O)c2ccc(OC(F)F)c(Cl)c2)CC1 ZINC000502735232 567448388 /nfs/dbraw/zinc/44/83/88/567448388.db2.gz DDJLSVBMHMCNJF-UHFFFAOYSA-N 0 3 396.887 3.342 10 0 GGAEHN COc1cc2c(cc1OC)CCN(Cc1cncc(Br)c1)CC2 ZINC000502725729 567448487 /nfs/dbraw/zinc/44/84/87/567448487.db2.gz CFUMXNVLXDTZJB-UHFFFAOYSA-N 0 3 377.282 3.462 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)C(C)(C)c3cccc(Br)c3)[C@H]2C1 ZINC000502715083 567448639 /nfs/dbraw/zinc/44/86/39/567448639.db2.gz ZSDYXSCXAIRHBE-DLBZAZTESA-N 0 3 395.341 3.048 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)CCOc3ccc(Cl)cc3Cl)[C@H]2C1 ZINC000502726660 567448801 /nfs/dbraw/zinc/44/88/01/567448801.db2.gz ODYXXUNBLSFVHC-DOTOQJQBSA-N 0 3 387.307 3.084 10 0 GGAEHN CN(Cc1ccc(Br)o1)C(=O)Nc1ccc2c(c1)OCCNC2 ZINC000528716750 567451135 /nfs/dbraw/zinc/45/11/35/567451135.db2.gz WRCVYHAWDLEFSM-UHFFFAOYSA-N 0 3 380.242 3.188 10 0 GGAEHN O=C(C[C@@H]1NCc2ccccc21)N1CCOc2cccc(Br)c2C1 ZINC000662585235 567451239 /nfs/dbraw/zinc/45/12/39/567451239.db2.gz SWMBOWCNLXSCJT-KRWDZBQOSA-N 0 3 387.277 3.405 10 0 GGAEHN C[C@H]1O[C@@H](C)[C@H](C)[C@H]1NCC(=O)Nc1ccc(Br)cc1Cl ZINC000528757499 567453312 /nfs/dbraw/zinc/45/33/12/567453312.db2.gz CFLJKKVSVQMAMR-SPTRTOBYSA-N 0 3 375.694 3.443 10 0 GGAEHN COC(=O)c1cnc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)c(Cl)c1 ZINC000594031926 567453481 /nfs/dbraw/zinc/45/34/81/567453481.db2.gz QROBFZCTXVTBKC-VHSXEESVSA-N 0 3 380.750 3.208 10 0 GGAEHN Brc1cc(CNCCCn2ccnn2)c(Br)s1 ZINC000641748407 567454381 /nfs/dbraw/zinc/45/43/81/567454381.db2.gz XIERFNPUCLYXCW-UHFFFAOYSA-N 0 3 380.109 3.045 10 0 GGAEHN CC(C)c1[nH]nc(C(=O)Nc2ccc([C@@H]3CNCCO3)cc2)c1Br ZINC000662685529 567455794 /nfs/dbraw/zinc/45/57/94/567455794.db2.gz DVRXRAMRWQTUDZ-ZDUSSCGKSA-N 0 3 393.285 3.209 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2cc(SC)ccc2Cl)CC1 ZINC000478440252 567456288 /nfs/dbraw/zinc/45/62/88/567456288.db2.gz WRAUYBALOWHKBF-UHFFFAOYSA-N 0 3 377.897 3.428 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2c(Cl)cc(F)cc2Cl)CC1 ZINC000478442768 567457076 /nfs/dbraw/zinc/45/70/76/567457076.db2.gz ITRDMWFPSSURHD-UHFFFAOYSA-N 0 3 384.238 3.499 10 0 GGAEHN FC(F)O[C@H]1CCN(CCCOc2cccc(I)c2)C1 ZINC000570109286 567458307 /nfs/dbraw/zinc/45/83/07/567458307.db2.gz MVMBKRGZAKLKFJ-ZDUSSCGKSA-N 0 3 397.203 3.374 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2csc(Br)c2C)CC1 ZINC000478452351 567458595 /nfs/dbraw/zinc/45/85/95/567458595.db2.gz PWPVMBQXYXPJLY-UHFFFAOYSA-N 0 3 396.310 3.185 10 0 GGAEHN O=C(CCN1CCC[C@@H]1c1ccc(=O)[nH]n1)Nc1cccc(Br)c1 ZINC000528797114 567458881 /nfs/dbraw/zinc/45/88/81/567458881.db2.gz VEHZYDXWIVQVNP-OAHLLOKOSA-N 0 3 391.269 3.110 10 0 GGAEHN COc1ccccc1[C@H]1[C@@H](N)CCCN1C(=O)c1cc(Br)cn1C ZINC000457361923 567460376 /nfs/dbraw/zinc/46/03/76/567460376.db2.gz LGHVXPHEIRNYIF-YOEHRIQHSA-N 0 3 392.297 3.101 10 0 GGAEHN CCN1CC[C@H](N(C)C(=O)c2sc3c(c2Br)CNC3)C[C@H]1C ZINC000662743904 567460532 /nfs/dbraw/zinc/46/05/32/567460532.db2.gz WZXTUZKPQNZWEZ-MNOVXSKESA-N 0 3 386.359 3.059 10 0 GGAEHN O=C([C@@H]1CNCc2ccccc21)N1CCOc2cc(Br)ccc2C1 ZINC000662743509 567460790 /nfs/dbraw/zinc/46/07/90/567460790.db2.gz KGQTYEJOUDIVBM-QGZVFWFLSA-N 0 3 387.277 3.057 10 0 GGAEHN NC[C@@H](C(=O)N1CCOc2cc(Br)ccc2C1)c1ccc(F)cc1 ZINC000662740493 567460827 /nfs/dbraw/zinc/46/08/27/567460827.db2.gz GPJXEGJSNHAXHG-MRXNPFEDSA-N 0 3 393.256 3.052 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2scc(C)c2Br)CC1 ZINC000478492976 567462265 /nfs/dbraw/zinc/46/22/65/567462265.db2.gz WFLQSHIBRAIACT-UHFFFAOYSA-N 0 3 396.310 3.185 10 0 GGAEHN O=S(=O)(CCN[C@@H]1CCc2ccccc2C1)c1cccc(Br)c1 ZINC000570155865 567462648 /nfs/dbraw/zinc/46/26/48/567462648.db2.gz RVPBLOMIRLZOIS-QGZVFWFLSA-N 0 3 394.334 3.370 10 0 GGAEHN CSC1(CNC(=O)N[C@H](c2ccc(C)o2)C(F)(F)F)CCN(C)CC1 ZINC000594161333 567463746 /nfs/dbraw/zinc/46/37/46/567463746.db2.gz HMHQDVLKNOMYMH-CYBMUJFWSA-N 0 3 379.448 3.318 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)N[C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000503026637 567465433 /nfs/dbraw/zinc/46/54/33/567465433.db2.gz NYLNMGJGCOIFJQ-BLLLJJGKSA-N 0 3 386.323 3.391 10 0 GGAEHN O=C(c1cccc2c1CNC2)N1CCOC[C@H]1c1cccc(Br)c1 ZINC000662880518 567467611 /nfs/dbraw/zinc/46/76/11/567467611.db2.gz AJYSJYMCEDTAQK-SFHVURJKSA-N 0 3 387.277 3.266 10 0 GGAEHN CC(C)N1CCC[C@@H](NC(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000503067048 567468157 /nfs/dbraw/zinc/46/81/57/567468157.db2.gz ZRLQBAXIKKBSSS-LLVKDONJSA-N 0 3 375.257 3.259 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)Nc1ccc(F)c(Br)c1F ZINC000662922734 567468768 /nfs/dbraw/zinc/46/87/68/567468768.db2.gz XHVZZKTUFCVBQI-UDZBDMMHSA-N 0 3 389.240 3.198 10 0 GGAEHN COc1cc(NC(=O)c2cn[n-]c2[C@H]2CC[NH2+]C2)c(Cl)cc1Br ZINC000662920014 567468994 /nfs/dbraw/zinc/46/89/94/567468994.db2.gz QQQKNOUXEDCGLL-QMMMGPOBSA-N 0 3 399.676 3.163 10 0 GGAEHN CS[C@@H]1CN(C(=O)C[C@H]2OCc3cc(Cl)ccc32)C[C@H]1N1CCCC1 ZINC000594339529 567469403 /nfs/dbraw/zinc/46/94/03/567469403.db2.gz QHGIFNJHHWJCRA-KZNAEPCWSA-N 0 3 380.941 3.340 10 0 GGAEHN C[C@@H]1OC(C)(C)N[C@@H]1CNC(=O)Nc1cc(-c2ccc(Cl)s2)nn1C ZINC000570262760 567470240 /nfs/dbraw/zinc/47/02/40/567470240.db2.gz AKYBZFTWNRXJMQ-GXSJLCMTSA-N 0 3 383.905 3.037 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)Cc1c(F)ccc(Br)c1F ZINC000503165691 567470766 /nfs/dbraw/zinc/47/07/66/567470766.db2.gz BCPBFDIXAGLWRA-NSHDSACASA-N 0 3 377.273 3.362 10 0 GGAEHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)c1cc(Br)cc2[nH]cnc21 ZINC000503183375 567471922 /nfs/dbraw/zinc/47/19/22/567471922.db2.gz UXCRHRHDEXWCKM-NWDGAFQWSA-N 0 3 379.302 3.176 10 0 GGAEHN CC[NH+](CC)CCC[N-]S(=O)(=O)c1cccc(Br)c1Cl ZINC000551082940 567476841 /nfs/dbraw/zinc/47/68/41/567476841.db2.gz MBTFHQPANROTDL-UHFFFAOYSA-N 0 3 383.739 3.113 10 0 GGAEHN COc1cc(CN[C@H]2CCCN(C)C2)cc(Br)c1OC(F)F ZINC000619771172 567480116 /nfs/dbraw/zinc/48/01/16/567480116.db2.gz STPLMHPRGLGTQH-NSHDSACASA-N 0 3 379.245 3.243 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)c1cc(Br)cc2[nH]cnc21 ZINC000503293126 567480580 /nfs/dbraw/zinc/48/05/80/567480580.db2.gz SGWDUFSTYDBPHD-TXEJJXNPSA-N 0 3 379.302 3.318 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CNCC[C@H](C)[S@@](C)=O ZINC000594498744 567482417 /nfs/dbraw/zinc/48/24/17/567482417.db2.gz VISNDRXNNMYRDT-AMXDTQDGSA-N 0 3 384.343 3.190 10 0 GGAEHN C[C@H]1CN(C)CC[C@H]1N(C)S(=O)(=O)c1cccc(Br)c1Cl ZINC000551168324 567482791 /nfs/dbraw/zinc/48/27/91/567482791.db2.gz XUUHFSXGGRHQER-CMPLNLGQSA-N 0 3 395.750 3.063 10 0 GGAEHN C[C@@H](CN(C)C)NC(=O)c1cccnc1Oc1ccc(F)cc1Br ZINC000570420619 567482855 /nfs/dbraw/zinc/48/28/55/567482855.db2.gz MLMZEEPUGURHBA-NSHDSACASA-N 0 3 396.260 3.455 10 0 GGAEHN OC[C@@H](NCc1cnc(-c2ccc(Br)cc2)s1)C1CCOCC1 ZINC000570426425 567483631 /nfs/dbraw/zinc/48/36/31/567483631.db2.gz NGAUWTQBVONZDF-MRXNPFEDSA-N 0 3 397.338 3.450 10 0 GGAEHN Cc1ccc(Br)c(OCC(=O)NC2CCN(C3CC3)CC2)c1F ZINC000478835403 567485702 /nfs/dbraw/zinc/48/57/02/567485702.db2.gz IZSHUVQQMNQXBC-UHFFFAOYSA-N 0 3 385.277 3.018 10 0 GGAEHN NC(=O)[C@H](NC1CCC(OC(F)F)CC1)c1ccc(Br)cc1 ZINC000642707711 567485875 /nfs/dbraw/zinc/48/58/75/567485875.db2.gz JZESYQBJVZDGDH-WXRRBKDZSA-N 0 3 377.229 3.116 10 0 GGAEHN CCCN1CC[C@@H](NC(=O)c2c(F)c(F)c(Br)c(F)c2F)C1 ZINC000619903635 567486405 /nfs/dbraw/zinc/48/64/05/567486405.db2.gz BGCZFLJCRNILFP-SSDOTTSWSA-N 0 3 383.183 3.220 10 0 GGAEHN CSc1cc(Br)ccc1CN[C@H](CO)C[C@H](O)C(C)(C)C ZINC000551219364 567489808 /nfs/dbraw/zinc/48/98/08/567489808.db2.gz JUIZTMDGQZTMSS-ZFWWWQNUSA-N 0 3 376.360 3.419 10 0 GGAEHN COC[C@@](C)(CCO)NCc1cc(Br)c(C)c(Br)c1 ZINC000551244183 567492051 /nfs/dbraw/zinc/49/20/51/567492051.db2.gz ALHBNOVSYIHAQN-CQSZACIVSA-N 0 3 395.135 3.397 10 0 GGAEHN CCOc1cc(CN[C@H](C)Cn2cc(Br)ccc2=O)ccc1OC ZINC000551264903 567492463 /nfs/dbraw/zinc/49/24/63/567492463.db2.gz FTROENGGEZICJE-CYBMUJFWSA-N 0 3 395.297 3.196 10 0 GGAEHN CCc1ccc(S(=O)(=O)N(C)C[C@@H]2CCN(Cc3ccccc3)C2)s1 ZINC000437333668 567493753 /nfs/dbraw/zinc/49/37/53/567493753.db2.gz ORMBUVONKOLKMI-KRWDZBQOSA-N 0 3 378.563 3.453 10 0 GGAEHN CC[C@@H](Cn1cncn1)N[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O ZINC000551279331 567494217 /nfs/dbraw/zinc/49/42/17/567494217.db2.gz FIMNQTDWULNZQG-ZFWWWQNUSA-N 0 3 382.295 3.149 10 0 GGAEHN C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)N1CCN2CCC1CC2 ZINC000551290692 567494530 /nfs/dbraw/zinc/49/45/30/567494530.db2.gz GRJKPIQRIKKIQD-GFCCVEGCSA-N 0 3 384.293 3.009 10 0 GGAEHN CN(C[C@H]1CCCN(C)C1)C(=O)Cc1c(F)ccc(Br)c1F ZINC000503634177 567498163 /nfs/dbraw/zinc/49/81/63/567498163.db2.gz PHFDEAUTDWSDSJ-NSHDSACASA-N 0 3 375.257 3.070 10 0 GGAEHN COC[C@@H](O)CN[C@@H]1CCCc2c(Br)cc(Br)cc21 ZINC000479051707 567498530 /nfs/dbraw/zinc/49/85/30/567498530.db2.gz ARXUHDYDQFYHEX-IINYFYTJSA-N 0 3 393.119 3.186 10 0 GGAEHN COC1CCN(C(C)(C)CNC(=O)N2CCc3sc(Cl)cc3C2)CC1 ZINC000570628442 567500459 /nfs/dbraw/zinc/50/04/59/567500459.db2.gz WNVCIOBATIBRBA-UHFFFAOYSA-N 0 3 385.961 3.359 10 0 GGAEHN CN(C)CCN(Cc1ccco1)C(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503692498 567502196 /nfs/dbraw/zinc/50/21/96/567502196.db2.gz OVJCEHFKQFHVEV-UHFFFAOYSA-N 0 3 391.269 3.122 10 0 GGAEHN C[C@H](O)[C@H](NCCC(=O)Nc1cccc(Br)c1)c1ccccc1 ZINC000663376993 567502380 /nfs/dbraw/zinc/50/23/80/567502380.db2.gz XPHDZHZLPQWSMY-UGSOOPFHSA-N 0 3 377.282 3.489 10 0 GGAEHN C[C@H](c1ccccc1)[C@@H](O)CNC[C@@H](O)COc1c(Cl)cccc1Cl ZINC000663380774 567502744 /nfs/dbraw/zinc/50/27/44/567502744.db2.gz ZPOAEDAHPQVZLT-SIIHOXLZSA-N 0 3 384.303 3.487 10 0 GGAEHN CC(C)N1CC[C@H](N(C)C(=O)N[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000457937937 567507478 /nfs/dbraw/zinc/50/74/78/567507478.db2.gz PEPJLLKHTSQFJQ-GOEBONIOSA-N 0 3 396.329 3.397 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NCc1cnccc1C(F)(F)F ZINC000663470614 567510865 /nfs/dbraw/zinc/51/08/65/567510865.db2.gz NTULMNRUMUPCCA-JTQLQIEISA-N 0 3 390.203 3.203 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)Nc1cc(Br)ccc1Br ZINC000620321956 567511528 /nfs/dbraw/zinc/51/15/28/567511528.db2.gz DRQUDNVGKBSCNV-JTQLQIEISA-N 0 3 391.107 3.427 10 0 GGAEHN CCN(C(=O)N[C@H](C)c1ccc(OC)c(Br)c1)[C@@H]1CCN(C)C1 ZINC000663516477 567513134 /nfs/dbraw/zinc/51/31/34/567513134.db2.gz QNGPSUUPRHYQOQ-TZMCWYRMSA-N 0 3 384.318 3.254 10 0 GGAEHN CCN(C(=O)NCCc1ccc(-c2csc(C)n2)s1)[C@H]1CCN(C)C1 ZINC000663526884 567514499 /nfs/dbraw/zinc/51/44/99/567514499.db2.gz WIGDZWZSXSKWFA-AWEZNQCLSA-N 0 3 378.567 3.458 10 0 GGAEHN C[C@@H](Oc1ccccc1Br)C(=O)N1CCc2ccccc2[C@@H]1CN ZINC000570801881 567515719 /nfs/dbraw/zinc/51/57/19/567515719.db2.gz GMPDRHQBSVJPJR-DYVFJYSZSA-N 0 3 389.293 3.301 10 0 GGAEHN COc1cc(Br)ccc1CN1CCC[C@@H](N2CCOCC2)CC1 ZINC000570866250 567518805 /nfs/dbraw/zinc/51/88/05/567518805.db2.gz KTMBHKXVDBHIDY-QGZVFWFLSA-N 0 3 383.330 3.144 10 0 GGAEHN O=C(c1cccc(F)c1Br)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000551593862 567523145 /nfs/dbraw/zinc/52/31/45/567523145.db2.gz UDJBRFVERFXSOP-CQSZACIVSA-N 0 3 399.304 3.305 10 0 GGAEHN COC(=O)[C@@H]1C[C@@H]1[C@H](C)NCc1cc(Br)ccc1OC(F)F ZINC000594918511 567525073 /nfs/dbraw/zinc/52/50/73/567525073.db2.gz BEKRTXJCMVNANG-XXILOJSOSA-N 0 3 378.213 3.338 10 0 GGAEHN COC(=O)[C@@H]1C[C@H]1[C@@H](C)NCc1cc(Br)ccc1OC(F)F ZINC000594918509 567525000 /nfs/dbraw/zinc/52/50/00/567525000.db2.gz BEKRTXJCMVNANG-JFUSQASVSA-N 0 3 378.213 3.338 10 0 GGAEHN CN(C)CCN(Cc1ccccn1)c1nc(C2CC2)ncc1Br ZINC000663731657 567525447 /nfs/dbraw/zinc/52/54/47/567525447.db2.gz OHJTVRYOJUAKFS-UHFFFAOYSA-N 0 3 376.302 3.080 10 0 GGAEHN Brc1cnc(C2CC2)nc1N1CC[C@H](OCCN2CCCCC2)C1 ZINC000663732308 567525597 /nfs/dbraw/zinc/52/55/97/567525597.db2.gz VAFXOAOSPBZBQW-HNNXBMFYSA-N 0 3 395.345 3.198 10 0 GGAEHN CC[C@H](Cc1ccccc1Br)NC(=O)N1CCN2CCC1CC2 ZINC000551644166 567525998 /nfs/dbraw/zinc/52/59/98/567525998.db2.gz KKIBMWRCVJWMBL-OAHLLOKOSA-N 0 3 380.330 3.260 10 0 GGAEHN CC1(C)CN(CCCOc2cccc(I)c2)CC[C@H]1O ZINC000438338973 567526299 /nfs/dbraw/zinc/52/62/99/567526299.db2.gz CCNTZZINUGAOIC-OAHLLOKOSA-N 0 3 389.277 3.153 10 0 GGAEHN CCN1CCC[C@H](NC(=O)c2cc(C)n(-c3ccc(Br)cc3)n2)C1 ZINC000479344412 567526399 /nfs/dbraw/zinc/52/63/99/567526399.db2.gz CCTAWXJBSYNIDH-HNNXBMFYSA-N 0 3 391.313 3.157 10 0 GGAEHN O=C(Nc1nnc(SCc2ccc(F)cc2)s1)[C@H]1CNCCC1(F)F ZINC000644017137 567526803 /nfs/dbraw/zinc/52/68/03/567526803.db2.gz AEHZAMFZOYFVIU-LLVKDONJSA-N 0 3 388.440 3.153 10 0 GGAEHN Clc1ccc(I)c(CN[C@H]2CCc3nc[nH]c3C2)c1 ZINC000594943195 567527563 /nfs/dbraw/zinc/52/75/63/567527563.db2.gz ICAHHYXHLQYETM-NSHDSACASA-N 0 3 387.652 3.315 10 0 GGAEHN Clc1ccc(I)c(CN[C@H]2CCc3[nH]cnc3C2)c1 ZINC000594943195 567527567 /nfs/dbraw/zinc/52/75/67/567527567.db2.gz ICAHHYXHLQYETM-NSHDSACASA-N 0 3 387.652 3.315 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)[C@@H](CN)c1ccccc1 ZINC000570962308 567527609 /nfs/dbraw/zinc/52/76/09/567527609.db2.gz VLZOFIIPFKMXHX-LRDDRELGSA-N 0 3 377.282 3.377 10 0 GGAEHN CN1CCN(c2ccncc2NC(=O)c2cc3cc(Cl)sc3[nH]2)CC1 ZINC000570984813 567528199 /nfs/dbraw/zinc/52/81/99/567528199.db2.gz MLLLNEJWYVHAPA-UHFFFAOYSA-N 0 3 375.885 3.282 10 0 GGAEHN CN1CCN(CC2(C)CCN(Cc3ccsc3Br)CC2)CC1 ZINC000529545025 567528519 /nfs/dbraw/zinc/52/85/19/567528519.db2.gz ZEYGJNHENMGCLA-UHFFFAOYSA-N 0 3 386.403 3.360 10 0 GGAEHN CCN(C(=O)N[C@H]1CCOc2ccc(Br)cc21)[C@@H]1CCN(CC)C1 ZINC000663786598 567530564 /nfs/dbraw/zinc/53/05/64/567530564.db2.gz IURUIHWXFPCLAT-ZBFHGGJFSA-N 0 3 396.329 3.398 10 0 GGAEHN CCNC(=O)N1CC[C@H](N[C@@H](c2ccc(Br)cc2F)C2CC2)C1 ZINC000479382465 567530968 /nfs/dbraw/zinc/53/09/68/567530968.db2.gz AAOVLUAYEHUGPY-XJKSGUPXSA-N 0 3 384.293 3.433 10 0 GGAEHN CCNC(=O)C[C@@H]1CCCCN1C[C@@H](O)COc1cc(Cl)ccc1Cl ZINC000551718524 567531196 /nfs/dbraw/zinc/53/11/96/567531196.db2.gz GWAKBGNLRYTKIC-LSDHHAIUSA-N 0 3 389.323 3.114 10 0 GGAEHN CCN(C(=O)N[C@@H]1CCOc2ccc(Br)cc21)[C@H]1CCN(C)C1 ZINC000663788244 567531637 /nfs/dbraw/zinc/53/16/37/567531637.db2.gz ZGBUVVLRFHIHJN-DZGCQCFKSA-N 0 3 382.302 3.008 10 0 GGAEHN CCN(C(=O)N[C@H]1CCOc2ccc(Br)cc21)[C@H]1CCN(C)C1 ZINC000663788247 567531723 /nfs/dbraw/zinc/53/17/23/567531723.db2.gz ZGBUVVLRFHIHJN-ZFWWWQNUSA-N 0 3 382.302 3.008 10 0 GGAEHN Ic1ccc(CCNCc2ccnn2CC2CC2)cc1 ZINC000594995585 567533057 /nfs/dbraw/zinc/53/30/57/567533057.db2.gz SHVXMBLRPGWQBL-UHFFFAOYSA-N 0 3 381.261 3.230 10 0 GGAEHN COC(=O)CC(C)(C)C[C@H](C)NCCS(=O)(=O)c1ccc(Cl)cc1 ZINC000595007587 567534168 /nfs/dbraw/zinc/53/41/68/567534168.db2.gz MSVUROPYPYJXHB-ZDUSSCGKSA-N 0 3 375.918 3.071 10 0 GGAEHN COC(=O)CC(C)(C)C[C@@H](C)NCC(=O)Nc1ccc(Br)cc1 ZINC000595010521 567534371 /nfs/dbraw/zinc/53/43/71/567534371.db2.gz XHHHFNOKPRPAOK-GFCCVEGCSA-N 0 3 385.302 3.345 10 0 GGAEHN O[C@@H](CNCc1cc(Br)c2c(c1)OCCO2)Cc1ccc(F)cc1 ZINC000571074606 567534701 /nfs/dbraw/zinc/53/47/01/567534701.db2.gz XADZSRISFHHKKH-OAHLLOKOSA-N 0 3 396.256 3.053 10 0 GGAEHN C[C@H](CCN[C@@H]1CCc2ccc(I)cc21)[S@@](C)=O ZINC000595021778 567535567 /nfs/dbraw/zinc/53/55/67/567535567.db2.gz GBALYKTZZHRAPX-MAZCYNQFSA-N 0 3 377.291 3.025 10 0 GGAEHN C[C@@H](CSCCF)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O ZINC000595016915 567535951 /nfs/dbraw/zinc/53/59/51/567535951.db2.gz AWYBPXIJYMLGGS-SWLSCSKDSA-N 0 3 376.444 3.464 10 0 GGAEHN CC1(C)OC[C@@H]2C[C@@]21NCc1cc(Br)cc(Br)c1N ZINC000529645994 567537365 /nfs/dbraw/zinc/53/73/65/567537365.db2.gz VLMIDCUCEJPAJK-LKFCYVNXSA-N 0 3 390.119 3.451 10 0 GGAEHN Cc1cc(NC(=O)[C@@H]2CNCCC2(F)F)nn1-c1ccc(Cl)c(Cl)c1 ZINC000644152944 567537247 /nfs/dbraw/zinc/53/72/47/567537247.db2.gz IBQJKWYHNDMOQN-NSHDSACASA-N 0 3 389.233 3.093 10 0 GGAEHN CCN(C(=O)NCc1cc(Br)ccc1OC)[C@H]1CCN(CC)C1 ZINC000663873651 567537401 /nfs/dbraw/zinc/53/74/01/567537401.db2.gz FIPSVZZZESWGRI-HNNXBMFYSA-N 0 3 384.318 3.083 10 0 GGAEHN CCN(C(=O)NCc1cc(Br)ccc1OC)[C@@H]1CCN(CC)C1 ZINC000663873652 567537527 /nfs/dbraw/zinc/53/75/27/567537527.db2.gz FIPSVZZZESWGRI-OAHLLOKOSA-N 0 3 384.318 3.083 10 0 GGAEHN C[C@H](CSCCF)N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 ZINC000595034239 567537973 /nfs/dbraw/zinc/53/79/73/567537973.db2.gz WHCHNUSSVVPOOA-OCCSQVGLSA-N 0 3 378.435 3.487 10 0 GGAEHN C[C@H](CSCCF)N[C@H]1CCN(c2cccc(Br)c2)C1=O ZINC000595049083 567539194 /nfs/dbraw/zinc/53/91/94/567539194.db2.gz UJYWWNDASYISOQ-RISCZKNCSA-N 0 3 375.307 3.235 10 0 GGAEHN CO[C@H](CN[C@H](C)c1ccc(F)c(I)c1)[C@H]1CCOC1 ZINC000595062941 567540307 /nfs/dbraw/zinc/54/03/07/567540307.db2.gz YGEJJYNTMWPUFG-IFUGULHKSA-N 0 3 393.240 3.132 10 0 GGAEHN CC(C)(NCC(=O)NC1CCN(C2CC2)CC1)c1ccc(Br)cc1 ZINC000438670494 567540553 /nfs/dbraw/zinc/54/05/53/567540553.db2.gz WEJSYMZXIPQRKC-UHFFFAOYSA-N 0 3 394.357 3.017 10 0 GGAEHN FC1(F)C[C@H]1OCCN[C@@H]1CCc2ccc(I)cc21 ZINC000595066998 567540846 /nfs/dbraw/zinc/54/08/46/567540846.db2.gz DGMDVJWWIZHYEE-CHWSQXEVSA-N 0 3 379.188 3.292 10 0 GGAEHN CO[C@H](CN[C@@H](C)c1ccc(F)c(I)c1)[C@@H]1CCOC1 ZINC000595062944 567540859 /nfs/dbraw/zinc/54/08/59/567540859.db2.gz YGEJJYNTMWPUFG-JVLSTEMRSA-N 0 3 393.240 3.132 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCCC1)c1c[nH]c2ncc(Br)cc12 ZINC000529715969 567542950 /nfs/dbraw/zinc/54/29/50/567542950.db2.gz LCOJGMGAKLWVDK-CQSZACIVSA-N 0 3 391.313 3.462 10 0 GGAEHN O=C(N[C@H]1CCc2c1ccc(Cl)c2Cl)N[C@H]1CCCN(CCCO)C1 ZINC000458383461 567542959 /nfs/dbraw/zinc/54/29/59/567542959.db2.gz ZRCINLPBAFPXFO-LRDDRELGSA-N 0 3 386.323 3.127 10 0 GGAEHN C[C@@H](Sc1ccc(Br)cc1)C(=O)N[C@@H]1CNCCC1(F)F ZINC000571207139 567544501 /nfs/dbraw/zinc/54/45/01/567544501.db2.gz OZHUCJWPNPUSPH-BXKDBHETSA-N 0 3 379.270 3.043 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)N[C@@H](CO)c1ccc(Br)cc1 ZINC000504695470 567544658 /nfs/dbraw/zinc/54/46/58/567544658.db2.gz PCGYEWGPRCJFHF-VBQJREDUSA-N 0 3 398.345 3.045 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)c3cc(Br)sc3Br)[C@@H]2C1 ZINC000644814047 567581020 /nfs/dbraw/zinc/58/10/20/567581020.db2.gz INCRDRAYXYOJML-IONNQARKSA-N 0 3 394.132 3.049 10 0 GGAEHN CC[C@@H]1CN(C(=O)c2cnn(-c3cccc(Br)c3)c2C)C[C@H](C)N1 ZINC000620903179 567548970 /nfs/dbraw/zinc/54/89/70/567548970.db2.gz HSWHXXDLRVAWSE-SWLSCSKDSA-N 0 3 391.313 3.156 10 0 GGAEHN CC[C@@H]1CN(C(=O)c2ccc(Sc3ccccc3Cl)nn2)C[C@H](C)N1 ZINC000620903211 567549030 /nfs/dbraw/zinc/54/90/30/567549030.db2.gz IYFIVQFWEQIPPF-QWHCGFSZSA-N 0 3 376.913 3.494 10 0 GGAEHN CC[C@@H]1CN(C(=O)c2cc(Br)sc2Br)C[C@H](C)N1 ZINC000620903596 567549217 /nfs/dbraw/zinc/54/92/17/567549217.db2.gz WXIQIIINIFFGDO-JGVFFNPUSA-N 0 3 396.148 3.486 10 0 GGAEHN CC[C@@H]1CN(C(=O)CCC(=O)c2cc(Br)ccc2OC)C[C@H](C)N1 ZINC000620907156 567550513 /nfs/dbraw/zinc/55/05/13/567550513.db2.gz GBFLQOCQHVXTOE-GXTWGEPZSA-N 0 3 397.313 3.020 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1cc(F)cc(Br)c1 ZINC000620914166 567550527 /nfs/dbraw/zinc/55/05/27/567550527.db2.gz KNYWJIWHBCYNLM-INIZCTEOSA-N 0 3 399.304 3.304 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)[C@@H]1SCCc2sccc21 ZINC000620915122 567550753 /nfs/dbraw/zinc/55/07/53/567550753.db2.gz CNPPVELSRVGRTH-RHSMWYFYSA-N 0 3 380.579 3.180 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1cc(Br)cs1 ZINC000620915377 567551028 /nfs/dbraw/zinc/55/10/28/567551028.db2.gz JMRXUWXIGIEHFB-CYBMUJFWSA-N 0 3 387.343 3.226 10 0 GGAEHN CC[C@@H]1CN(C(=O)c2cc3c([nH]2)c(Br)ccc3OC)C[C@H](C)N1 ZINC000620905979 567551078 /nfs/dbraw/zinc/55/10/78/567551078.db2.gz KDIBVMFCSWVNQD-WDEREUQCSA-N 0 3 380.286 3.152 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1ccc(Br)s1 ZINC000620917477 567551125 /nfs/dbraw/zinc/55/11/25/567551125.db2.gz JNOSELHELVLATF-LBPRGKRZSA-N 0 3 387.343 3.226 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)[C@H]1SCCc2sccc21 ZINC000620915121 567551144 /nfs/dbraw/zinc/55/11/44/567551144.db2.gz CNPPVELSRVGRTH-PBHICJAKSA-N 0 3 380.579 3.180 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1ccc(C(F)(F)F)s1 ZINC000620911607 567551171 /nfs/dbraw/zinc/55/11/71/567551171.db2.gz GSWRDIXNNAHFLV-LBPRGKRZSA-N 0 3 376.444 3.482 10 0 GGAEHN O=S1(=O)C[C@@H](CNCCCc2c(F)cccc2Cl)Oc2ccccc21 ZINC000571285609 567551996 /nfs/dbraw/zinc/55/19/96/567551996.db2.gz DWCWHAHJQZJYKR-CYBMUJFWSA-N 0 3 383.872 3.236 10 0 GGAEHN C[C@H](COc1ccc2cc(Br)ccc2c1)NC1COCCOC1 ZINC000644552051 567558537 /nfs/dbraw/zinc/55/85/37/567558537.db2.gz CVVSMWLJSQIGJC-CYBMUJFWSA-N 0 3 380.282 3.375 10 0 GGAEHN CC[C@@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccc(OC(F)F)cc1 ZINC000552097153 567558817 /nfs/dbraw/zinc/55/88/17/567558817.db2.gz UZJURAKHSDOJPH-GOEBONIOSA-N 0 3 376.469 3.143 10 0 GGAEHN O=C(c1cscc1Br)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000552109096 567559301 /nfs/dbraw/zinc/55/93/01/567559301.db2.gz DNSWDVJIUKRESS-ZDUSSCGKSA-N 0 3 387.343 3.228 10 0 GGAEHN C[C@@H](Cc1c(Cl)cccc1Cl)NC[C@H]1CCCCN1S(C)(=O)=O ZINC000552100755 567559566 /nfs/dbraw/zinc/55/95/66/567559566.db2.gz UAYNLQYHTBXFBI-QWHCGFSZSA-N 0 3 379.353 3.328 10 0 GGAEHN CCN(CC)CCN(C(=O)c1ccncc1F)c1ccc(Br)cn1 ZINC000571407806 567560177 /nfs/dbraw/zinc/56/01/77/567560177.db2.gz LFRHTPZRUGDZJT-UHFFFAOYSA-N 0 3 395.276 3.367 10 0 GGAEHN O=C(Cc1c(F)ccc(Br)c1F)NC[C@@H]1CCN1C1CCCC1 ZINC000530028193 567561190 /nfs/dbraw/zinc/56/11/90/567561190.db2.gz PGMOHSAVWXOYBM-LBPRGKRZSA-N 0 3 387.268 3.403 10 0 GGAEHN Cc1nc2ccc(Br)cn2c1C(=O)NC[C@@H]1CCN1C1CCCC1 ZINC000530030494 567561295 /nfs/dbraw/zinc/56/12/95/567561295.db2.gz ZVSRWDPJNMSJBG-HNNXBMFYSA-N 0 3 391.313 3.152 10 0 GGAEHN CN(C)C[C@H](NC(=O)[C@@H]1CCn2ccnc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031236 567561362 /nfs/dbraw/zinc/56/13/62/567561362.db2.gz DAGUYTYOTAMQBP-CJNGLKHVSA-N 0 3 381.307 3.171 10 0 GGAEHN C[C@@H](N[C@@H]1CCN(CC(=O)OC(C)(C)C)C1=O)c1ccc(Br)cc1 ZINC000595408188 567561679 /nfs/dbraw/zinc/56/16/79/567561679.db2.gz JBSDODUVVVPFSL-IUODEOHRSA-N 0 3 397.313 3.042 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCC1)c1cccc(I)c1 ZINC000530024194 567561983 /nfs/dbraw/zinc/56/19/83/567561983.db2.gz AILXZGWNFWQLAX-HNNXBMFYSA-N 0 3 384.261 3.038 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCC1)[C@H]1COc2ccc(Br)cc21 ZINC000530022635 567562125 /nfs/dbraw/zinc/56/21/25/567562125.db2.gz IRVXDYVYPCKJMU-ZBFHGGJFSA-N 0 3 379.298 3.058 10 0 GGAEHN O=C(Cc1cn2cc(Cl)cc(Cl)c2n1)NC[C@@H]1CCN1C1CCCC1 ZINC000530024303 567562394 /nfs/dbraw/zinc/56/23/94/567562394.db2.gz KZNAUYXTPIECAE-HNNXBMFYSA-N 0 3 381.307 3.317 10 0 GGAEHN O=C(Cc1cn2cc(Cl)cc(Cl)c2n1)NC[C@H]1CCN1C1CCCC1 ZINC000530024304 567562409 /nfs/dbraw/zinc/56/24/09/567562409.db2.gz KZNAUYXTPIECAE-OAHLLOKOSA-N 0 3 381.307 3.317 10 0 GGAEHN CN(C)C[C@H](NC(=O)[C@@H]1CCn2cncc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031263 567562516 /nfs/dbraw/zinc/56/25/16/567562516.db2.gz DMKMRTNRUNKZPA-DYVFJYSZSA-N 0 3 381.307 3.171 10 0 GGAEHN COc1cc(Br)c(C(=O)NC[C@H]2CCN2C2CCCC2)cc1OC ZINC000530023867 567562602 /nfs/dbraw/zinc/56/26/02/567562602.db2.gz XHTHOAQMOUBLGZ-CYBMUJFWSA-N 0 3 397.313 3.213 10 0 GGAEHN COCCN(C)CCCNC(=O)c1c(C)cc(Br)cc1Cl ZINC000479844060 567562850 /nfs/dbraw/zinc/56/28/50/567562850.db2.gz XMHLQVYXZAMANL-UHFFFAOYSA-N 0 3 377.710 3.109 10 0 GGAEHN CN(C)C[C@H](NC(=O)[C@@H]1CCc2nc[nH]c2C1)c1ccc(Cl)c(Cl)c1 ZINC000530032085 567563836 /nfs/dbraw/zinc/56/38/36/567563836.db2.gz FSLLOWKKHDFRJD-PXAZEXFGSA-N 0 3 381.307 3.241 10 0 GGAEHN CN(C)C[C@H](NC(=O)[C@@H]1CCc2[nH]cnc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530032085 567563838 /nfs/dbraw/zinc/56/38/38/567563838.db2.gz FSLLOWKKHDFRJD-PXAZEXFGSA-N 0 3 381.307 3.241 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N1CCN(C2CC2)C[C@@H](C)C1 ZINC000458688130 567565743 /nfs/dbraw/zinc/56/57/43/567565743.db2.gz XBYASFBHBZVWST-CYBMUJFWSA-N 0 3 396.329 3.083 10 0 GGAEHN COc1cc(Br)ccc1CNC[C@H](O)CN(C)Cc1ccccc1 ZINC000644625703 567566787 /nfs/dbraw/zinc/56/67/87/567566787.db2.gz KFIFNIWANCWDBO-SFHVURJKSA-N 0 3 393.325 3.040 10 0 GGAEHN COC(=O)C[C@](C)(NCCO[C@@H]1CC1(F)F)c1ccc(Br)cc1 ZINC000595484847 567566999 /nfs/dbraw/zinc/56/69/99/567566999.db2.gz SKCQQCSXGPHXSQ-HIFRSBDPSA-N 0 3 392.240 3.241 10 0 GGAEHN NC(=O)[C@H]1CCCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000505232974 567566863 /nfs/dbraw/zinc/56/68/63/567566863.db2.gz ZCWKPHWKTBJUKG-LBPRGKRZSA-N 0 3 380.311 3.270 10 0 GGAEHN COC(=O)c1cc(Cl)cc(Cl)c1NC(=O)CNC1(CCO)CCCC1 ZINC000595508992 567569841 /nfs/dbraw/zinc/56/98/41/567569841.db2.gz MYBJGFFLOLDWEJ-UHFFFAOYSA-N 0 3 389.279 3.003 10 0 GGAEHN CCN(C(=O)N[C@H](C)Cc1ccc(F)c(Br)c1)[C@H]1CCN(C)C1 ZINC000664460919 567570376 /nfs/dbraw/zinc/57/03/76/567570376.db2.gz KRGARASZJTZBQA-OCCSQVGLSA-N 0 3 386.309 3.255 10 0 GGAEHN COC(=O)[C@@](C)(O)CN1CCC(COc2cc(Cl)cc(Cl)c2)CC1 ZINC000571559833 567571681 /nfs/dbraw/zinc/57/16/81/567571681.db2.gz ZTYOWLSCUZJXKL-KRWDZBQOSA-N 0 3 376.280 3.008 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N1CCC(c2cccc(Br)c2)CC1 ZINC000479975007 567573032 /nfs/dbraw/zinc/57/30/32/567573032.db2.gz ADMGVLBGNNZZAC-KRWDZBQOSA-N 0 3 380.330 3.432 10 0 GGAEHN CCN(C(=O)N[C@@H](C)Cc1cc(Br)ccc1F)[C@@H]1CCN(C)C1 ZINC000664527802 567573089 /nfs/dbraw/zinc/57/30/89/567573089.db2.gz WHIULBRXTNFVFC-SWLSCSKDSA-N 0 3 386.309 3.255 10 0 GGAEHN COc1cc(CN[C@@H]2CCN(C)[C@H]2c2ccccc2)c(Br)cn1 ZINC000621290944 567574072 /nfs/dbraw/zinc/57/40/72/567574072.db2.gz AALSSWSXUBWRKM-AEFFLSMTSA-N 0 3 376.298 3.388 10 0 GGAEHN O=C(CCNC1(c2ccc(Br)cc2)CCOCC1)N1CCCCC1 ZINC000505479414 567578559 /nfs/dbraw/zinc/57/85/59/567578559.db2.gz GUNMVVGDRWXBAK-UHFFFAOYSA-N 0 3 395.341 3.447 10 0 GGAEHN CC[C@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccccc1OC(F)F ZINC000552333722 567579102 /nfs/dbraw/zinc/57/91/02/567579102.db2.gz MWKQBIYYCIGPEE-ZFWWWQNUSA-N 0 3 376.469 3.143 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)c2csc(-c3cc(Br)cs3)n2)C1 ZINC000644812104 567579202 /nfs/dbraw/zinc/57/92/02/567579202.db2.gz CBVWBGKZJNKVLI-CABZTGNLSA-N 0 3 398.351 3.410 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)c2ccc(Br)c(C(F)(F)F)c2)C1 ZINC000644812418 567579287 /nfs/dbraw/zinc/57/92/87/567579287.db2.gz CSRWSBKHOVXQHP-GWCFXTLKSA-N 0 3 377.204 3.244 10 0 GGAEHN Cc1cc(Br)cc(C)c1N1CCC[C@H](N[C@H]2CCCOC2)C1=O ZINC000552333622 567579265 /nfs/dbraw/zinc/57/92/65/567579265.db2.gz KFEVWUYCKAEIKU-HOTGVXAUSA-N 0 3 381.314 3.330 10 0 GGAEHN Cc1cc(Br)cc(C)c1N1CCC[C@@H](N[C@@H]2CCCOC2)C1=O ZINC000552333623 567579462 /nfs/dbraw/zinc/57/94/62/567579462.db2.gz KFEVWUYCKAEIKU-HZPDHXFCSA-N 0 3 381.314 3.330 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)CCOc3ccc(Cl)cc3Br)[C@@H]2C1 ZINC000644814332 567580213 /nfs/dbraw/zinc/58/02/13/567580213.db2.gz JOOKBSYJEUCYGQ-SMDDNHRTSA-N 0 3 387.705 3.034 10 0 GGAEHN Cc1cc(SCC(=O)N2CC[C@H]3CN(C)C[C@@H]32)c(C)cc1Br ZINC000644820139 567580373 /nfs/dbraw/zinc/58/03/73/567580373.db2.gz UQYMDEBRKXANCL-ZFWWWQNUSA-N 0 3 383.355 3.321 10 0 GGAEHN Brc1cc2c(c(CNc3ccc4c(c3)OCCNC4)c1)OCC2 ZINC000530183651 567580472 /nfs/dbraw/zinc/58/04/72/567580472.db2.gz SKMMSUYTPHXTSZ-UHFFFAOYSA-N 0 3 375.266 3.478 10 0 GGAEHN CNC(=O)[C@H](C)Oc1ccc(Br)cc1CNCC[C@@H]1CC1(F)F ZINC000621377364 567580952 /nfs/dbraw/zinc/58/09/52/567580952.db2.gz WSIHISXBVSHIQR-CMPLNLGQSA-N 0 3 391.256 3.097 10 0 GGAEHN Cc1cc(C(=O)N2CC[C@@H]3CN(C)C[C@H]32)nn1-c1ccc(Cl)cc1Cl ZINC000644818378 567580897 /nfs/dbraw/zinc/58/08/97/567580897.db2.gz LVVRQLATAYIQLW-SJKOYZFVSA-N 0 3 379.291 3.264 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)Cc3csc4ccc(Br)cc34)[C@@H]2C1 ZINC000644820469 567580956 /nfs/dbraw/zinc/58/09/56/567580956.db2.gz WOHDBPHVFQCXPD-IAQYHMDHSA-N 0 3 379.323 3.369 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)CCCCOc3ccc(Br)cc3)[C@@H]2C1 ZINC000644822158 567580975 /nfs/dbraw/zinc/58/09/75/567580975.db2.gz OYQPAINGXCVERK-RHSMWYFYSA-N 0 3 381.314 3.161 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)CCc2nc3cc(Br)ccc3s2)C1 ZINC000644818938 567581310 /nfs/dbraw/zinc/58/13/10/567581310.db2.gz OYSBVLCKEMGGHM-FZMZJTMJSA-N 0 3 394.338 3.154 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCCC1)c1nc(C2CC2)ncc1Br ZINC000530190948 567581870 /nfs/dbraw/zinc/58/18/70/567581870.db2.gz WJFAQIRHDNVQBW-AWEZNQCLSA-N 0 3 393.329 3.253 10 0 GGAEHN CCCOc1c(Br)cc(CN2CC[C@@H]3CN(C)C[C@@H]32)cc1OC ZINC000644840511 567581897 /nfs/dbraw/zinc/58/18/97/567581897.db2.gz KPCFUZIRFAJLII-ZBFHGGJFSA-N 0 3 383.330 3.382 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCCC1)c1nc(C2CC2)ncc1Br ZINC000530190949 567582099 /nfs/dbraw/zinc/58/20/99/567582099.db2.gz WJFAQIRHDNVQBW-CQSZACIVSA-N 0 3 393.329 3.253 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2Cc2ccc(OC(F)(F)F)c(Br)c2)C1 ZINC000644840282 567582300 /nfs/dbraw/zinc/58/23/00/567582300.db2.gz JUJOBIYXVMXPHX-AAEUAGOBSA-N 0 3 379.220 3.484 10 0 GGAEHN CN1C[C@H]2CCN(Cc3ccc(OC(F)(F)F)c(Br)c3)[C@@H]2C1 ZINC000644840283 567582398 /nfs/dbraw/zinc/58/23/98/567582398.db2.gz JUJOBIYXVMXPHX-DGCLKSJQSA-N 0 3 379.220 3.484 10 0 GGAEHN COc1cc(CN2CC[C@@H]3CN(C)C[C@@H]32)cc(Br)c1OC(F)F ZINC000644839967 567582542 /nfs/dbraw/zinc/58/25/42/567582542.db2.gz HTTWSUXTRNETMQ-YPMHNXCESA-N 0 3 391.256 3.195 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CC[C@H]2CN(C)C[C@H]21 ZINC000644840326 567582671 /nfs/dbraw/zinc/58/26/71/567582671.db2.gz KHCQDWGLKRSAPR-KBXCAEBGSA-N 0 3 375.314 3.079 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CC[C@@H]2CN(C)C[C@H]21 ZINC000644840329 567582703 /nfs/dbraw/zinc/58/27/03/567582703.db2.gz KHCQDWGLKRSAPR-RDTXWAMCSA-N 0 3 375.314 3.079 10 0 GGAEHN CCN(C(=O)NCc1ccc(Br)cc1OC)[C@@H]1CCN(CC)C1 ZINC000664713744 567584119 /nfs/dbraw/zinc/58/41/19/567584119.db2.gz SLBSWZWDIWNFJP-OAHLLOKOSA-N 0 3 384.318 3.083 10 0 GGAEHN O=C1N[C@H](c2ccc(Br)cc2)C(=O)N1C[C@@H]1CCN1C1CCCC1 ZINC000530212591 567584930 /nfs/dbraw/zinc/58/49/30/567584930.db2.gz LEMOXJMQIGDAIO-JKSUJKDBSA-N 0 3 392.297 3.059 10 0 GGAEHN CCN(C(=O)N[C@@H](C)c1ccc(Br)cc1OC)[C@@H]1CCN(C)C1 ZINC000664730150 567585702 /nfs/dbraw/zinc/58/57/02/567585702.db2.gz PUVKIWGIDJSKGD-GXTWGEPZSA-N 0 3 384.318 3.254 10 0 GGAEHN C[C@@]1(CNC[C@H](O)c2cccc(Br)c2)COc2ccccc2O1 ZINC000530236700 567586352 /nfs/dbraw/zinc/58/63/52/567586352.db2.gz WVAPQSQLCJXUTJ-MAUKXSAKSA-N 0 3 378.266 3.302 10 0 GGAEHN CC[C@@H]1CN(C)CCN1CCCOc1cccc(I)c1 ZINC000552397508 567587405 /nfs/dbraw/zinc/58/74/05/567587405.db2.gz GMMASOXLCRAMJR-OAHLLOKOSA-N 0 3 388.293 3.086 10 0 GGAEHN CCOC(=O)CC1(NCCOc2c(Cl)cccc2Cl)CCOCC1 ZINC000595883836 567587982 /nfs/dbraw/zinc/58/79/82/567587982.db2.gz BALIXXOHJVOSKB-UHFFFAOYSA-N 0 3 376.280 3.464 10 0 GGAEHN CCN(C(=O)N[C@H]1CSc2ccc(Br)cc21)[C@H]1CCN(C)C1 ZINC000664773545 567588101 /nfs/dbraw/zinc/58/81/01/567588101.db2.gz UVFQCSDCJQMONX-JSGCOSHPSA-N 0 3 384.343 3.332 10 0 GGAEHN O=C(NC/C=C\c1ccc(Br)cc1)N1CC[C@@H](N2CC=CC2)C1 ZINC000458958319 567589653 /nfs/dbraw/zinc/58/96/53/567589653.db2.gz ACVMTKAHNWBDBX-CWIOURORSA-N 0 3 376.298 3.118 10 0 GGAEHN CCN(C(=O)N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1)[C@H]1CCN(C)C1 ZINC000664785169 567589649 /nfs/dbraw/zinc/58/96/49/567589649.db2.gz HUCWSNQEAHIELU-HEHGZKQESA-N 0 3 384.293 3.180 10 0 GGAEHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)N[C@H]1CCOC1(C)C ZINC000458956596 567590160 /nfs/dbraw/zinc/59/01/60/567590160.db2.gz PXRZEPXJIHTXHW-INIZCTEOSA-N 0 3 398.345 3.090 10 0 GGAEHN CN(C(=O)NC/C=C\c1ccc(Br)cc1)[C@H]1CCN(C2CC2)C1 ZINC000458974366 567591395 /nfs/dbraw/zinc/59/13/95/567591395.db2.gz NHCFLMFMZLHOSX-KYVUIXNKSA-N 0 3 378.314 3.340 10 0 GGAEHN CN(C(=O)NC/C=C/c1ccc(Br)cc1)[C@H]1CCN(C2CC2)C1 ZINC000458974371 567591874 /nfs/dbraw/zinc/59/18/74/567591874.db2.gz NHCFLMFMZLHOSX-YATRRXNKSA-N 0 3 378.314 3.340 10 0 GGAEHN CCN(C(=O)N[C@@H]1CCOc2c(Br)cccc21)[C@H]1CCN(C)C1 ZINC000664823750 567592017 /nfs/dbraw/zinc/59/20/17/567592017.db2.gz JUZQTKYSURQUKT-SWLSCSKDSA-N 0 3 382.302 3.008 10 0 GGAEHN CCN(C(=O)N[C@@H]1CCOc2c(Br)cccc21)[C@@H]1CCN(CC)C1 ZINC000664822734 567592362 /nfs/dbraw/zinc/59/23/62/567592362.db2.gz BSEMJFPQFXUCMV-CZUORRHYSA-N 0 3 396.329 3.398 10 0 GGAEHN CCN(C(=O)NCC(F)(F)c1ccc(Br)cc1)[C@@H]1CCN(C)C1 ZINC000621553418 567593431 /nfs/dbraw/zinc/59/34/31/567593431.db2.gz ZWCYRKQDENKTDG-CQSZACIVSA-N 0 3 390.272 3.277 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)CSCc2cc(-c3cccs3)on2)CCSC1 ZINC000480269230 567593502 /nfs/dbraw/zinc/59/35/02/567593502.db2.gz VJZQJXRPNUAHHT-QGZVFWFLSA-N 0 3 397.591 3.190 10 0 GGAEHN CCN(C(=O)N[C@H](c1cncc(Br)c1)C1CC1)[C@H]1CCN(C)C1 ZINC000664849562 567593952 /nfs/dbraw/zinc/59/39/52/567593952.db2.gz BVHLKXQFUIFCSB-HOTGVXAUSA-N 0 3 381.318 3.031 10 0 GGAEHN CCN(C(=O)N[C@@H](c1cncc(Br)c1)C1CC1)[C@H]1CCN(CC)C1 ZINC000664850175 567594923 /nfs/dbraw/zinc/59/49/23/567594923.db2.gz IJQGBCTZNRUKKS-DLBZAZTESA-N 0 3 395.345 3.421 10 0 GGAEHN CCOC(=O)c1sc2ccsc2c1CNC(=O)C1(NC2CC2)CCC1 ZINC000595937912 567595174 /nfs/dbraw/zinc/59/51/74/567595174.db2.gz ZAQNYNJPZBNEOO-UHFFFAOYSA-N 0 3 378.519 3.430 10 0 GGAEHN CCN(C(=O)N[C@H](c1cncc(Br)c1)C1CC1)[C@@H]1CCN(CC)C1 ZINC000664850178 567595361 /nfs/dbraw/zinc/59/53/61/567595361.db2.gz IJQGBCTZNRUKKS-SJORKVTESA-N 0 3 395.345 3.421 10 0 GGAEHN O=C(c1ccccc1)N1C[C@H](CNCc2ccsc2Cl)N2CC[C@H]1C2 ZINC000480308799 567595873 /nfs/dbraw/zinc/59/58/73/567595873.db2.gz HWJSLEWJWLZZFS-IRXDYDNUSA-N 0 3 375.925 3.090 10 0 GGAEHN O=C(c1ccccc1)N1C[C@@H](CNCc2ccsc2Cl)N2CC[C@H]1C2 ZINC000480308797 567595933 /nfs/dbraw/zinc/59/59/33/567595933.db2.gz HWJSLEWJWLZZFS-DLBZAZTESA-N 0 3 375.925 3.090 10 0 GGAEHN O=C(Cc1cscc1Br)Nc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000552550126 567596227 /nfs/dbraw/zinc/59/62/27/567596227.db2.gz LHRMCAWYUCNGGT-OAHLLOKOSA-N 0 3 395.322 3.258 10 0 GGAEHN Brc1ccc([C@@H](Cc2ccccn2)NC[C@@H]2COCCO2)cc1 ZINC000552575766 567597894 /nfs/dbraw/zinc/59/78/94/567597894.db2.gz HMYZUMJJXMZNND-QZTJIDSGSA-N 0 3 377.282 3.133 10 0 GGAEHN CCN(C(=O)NCc1cc(F)c(F)cc1Br)[C@@H]1CCN(CC)C1 ZINC000664887543 567598069 /nfs/dbraw/zinc/59/80/69/567598069.db2.gz UKDZNCGIPKWSNJ-GFCCVEGCSA-N 0 3 390.272 3.353 10 0 GGAEHN CN(C(=O)N[C@@H]1CCc2c1ccc(F)c2Br)[C@@H]1CCN(C2CC2)C1 ZINC000459070727 567598361 /nfs/dbraw/zinc/59/83/61/567598361.db2.gz RRNJAXCQSYVNAT-MLGOLLRUSA-N 0 3 396.304 3.454 10 0 GGAEHN NC(=O)C1CCN(Cc2cnc(-c3ccc(Br)cc3)s2)CC1 ZINC000505843472 567599564 /nfs/dbraw/zinc/59/95/64/567599564.db2.gz YJLSEECBYKFZNB-UHFFFAOYSA-N 0 3 380.311 3.270 10 0 GGAEHN CCN(C(=O)N[C@H]1C[C@H](c2ccc(Br)cc2)C1)[C@@H]1CCN(C)C1 ZINC000664938136 567599832 /nfs/dbraw/zinc/59/98/32/567599832.db2.gz MJPGLRANUSEYEB-DJIMGWMZSA-N 0 3 380.330 3.431 10 0 GGAEHN CN(C)[C@]1(CNC(=O)CSc2cccc(C(F)(F)F)c2)CCSC1 ZINC000480389315 567600006 /nfs/dbraw/zinc/60/00/06/567600006.db2.gz YHFBTPUTKQBTKM-HNNXBMFYSA-N 0 3 378.485 3.351 10 0 GGAEHN CCN(C(=O)NCCC(=O)Nc1cc(Cl)cc(Cl)c1)[C@H]1CCN(C)C1 ZINC000664968593 567602968 /nfs/dbraw/zinc/60/29/68/567602968.db2.gz RTPKGOOQJNAPAN-HNNXBMFYSA-N 0 3 387.311 3.058 10 0 GGAEHN CC(C)N(C)CC(=O)N1CCC[C@H]1c1ccccc1I ZINC000505960753 567605032 /nfs/dbraw/zinc/60/50/32/567605032.db2.gz YPTCRGOKJFIKNW-HNNXBMFYSA-N 0 3 386.277 3.295 10 0 GGAEHN CCN(C(=O)N[C@H]1CCc2c1ccc(F)c2Br)[C@@H]1CCN(C)C1 ZINC000665040715 567606482 /nfs/dbraw/zinc/60/64/82/567606482.db2.gz UFMLSCYFQSBBKA-ABAIWWIYSA-N 0 3 384.293 3.311 10 0 GGAEHN CCN(C(=O)N[C@H]1CCc2c1ccc(F)c2Br)[C@H]1CCN(C)C1 ZINC000665040724 567606608 /nfs/dbraw/zinc/60/66/08/567606608.db2.gz UFMLSCYFQSBBKA-NHYWBVRUSA-N 0 3 384.293 3.311 10 0 GGAEHN C[C@@H](NC(=O)N1CCOC2(CCN(C)CC2)C1)c1ccc(Br)cc1 ZINC000645117053 567607354 /nfs/dbraw/zinc/60/73/54/567607354.db2.gz DRPZUZOBUGRQNY-CQSZACIVSA-N 0 3 396.329 3.016 10 0 GGAEHN CN(C(=O)c1c(F)c(F)c(Br)c(F)c1F)C1CCN(C)CC1 ZINC000665073001 567607634 /nfs/dbraw/zinc/60/76/34/567607634.db2.gz CIOXSQKUMCEFMV-UHFFFAOYSA-N 0 3 383.183 3.172 10 0 GGAEHN COC(=O)CC1(NCc2cc(Br)cc(Br)c2)CC1 ZINC000572047274 567608163 /nfs/dbraw/zinc/60/81/63/567608163.db2.gz ZPBIZBGXDZSPJF-UHFFFAOYSA-N 0 3 377.076 3.397 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)N1CCO[C@@]2(CCSC2)C1)c1ccsc1 ZINC000645141757 567608595 /nfs/dbraw/zinc/60/85/95/567608595.db2.gz RAYQUBBLJZLKCP-AEFFLSMTSA-N 0 3 383.583 3.049 10 0 GGAEHN OC1CCN(CCCN[C@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621750621 567608679 /nfs/dbraw/zinc/60/86/79/567608679.db2.gz TUSMSEMCHOJPCO-OAHLLOKOSA-N 0 3 377.273 3.192 10 0 GGAEHN OC1CCN(CCCN[C@@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621750620 567608843 /nfs/dbraw/zinc/60/88/43/567608843.db2.gz TUSMSEMCHOJPCO-HNNXBMFYSA-N 0 3 377.273 3.192 10 0 GGAEHN CCN1CCN([C@H](C)CN[C@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621750130 567609189 /nfs/dbraw/zinc/60/91/89/567609189.db2.gz IZXQKQSCAGZUNL-CZUORRHYSA-N 0 3 390.316 3.371 10 0 GGAEHN CCN1CCN([C@H](C)CN[C@@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621750129 567609206 /nfs/dbraw/zinc/60/92/06/567609206.db2.gz IZXQKQSCAGZUNL-CJNGLKHVSA-N 0 3 390.316 3.371 10 0 GGAEHN CN1CCN(CCCCN[C@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621750942 567609229 /nfs/dbraw/zinc/60/92/29/567609229.db2.gz ZFXCQSPOVXESHO-MRXNPFEDSA-N 0 3 390.316 3.373 10 0 GGAEHN CN1CCN(CCN[C@H](c2ccc(Br)cc2)C(F)F)CC1(C)C ZINC000621761875 567609740 /nfs/dbraw/zinc/60/97/40/567609740.db2.gz OTCXEVULKSJJCN-OAHLLOKOSA-N 0 3 390.316 3.371 10 0 GGAEHN O=S1(=O)CC[C@@H](NCC[C@@H]2CC2(F)F)c2cc(Br)ccc21 ZINC000621768496 567610616 /nfs/dbraw/zinc/61/06/16/567610616.db2.gz QIASCNCLZFGSNL-BXKDBHETSA-N 0 3 380.254 3.303 10 0 GGAEHN COCCN1CCC(NC(=O)c2c(C)cc(Br)cc2Cl)CC1 ZINC000480544227 567611368 /nfs/dbraw/zinc/61/13/68/567611368.db2.gz VFXFYUFJECRXND-UHFFFAOYSA-N 0 3 389.721 3.252 10 0 GGAEHN COC(=O)[C@@H]1CC12CCN(Cc1nc3ccc(Br)cc3[nH]1)CC2 ZINC000480561897 567612546 /nfs/dbraw/zinc/61/25/46/567612546.db2.gz ZJQMKRRGKAGLNH-LBPRGKRZSA-N 0 3 378.270 3.101 10 0 GGAEHN O=S(=O)(CCCN[C@@H]1CCN(c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000645221303 567612824 /nfs/dbraw/zinc/61/28/24/567612824.db2.gz MMZSVGLGPKFSMV-QGZVFWFLSA-N 0 3 378.925 3.372 10 0 GGAEHN CCN(CC)CCN(C(=O)Cc1cc(C)on1)c1ccc(Br)cn1 ZINC000572085275 567613050 /nfs/dbraw/zinc/61/30/50/567613050.db2.gz YUBPQKSITHCEJM-UHFFFAOYSA-N 0 3 395.301 3.058 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)NCc1cc(F)c(F)cc1Br ZINC000506164203 567613477 /nfs/dbraw/zinc/61/34/77/567613477.db2.gz PNXNLUFXNIUFNC-LLVKDONJSA-N 0 3 390.272 3.401 10 0 GGAEHN Cn1cc(C[C@@H]2CCN(C[C@H](O)COc3c(Cl)cccc3Cl)C2)cn1 ZINC000530627039 567614948 /nfs/dbraw/zinc/61/49/48/567614948.db2.gz BEFLVNBKEXJJRB-ZFWWWQNUSA-N 0 3 384.307 3.031 10 0 GGAEHN Cn1cc(C[C@H]2CCN(C[C@H](O)COc3c(Cl)cccc3Cl)C2)cn1 ZINC000530627037 567615337 /nfs/dbraw/zinc/61/53/37/567615337.db2.gz BEFLVNBKEXJJRB-HIFRSBDPSA-N 0 3 384.307 3.031 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)c1cc2c(cc1Br)OCO2 ZINC000621861291 567616077 /nfs/dbraw/zinc/61/60/77/567616077.db2.gz XFLMXENHYAPNRL-VXGBXAGGSA-N 0 3 383.286 3.171 10 0 GGAEHN C[C@@H](NCc1nc(C[NH3+])cc(=O)[n-]1)c1cc2cc(Br)ccc2o1 ZINC000665291848 567617106 /nfs/dbraw/zinc/61/71/06/567617106.db2.gz MHSDCXRZKXXUBD-SECBINFHSA-N 0 3 377.242 3.000 10 0 GGAEHN CC1(C)CC[C@@H](NCc2nc(C[NH3+])cc(=O)[n-]2)c2cc(Br)ccc21 ZINC000665292575 567617237 /nfs/dbraw/zinc/61/72/37/567617237.db2.gz DCHSESIOOXZJAQ-OAHLLOKOSA-N 0 3 391.313 3.306 10 0 GGAEHN Cn1cncc1CCN1CCC[C@H]1c1ccc(I)cc1 ZINC000459363570 567619075 /nfs/dbraw/zinc/61/90/75/567619075.db2.gz RLZHFGVVWVZZIM-INIZCTEOSA-N 0 3 381.261 3.404 10 0 GGAEHN COC(=O)c1cc(Cl)cc(Cl)c1N1CCC(N2CCCOCC2)CC1 ZINC000596268420 567619701 /nfs/dbraw/zinc/61/97/01/567619701.db2.gz KFTYBECFDURXIT-UHFFFAOYSA-N 0 3 387.307 3.471 10 0 GGAEHN COC1CCN(C(C)(C)CNC(=O)Cc2cscc2Br)CC1 ZINC000645340659 567619669 /nfs/dbraw/zinc/61/96/69/567619669.db2.gz BREYNOYFFWNWEG-UHFFFAOYSA-N 0 3 389.359 3.059 10 0 GGAEHN COC(=O)[C@H]1CC12CCN(C[C@@H](O)COc1c(Cl)cccc1Cl)CC2 ZINC000506264394 567619741 /nfs/dbraw/zinc/61/97/41/567619741.db2.gz OLAQIKHIIPFHDZ-CHWSQXEVSA-N 0 3 388.291 3.008 10 0 GGAEHN CCC(CC)(NC[C@H](O)CN1CCOCC1)c1ccc(Cl)c(Cl)c1 ZINC000440310374 567622350 /nfs/dbraw/zinc/62/23/50/567622350.db2.gz CPCNRZUCJLSHKA-HNNXBMFYSA-N 0 3 375.340 3.291 10 0 GGAEHN COC(=O)CCC1CCN(C[C@@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000530763170 567622454 /nfs/dbraw/zinc/62/24/54/567622454.db2.gz XWDIEYGWGBBBCD-CQSZACIVSA-N 0 3 390.307 3.398 10 0 GGAEHN CCOc1cc(C[NH2+]CCN(C)CC(F)(F)F)cc(Br)c1[O-] ZINC000459405011 567622513 /nfs/dbraw/zinc/62/25/13/567622513.db2.gz AQCZLFULMPMVQQ-UHFFFAOYSA-N 0 3 385.224 3.137 10 0 GGAEHN CCOc1cc(CN[C@H]2CC(=O)N(C(C)(C)C)C2)cc(Br)c1O ZINC000459419203 567623446 /nfs/dbraw/zinc/62/34/46/567623446.db2.gz DLWWOUPMBCAEHL-LBPRGKRZSA-N 0 3 385.302 3.042 10 0 GGAEHN CN1CCC(CNCc2cccc([O-])c2Br)([NH+]2CCCCC2)CC1 ZINC000459421612 567624213 /nfs/dbraw/zinc/62/42/13/567624213.db2.gz MLDFOCFAUCDQQU-UHFFFAOYSA-N 0 3 396.373 3.195 10 0 GGAEHN CCO[C@@H]1C[C@H](NCc2nnc(-c3ccc(Br)cc3)[nH]2)[C@H]1SC ZINC000459458902 567625368 /nfs/dbraw/zinc/62/53/68/567625368.db2.gz HMPVTYNLLDOHOZ-GZBFAFLISA-N 0 3 397.342 3.233 10 0 GGAEHN CCO[C@@H]1C[C@@H](NCc2nnc(-c3ccc(Br)cc3)[nH]2)[C@@H]1SC ZINC000459458904 567625595 /nfs/dbraw/zinc/62/55/95/567625595.db2.gz HMPVTYNLLDOHOZ-NFAWXSAZSA-N 0 3 397.342 3.233 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@@H]1CCCS1)c1ccc(Br)cn1 ZINC000572246867 567625798 /nfs/dbraw/zinc/62/57/98/567625798.db2.gz NUJKLIXBCBNFDK-AWEZNQCLSA-N 0 3 386.359 3.415 10 0 GGAEHN CCOc1cc(C[NH2+]CCC(=O)N2CCCCCC2)cc(Br)c1[O-] ZINC000459475187 567628169 /nfs/dbraw/zinc/62/81/69/567628169.db2.gz ZHOAECIBGCFMPL-UHFFFAOYSA-N 0 3 399.329 3.436 10 0 GGAEHN CC[C@@H]1CC[C@H](C)C[C@H]1NCc1ccc(S(=O)(=O)N2CCOCC2)s1 ZINC000572341634 567632230 /nfs/dbraw/zinc/63/22/30/567632230.db2.gz XJKUNSXRPHCNMC-ZMSDIMECSA-N 0 3 386.583 3.073 10 0 GGAEHN Cc1cc(C(=O)NCCN2CC[C@H](C)C2)nn1-c1ccc(Br)cc1 ZINC000530949590 567633064 /nfs/dbraw/zinc/63/30/64/567633064.db2.gz YXIYXSYMNUSNID-ZDUSSCGKSA-N 0 3 391.313 3.015 10 0 GGAEHN C[C@H](NC[C@@H]1CCN(S(=O)(=O)c2cccs2)C1)c1cc(F)ccc1F ZINC000506630420 567633644 /nfs/dbraw/zinc/63/36/44/567633644.db2.gz LEVUPGMGJBGMES-STQMWFEESA-N 0 3 386.489 3.388 10 0 GGAEHN C[C@@H](NC[C@@H]1CCN(S(=O)(=O)c2cccs2)C1)c1cc(F)ccc1F ZINC000506630418 567633838 /nfs/dbraw/zinc/63/38/38/567633838.db2.gz LEVUPGMGJBGMES-OLZOCXBDSA-N 0 3 386.489 3.388 10 0 GGAEHN CCOc1cc(CN2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)cc(Br)c1[O-] ZINC000459550644 567635163 /nfs/dbraw/zinc/63/51/63/567635163.db2.gz KKHXLWMFJHXOHO-ZBFHGGJFSA-N 0 3 383.330 3.470 10 0 GGAEHN CCOc1cc(CN2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)cc(Br)c1[O-] ZINC000459550644 567635167 /nfs/dbraw/zinc/63/51/67/567635167.db2.gz KKHXLWMFJHXOHO-ZBFHGGJFSA-N 0 3 383.330 3.470 10 0 GGAEHN CCOc1cc(CN2CCC[C@H]3C[N@H+](C)CC[C@@H]32)cc(Br)c1[O-] ZINC000459550643 567636044 /nfs/dbraw/zinc/63/60/44/567636044.db2.gz KKHXLWMFJHXOHO-HOCLYGCPSA-N 0 3 383.330 3.470 10 0 GGAEHN CCOc1cc(CN2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)cc(Br)c1[O-] ZINC000459550643 567636048 /nfs/dbraw/zinc/63/60/48/567636048.db2.gz KKHXLWMFJHXOHO-HOCLYGCPSA-N 0 3 383.330 3.470 10 0 GGAEHN CCOc1cc(CN2CC[N@@H+](C3CC3)C[C@@H](C)C2)cc(Br)c1[O-] ZINC000459573134 567640054 /nfs/dbraw/zinc/64/00/54/567640054.db2.gz RPWTWPZQEOSCCI-ZDUSSCGKSA-N 0 3 383.330 3.470 10 0 GGAEHN CCOc1cc(CN2CC[N@H+](C3CC3)C[C@@H](C)C2)cc(Br)c1[O-] ZINC000459573134 567640059 /nfs/dbraw/zinc/64/00/59/567640059.db2.gz RPWTWPZQEOSCCI-ZDUSSCGKSA-N 0 3 383.330 3.470 10 0 GGAEHN CCOc1cc(C[NH2+][C@H]([C@H](CO)C2CC2)C2CC2)cc(Br)c1[O-] ZINC000459591079 567640895 /nfs/dbraw/zinc/64/08/95/567640895.db2.gz ZRBHQKGNGLGXDG-PBHICJAKSA-N 0 3 384.314 3.440 10 0 GGAEHN CCOc1cc(C[NH2+][C@@H]([C@H](CO)C2CC2)C2CC2)cc(Br)c1[O-] ZINC000459591080 567641200 /nfs/dbraw/zinc/64/12/00/567641200.db2.gz ZRBHQKGNGLGXDG-RHSMWYFYSA-N 0 3 384.314 3.440 10 0 GGAEHN CCN(C(=O)Nc1cc(Cl)ccc1N1CCSCC1)[C@@H]1CCN(C)C1 ZINC000665913086 567642948 /nfs/dbraw/zinc/64/29/48/567642948.db2.gz BFZFGJXTCRERKP-OAHLLOKOSA-N 0 3 382.961 3.451 10 0 GGAEHN O=C(C(C[C@H]1COCCO1)C(F)(F)F)N1CCCSc2ccccc21 ZINC000665927607 567644520 /nfs/dbraw/zinc/64/45/20/567644520.db2.gz WRYNYDKGKFIYON-QWHCGFSZSA-N 0 3 375.412 3.499 10 0 GGAEHN CC[C@@H](Cn1cncn1)NCc1cc(Br)ccc1OC(F)F ZINC000572503317 567644897 /nfs/dbraw/zinc/64/48/97/567644897.db2.gz QBFMCMCKNFOEGN-LBPRGKRZSA-N 0 3 375.217 3.210 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNS(=O)(=O)Cc1ccc(Br)cc1 ZINC000480988433 567649361 /nfs/dbraw/zinc/64/93/61/567649361.db2.gz NSQMVXGNZUUSDM-OKILXGFUSA-N 0 3 389.359 3.131 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@H]1C[C@H](C)N(C2CC2)C1 ZINC000440963831 567649951 /nfs/dbraw/zinc/64/99/51/567649951.db2.gz WJQUISJUDCBJIU-WWGRRREGSA-N 0 3 380.330 3.305 10 0 GGAEHN CCN(C(=O)Nc1ccc(Br)c(C(=O)OC)c1)[C@@H]1CCN(CC)C1 ZINC000596820409 567656030 /nfs/dbraw/zinc/65/60/30/567656030.db2.gz ONTTXVODZNJLJA-CYBMUJFWSA-N 0 3 398.301 3.184 10 0 GGAEHN COc1ccc([C@@H](CO)CNCc2ccc(Br)cc2OC)cc1 ZINC000459752320 567656678 /nfs/dbraw/zinc/65/66/78/567656678.db2.gz OLMGKTOCVUMADX-OAHLLOKOSA-N 0 3 380.282 3.332 10 0 GGAEHN C[C@H](NC(=O)CN1CCC[C@H]([C@H]2CCOC2)C1)c1ccc(Br)cc1 ZINC000441201934 567657614 /nfs/dbraw/zinc/65/76/14/567657614.db2.gz HBZAEFXLNCRKKH-XIRDDKMYSA-N 0 3 395.341 3.375 10 0 GGAEHN CO[C@H]1CCCC[C@@H]1N[C@H](C)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000441242400 567658072 /nfs/dbraw/zinc/65/80/72/567658072.db2.gz FFSPFFNHAFKEDE-COXVUDFISA-N 0 3 383.330 3.343 10 0 GGAEHN Cc1cc(NC(=O)Cc2ccc(Br)s2)n(C2CCN(C)CC2)n1 ZINC000531425279 567658156 /nfs/dbraw/zinc/65/81/56/567658156.db2.gz PELUXAPZMLMNRZ-UHFFFAOYSA-N 0 3 397.342 3.463 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNS(=O)(=O)Cc1cccc(Br)c1 ZINC000553477884 567658105 /nfs/dbraw/zinc/65/81/05/567658105.db2.gz CRVJDTXGPFLEGT-KBPBESRZSA-N 0 3 389.359 3.131 10 0 GGAEHN C[C@@H](NC[C@@H]1CCCNC1=O)c1ccc(Br)cc1Br ZINC000666188353 567659092 /nfs/dbraw/zinc/65/90/92/567659092.db2.gz ZURSAEJPHKPRQA-ZJUUUORDSA-N 0 3 390.119 3.388 10 0 GGAEHN C[C@H](NC[C@H]1CCCNC1=O)c1ccc(Br)cc1Br ZINC000666188352 567659177 /nfs/dbraw/zinc/65/91/77/567659177.db2.gz ZURSAEJPHKPRQA-VHSXEESVSA-N 0 3 390.119 3.388 10 0 GGAEHN O=C(CN1CCC[C@H]([C@@H]2CCOC2)C1)NCCc1cccc(Cl)c1Cl ZINC000441283198 567659366 /nfs/dbraw/zinc/65/93/66/567659366.db2.gz WJQIFXJXJCTASX-JKSUJKDBSA-N 0 3 385.335 3.401 10 0 GGAEHN C[C@@H]1CCCN(CCNC(=O)N[C@@H]2CCOc3c(Br)cccc32)C1 ZINC000507100469 567659503 /nfs/dbraw/zinc/65/95/03/567659503.db2.gz HHOBGIZTQSITPB-CZUORRHYSA-N 0 3 396.329 3.304 10 0 GGAEHN CCN(C(=O)Nc1ccc(Br)c(C(=O)OC)c1C)[C@H]1CCN(C)C1 ZINC000596872813 567660300 /nfs/dbraw/zinc/66/03/00/567660300.db2.gz ZZMDUALSFBBEFE-LBPRGKRZSA-N 0 3 398.301 3.102 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@@H]1CC[C@@H](OC)C1)c1ccc(Br)cn1 ZINC000622860457 567662416 /nfs/dbraw/zinc/66/24/16/567662416.db2.gz ZYCNCHXOUVYJBN-GDBMZVCRSA-N 0 3 398.345 3.334 10 0 GGAEHN COc1ccc(CN(C)C)cc1NC(=O)c1cncc(Br)c1C ZINC000666284661 567662552 /nfs/dbraw/zinc/66/25/52/567662552.db2.gz AFHMALAGGUHPIC-UHFFFAOYSA-N 0 3 378.270 3.475 10 0 GGAEHN CCN(C(=O)Nc1cc(C(=O)OC)c(Br)cc1C)[C@@H]1CCN(C)C1 ZINC000596902535 567663713 /nfs/dbraw/zinc/66/37/13/567663713.db2.gz DWBDGSVLIFMBMY-GFCCVEGCSA-N 0 3 398.301 3.102 10 0 GGAEHN Cc1c(Br)cncc1C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000666343926 567665500 /nfs/dbraw/zinc/66/55/00/567665500.db2.gz SUKMPYRGXWVDTH-UHFFFAOYSA-N 0 3 398.370 3.244 10 0 GGAEHN CCN1CC[C@@H](NCCCS(=O)(=O)C(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000572783460 567665719 /nfs/dbraw/zinc/66/57/19/567665719.db2.gz PWYJEUKARIDBKQ-QZTJIDSGSA-N 0 3 390.952 3.417 10 0 GGAEHN CCN(C(=O)Nc1cc(Br)cc(C(=O)OC)c1C)[C@@H]1CCN(C)C1 ZINC000596930670 567665807 /nfs/dbraw/zinc/66/58/07/567665807.db2.gz DKOVITMIGRSEOA-CYBMUJFWSA-N 0 3 398.301 3.102 10 0 GGAEHN Cc1cc(I)cc(NC(=O)CCN(C)c2ccncc2)c1 ZINC000553566314 567666648 /nfs/dbraw/zinc/66/66/48/567666648.db2.gz GJCFZXKCXUOBJZ-UHFFFAOYSA-N 0 3 395.244 3.460 10 0 GGAEHN CCN(C(=O)Nc1cc(Br)cc(C(=O)OC)c1C)[C@H]1CCN(C)C1 ZINC000596930673 567667121 /nfs/dbraw/zinc/66/71/21/567667121.db2.gz DKOVITMIGRSEOA-ZDUSSCGKSA-N 0 3 398.301 3.102 10 0 GGAEHN C[C@@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccc(OC(F)(F)F)cc1 ZINC000507245360 567669385 /nfs/dbraw/zinc/66/93/85/567669385.db2.gz ZBCNPFIQOGLYIV-OCCSQVGLSA-N 0 3 380.432 3.050 10 0 GGAEHN CN1CCC(NC(=O)c2cc(Oc3cccc(Br)c3)ccn2)CC1 ZINC000531633718 567670392 /nfs/dbraw/zinc/67/03/92/567670392.db2.gz FIYMXCPZRIQFQP-UHFFFAOYSA-N 0 3 390.281 3.460 10 0 GGAEHN CCN(C(=O)N[C@@H]1CSCc2ccc(Br)cc21)[C@H]1CCN(C)C1 ZINC000666399419 567672092 /nfs/dbraw/zinc/67/20/92/567672092.db2.gz LKMPVWHKYKGTDK-GOEBONIOSA-N 0 3 398.370 3.473 10 0 GGAEHN CCN(C(=O)N[C@@H]1CSCc2ccc(Br)cc21)[C@@H]1CCN(C)C1 ZINC000666399418 567672551 /nfs/dbraw/zinc/67/25/51/567672551.db2.gz LKMPVWHKYKGTDK-GDBMZVCRSA-N 0 3 398.370 3.473 10 0 GGAEHN Cc1cc(Br)cc(C)c1S(=O)(=O)NC[C@H](C)CN1CCCC1 ZINC000507308933 567674030 /nfs/dbraw/zinc/67/40/30/567674030.db2.gz IWKUGAJWOSPLER-LBPRGKRZSA-N 0 3 389.359 3.076 10 0 GGAEHN CN1C[C@@H](c2ccccc2)[C@H](CNS(=O)(=O)Cc2ccccc2Cl)C1 ZINC000645842861 567674517 /nfs/dbraw/zinc/67/45/17/567674517.db2.gz WBYRRESGOJLYPK-MSOLQXFVSA-N 0 3 378.925 3.105 10 0 GGAEHN C[C@H](NCCCN1CCC[C@H]1C(=O)N(C)C)c1sccc1Br ZINC000531705949 567674541 /nfs/dbraw/zinc/67/45/41/567674541.db2.gz DZBFKBPPKHUTOO-JSGCOSHPSA-N 0 3 388.375 3.104 10 0 GGAEHN O=C(N[C@@H]1CSCc2ccc(Br)cc21)N1CCN2CCC1CC2 ZINC000666402386 567675096 /nfs/dbraw/zinc/67/50/96/567675096.db2.gz XYDDLTZVVWDZNP-MRXNPFEDSA-N 0 3 396.354 3.227 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCc2cc(Br)ccc21 ZINC000507335971 567675590 /nfs/dbraw/zinc/67/55/90/567675590.db2.gz YPOPJVURAQMQHL-QGZVFWFLSA-N 0 3 380.330 3.420 10 0 GGAEHN COC(=O)c1ccc(CNCCCS(=O)(=O)c2ccccc2)cc1Cl ZINC000597051935 567678200 /nfs/dbraw/zinc/67/82/00/567678200.db2.gz OFYOUUAZALSIIN-UHFFFAOYSA-N 0 3 381.881 3.080 10 0 GGAEHN CCN1CCN(Cc2ccc(CNC(=O)c3ccsc3Cl)cc2)CC1 ZINC000666430967 567678182 /nfs/dbraw/zinc/67/81/82/567678182.db2.gz DKKCVLMEYYAWBW-UHFFFAOYSA-N 0 3 377.941 3.469 10 0 GGAEHN CO[C@H]1C[C@H]2C[C@@H](NCC(=O)Nc3ccc(Br)c(C)c3)C[C@H]2C1 ZINC000572994428 567679849 /nfs/dbraw/zinc/67/98/49/567679849.db2.gz JZZTVCDGNZPESR-SDSIWUNFSA-N 0 3 381.314 3.489 10 0 GGAEHN CCn1c(-c2ccccc2Br)nnc1N1CCCN(CC)CC1 ZINC000460238338 567680187 /nfs/dbraw/zinc/68/01/87/567680187.db2.gz MTEIJKBMWUFTEY-UHFFFAOYSA-N 0 3 378.318 3.260 10 0 GGAEHN CCc1nc(C)c([C@H](C)N[C@H]2CCN(S(=O)(=O)c3ccccc3)C2)s1 ZINC000573014679 567681209 /nfs/dbraw/zinc/68/12/09/567681209.db2.gz DOOKSSLNZXWFAF-ZFWWWQNUSA-N 0 3 379.551 3.128 10 0 GGAEHN CCn1c(-c2ccc(Br)s2)nnc1N(C)[C@H]1CCN(C2CC2)C1 ZINC000460299388 567682958 /nfs/dbraw/zinc/68/29/58/567682958.db2.gz DJCXFEIGIXEYBW-LBPRGKRZSA-N 0 3 396.358 3.462 10 0 GGAEHN Cc1cc(Br)c(CNC[C@@]2(O)CCSC2)cc1Br ZINC000623438544 567710679 /nfs/dbraw/zinc/71/06/79/567710679.db2.gz CVBOAVAMKSDWLA-ZDUSSCGKSA-N 0 3 395.160 3.478 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)NCc1ccc(Br)cc1C(F)(F)F ZINC000481528744 567684340 /nfs/dbraw/zinc/68/43/40/567684340.db2.gz XOFRJOWCBHTGME-LBPRGKRZSA-N 0 3 394.235 3.361 10 0 GGAEHN CCO[C@@H]1C[C@@](N)(C(=O)N[C@@H](C)c2ccc(Br)cc2OC)C1(C)C ZINC000573088685 567686843 /nfs/dbraw/zinc/68/68/43/567686843.db2.gz YIGDUPPNLPJMQO-BKGUAONASA-N 0 3 399.329 3.167 10 0 GGAEHN CCN(C(=O)Nc1cc(OC)c(Br)c(OC)c1)[C@H]1CCN(C)C1 ZINC000666565453 567687252 /nfs/dbraw/zinc/68/72/52/567687252.db2.gz OXBXKPAUGLCKKG-LBPRGKRZSA-N 0 3 386.290 3.024 10 0 GGAEHN CC1(C)CCCN[C@@H]1C(=O)NC[C@H]1CCN(c2cccc(Br)c2)C1 ZINC000573094242 567687331 /nfs/dbraw/zinc/68/73/31/567687331.db2.gz UNIXFDXELPJBGZ-RHSMWYFYSA-N 0 3 394.357 3.170 10 0 GGAEHN CC1(C)CCCN[C@@H]1C(=O)NC[C@@H]1CCN(c2cccc(Br)c2)C1 ZINC000573094243 567687344 /nfs/dbraw/zinc/68/73/44/567687344.db2.gz UNIXFDXELPJBGZ-WMLDXEAASA-N 0 3 394.357 3.170 10 0 GGAEHN CN(C)c1c(Cl)cccc1NC(=O)C(C[C@H]1COCCO1)C(F)(F)F ZINC000666613932 567689149 /nfs/dbraw/zinc/68/91/49/567689149.db2.gz IYYLSOHMEDREER-WDEREUQCSA-N 0 3 380.794 3.329 10 0 GGAEHN CC[C@H](NCCNS(=O)(=O)c1cccc(Cl)c1)c1cccc(OC)c1 ZINC000531952161 567689674 /nfs/dbraw/zinc/68/96/74/567689674.db2.gz HNIZEZUBBQIWPH-SFHVURJKSA-N 0 3 382.913 3.368 10 0 GGAEHN Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N1CCC[C@@](O)(CN(C)C)C1 ZINC000646022733 567690161 /nfs/dbraw/zinc/69/01/61/567690161.db2.gz BPUKDQSSFCZJQZ-QGZVFWFLSA-N 0 3 399.969 3.362 10 0 GGAEHN Cc1cc(Br)c(CNC(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)s1 ZINC000666640884 567690798 /nfs/dbraw/zinc/69/07/98/567690798.db2.gz YRWDTAAFZNHYPA-OCCSQVGLSA-N 0 3 386.359 3.445 10 0 GGAEHN Cc1cc(Br)c(CNC(=O)N2CC[C@@]3(C2)CCCN(C)C3)s1 ZINC000666638335 567690960 /nfs/dbraw/zinc/69/09/60/567690960.db2.gz CIZUUFRFWRUGNR-INIZCTEOSA-N 0 3 386.359 3.446 10 0 GGAEHN O=C(CCNC[C@@H]1COc2ccccc2O1)Nc1cccc(Br)c1 ZINC000573165586 567692493 /nfs/dbraw/zinc/69/24/93/567692493.db2.gz IXPZPMQXKWQPAH-OAHLLOKOSA-N 0 3 391.265 3.207 10 0 GGAEHN CC(C)[C@@H](NCC(=O)Nc1ccccc1Br)C1(CO)CC=CC1 ZINC000646085462 567693331 /nfs/dbraw/zinc/69/33/31/567693331.db2.gz FBRSCETYKPBHSG-QGZVFWFLSA-N 0 3 381.314 3.331 10 0 GGAEHN CC(C)[C@@H](NCC(=O)Nc1ccc(Br)cc1)C1(CO)CC=CC1 ZINC000646085003 567693573 /nfs/dbraw/zinc/69/35/73/567693573.db2.gz GTVLXQLDAXPSAH-QGZVFWFLSA-N 0 3 381.314 3.331 10 0 GGAEHN CCCCN([C@@H]1CCN(CC(F)(F)F)C1=O)[C@H]1CCc2ncsc2C1 ZINC000646129166 567694404 /nfs/dbraw/zinc/69/44/04/567694404.db2.gz YUMQMBHSMPUGIH-GXTWGEPZSA-N 0 3 375.460 3.266 10 0 GGAEHN CCN(CC)[C@H](CNc1ncncc1Br)c1cccc(OC)c1 ZINC000481699286 567696939 /nfs/dbraw/zinc/69/69/39/567696939.db2.gz UXHXFOOWSWAJPB-MRXNPFEDSA-N 0 3 379.302 3.165 10 0 GGAEHN Nc1ccnc2c1CN(c1nc(C(F)(F)F)c(Br)s1)CC2 ZINC000623283137 567697054 /nfs/dbraw/zinc/69/70/54/567697054.db2.gz NZTBEPKUAJZKPU-UHFFFAOYSA-N 0 3 379.205 3.464 10 0 GGAEHN Cn1ncc2ccc(CNC[C@@H](O)COc3c(Cl)cccc3Cl)cc21 ZINC000573238071 567697966 /nfs/dbraw/zinc/69/79/66/567697966.db2.gz MDESSRTWLHJJLN-CQSZACIVSA-N 0 3 380.275 3.410 10 0 GGAEHN CNS(=O)(=O)c1cccc([C@H](C)NCCc2ccccc2Br)c1 ZINC000481717149 567698465 /nfs/dbraw/zinc/69/84/65/567698465.db2.gz IXFSACITLHCAKU-ZDUSSCGKSA-N 0 3 397.338 3.251 10 0 GGAEHN CNS(=O)(=O)c1cccc([C@@H](C)NCCc2ccccc2Br)c1 ZINC000481717147 567698922 /nfs/dbraw/zinc/69/89/22/567698922.db2.gz IXFSACITLHCAKU-CYBMUJFWSA-N 0 3 397.338 3.251 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NC[C@H](C)N1CCC[C@H](C)C1 ZINC000460718429 567699626 /nfs/dbraw/zinc/69/96/26/567699626.db2.gz LEWYCWYWCAYYOB-KBPBESRZSA-N 0 3 383.330 3.237 10 0 GGAEHN CCSCc1ccnc(NC(=O)C(C[C@@H]2COCCO2)C(F)(F)F)c1 ZINC000597455188 567700655 /nfs/dbraw/zinc/70/06/55/567700655.db2.gz HKDAJFSPLOOFAX-OLZOCXBDSA-N 0 3 378.416 3.257 10 0 GGAEHN CO[C@@H](C)CN(CC(=O)N(C)Cc1cc(Br)cs1)C(C)C ZINC000532160743 567700767 /nfs/dbraw/zinc/70/07/67/567700767.db2.gz MPRPOTXDGBSENM-LBPRGKRZSA-N 0 3 377.348 3.214 10 0 GGAEHN CCN(C(=O)Nc1cc(Br)cc2nc(C)oc21)[C@H]1CCN(C)C1 ZINC000666742569 567702260 /nfs/dbraw/zinc/70/22/60/567702260.db2.gz DDBDWODPWGPOBK-LBPRGKRZSA-N 0 3 381.274 3.457 10 0 GGAEHN CN(CCN(C)C1CC1)C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000507779577 567705715 /nfs/dbraw/zinc/70/57/15/567705715.db2.gz PUGTWGMZVABKJK-HNNXBMFYSA-N 0 3 382.302 3.008 10 0 GGAEHN C[C@H](N[C@H]1CN(Cc2ccccc2)C[C@H]1C)c1ncc(Br)cn1 ZINC000573344263 567706121 /nfs/dbraw/zinc/70/61/21/567706121.db2.gz QAHIBVHWVDISRG-KEYYUXOJSA-N 0 3 375.314 3.410 10 0 GGAEHN O=C(NCCc1ccc(Br)s1)NC[C@@H]1CCN1C1CCCC1 ZINC000623382494 567706568 /nfs/dbraw/zinc/70/65/68/567706568.db2.gz IARUPBBGDOUXOH-ZDUSSCGKSA-N 0 3 386.359 3.369 10 0 GGAEHN Cc1ccc(Br)c(NC(=O)N2CCOC3(CCN(C)CC3)C2)c1 ZINC000646327165 567707389 /nfs/dbraw/zinc/70/73/89/567707389.db2.gz KLBPMTDRFGPMOL-UHFFFAOYSA-N 0 3 382.302 3.086 10 0 GGAEHN O=S1(=O)CCC(CCNCc2cc(Br)ccc2Cl)CC1 ZINC000507818379 567708462 /nfs/dbraw/zinc/70/84/62/567708462.db2.gz FSUFKKHOYAGIMM-UHFFFAOYSA-N 0 3 380.735 3.407 10 0 GGAEHN CC(C)N(CCN(C)C)C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000507813042 567708526 /nfs/dbraw/zinc/70/85/26/567708526.db2.gz QBZQJRPMQQNWNX-OAHLLOKOSA-N 0 3 384.318 3.254 10 0 GGAEHN CC[C@@H](COC)NCc1cc(Cl)cc(Cl)c1OCCN1CCOCC1 ZINC000623427065 567709285 /nfs/dbraw/zinc/70/92/85/567709285.db2.gz LGPQOMSFKKMHJZ-INIZCTEOSA-N 0 3 391.339 3.219 10 0 GGAEHN O=S1(=O)CCC(CCNCc2cc(Cl)ccc2Br)CC1 ZINC000507833519 567709723 /nfs/dbraw/zinc/70/97/23/567709723.db2.gz MXDASYSGGBYEBA-UHFFFAOYSA-N 0 3 380.735 3.407 10 0 GGAEHN O=S(=O)(c1ccccc1)N1CC[C@H](N[C@H]2CCc3ccc(Cl)cc32)C1 ZINC000554116093 567709980 /nfs/dbraw/zinc/70/99/80/567709980.db2.gz LOGYBPKUWQVARQ-LPHOPBHVSA-N 0 3 376.909 3.380 10 0 GGAEHN Cc1nc(-c2ccc(CNC(=O)N[C@@H]3CN(C4CC4)C[C@@H]3C)s2)cs1 ZINC000532320214 567710314 /nfs/dbraw/zinc/71/03/14/567710314.db2.gz BBYGWLSJUBNBNG-XHDPSFHLSA-N 0 3 376.551 3.462 10 0 GGAEHN Clc1cc(Cl)c(OCCN2CCOCC2)c(CN[C@@H]2CCSC2)c1 ZINC000623433021 567710294 /nfs/dbraw/zinc/71/02/94/567710294.db2.gz WVIRUNXZCUJTIF-OAHLLOKOSA-N 0 3 391.364 3.300 10 0 GGAEHN Cc1cc(C)c(NC(=O)N2CCOC3(CCN(C)CC3)C2)cc1Br ZINC000646367129 567711956 /nfs/dbraw/zinc/71/19/56/567711956.db2.gz LUIHNBPQTCMTAX-UHFFFAOYSA-N 0 3 396.329 3.394 10 0 GGAEHN Cc1[nH]c2ccc(Br)cc2c1CC(=O)N1CCN2CCC1CC2 ZINC000507876133 567712147 /nfs/dbraw/zinc/71/21/47/567712147.db2.gz OVTXXZKGAHGGIV-UHFFFAOYSA-N 0 3 376.298 3.088 10 0 GGAEHN CSC1(CNC(=O)c2c[nH]c3cccc(Br)c23)CCN(C)CC1 ZINC000460971147 567713452 /nfs/dbraw/zinc/71/34/52/567713452.db2.gz OWVZHYLKNVBRQS-UHFFFAOYSA-N 0 3 396.354 3.488 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CCC[C@@]3(CCN(C)C3)C2)c1 ZINC000597716143 567713881 /nfs/dbraw/zinc/71/38/81/567713881.db2.gz OHCHDDNWRQLOMY-KRWDZBQOSA-N 0 3 398.288 3.158 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cn3cc(Cl)cc(Cl)c3n2)C[C@@H]1N1CCCC1 ZINC000442889359 567716060 /nfs/dbraw/zinc/71/60/60/567716060.db2.gz GDJHPXSWBNYGJK-GJZGRUSLSA-N 0 3 399.347 3.293 10 0 GGAEHN CN(Cc1cccc(Br)c1OC[C@@H]1CCCO1)CC1(O)CCC1 ZINC000442890062 567716070 /nfs/dbraw/zinc/71/60/70/567716070.db2.gz GVGGKIIZEYAVCO-HNNXBMFYSA-N 0 3 384.314 3.354 10 0 GGAEHN CCCN(C(=O)Nc1cnc2c(Br)cccn12)[C@@H]1CCN(C)C1 ZINC000646403166 567716299 /nfs/dbraw/zinc/71/62/99/567716299.db2.gz ZSXZTBXMYJMCQA-GFCCVEGCSA-N 0 3 380.290 3.045 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000646450851 567718234 /nfs/dbraw/zinc/71/82/34/567718234.db2.gz ZJOGJNFTGVAETA-FJIDUMEYSA-N 0 3 383.319 3.419 10 0 GGAEHN C[C@@H]1C[C@@H]1N1C[C@@H](NCc2ccc(OC(F)F)c(Br)c2)CC1=O ZINC000507953925 567718321 /nfs/dbraw/zinc/71/83/21/567718321.db2.gz WCWNITXYBKNYCM-CDMKHQONSA-N 0 3 389.240 3.149 10 0 GGAEHN C[C@H](Oc1cccc(Cl)c1Cl)C(=O)N1CCOC[C@@H]1[C@H]1CCCN1C ZINC000646447500 567718493 /nfs/dbraw/zinc/71/84/93/567718493.db2.gz UNISWQOALOZPGB-NWANDNLSSA-N 0 3 387.307 3.082 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)c1cc(Br)ccc1Cl ZINC000646449519 567718543 /nfs/dbraw/zinc/71/85/43/567718543.db2.gz OGOOMVWUCRONRR-HUUCEWRRSA-N 0 3 387.705 3.038 10 0 GGAEHN C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CCOC[C@H]1[C@H]1CCCN1C ZINC000646449960 567718666 /nfs/dbraw/zinc/71/86/66/567718666.db2.gz SDYUIESRPKTTMM-VUCTXSBTSA-N 0 3 387.307 3.082 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1csc(-c2ccc(Cl)s2)n1 ZINC000646443610 567718809 /nfs/dbraw/zinc/71/88/09/567718809.db2.gz HFBOEOVDMMNCLB-QWHCGFSZSA-N 0 3 397.953 3.460 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000646450854 567718841 /nfs/dbraw/zinc/71/88/41/567718841.db2.gz ZJOGJNFTGVAETA-XDNAFOTISA-N 0 3 383.319 3.419 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000646450853 567719061 /nfs/dbraw/zinc/71/90/61/567719061.db2.gz ZJOGJNFTGVAETA-TVFCKZIOSA-N 0 3 383.319 3.419 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)c1ccc(C(F)(F)F)cc1Cl ZINC000646445684 567719124 /nfs/dbraw/zinc/71/91/24/567719124.db2.gz CCLRSQCPUNGPKH-HUUCEWRRSA-N 0 3 376.806 3.294 10 0 GGAEHN Cc1ccc(I)c(C(=O)NC[C@@H]2CCN2C(C)(C)C)c1 ZINC000597859047 567719196 /nfs/dbraw/zinc/71/91/96/567719196.db2.gz QPSCISYSWCMILS-LBPRGKRZSA-N 0 3 386.277 3.202 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1ccc(C(F)(F)F)cc1Cl ZINC000646445685 567719138 /nfs/dbraw/zinc/71/91/38/567719138.db2.gz CCLRSQCPUNGPKH-LSDHHAIUSA-N 0 3 376.806 3.294 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)c1ccc(C(F)(F)F)cc1Cl ZINC000646445683 567719294 /nfs/dbraw/zinc/71/92/94/567719294.db2.gz CCLRSQCPUNGPKH-GJZGRUSLSA-N 0 3 376.806 3.294 10 0 GGAEHN CC[C@H](CNCc1cc(Cl)cc(Cl)c1OCCN1CCOCC1)OC ZINC000623528243 567719415 /nfs/dbraw/zinc/71/94/15/567719415.db2.gz BXRBFTICYKWNKQ-MRXNPFEDSA-N 0 3 391.339 3.219 10 0 GGAEHN CN1CCC(NC(=O)c2c(F)ccc(C(F)(F)F)c2Br)CC1 ZINC000623528956 567719487 /nfs/dbraw/zinc/71/94/87/567719487.db2.gz NDYKZBUIGLRNSC-UHFFFAOYSA-N 0 3 383.183 3.431 10 0 GGAEHN Cc1ccc(I)cc1C(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000597858119 567719752 /nfs/dbraw/zinc/71/97/52/567719752.db2.gz JSQFVPDYFRNRHH-ZDUSSCGKSA-N 0 3 386.277 3.202 10 0 GGAEHN FC1(F)C[C@@H]1OCCNCc1c[nH]nc1-c1ccc(Br)s1 ZINC000623564410 567721566 /nfs/dbraw/zinc/72/15/66/567721566.db2.gz BSAZAPKTYOYQNX-JTQLQIEISA-N 0 3 378.242 3.415 10 0 GGAEHN CO[C@@H]1CCC[C@H]([C@H](CO)NCc2ccc(Br)c(F)c2F)C1 ZINC000623562931 567721709 /nfs/dbraw/zinc/72/17/09/567721709.db2.gz IBNUUUXRTKGZNE-SUHUHFCYSA-N 0 3 378.257 3.383 10 0 GGAEHN CO[C@@H](CNCc1c[nH]nc1-c1ccc(Br)s1)[C@H]1CCOC1 ZINC000623562002 567721983 /nfs/dbraw/zinc/72/19/83/567721983.db2.gz DZYRNDHIULJLNX-JQWIXIFHSA-N 0 3 386.315 3.042 10 0 GGAEHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)[C@@H]1CCc2cc(Br)ccc21 ZINC000573567932 567723416 /nfs/dbraw/zinc/72/34/16/567723416.db2.gz RPSRXXXUXRFDOZ-FUHWJXTLSA-N 0 3 395.341 3.048 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)Nc1cnc2c(Br)cccn12 ZINC000667099474 567724735 /nfs/dbraw/zinc/72/47/35/567724735.db2.gz YBUMXOWMBUMEAV-NSHDSACASA-N 0 3 380.290 3.091 10 0 GGAEHN O=C(NCc1cc(F)c(Br)cc1F)N[C@H]1CCN(CC2CC2)C1 ZINC000623633447 567726231 /nfs/dbraw/zinc/72/62/31/567726231.db2.gz QUAYXHOREDIODB-LBPRGKRZSA-N 0 3 388.256 3.011 10 0 GGAEHN O=C(NCc1cc(F)c(Br)cc1F)N[C@@H]1CCN(CC2CC2)C1 ZINC000623633446 567726402 /nfs/dbraw/zinc/72/64/02/567726402.db2.gz QUAYXHOREDIODB-GFCCVEGCSA-N 0 3 388.256 3.011 10 0 GGAEHN OCCOC1(CNCc2ccccc2Br)CCC(F)(F)CC1 ZINC000623635808 567726794 /nfs/dbraw/zinc/72/67/94/567726794.db2.gz WYPCFLCMCACNIM-UHFFFAOYSA-N 0 3 378.257 3.496 10 0 GGAEHN C[C@@H](NC[C@H](CO)c1cccnc1)c1ccccc1I ZINC000554403579 567726866 /nfs/dbraw/zinc/72/68/66/567726866.db2.gz XKNHHOKBBHPFKW-TZMCWYRMSA-N 0 3 382.245 3.113 10 0 GGAEHN O=C(NC1CCN(C2CC2)CC1)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000623629902 567726896 /nfs/dbraw/zinc/72/68/96/567726896.db2.gz RCRCTTRROQCCNS-BPQIPLTHSA-N 0 3 375.310 3.078 10 0 GGAEHN CC(C)(C)n1cc(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)cn1 ZINC000623644221 567728197 /nfs/dbraw/zinc/72/81/97/567728197.db2.gz QDHCBUFQDGHPLN-IBGZPJMESA-N 0 3 392.341 3.410 10 0 GGAEHN OC[C@@]1(NCc2cn3ccccc3n2)CCc2cc(Br)ccc2C1 ZINC000623643976 567728227 /nfs/dbraw/zinc/72/82/27/567728227.db2.gz IUEUGIKYEXHTPQ-LJQANCHMSA-N 0 3 386.293 3.106 10 0 GGAEHN COc1ccc(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)cc1O ZINC000623644427 567728264 /nfs/dbraw/zinc/72/82/64/567728264.db2.gz XIUJSGPAJANHEV-IBGZPJMESA-N 0 3 392.293 3.173 10 0 GGAEHN OC[C@@]1(NCc2cnc3ccccn23)CCc2cc(Br)ccc2C1 ZINC000623643755 567728289 /nfs/dbraw/zinc/72/82/89/567728289.db2.gz AMSXKACBEUWYCT-LJQANCHMSA-N 0 3 386.293 3.106 10 0 GGAEHN CCN(C(=O)c1cc(Cl)ccc1I)[C@H]1CCN(C)C1 ZINC000597946617 567728861 /nfs/dbraw/zinc/72/88/61/567728861.db2.gz QQAWVBSJFDXTGO-NSHDSACASA-N 0 3 392.668 3.111 10 0 GGAEHN CCN(C(=O)c1cc(I)cc(C)c1C)[C@H]1CCN(C)C1 ZINC000597945973 567729003 /nfs/dbraw/zinc/72/90/03/567729003.db2.gz LMKIMXSTPGQIIC-AWEZNQCLSA-N 0 3 386.277 3.074 10 0 GGAEHN CN1CC[C@]2(CCN(C(=O)Nc3cnc(-c4ccc(Cl)s4)nc3)C2)C1 ZINC000646545777 567729162 /nfs/dbraw/zinc/72/91/62/567729162.db2.gz UGGDXCZTGOKVAQ-KRWDZBQOSA-N 0 3 377.901 3.418 10 0 GGAEHN O=C(NCCc1nc(C(F)(F)F)cs1)NC[C@H]1CCN1C1CCCC1 ZINC000623682711 567730684 /nfs/dbraw/zinc/73/06/84/567730684.db2.gz ZMKJSNRCUHRDJS-GFCCVEGCSA-N 0 3 376.448 3.021 10 0 GGAEHN Brc1cnn(C2CCN(CCOCCOc3ccccc3)CC2)c1 ZINC000597996250 567731815 /nfs/dbraw/zinc/73/18/15/567731815.db2.gz ZCHNFZCXBPXGNY-UHFFFAOYSA-N 0 3 394.313 3.378 10 0 GGAEHN O=C(CCCc1cccc(Br)c1)NCCCNCc1cccnc1 ZINC000646615570 567731797 /nfs/dbraw/zinc/73/17/97/567731797.db2.gz ZFEPUKIJWCNBCJ-UHFFFAOYSA-N 0 3 390.325 3.463 10 0 GGAEHN C[C@H]1C[C@@H](c2ccc(Br)cc2)CN1C(=O)NC1CCN(C)CC1 ZINC000623704554 567732014 /nfs/dbraw/zinc/73/20/14/567732014.db2.gz ADEBZOALRQHVHB-DZGCQCFKSA-N 0 3 380.330 3.431 10 0 GGAEHN Cn1c(-c2ccccc2Br)nnc1N1CC[C@H](N2CCCCC2)C1 ZINC000508138828 567733084 /nfs/dbraw/zinc/73/30/84/567733084.db2.gz PFTAHQIFGGMSOU-AWEZNQCLSA-N 0 3 390.329 3.309 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1cccc(F)c1I ZINC000532755731 567733184 /nfs/dbraw/zinc/73/31/84/567733184.db2.gz AVPXQFATSZRNHX-LLVKDONJSA-N 0 3 390.240 3.035 10 0 GGAEHN O=C(NCC/C=C/c1ccc(Br)cc1)N[C@@H]1CCN(C2CC2)C1 ZINC000623719176 567733782 /nfs/dbraw/zinc/73/37/82/567733782.db2.gz KBOFIGMQOYQRLI-BCMPFUBYSA-N 0 3 378.314 3.388 10 0 GGAEHN O=C(NCCN1CCCCCC1)Nc1ccc2nccnc2c1Br ZINC000554543298 567734504 /nfs/dbraw/zinc/73/45/04/567734504.db2.gz QCDYQPACVFCMEI-UHFFFAOYSA-N 0 3 392.301 3.390 10 0 GGAEHN CO[C@]1(CNCc2cnc(-c3ccc(Br)cc3)s2)CCOC1 ZINC000461436862 567736864 /nfs/dbraw/zinc/73/68/64/567736864.db2.gz DUCLVFUTIGIPMV-INIZCTEOSA-N 0 3 383.311 3.468 10 0 GGAEHN Cc1noc([C@H]2OCC[C@H]2N[C@@H](C)Cc2ccc(F)cc2Br)n1 ZINC000623816643 567738863 /nfs/dbraw/zinc/73/88/63/567738863.db2.gz HZWITFVXMXMQPL-AMFBXLIHSA-N 0 3 384.249 3.330 10 0 GGAEHN Cc1noc([C@@H]2OCC[C@@H]2NCc2ccnc3c(Br)cccc23)n1 ZINC000623816812 567739295 /nfs/dbraw/zinc/73/92/95/567739295.db2.gz PIRVPLBIOOTINN-GOEBONIOSA-N 0 3 389.253 3.309 10 0 GGAEHN CN1CC[C@@H](NCCS(=O)(=O)c2ccccc2)[C@@H]1c1ccc(Cl)cc1 ZINC000573884973 567742427 /nfs/dbraw/zinc/74/24/27/567742427.db2.gz CFVXLLFSLSVNNW-MOPGFXCFSA-N 0 3 378.925 3.149 10 0 GGAEHN Cc1ccc([C@@H](CNC(=O)c2cncc(Br)c2C)N(C)C)cc1 ZINC000667354678 567743079 /nfs/dbraw/zinc/74/30/79/567743079.db2.gz PIGDVUSUTAURCW-QGZVFWFLSA-N 0 3 376.298 3.494 10 0 GGAEHN C/C(=C/c1cccc(C(F)(F)F)c1)CNC[C@H]1CCCN1S(C)(=O)=O ZINC000554718594 567744399 /nfs/dbraw/zinc/74/43/99/567744399.db2.gz XGRXODKZMBOGLX-RCBBPTIPSA-N 0 3 376.444 3.122 10 0 GGAEHN Cc1ccc(Br)cc1[C@@H](C)NCc1cccc(OCC(N)=O)c1 ZINC000623899878 567745709 /nfs/dbraw/zinc/74/57/09/567745709.db2.gz WEQDLQCLKIOJJE-CYBMUJFWSA-N 0 3 377.282 3.472 10 0 GGAEHN O=C(NC[C@H](c1cccs1)N1CCCC1)[C@@H]1CCCN1CC(F)(F)F ZINC000461744090 567745987 /nfs/dbraw/zinc/74/59/87/567745987.db2.gz DFDIPADTFFVOTN-UONOGXRCSA-N 0 3 375.460 3.028 10 0 GGAEHN C[C@@H](NCc1ccc(Br)cc1N1CCOCC1)[C@@H]1CCCCO1 ZINC000623922352 567746243 /nfs/dbraw/zinc/74/62/43/567746243.db2.gz XKHHGTMZAIOWCE-KDOFPFPSSA-N 0 3 383.330 3.333 10 0 GGAEHN C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)NCC1(CS(C)(=O)=O)CC1 ZINC000623918747 567746435 /nfs/dbraw/zinc/74/64/35/567746435.db2.gz ZZSDFCHSGBCJQF-SNVBAGLBSA-N 0 3 384.851 3.099 10 0 GGAEHN Cc1cc(N2CC[C@@H](N[C@H](C)c3cc(Br)ccc3C)C2=O)n(C)n1 ZINC000623918166 567746673 /nfs/dbraw/zinc/74/66/73/567746673.db2.gz JRJHOXRFKTYWJK-CZUORRHYSA-N 0 3 391.313 3.256 10 0 GGAEHN Cc1ccc(Br)cc1[C@@H](C)N[C@@H]1CCN(C2CCOCC2)C1=O ZINC000623918577 567747016 /nfs/dbraw/zinc/74/70/16/567747016.db2.gz VKFVQODARSFDBW-CXAGYDPISA-N 0 3 381.314 3.188 10 0 GGAEHN CO[C@@H]1CC[C@@H](C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)C1 ZINC000667427343 567746956 /nfs/dbraw/zinc/74/69/56/567746956.db2.gz CGOJRHXMTRCOHA-NVXWUHKLSA-N 0 3 383.330 3.154 10 0 GGAEHN C[C@H](NCc1ccc(Br)cc1N1CCOCC1)[C@@H]1CCCCO1 ZINC000623922353 567747809 /nfs/dbraw/zinc/74/78/09/567747809.db2.gz XKHHGTMZAIOWCE-KSSFIOAISA-N 0 3 383.330 3.333 10 0 GGAEHN Cc1onc(-c2cccc(Br)c2)c1C(=O)N1CC[C@@H]2CN(C)C[C@H]21 ZINC000646916514 567748095 /nfs/dbraw/zinc/74/80/95/567748095.db2.gz KCEMVDOBYPHGJA-UKRRQHHQSA-N 0 3 390.281 3.189 10 0 GGAEHN Cc1onc(-c2cccc(Br)c2)c1C(=O)N1CC[C@H]2CN(C)C[C@@H]21 ZINC000646916515 567748343 /nfs/dbraw/zinc/74/83/43/567748343.db2.gz KCEMVDOBYPHGJA-ZFWWWQNUSA-N 0 3 390.281 3.189 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)c3[nH]c4ccc(Br)cc4c3Cl)[C@@H]2C1 ZINC000646915668 567748431 /nfs/dbraw/zinc/74/84/31/567748431.db2.gz SHVICHALBNYUTR-TVQRCGJNSA-N 0 3 382.689 3.360 10 0 GGAEHN Cc1cc(C(=O)N2CC[C@H]3CN(C)C[C@@H]32)nn1-c1ccc(Cl)c(Cl)c1 ZINC000646934950 567749860 /nfs/dbraw/zinc/74/98/60/567749860.db2.gz YDDYVJKEUQBRNV-SJCJKPOMSA-N 0 3 379.291 3.264 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)COc3ccc4cc(Br)ccc4c3)[C@@H]2C1 ZINC000646937428 567749876 /nfs/dbraw/zinc/74/98/76/567749876.db2.gz LKFANQPKKRRPOU-MAUKXSAKSA-N 0 3 389.293 3.144 10 0 GGAEHN O=C(NCCN1CCCCCC1)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000623979753 567752171 /nfs/dbraw/zinc/75/21/71/567752171.db2.gz KXHYLFBUJMYHSR-CGTJXYLNSA-N 0 3 377.326 3.327 10 0 GGAEHN OC[C@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1ncc(Br)cc1F ZINC000623989075 567752175 /nfs/dbraw/zinc/75/21/75/567752175.db2.gz IUFQRZVLYLQGDJ-PBHICJAKSA-N 0 3 394.288 3.278 10 0 GGAEHN C[C@@H](N[C@@H](C)Cc1ncc(C(F)(F)F)cc1Cl)C1(S(C)(=O)=O)CC1 ZINC000623982483 567752443 /nfs/dbraw/zinc/75/24/43/567752443.db2.gz WCVIUJHDVJRBKB-VHSXEESVSA-N 0 3 384.851 3.240 10 0 GGAEHN C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)NCC1(CS(C)(=O)=O)CCC1 ZINC000624002134 567753738 /nfs/dbraw/zinc/75/37/38/567753738.db2.gz WTXMWOJTHZFICA-LLVKDONJSA-N 0 3 398.878 3.489 10 0 GGAEHN COC[C@@H](C)CN[C@@H]1CCCN(c2c(C)cc(Br)cc2C)C1=O ZINC000554874372 567754461 /nfs/dbraw/zinc/75/44/61/567754461.db2.gz VTPVZINYANXLQA-BLLLJJGKSA-N 0 3 383.330 3.433 10 0 GGAEHN C[C@@H](CC(=O)NCCNc1ccncc1)c1ccc(F)c(Br)c1 ZINC000461937638 567756883 /nfs/dbraw/zinc/75/68/83/567756883.db2.gz QTLQBZYJLDSOTK-LBPRGKRZSA-N 0 3 380.261 3.127 10 0 GGAEHN O=C(CCSc1ccccc1Br)N[C@@H]1CNCCC1(F)F ZINC000647075759 567759144 /nfs/dbraw/zinc/75/91/44/567759144.db2.gz DUFDEECZYAEKIZ-GFCCVEGCSA-N 0 3 379.270 3.045 10 0 GGAEHN N[C@@H]1CCCc2cn(Cc3nc(-c4cc(Br)cs4)no3)nc21 ZINC000574150971 567759773 /nfs/dbraw/zinc/75/97/73/567759773.db2.gz SNURTFQZIHDBKT-SNVBAGLBSA-N 0 3 380.271 3.142 10 0 GGAEHN C[C@@H](N[C@H]1CCN(c2ccc3nncn3n2)C1)c1ccc(Cl)cc1Cl ZINC000624114040 567760620 /nfs/dbraw/zinc/76/06/20/567760620.db2.gz RTMHAUFNJMUXSE-YPMHNXCESA-N 0 3 377.279 3.361 10 0 GGAEHN C[C@H](N[C@H]1CCN(c2ccc3nncn3n2)C1)c1ccc(Cl)c(Cl)c1 ZINC000624113913 567760702 /nfs/dbraw/zinc/76/07/02/567760702.db2.gz PGBXBTZVZZNCEU-AAEUAGOBSA-N 0 3 377.279 3.361 10 0 GGAEHN C[C@@H](NCC1(OCCO)CCC(F)(F)CC1)c1cncc(Br)c1 ZINC000624104107 567760796 /nfs/dbraw/zinc/76/07/96/567760796.db2.gz YIBROUHGCQWCQL-GFCCVEGCSA-N 0 3 393.272 3.452 10 0 GGAEHN CC[C@H](CO)N1CCN(c2ccnc3c(Br)ccc(F)c23)CC1 ZINC000443512295 567764091 /nfs/dbraw/zinc/76/40/91/567764091.db2.gz VOFNSRXBCQGQNE-GFCCVEGCSA-N 0 3 382.277 3.029 10 0 GGAEHN C[C@H](NC[C@@H]1COCCN1C)c1ccc(Br)cc1C(F)(F)F ZINC000624175532 567764668 /nfs/dbraw/zinc/76/46/68/567764668.db2.gz RIDVWAFDIDLEMK-CMPLNLGQSA-N 0 3 381.236 3.449 10 0 GGAEHN Cc1c([C@H](C)NC[C@H]2COCCN2C)cnn1-c1ccc(Cl)cc1Cl ZINC000624173994 567765403 /nfs/dbraw/zinc/76/54/03/567765403.db2.gz PBOCIJUKNZONHL-WFASDCNBSA-N 0 3 383.323 3.469 10 0 GGAEHN O=C(Nc1ccc(-c2ccc(Cl)s2)nn1)N[C@@H]1CCN(CC2CC2)C1 ZINC000667682654 567765535 /nfs/dbraw/zinc/76/55/35/567765535.db2.gz SCTWYXNMGVSOKT-GFCCVEGCSA-N 0 3 377.901 3.464 10 0 GGAEHN O=C(Nc1ccc(-c2ccc(Cl)s2)nn1)N[C@H]1CCN(CC2CC2)C1 ZINC000667682655 567765820 /nfs/dbraw/zinc/76/58/20/567765820.db2.gz SCTWYXNMGVSOKT-LBPRGKRZSA-N 0 3 377.901 3.464 10 0 GGAEHN NS(=O)(=O)c1ccc(CNCC2(c3ccc(Cl)cc3)CCC2)c(F)c1 ZINC000647178559 567768530 /nfs/dbraw/zinc/76/85/30/567768530.db2.gz ZDROVHLPOMTBKQ-UHFFFAOYSA-N 0 3 382.888 3.338 10 0 GGAEHN C[C@H](N[C@H]1CCOC[C@H]1O)c1ccc(Br)cc1Br ZINC000624235245 567769552 /nfs/dbraw/zinc/76/95/52/567769552.db2.gz HDLKDJUCJUXDQQ-AQUOVQTQSA-N 0 3 379.092 3.012 10 0 GGAEHN CC(C)Cc1ncc(CNC[C@@H](c2cccs2)N2CCN(C)CC2)s1 ZINC000533449444 567770436 /nfs/dbraw/zinc/77/04/36/567770436.db2.gz MEZZCYNMWRQPJS-KRWDZBQOSA-N 0 3 378.611 3.481 10 0 GGAEHN C[C@H](NC[C@H]1CN(Cc2ccncc2)CCO1)c1cccc(Br)c1 ZINC000624266628 567770872 /nfs/dbraw/zinc/77/08/72/567770872.db2.gz RSVOFHJNWJJNNW-KXBFYZLASA-N 0 3 390.325 3.396 10 0 GGAEHN NS(=O)(=O)c1ccc(CNC2(Cc3ccc(Cl)cc3)CCC2)c(F)c1 ZINC000647212516 567771478 /nfs/dbraw/zinc/77/14/78/567771478.db2.gz ZPIRJLOKBDWIGW-UHFFFAOYSA-N 0 3 382.888 3.382 10 0 GGAEHN Brc1cccc(N2CC[C@@H](NCc3ccnn3-c3ccccn3)C2)c1 ZINC000647207100 567771599 /nfs/dbraw/zinc/77/15/99/567771599.db2.gz WRRSZANLIUCZDN-MRXNPFEDSA-N 0 3 398.308 3.398 10 0 GGAEHN NS(=O)(=O)c1ccc2c(c1)[C@@H](NCC1(C(F)(F)F)CCCC1)CCC2 ZINC000624272578 567772172 /nfs/dbraw/zinc/77/21/72/567772172.db2.gz LCACBOGUAGCMEH-HNNXBMFYSA-N 0 3 376.444 3.424 10 0 GGAEHN O=S1(=O)C[C@H](CN[C@H]2CCc3cccc(Cl)c3C2)Oc2ccccc21 ZINC000647223632 567772548 /nfs/dbraw/zinc/77/25/48/567772548.db2.gz IMQJIWJNXYYTMJ-GJZGRUSLSA-N 0 3 377.893 3.022 10 0 GGAEHN CC(C)(CNCc1cc(Br)ccc1OC(F)F)[C@@]1(O)CCOC1 ZINC000647245930 567773998 /nfs/dbraw/zinc/77/39/98/567773998.db2.gz MQTAOVAAHZNYRU-MRXNPFEDSA-N 0 3 394.256 3.318 10 0 GGAEHN CC(C)(CNCc1cc(Br)ccc1OC(F)F)[C@]1(O)CCOC1 ZINC000647245929 567774220 /nfs/dbraw/zinc/77/42/20/567774220.db2.gz MQTAOVAAHZNYRU-INIZCTEOSA-N 0 3 394.256 3.318 10 0 GGAEHN O=C(Nc1cnc2c(c1)CNCC2)N[C@@H]1COc2c1ccc(Cl)c2Cl ZINC000667797142 567774306 /nfs/dbraw/zinc/77/43/06/567774306.db2.gz DFIHXGXLTAIIMI-CQSZACIVSA-N 0 3 379.247 3.289 10 0 GGAEHN CN(C)C[C@@H](NC(=O)CSCC(=O)OC(C)(C)C)c1ccc(Cl)cc1 ZINC000555231222 567775295 /nfs/dbraw/zinc/77/52/95/567775295.db2.gz OIZDERPNLSURNR-OAHLLOKOSA-N 0 3 386.945 3.134 10 0 GGAEHN COC[C@@](C)(CCO)NCc1cnc(-c2ccc(Br)cc2)s1 ZINC000533565171 567775766 /nfs/dbraw/zinc/77/57/66/567775766.db2.gz ZUORXMUZIBDFGX-MRXNPFEDSA-N 0 3 385.327 3.450 10 0 GGAEHN CCCN1CC[C@@H](NC(=O)NCc2cc(F)c(Br)cc2F)C1 ZINC000624380688 567776808 /nfs/dbraw/zinc/77/68/08/567776808.db2.gz OTTSUKJANUYCJG-LLVKDONJSA-N 0 3 376.245 3.011 10 0 GGAEHN NCc1cccc2c1N(S(=O)(=O)c1ccc(Br)cc1F)CCC2 ZINC000624390108 567777327 /nfs/dbraw/zinc/77/73/27/567777327.db2.gz VGFDIESTVIYAFH-UHFFFAOYSA-N 0 3 399.285 3.188 10 0 GGAEHN COCc1cc(Cl)cc(S(=O)(=O)N2CCCc3cccc(CN)c32)c1 ZINC000624389444 567777767 /nfs/dbraw/zinc/77/77/67/567777767.db2.gz ARMXMZNPBKIQAU-UHFFFAOYSA-N 0 3 380.897 3.087 10 0 GGAEHN NCc1cccc2c1N(S(=O)(=O)Cc1ccc(Br)cc1)CCC2 ZINC000624389126 567777860 /nfs/dbraw/zinc/77/78/60/567777860.db2.gz RCLCJVNCQWUQKS-UHFFFAOYSA-N 0 3 395.322 3.190 10 0 GGAEHN O[C@H]1CCN(Cc2ccc(CNc3ncc(Br)cc3F)cc2)C1 ZINC000624392775 567778664 /nfs/dbraw/zinc/77/86/64/567778664.db2.gz YZZXIMMSKNJKPI-HNNXBMFYSA-N 0 3 380.261 3.162 10 0 GGAEHN C[C@@H](NC[C@H](CO)Cc1cccc(Br)c1)c1cc2n(n1)CCCC2 ZINC000647301481 567778688 /nfs/dbraw/zinc/77/86/88/567778688.db2.gz VJPGNTSUINAIDP-GDBMZVCRSA-N 0 3 392.341 3.484 10 0 GGAEHN C[C@@H](NC[C@H](CO)Cc1ccccc1Br)c1cc2n(n1)CCCC2 ZINC000647301392 567778715 /nfs/dbraw/zinc/77/87/15/567778715.db2.gz JJMVBVGCXBYXPQ-HUUCEWRRSA-N 0 3 392.341 3.484 10 0 GGAEHN C[C@H](NC[C@H](CO)Cc1ccc(Br)cc1)c1cc2n(n1)CCCC2 ZINC000647301294 567778753 /nfs/dbraw/zinc/77/87/53/567778753.db2.gz BEUPVOZRSPPWEK-GOEBONIOSA-N 0 3 392.341 3.484 10 0 GGAEHN C[C@H](NC[C@H](CO)Cc1ccccc1Br)c1cc2n(n1)CCCC2 ZINC000647301393 567779031 /nfs/dbraw/zinc/77/90/31/567779031.db2.gz JJMVBVGCXBYXPQ-LSDHHAIUSA-N 0 3 392.341 3.484 10 0 GGAEHN CCC(=O)N1CCC(NC2(c3cc(Br)ccc3OC)CC2)CC1 ZINC000647315085 567779568 /nfs/dbraw/zinc/77/95/68/567779568.db2.gz GMKHBGOKYDSQCU-UHFFFAOYSA-N 0 3 381.314 3.437 10 0 GGAEHN CC(C)(CN[C@H](c1ccc(Br)cc1)[C@H]1CCCO1)[C@]1(O)CCOC1 ZINC000647340682 567779976 /nfs/dbraw/zinc/77/99/76/567779976.db2.gz NCOHNRZEADDKNH-LMMKCTJWSA-N 0 3 398.341 3.436 10 0 GGAEHN Cc1ccc(C(=O)N2CC[C@@H](OCCN3CCCCC3)C2)c(Br)c1 ZINC000533649765 567780792 /nfs/dbraw/zinc/78/07/92/567780792.db2.gz XAQCZDNPBUPHRM-MRXNPFEDSA-N 0 3 395.341 3.475 10 0 GGAEHN CN1CC[C@@H]2CN(C(=O)NCC/C=C\c3ccc(Br)cc3)C[C@@H]21 ZINC000624489102 567784004 /nfs/dbraw/zinc/78/40/04/567784004.db2.gz USXLBWNQYMQFRO-KFZRMEMPSA-N 0 3 378.314 3.198 10 0 GGAEHN CC(C(=O)N1CCc2sccc2C1)S(=O)(=O)C(C)(C)c1ccccc1 ZINC000555464624 567785302 /nfs/dbraw/zinc/78/53/02/567785302.db2.gz MTKBXPJITCBKRO-CQSZACIVSA-N 0 3 377.531 3.371 10 0 GGAEHN Brc1cc(CNCCc2cnc(C3CC3)nc2)cc2c1OCCO2 ZINC000533740909 567785406 /nfs/dbraw/zinc/78/54/06/567785406.db2.gz DCZQDCLVNFCJTF-UHFFFAOYSA-N 0 3 390.281 3.220 10 0 GGAEHN COc1cc(Br)ccc1CN[C@@H]1CCCN(c2cc(C)nn2C)C1 ZINC000444016415 567785597 /nfs/dbraw/zinc/78/55/97/567785597.db2.gz ZFIXGJYFAZOSGV-MRXNPFEDSA-N 0 3 393.329 3.258 10 0 GGAEHN COc1ccc(Br)cc1CN[C@H]1CCCN(c2cc(C)nn2C)C1 ZINC000444014387 567785803 /nfs/dbraw/zinc/78/58/03/567785803.db2.gz PJPSWJOESKHBNH-INIZCTEOSA-N 0 3 393.329 3.258 10 0 GGAEHN COc1ccc(CCC(=O)N2CC[C@@H](N3CCCC3)C2)c(Br)c1 ZINC000668008953 567787825 /nfs/dbraw/zinc/78/78/25/567787825.db2.gz JAUDCZCXMNHAQI-OAHLLOKOSA-N 0 3 381.314 3.087 10 0 GGAEHN CN(C)[C@@H]1CCCN(C(=O)c2cc(Br)cc(N3CCCC3)c2)C1 ZINC000668022800 567789737 /nfs/dbraw/zinc/78/97/37/567789737.db2.gz QJQQIZLVMFBIKM-MRXNPFEDSA-N 0 3 380.330 3.216 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)cc2F)[C@@H](C)C1 ZINC000444083168 567790847 /nfs/dbraw/zinc/79/08/47/567790847.db2.gz JOKCQHAOPXTNEF-FZMZJTMJSA-N 0 3 382.423 3.195 10 0 GGAEHN Cc1ccsc1[C@H](CO)NC[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000555589687 567791132 /nfs/dbraw/zinc/79/11/32/567791132.db2.gz CCWSDQCBEQXAMJ-OCCSQVGLSA-N 0 3 376.305 3.426 10 0 GGAEHN CC[NH+]1CCC(CC[N-]S(=O)(=O)c2ccc(C(F)(F)F)cc2F)CC1 ZINC000444078616 567791353 /nfs/dbraw/zinc/79/13/53/567791353.db2.gz ZKVBCIWLUMCDQQ-UHFFFAOYSA-N 0 3 382.423 3.245 10 0 GGAEHN CCSc1ccc(CC(=O)N[C@@H]2CCN(C3CC3)C2)c(Br)c1 ZINC000624611863 567791715 /nfs/dbraw/zinc/79/17/15/567791715.db2.gz DLJISJCXCDZWLS-CYBMUJFWSA-N 0 3 383.355 3.457 10 0 GGAEHN CN(C)C[C@@]1(O)CCCN(C(=O)CSc2cc(Cl)ccc2Cl)C1 ZINC000647625237 567793298 /nfs/dbraw/zinc/79/32/98/567793298.db2.gz ZDMQQHCLHVXBFN-INIZCTEOSA-N 0 3 377.337 3.001 10 0 GGAEHN CCO[C@@H]1C[C@@H](NCc2ccc(OC)c(Br)c2)[C@H]1n1cccn1 ZINC000555646980 567793519 /nfs/dbraw/zinc/79/35/19/567793519.db2.gz LPDQWEGQOGXXAG-DJIMGWMZSA-N 0 3 380.286 3.163 10 0 GGAEHN Cn1cc([C@@H](NC[C@H](O)COc2cccc(Br)c2)C(C)(C)C)cn1 ZINC000574712872 567793628 /nfs/dbraw/zinc/79/36/28/567793628.db2.gz KOLRLOWQAKVHGM-DOTOQJQBSA-N 0 3 396.329 3.299 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1ccc(Br)c(Cl)c1F ZINC000444166387 567795355 /nfs/dbraw/zinc/79/53/55/567795355.db2.gz BQCKGWIMBZTPPX-SNVBAGLBSA-N 0 3 393.684 3.082 10 0 GGAEHN COc1ccc(CCC(=O)N2CCCN(C(C)C)CC2)c(Br)c1 ZINC000668101009 567795735 /nfs/dbraw/zinc/79/57/35/567795735.db2.gz CSGRAVBBYDQMDR-UHFFFAOYSA-N 0 3 383.330 3.333 10 0 GGAEHN C[C@H](CNC(=O)c1cc(Br)cc(N2CCCC2)c1)N(C)C1CC1 ZINC000668095763 567795821 /nfs/dbraw/zinc/79/58/21/567795821.db2.gz PUISDWFANSVHFT-CYBMUJFWSA-N 0 3 380.330 3.262 10 0 GGAEHN COC[C@H](CC1CCOCC1)N[C@@H]1COc2cc(F)c(Br)cc21 ZINC000668107559 567796981 /nfs/dbraw/zinc/79/69/81/567796981.db2.gz GCAVJODHCIVFBH-BLLLJJGKSA-N 0 3 388.277 3.443 10 0 GGAEHN CN(C)CCN(Cc1cn(C2CCC2)nn1)Cc1ccc(Br)cc1 ZINC000668159023 567798980 /nfs/dbraw/zinc/79/89/80/567798980.db2.gz IWMWESJIUFVMJA-UHFFFAOYSA-N 0 3 392.345 3.329 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCC1)N[C@@H](CO)c1cccc(Cl)c1Cl ZINC000624788565 567800309 /nfs/dbraw/zinc/80/03/09/567800309.db2.gz WAUZAWDHZLROAY-CJNGLKHVSA-N 0 3 386.323 3.343 10 0 GGAEHN CN(CCN1CCCC1)C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000668198254 567800576 /nfs/dbraw/zinc/80/05/76/567800576.db2.gz JZFNUDAQWMKUAP-UHFFFAOYSA-N 0 3 380.330 3.217 10 0 GGAEHN C[C@@H](CCNCc1c[nH]nc1-c1ccc(Br)s1)[S@](C)=O ZINC000598968434 567800714 /nfs/dbraw/zinc/80/07/14/567800714.db2.gz NEAJSFHZPDGJRM-LXGOIASLSA-N 0 3 376.345 3.147 10 0 GGAEHN O=C(NCC1(N2CCSCC2)CCCC1)N(CC(F)F)CC1CCC1 ZINC000534137215 567801506 /nfs/dbraw/zinc/80/15/06/567801506.db2.gz DAAXCKNKFJWOBD-UHFFFAOYSA-N 0 3 375.529 3.425 10 0 GGAEHN Cc1cc(CNCC2(C(=O)OC(C)(C)C)CCOCC2)ncc1Br ZINC000598979374 567801793 /nfs/dbraw/zinc/80/17/93/567801793.db2.gz CMEIXKGARGAQII-UHFFFAOYSA-N 0 3 399.329 3.381 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)c1[nH]c2ccc(Cl)cc2c1Cl ZINC000647822077 567802755 /nfs/dbraw/zinc/80/27/55/567802755.db2.gz PXKLLSMZDSMQPA-HUUCEWRRSA-N 0 3 382.291 3.410 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)Cc1csc2ccc(Cl)cc12 ZINC000647821778 567802854 /nfs/dbraw/zinc/80/28/54/567802854.db2.gz MBDINRWAENBGIO-SJORKVTESA-N 0 3 378.925 3.419 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)c1cccc(Br)c1Cl ZINC000647823040 567802894 /nfs/dbraw/zinc/80/28/94/567802894.db2.gz BUHQZRDQWMGGRJ-ZIAGYGMSSA-N 0 3 387.705 3.038 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1cccc(Br)c1Cl ZINC000647823038 567803178 /nfs/dbraw/zinc/80/31/78/567803178.db2.gz BUHQZRDQWMGGRJ-KGLIPLIRSA-N 0 3 387.705 3.038 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)Cc1csc2ccc(Cl)cc12 ZINC000647821777 567803305 /nfs/dbraw/zinc/80/33/05/567803305.db2.gz MBDINRWAENBGIO-IRXDYDNUSA-N 0 3 378.925 3.419 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)c1[nH]c2ccc(Cl)cc2c1Cl ZINC000647822076 567803385 /nfs/dbraw/zinc/80/33/85/567803385.db2.gz PXKLLSMZDSMQPA-GJZGRUSLSA-N 0 3 382.291 3.410 10 0 GGAEHN COC(=O)CCNC(=O)CCN[C@H](c1ccc(Cl)c(Cl)c1)C(C)C ZINC000599089724 567805031 /nfs/dbraw/zinc/80/50/31/567805031.db2.gz WGCWNJMYVHPYCD-KRWDZBQOSA-N 0 3 375.296 3.350 10 0 GGAEHN COC(=O)c1csc([C@@H](C)NCC2(OCCO)CCC(F)(F)CC2)c1 ZINC000599066445 567805070 /nfs/dbraw/zinc/80/50/70/567805070.db2.gz RLFFKIVAWWLAEG-GFCCVEGCSA-N 0 3 377.453 3.142 10 0 GGAEHN CC[C@H](N[C@@H]1CCN(C2CCC2)C1=O)c1ccc(I)cc1 ZINC000599093297 567805420 /nfs/dbraw/zinc/80/54/20/567805420.db2.gz OJICRMWNSDSLSP-JKSUJKDBSA-N 0 3 398.288 3.485 10 0 GGAEHN CCCN(CCN(C)C)C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000668301861 567805899 /nfs/dbraw/zinc/80/58/99/567805899.db2.gz UOJUWSJDZMQULM-UHFFFAOYSA-N 0 3 382.346 3.463 10 0 GGAEHN C[C@H](CNC(=O)c1cc(Br)cc(N2CCCC2)c1)N1CCCC1 ZINC000668297536 567805977 /nfs/dbraw/zinc/80/59/77/567805977.db2.gz UNMAIPWIDHPHMI-CQSZACIVSA-N 0 3 380.330 3.263 10 0 GGAEHN CCCN(CCN(C)C)C(=O)c1c(F)c(F)c(Br)c(F)c1F ZINC000668301178 567806097 /nfs/dbraw/zinc/80/60/97/567806097.db2.gz FYCLRAXCAWKTEI-UHFFFAOYSA-N 0 3 385.199 3.419 10 0 GGAEHN C[C@@H](Cc1cc(Br)ccc1F)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000534381637 567809270 /nfs/dbraw/zinc/80/92/70/567809270.db2.gz BSAVIROZXPYTNZ-XJKSGUPXSA-N 0 3 396.304 3.175 10 0 GGAEHN C[C@H](Cc1cc(Br)ccc1F)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000534381636 567809301 /nfs/dbraw/zinc/80/93/01/567809301.db2.gz BSAVIROZXPYTNZ-CZUORRHYSA-N 0 3 396.304 3.175 10 0 GGAEHN O=C(N[C@@H]1CCN(CC2CC2)C1)c1cc(Br)cc(N2CCCC2)c1 ZINC000668457734 567810806 /nfs/dbraw/zinc/81/08/06/567810806.db2.gz ODACURWDWRUMJN-QGZVFWFLSA-N 0 3 392.341 3.263 10 0 GGAEHN CN1CCC[C@@H](CNC(=O)c2c(F)c(F)c(Br)c(F)c2F)C1 ZINC000668463512 567810843 /nfs/dbraw/zinc/81/08/43/567810843.db2.gz SBSASVVCQAHHLA-ZETCQYMHSA-N 0 3 383.183 3.077 10 0 GGAEHN O=C(N[C@H]1CCN(CC2CC2)C1)c1c(F)c(F)c(Br)c(F)c1F ZINC000668457823 567810921 /nfs/dbraw/zinc/81/09/21/567810921.db2.gz PZOCHQYTLIIJAV-QMMMGPOBSA-N 0 3 395.194 3.220 10 0 GGAEHN CN1CCC[C@H](CNC(=O)c2c(F)c(F)c(Br)c(F)c2F)C1 ZINC000668463511 567811164 /nfs/dbraw/zinc/81/11/64/567811164.db2.gz SBSASVVCQAHHLA-SSDOTTSWSA-N 0 3 383.183 3.077 10 0 GGAEHN CC1(OCC(=O)N[C@@H](c2ccccc2)c2ccc(Br)cc2)CNC1 ZINC000648019657 567811232 /nfs/dbraw/zinc/81/12/32/567811232.db2.gz PAHHEBCUNLJFFK-SFHVURJKSA-N 0 3 389.293 3.033 10 0 GGAEHN NC(=O)c1ccc(NC(=O)CCN2CC[C@H](CC(F)(F)F)C2)cc1Cl ZINC000444711537 567811885 /nfs/dbraw/zinc/81/18/85/567811885.db2.gz XSQRMNDMLDCFKF-SNVBAGLBSA-N 0 3 377.794 3.042 10 0 GGAEHN CO[C@@H]1CS(=O)(=O)C[C@@H]1N[C@H]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000668506059 567812605 /nfs/dbraw/zinc/81/26/05/567812605.db2.gz GGDSAEINVOGQRX-VCOSZWKGSA-N 0 3 378.321 3.031 10 0 GGAEHN NC[C@H](C(=O)N1CCc2c(F)cc(Br)cc2C1)c1ccc(F)cc1 ZINC000648101774 567813202 /nfs/dbraw/zinc/81/32/02/567813202.db2.gz BSPYGSHEAUGQMC-INIZCTEOSA-N 0 3 395.247 3.355 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)N[C@H]1CC[C@H](C)S(=O)(=O)C1 ZINC000668560777 567813528 /nfs/dbraw/zinc/81/35/28/567813528.db2.gz HJYRWECDWADDGN-SUNKGSAMSA-N 0 3 378.307 3.075 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1C[C@@H](C)[C@H](O)[C@@H](C)C1 ZINC000668553851 567813538 /nfs/dbraw/zinc/81/35/38/567813538.db2.gz HVLSHAVYSWQSEH-MCBXIFIFSA-N 0 3 378.314 3.392 10 0 GGAEHN C[C@@H]1CC[C@@H](NC2CC(c3ccc(Br)cc3F)C2)CS1(=O)=O ZINC000668563511 567813675 /nfs/dbraw/zinc/81/36/75/567813675.db2.gz YLQQHFPGDCOQRW-MLWDRFBSSA-N 0 3 390.318 3.390 10 0 GGAEHN C[C@@H]1CC[C@H](NC2CC(c3ccc(Br)cc3F)C2)CS1(=O)=O ZINC000668563512 567813701 /nfs/dbraw/zinc/81/37/01/567813701.db2.gz YLQQHFPGDCOQRW-VSUDMTKCSA-N 0 3 390.318 3.390 10 0 GGAEHN C[C@H](CC(=O)Nc1ccc2c(c1F)CCNC2)n1cc(Br)cn1 ZINC000648132348 567814032 /nfs/dbraw/zinc/81/40/32/567814032.db2.gz CUJSUMOSMXOEMD-SNVBAGLBSA-N 0 3 381.249 3.020 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1C[C@@H]2COC[C@]2(C)C1 ZINC000668596269 567814395 /nfs/dbraw/zinc/81/43/95/567814395.db2.gz FMJMYYAEQKVNQW-QAPCUYQASA-N 0 3 376.298 3.412 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)C1(N)Cc3ccccc3C1)CC2 ZINC000648170078 567814506 /nfs/dbraw/zinc/81/45/06/567814506.db2.gz KPGNZNLGYVIJFL-UHFFFAOYSA-N 0 3 385.305 3.139 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)C1(N)Cc2ccccc2C1 ZINC000648159375 567814583 /nfs/dbraw/zinc/81/45/83/567814583.db2.gz CIIJOQJSTNVGKB-GFCCVEGCSA-N 0 3 389.293 3.131 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1C[C@H]2COC[C@]2(C)C1 ZINC000668598577 567814616 /nfs/dbraw/zinc/81/46/16/567814616.db2.gz ZGZYDRNSIHRQJQ-YJBOKZPZSA-N 0 3 376.298 3.412 10 0 GGAEHN COc1cc(Br)c(CN[C@@H]2CCC[C@H]2Cc2cnn(C)c2)cc1O ZINC000668610260 567814658 /nfs/dbraw/zinc/81/46/58/567814658.db2.gz RGFGUJGKYJEVML-XJKSGUPXSA-N 0 3 394.313 3.398 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1C[C@@H]2COC[C@@]2(C)C1 ZINC000668598574 567814815 /nfs/dbraw/zinc/81/48/15/567814815.db2.gz ZGZYDRNSIHRQJQ-CRAIPNDOSA-N 0 3 376.298 3.412 10 0 GGAEHN CC(C)C[C@H](NC(=O)Nc1cc(Cl)ccc1Cl)C(=O)NCCN(C)C ZINC000534645533 567815752 /nfs/dbraw/zinc/81/57/52/567815752.db2.gz BFJQVIFPHQVPEY-HNNXBMFYSA-N 0 3 389.327 3.207 10 0 GGAEHN Cc1nccn1[C@H](C)c1nc(CC2CCN(C)CC2)nn1Cc1ccccc1 ZINC000096133440 570211884 /nfs/dbraw/zinc/21/18/84/570211884.db2.gz GYLFKKUSXYJVJZ-QGZVFWFLSA-N 0 3 378.524 3.325 10 0 GGAEHN CN(C)Cc1ccccc1CNC(=O)Nc1cc2c(cc1Cl)OCCO2 ZINC000048361549 570243202 /nfs/dbraw/zinc/24/32/02/570243202.db2.gz QUXZBIGRFWYHBP-UHFFFAOYSA-N 0 3 375.856 3.495 10 0 GGAEHN CCc1nc2cccnc2n1-c1ccc(C(=O)NC[C@H]2CCCN2CC)cc1 ZINC000020934115 570250909 /nfs/dbraw/zinc/25/09/09/570250909.db2.gz MMCRPDQBJXEBLH-GOSISDBHSA-N 0 3 377.492 3.197 10 0 GGAEHN O=C(NCCN1CCC(Cc2ccccc2)CC1)[C@@H]1COc2ccccc2C1 ZINC000015786154 570252504 /nfs/dbraw/zinc/25/25/04/570252504.db2.gz FMDSKGHNWGZKPL-QFIPXVFZSA-N 0 3 378.516 3.309 10 0 GGAEHN NC(=O)[C@@H](CNCc1ccccc1OCc1ccccn1)Cc1ccc(F)cc1 ZINC000095452872 570283603 /nfs/dbraw/zinc/28/36/03/570283603.db2.gz YDRUTUUAAAVDDL-LJQANCHMSA-N 0 3 393.462 3.234 10 0 GGAEHN CCCOc1ccc(CNCCSc2nnnn2-c2ccccc2)cc1OC ZINC000020931190 570285287 /nfs/dbraw/zinc/28/52/87/570285287.db2.gz ZVQVEACUYZCYEB-UHFFFAOYSA-N 0 3 399.520 3.342 10 0 GGAEHN CN(C(=O)c1cc(C(F)(F)F)n[nH]1)[C@H]1CCCN(CCc2ccccc2)C1 ZINC000020996593 570286694 /nfs/dbraw/zinc/28/66/94/570286694.db2.gz FGMNJDCNKBNTDQ-HNNXBMFYSA-N 0 3 380.414 3.208 10 0 GGAEHN CCC(=O)N(Cc1ccccc1)c1ccc(CC(=O)NCCN2CCCC2)cc1 ZINC000034679815 570292286 /nfs/dbraw/zinc/29/22/86/570292286.db2.gz KVVSLBVODHWSSH-UHFFFAOYSA-N 0 3 393.531 3.384 10 0 GGAEHN CC[C@@H]1c2ccsc2CCN1C[C@@H](O)COCc1ccc2c(c1)OCO2 ZINC000012920392 570294160 /nfs/dbraw/zinc/29/41/60/570294160.db2.gz OZQYJNMRXUTVLF-NVXWUHKLSA-N 0 3 375.490 3.364 10 0 GGAEHN CC[C@H]1c2ccsc2CCN1C[C@@H](O)COCc1ccc2c(c1)OCO2 ZINC000012920387 570294200 /nfs/dbraw/zinc/29/42/00/570294200.db2.gz OZQYJNMRXUTVLF-WBVHZDCISA-N 0 3 375.490 3.364 10 0 GGAEHN CCOC(=O)c1cc(F)c2c(c1)O[C@@]1(CCN(C(=O)OC(C)(C)C)C1)C[C@H]2N ZINC000725260140 570307885 /nfs/dbraw/zinc/30/78/85/570307885.db2.gz NFPVMUMJLAQTFF-VLIAUNLRSA-N 0 3 394.443 3.164 10 0 GGAEHN CCOC(=O)c1cc(F)c2c(c1)O[C@]1(CCN(C(=O)OC(C)(C)C)C1)C[C@@H]2N ZINC000725260139 570307923 /nfs/dbraw/zinc/30/79/23/570307923.db2.gz NFPVMUMJLAQTFF-VBKZILBWSA-N 0 3 394.443 3.164 10 0 GGAEHN CCOC(=O)c1cc(F)c2c(c1)O[C@]1(CCN(C(=O)OC(C)(C)C)C1)C[C@H]2N ZINC000725260138 570307927 /nfs/dbraw/zinc/30/79/27/570307927.db2.gz NFPVMUMJLAQTFF-JLTOFOAXSA-N 0 3 394.443 3.164 10 0 GGAEHN CCOC(=O)c1ccc2c(c1)O[C@]1(CCN(C(=O)OC(C)(C)C)C1)C[C@@H]2N ZINC000725260526 570310029 /nfs/dbraw/zinc/31/00/29/570310029.db2.gz RNRWPNQWSSYDHZ-MGPUTAFESA-N 0 3 376.453 3.025 10 0 GGAEHN CCOC(=O)c1cc(C)c2c(c1)O[C@@]1(CCN(C(=O)OC(C)(C)C)C1)C[C@H]2N ZINC000725260786 570310674 /nfs/dbraw/zinc/31/06/74/570310674.db2.gz WSCGUPNRDWZURE-VFNWGFHPSA-N 0 3 390.480 3.334 10 0 GGAEHN CC(C)OCCOCc1cccc(NC(=O)N(C)[C@H]2CCN(C)C[C@@H]2C)c1 ZINC000075110219 570318928 /nfs/dbraw/zinc/31/89/28/570318928.db2.gz OKZKMDVBTRPHKS-PXNSSMCTSA-N 0 3 377.529 3.432 10 0 GGAEHN CCCn1c(=O)cc(C(C)C)c2ccc(OCC(=O)NCCN3CCCC3)cc21 ZINC000034836185 570335864 /nfs/dbraw/zinc/33/58/64/570335864.db2.gz KBRHLXOIMGLLFY-UHFFFAOYSA-N 0 3 399.535 3.126 10 0 GGAEHN COc1c(C)cc([C@H]2CCc3nc(C(=O)NCCN4CCCC4)cn3C2)cc1C ZINC000034899232 570343357 /nfs/dbraw/zinc/34/33/57/570343357.db2.gz YBVOUTPAIGUEHV-SFHVURJKSA-N 0 3 396.535 3.064 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)c2cc(-c3cncnc3)nc3ccc(Cl)cc32)C1 ZINC000023542335 570364861 /nfs/dbraw/zinc/36/48/61/570364861.db2.gz IDRNEBJBZCGIDE-OAHLLOKOSA-N 0 3 381.867 3.121 10 0 GGAEHN O=C(c1[nH]nc2ccccc21)N1CCN(CCOc2ccc(Cl)cc2)CC1 ZINC000023642644 570367831 /nfs/dbraw/zinc/36/78/31/570367831.db2.gz OXKNZUHSZLVQFM-UHFFFAOYSA-N 0 3 384.867 3.053 10 0 GGAEHN CCNC(=O)NC(=O)[C@H](NCCCn1ccc2ccccc21)c1ccccc1 ZINC000023818322 570373231 /nfs/dbraw/zinc/37/32/31/570373231.db2.gz YSECDBIWUICZDL-HXUWFJFHSA-N 0 3 378.476 3.208 10 0 GGAEHN CCOC(=O)c1nc2onc(C)c2c(N[C@H](CC)CN(C)Cc2ccccc2)n1 ZINC000035534943 570390092 /nfs/dbraw/zinc/39/00/92/570390092.db2.gz NOKOVBTXLMLFEU-MRXNPFEDSA-N 0 3 397.479 3.425 10 0 GGAEHN CCOC(=O)c1nc2onc(C)c2c(N[C@@H](CC)CN(C)Cc2ccccc2)n1 ZINC000035534942 570390141 /nfs/dbraw/zinc/39/01/41/570390141.db2.gz NOKOVBTXLMLFEU-INIZCTEOSA-N 0 3 397.479 3.425 10 0 GGAEHN C[C@H]1CN(C(=O)c2ccc(CNCc3ccc4c[nH]nc4c3)cc2)C[C@H](C)O1 ZINC000237765243 570395451 /nfs/dbraw/zinc/39/54/51/570395451.db2.gz MATFKIKIHWDSMO-HOTGVXAUSA-N 0 3 378.476 3.102 10 0 GGAEHN C[C@H]1CN(Cc2ccccc2CNCc2c[nH]nc2-c2cccnc2)C[C@H](C)O1 ZINC000237776074 570396098 /nfs/dbraw/zinc/39/60/98/570396098.db2.gz UUMRINVWULRCQU-ROUUACIJSA-N 0 3 391.519 3.371 10 0 GGAEHN CSc1ccc(N2C[C@H](C(=O)NC[C@H](c3ccccc3)N(C)C)CC2=O)cc1 ZINC000025238828 570408860 /nfs/dbraw/zinc/40/88/60/570408860.db2.gz ONFQUTAENVPJQS-YLJYHZDGSA-N 0 3 397.544 3.181 10 0 GGAEHN CCOc1cccc(CC(=O)Nc2ccc(CCN3CCN(C)CC3)cc2)c1 ZINC000121957950 570416887 /nfs/dbraw/zinc/41/68/87/570416887.db2.gz WYPJJYRACMSMCL-UHFFFAOYSA-N 0 3 381.520 3.056 10 0 GGAEHN COc1cc(C(=O)N[C@H]2CN(C3CC3)C[C@H]2C)ccc1OCc1c(C)noc1C ZINC000241301102 570431566 /nfs/dbraw/zinc/43/15/66/570431566.db2.gz LQJDSGAJZLCDSC-YJYMSZOUSA-N 0 3 399.491 3.092 10 0 GGAEHN CC(C)[C@@H]1CN(C(=O)[C@H]2CC[C@@H](O)CC2)CCCN1Cc1ccc(F)cc1 ZINC000244874466 570433859 /nfs/dbraw/zinc/43/38/59/570433859.db2.gz XBTIPTGDNOGTIC-TYPHKJRUSA-N 0 3 376.516 3.436 10 0 GGAEHN COCC(=O)N(C[C@H]1CN(Cc2ccc[nH]2)C[C@H]1c1ccccc1OC)C(C)C ZINC000247988456 570434098 /nfs/dbraw/zinc/43/40/98/570434098.db2.gz JONTVLQYLHESRM-WIYYLYMNSA-N 0 3 399.535 3.122 10 0 GGAEHN COc1ccc(COC[C@H](O)CN[C@H]2CCSc3ccccc32)cc1OC ZINC000089464548 570453869 /nfs/dbraw/zinc/45/38/69/570453869.db2.gz LNZOZEAGCKMUBA-AEFFLSMTSA-N 0 3 389.517 3.408 10 0 GGAEHN COc1ccc(COC[C@@H](O)CN[C@H]2CCSc3ccccc32)cc1OC ZINC000089464550 570454013 /nfs/dbraw/zinc/45/40/13/570454013.db2.gz LNZOZEAGCKMUBA-WMZOPIPTSA-N 0 3 389.517 3.408 10 0 GGAEHN O=C(NC[C@H]1CCCO1)C1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000028984203 570467242 /nfs/dbraw/zinc/46/72/42/570467242.db2.gz ITUZZXMADBALIA-QGZVFWFLSA-N 0 3 386.414 3.092 10 0 GGAEHN CNC(=O)C1CCN(CCCc2nc(-c3cccc(C(F)(F)F)c3)no2)CC1 ZINC000029455677 570474167 /nfs/dbraw/zinc/47/41/67/570474167.db2.gz DSOKUWHAHWJUAQ-UHFFFAOYSA-N 0 3 396.413 3.146 10 0 GGAEHN O=C(CN1CCC[C@@H](c2nc[nH]n2)C1)Nc1ccc(Oc2ccccc2)cc1 ZINC000252552762 570477512 /nfs/dbraw/zinc/47/75/12/570477512.db2.gz UYOYYEOWYHJWGE-MRXNPFEDSA-N 0 3 377.448 3.415 10 0 GGAEHN COC(=O)c1ccc2c(c1)[nH]c(=S)n(-c1cccc(CN3CCCC3)c1)c2=O ZINC000032959218 570511312 /nfs/dbraw/zinc/51/13/12/570511312.db2.gz QEMIMPLGBJFTIO-UHFFFAOYSA-N 0 3 395.484 3.057 10 0 GGAEHN CN(CCNC(=O)CC1CCN(C(=O)C2CCCCC2)CC1)Cc1ccccc1 ZINC000032974386 570561970 /nfs/dbraw/zinc/56/19/70/570561970.db2.gz ROLXXUHYHZFSPK-UHFFFAOYSA-N 0 3 399.579 3.444 10 0 GGAEHN O=C(CC1CCN(C(=O)c2ccccc2Cl)CC1)NCCN1CCCCC1 ZINC000032974438 570562033 /nfs/dbraw/zinc/56/20/33/570562033.db2.gz INEKXLQWNMKLDE-UHFFFAOYSA-N 0 3 391.943 3.184 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)[C@@H](C)NC(=O)Nc1ccccc1)c1ccccc1 ZINC000032983778 570572136 /nfs/dbraw/zinc/57/21/36/570572136.db2.gz QPAUDEDFTOUKCY-YLJYHZDGSA-N 0 3 382.508 3.396 10 0 GGAEHN CC(C)CNC(=O)[C@H]1Cc2ccccc2N2CCN(CCc3ccccc3)C[C@@H]12 ZINC000169680430 570601521 /nfs/dbraw/zinc/60/15/21/570601521.db2.gz OQSNJTBOUXXRGX-UPVQGACJSA-N 0 3 391.559 3.364 10 0 GGAEHN CCOC(=O)c1ccc(OC[C@H](O)CN(C)[C@H](C)c2ccc(F)cc2)cc1 ZINC000036392238 570675316 /nfs/dbraw/zinc/67/53/16/570675316.db2.gz TUVLYSBOWWNEJR-DNVCBOLYSA-N 0 3 375.440 3.435 10 0 GGAEHN CC(=O)c1cccc(NC(=O)[C@H](NCCCn2ccnc2)c2ccccc2)c1 ZINC000033040205 570679186 /nfs/dbraw/zinc/67/91/86/570679186.db2.gz BXCMFGLYXFNGME-OAQYLSRUSA-N 0 3 376.460 3.445 10 0 GGAEHN Cc1cc(CN[C@@H]2CCC(=O)N[C@H]2c2cnn(C)c2)ccc1Oc1cccnc1 ZINC000275431168 570692678 /nfs/dbraw/zinc/69/26/78/570692678.db2.gz FHWVIQPAWBFXFO-KNQAVFIVSA-N 0 3 391.475 3.025 10 0 GGAEHN C[C@@H](C(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F)N1C[C@H](C)C[C@H](C)C1 ZINC000012792227 570714188 /nfs/dbraw/zinc/71/41/88/570714188.db2.gz NTNOGZXQOWPDOJ-ZNMIVQPWSA-N 0 3 399.457 3.469 10 0 GGAEHN COc1ccc(CN(C[C@H](O)COc2ccccc2C)C[C@H]2CCCO2)cc1 ZINC000104971309 570736924 /nfs/dbraw/zinc/73/69/24/570736924.db2.gz RJDQZZHLYOTZFW-RBBKRZOGSA-N 0 3 385.504 3.425 10 0 GGAEHN CCN(CC)[C@H](CNC(=S)NCc1ccc2c(c1)OCO2)c1ccccc1 ZINC000013056147 570744302 /nfs/dbraw/zinc/74/43/02/570744302.db2.gz DBMCKBDJFQEVII-GOSISDBHSA-N 0 3 385.533 3.463 10 0 GGAEHN CN(C)C[C@@H]1CN(C(=O)Nc2cc(Cl)ccc2OCC2CCC2)CCO1 ZINC000189335124 570750646 /nfs/dbraw/zinc/75/06/46/570750646.db2.gz VSJBIPCQVJRHLC-MRXNPFEDSA-N 0 3 381.904 3.313 10 0 GGAEHN O=C(NCc1ccc(F)cc1)c1cccnc1N1CCN[C@@H](c2ccccc2)C1 ZINC000065255763 570753769 /nfs/dbraw/zinc/75/37/69/570753769.db2.gz SQBZMPYTUITMCR-OAQYLSRUSA-N 0 3 390.462 3.302 10 0 GGAEHN COc1ccccc1NC(=O)c1ccnc(N2CCN[C@@H](c3ccccc3)C2)c1 ZINC000065255902 570754167 /nfs/dbraw/zinc/75/41/67/570754167.db2.gz OSFCFOJRSOHHGV-HXUWFJFHSA-N 0 3 388.471 3.493 10 0 GGAEHN COc1ccc(NC(=O)c2ccnc(N3CCN[C@H](c4ccccc4)C3)c2)cc1 ZINC000065255899 570754398 /nfs/dbraw/zinc/75/43/98/570754398.db2.gz DUNKQKGOZNFAAF-NRFANRHFSA-N 0 3 388.471 3.493 10 0 GGAEHN Cc1cccc(N2CCN(C(=O)C3=CCN(Cc4ccccc4)CC3)CC2)c1 ZINC000064817954 570754435 /nfs/dbraw/zinc/75/44/35/570754435.db2.gz UIVYNNQOPDAKTI-UHFFFAOYSA-N 0 3 375.516 3.476 10 0 GGAEHN Cc1cccc(CNC(=O)c2ccnc(N3CCN[C@@H](c4ccccc4)C3)c2)c1 ZINC000065255944 570754695 /nfs/dbraw/zinc/75/46/95/570754695.db2.gz UVZAWWIAWXKCDK-JOCHJYFZSA-N 0 3 386.499 3.471 10 0 GGAEHN Cc1ccc(CNC(=O)c2ccnc(N3CCN[C@H](c4ccccc4)C3)c2)cc1 ZINC000065255927 570754734 /nfs/dbraw/zinc/75/47/34/570754734.db2.gz JDRIMLNNANEPAE-QFIPXVFZSA-N 0 3 386.499 3.471 10 0 GGAEHN Cc1cccc(CNC(=O)c2cccc(N3CCN[C@@H](c4ccccc4)C3)n2)c1 ZINC000065256278 570755224 /nfs/dbraw/zinc/75/52/24/570755224.db2.gz MTSPDWYDRVKYFE-JOCHJYFZSA-N 0 3 386.499 3.471 10 0 GGAEHN O=C(NCc1ccc(F)cc1)c1cccc(N2CCN[C@@H](c3ccccc3)C2)n1 ZINC000065256252 570755248 /nfs/dbraw/zinc/75/52/48/570755248.db2.gz WDQMSNQZWSQTRU-OAQYLSRUSA-N 0 3 390.462 3.302 10 0 GGAEHN O=C(NCc1cccc(F)c1)c1cccc(N2CCN[C@@H](c3ccccc3)C2)n1 ZINC000065256280 570755272 /nfs/dbraw/zinc/75/52/72/570755272.db2.gz UFPYGICWURVUNA-OAQYLSRUSA-N 0 3 390.462 3.302 10 0 GGAEHN COc1ccc(NC(=O)c2cccc(N3CCN[C@H](c4ccccc4)C3)n2)cc1 ZINC000065256233 570755294 /nfs/dbraw/zinc/75/52/94/570755294.db2.gz UHYDSPULEDLXAG-NRFANRHFSA-N 0 3 388.471 3.493 10 0 GGAEHN O=C(NCc1cccc(F)c1)c1cccc(N2CCN[C@H](c3ccccc3)C2)n1 ZINC000065256279 570755318 /nfs/dbraw/zinc/75/53/18/570755318.db2.gz UFPYGICWURVUNA-NRFANRHFSA-N 0 3 390.462 3.302 10 0 GGAEHN COc1ccc([C@H](CNC[C@H](O)COc2c(C)ccc(C)c2C)N(C)C)cc1 ZINC000096662925 570776625 /nfs/dbraw/zinc/77/66/25/570776625.db2.gz HMUSVDFDDZBJJF-UNMCSNQZSA-N 0 3 386.536 3.253 10 0 GGAEHN COc1cc(CNC[C@@H]2CCCO2)ccc1OCC(=O)Nc1ccc(C)cc1 ZINC000013731371 570783215 /nfs/dbraw/zinc/78/32/15/570783215.db2.gz FDFUHTXFNMGFGN-IBGZPJMESA-N 0 3 384.476 3.290 10 0 GGAEHN Cc1ccc2[nH]c(N3CCC(C(=O)NCCN4CCCC[C@H]4C)CC3)nc2c1 ZINC000033070817 570802512 /nfs/dbraw/zinc/80/25/12/570802512.db2.gz MFHSFQCEDCKYBA-QGZVFWFLSA-N 0 3 383.540 3.078 10 0 GGAEHN Cc1ccc2nc(N3CCC(C(=O)NCCN4CCCC[C@H]4C)CC3)[nH]c2c1 ZINC000033070817 570802514 /nfs/dbraw/zinc/80/25/14/570802514.db2.gz MFHSFQCEDCKYBA-QGZVFWFLSA-N 0 3 383.540 3.078 10 0 GGAEHN CN(CCNC(=O)[C@@H]1CCCN(c2nc3ccccc3[nH]2)C1)Cc1ccccc1 ZINC000033071811 570803000 /nfs/dbraw/zinc/80/30/00/570803000.db2.gz BEUPGVJRELHVPN-LJQANCHMSA-N 0 3 391.519 3.028 10 0 GGAEHN CC(=O)N[C@@H](CC(=O)N[C@H](CN(C)C)c1ccccc1)c1ccc(Cl)cc1 ZINC000032781286 570809164 /nfs/dbraw/zinc/80/91/64/570809164.db2.gz XTFPDZIBEDPKLF-VQTJNVASSA-N 0 3 387.911 3.326 10 0 GGAEHN Cc1nc(COc2ccc(CNCc3ccc(Cn4ccnc4)cc3)cc2)no1 ZINC000165105453 570813352 /nfs/dbraw/zinc/81/33/52/570813352.db2.gz BAGMRLDEICRXKY-UHFFFAOYSA-N 0 3 389.459 3.492 10 0 GGAEHN Cc1cccc(N2CCN(C(=O)C3CCN(c4ccncc4)CC3)C[C@@H]2C)c1 ZINC000033128942 570818128 /nfs/dbraw/zinc/81/81/28/570818128.db2.gz VVNUNXSFOIXUMO-IBGZPJMESA-N 0 3 378.520 3.344 10 0 GGAEHN O=c1cc(CN2CCCCCC2)nc2[nH]c(NCc3ccc(Cl)cc3)nn21 ZINC000101795874 570833901 /nfs/dbraw/zinc/83/39/01/570833901.db2.gz QSNFEXIYMUDKNR-UHFFFAOYSA-N 0 3 386.887 3.059 10 0 GGAEHN CC(C)c1ccc(CNc2nn3c([n-]2)nc(C[NH+]2CCCCC2)cc3=O)cc1 ZINC000101796817 570834232 /nfs/dbraw/zinc/83/42/32/570834232.db2.gz TWFWLZNWAOPMIF-UHFFFAOYSA-N 0 3 380.496 3.139 10 0 GGAEHN Cc1nnc(Sc2cc(C(=O)NCCN3CCCC3)c3ccccc3n2)s1 ZINC000003027179 570836549 /nfs/dbraw/zinc/83/65/49/570836549.db2.gz NWJQVDYITPFTQN-UHFFFAOYSA-N 0 3 399.545 3.372 10 0 GGAEHN CC(C)(C)OC(=O)NC1CCN(CCCC(=O)NCCc2ccccc2)CC1 ZINC000170595736 570853472 /nfs/dbraw/zinc/85/34/72/570853472.db2.gz BRWKPMZOLYSAMC-UHFFFAOYSA-N 0 3 389.540 3.115 10 0 GGAEHN Cc1nc(-c2cccc(C(=O)NC3CCN(Cc4ccccc4)CC3)c2)no1 ZINC000033257648 570864261 /nfs/dbraw/zinc/86/42/61/570864261.db2.gz OMDPSODHJQVBHR-UHFFFAOYSA-N 0 3 376.460 3.439 10 0 GGAEHN O=C1N(CCc2ccccc2)C[C@@H]2C[C@@H](c3cccc4nonc43)N3CCC[C@@]123 ZINC000012612118 570890390 /nfs/dbraw/zinc/89/03/90/570890390.db2.gz OZXGTIOGIIADEU-NYDSKATKSA-N 0 3 388.471 3.203 10 0 GGAEHN COCCNC(=O)NC(=O)CN[C@H](c1ccc(C2CCCCC2)cc1)C(C)C ZINC000015523732 570896123 /nfs/dbraw/zinc/89/61/23/570896123.db2.gz HJRBSASQTFVOMG-NRFANRHFSA-N 0 3 389.540 3.493 10 0 GGAEHN O=C(CCNC(=O)c1ccccc1Cl)NC1CCN(Cc2ccccc2)CC1 ZINC000015582670 570898135 /nfs/dbraw/zinc/89/81/35/570898135.db2.gz PZKYAVJROCLCQL-UHFFFAOYSA-N 0 3 399.922 3.241 10 0 GGAEHN COc1ccc(OC[C@H](O)CN(Cc2cccc(C)c2)C[C@@H]2CCCO2)cc1 ZINC000104973894 570910742 /nfs/dbraw/zinc/91/07/42/570910742.db2.gz AYGNGCIRTBWTHL-OFNKIYASSA-N 0 3 385.504 3.425 10 0 GGAEHN Cn1ccnc1[C@@H](O)C1CCN(C[C@@](C)(O)c2cccc(C(F)(F)F)c2)CC1 ZINC000089895887 570918626 /nfs/dbraw/zinc/91/86/26/570918626.db2.gz HRQHKFVPHVCDEA-PKOBYXMFSA-N 0 3 397.441 3.092 10 0 GGAEHN Cn1ccnc1[C@H](O)C1CCN(C[C@@](C)(O)c2cccc(C(F)(F)F)c2)CC1 ZINC000089895890 570918739 /nfs/dbraw/zinc/91/87/39/570918739.db2.gz HRQHKFVPHVCDEA-IEBWSBKVSA-N 0 3 397.441 3.092 10 0 GGAEHN COCCn1c(C)cc(O)c([C@@H](c2cccc(OC)c2)N2CCCCC2)c1=O ZINC000016993406 570923218 /nfs/dbraw/zinc/92/32/18/570923218.db2.gz IULKZXDYZQKZHF-OAQYLSRUSA-N 0 3 386.492 3.093 10 0 GGAEHN COCCn1c(C)cc(O)c([C@H](c2cccc(F)c2)N2CCC(C)CC2)c1=O ZINC000016993386 570923318 /nfs/dbraw/zinc/92/33/18/570923318.db2.gz AYQJNMZDQYNLJH-NRFANRHFSA-N 0 3 388.483 3.469 10 0 GGAEHN C[C@H](C(=O)N1[C@@H](C)CCC[C@@H]1C)N1CCC(C(=O)NCc2ccccc2)CC1 ZINC000016396470 570924240 /nfs/dbraw/zinc/92/42/40/570924240.db2.gz FHFCRYKRHKSARB-GBESFXJTSA-N 0 3 385.552 3.193 10 0 GGAEHN Cc1nc(C)n(C[C@@H]2CCCN(C[C@H]3CO[C@H](c4ccc(Cl)cc4)O3)C2)n1 ZINC000252477008 570965807 /nfs/dbraw/zinc/96/58/07/570965807.db2.gz GMGJUBWBSBPKGX-UXPWSPDFSA-N 0 3 390.915 3.375 10 0 GGAEHN CN(C)Cc1ccccc1CNC(=O)NCc1cccc(NC(=O)C2CC2)c1 ZINC000012729954 570973280 /nfs/dbraw/zinc/97/32/80/570973280.db2.gz LDHIFQNWGSXPGJ-UHFFFAOYSA-N 0 3 380.492 3.096 10 0 GGAEHN Cn1cc(-c2csc(CNc3ccccc3CN3CCC(CO)CC3)n2)cn1 ZINC000252538082 570992749 /nfs/dbraw/zinc/99/27/49/570992749.db2.gz MQBGDAZGHHXFFO-UHFFFAOYSA-N 0 3 397.548 3.360 10 0 GGAEHN C[C@@H](CCN1CCN(c2ccccc2)CC1)NC(=O)NCc1cccc(F)c1 ZINC000045593656 570992861 /nfs/dbraw/zinc/99/28/61/570992861.db2.gz XQZXWDQOOACTAV-SFHVURJKSA-N 0 3 384.499 3.226 10 0 GGAEHN CCCN1CCCN(C(=O)c2csc(-c3ccc4c(c3)OCCO4)n2)CC1 ZINC000109023081 570995229 /nfs/dbraw/zinc/99/52/29/570995229.db2.gz NOUPPRAREVVOLJ-UHFFFAOYSA-N 0 3 387.505 3.139 10 0 GGAEHN CC(=O)c1ccc(OCC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000170653304 570999649 /nfs/dbraw/zinc/99/96/49/570999649.db2.gz KSKUFYIAYDLGLJ-JTSKRJEESA-N 0 3 380.488 3.295 10 0 GGAEHN CCN1CC[C@@]2(CN(Cc3[nH]c4ccc(C)cc4c3C)CCN2C)CCC1=O ZINC000091326867 571004070 /nfs/dbraw/zinc/00/40/70/571004070.db2.gz WCNCUKHRBASGJE-HSZRJFAPSA-N 0 3 382.552 3.303 10 0 GGAEHN CC(C)C[C@H](N[C@H](C)C(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccccc1 ZINC000019625366 571021469 /nfs/dbraw/zinc/02/14/69/571021469.db2.gz ZOHDYDWKZVMLMB-BEFAXECRSA-N 0 3 389.521 3.038 10 0 GGAEHN CCN1CCc2nc[nH]c2C12CCN(Cc1nc3ccccc3nc1C)CC2 ZINC000092066516 571043902 /nfs/dbraw/zinc/04/39/02/571043902.db2.gz ZEOYORONFWHQFM-UHFFFAOYSA-N 0 3 376.508 3.031 10 0 GGAEHN CN(CCCNC(=O)Nc1cn(C)c(=O)c2ccccc12)Cc1ccccc1 ZINC000015680471 571044622 /nfs/dbraw/zinc/04/46/22/571044622.db2.gz OMRNXRNXDJXROR-UHFFFAOYSA-N 0 3 378.476 3.182 10 0 GGAEHN COc1cc(C(=O)N[C@H]2COc3ccccc32)ccc1OC1CCN(C)CC1 ZINC000095496857 571074393 /nfs/dbraw/zinc/07/43/93/571074393.db2.gz OEGDPPCDITUYOY-SFHVURJKSA-N 0 3 382.460 3.032 10 0 GGAEHN CN(C)[C@@H]1C[C@@H](CO)N(C(=O)Nc2ccc(-c3cc4ccccc4[nH]3)cc2)C1 ZINC000095523997 571089561 /nfs/dbraw/zinc/08/95/61/571089561.db2.gz TYFKSLHNBONQPQ-MOPGFXCFSA-N 0 3 378.476 3.364 10 0 GGAEHN O=C(Nc1cc(-c2cccs2)[nH]n1)C(C[C@H]1COCCO1)C(F)(F)F ZINC000616333084 651895656 /nfs/dbraw/zinc/89/56/56/651895656.db2.gz SUUXCBAOMOVQPA-UWVGGRQHSA-N 0 3 375.372 3.061 10 0 GGAEHN COC(=O)COc1cccc(NC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1 ZINC000054412471 1406726996 /nfs/dbraw/zinc/72/69/96/1406726996.db2.gz FIWJYQJBSUZZRW-APWZRJJASA-N 0 3 397.475 3.195 10 0 GGAEHN COc1ccc(C(=O)C2CCN(C[C@@H](O)COCc3ccccc3)CC2)cc1 ZINC000055471989 1406974589 /nfs/dbraw/zinc/97/45/89/1406974589.db2.gz MDUNJVVXQILGSQ-OAQYLSRUSA-N 0 3 383.488 3.168 10 0 GGAEHN Cc1ccc(C)n1CCN1CCN(C(=O)c2cc(-c3ccc(F)cc3)[nH]n2)CC1 ZINC000013366640 1399079359 /nfs/dbraw/zinc/07/93/59/1399079359.db2.gz FTTXMYPVCLPRKN-UHFFFAOYSA-N 0 3 395.482 3.092 10 0 GGAEHN Cc1noc2ncnc(NCCCN3CCN(c4cccc(C)c4)[C@@H](C)C3)c12 ZINC000020575194 1399349147 /nfs/dbraw/zinc/34/91/47/1399349147.db2.gz QDJAIQOXMWSEMU-INIZCTEOSA-N 0 3 380.496 3.247 10 0 GGAEHN Fc1ccccc1CN1CCC(CNc2nn3nnnc3c3ccccc32)CC1 ZINC000021777327 1399408801 /nfs/dbraw/zinc/40/88/01/1399408801.db2.gz RYHHRPMPYFHYNF-UHFFFAOYSA-N 0 3 391.454 3.136 10 0 GGAEHN Cc1ccc(NC(=O)N2CCN(c3cc(N4CCCC4)nc(C)n3)CC2)cc1C ZINC000021795079 1399410028 /nfs/dbraw/zinc/41/00/28/1399410028.db2.gz OXIBWXSDRNCVIN-UHFFFAOYSA-N 0 3 394.523 3.356 10 0 GGAEHN CN(C)C[C@@H](NC(=O)/C=C/c1ccc(N2CCCC2=O)cc1)c1ccccc1 ZINC000022376253 1399458365 /nfs/dbraw/zinc/45/83/65/1399458365.db2.gz QMTWPFAIMSHBOL-FFXXTYGZSA-N 0 3 377.488 3.246 10 0 GGAEHN CN(C)C[C@H](NC(=O)/C=C/c1ccc(N2CCCC2=O)cc1)c1ccccc1 ZINC000022376260 1399458506 /nfs/dbraw/zinc/45/85/06/1399458506.db2.gz QMTWPFAIMSHBOL-NKSQBSFPSA-N 0 3 377.488 3.246 10 0 GGAEHN COc1cccc(CS(=O)(=O)NCC2CCN(Cc3ccccc3)CC2)c1 ZINC000022999969 1399523883 /nfs/dbraw/zinc/52/38/83/1399523883.db2.gz YRNINDVDIOGEFP-UHFFFAOYSA-N 0 3 388.533 3.027 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)c1cccc(OCC(=O)OC)c1)c1ccsc1 ZINC000056508216 1407349395 /nfs/dbraw/zinc/34/93/95/1407349395.db2.gz BGXOTLNWECMIJK-GOSISDBHSA-N 0 3 390.505 3.113 10 0 GGAEHN O=C(CCn1cccn1)Nc1ccc(N2CCN(Cc3ccccc3)CC2)cc1 ZINC000045038888 1404041713 /nfs/dbraw/zinc/04/17/13/1404041713.db2.gz XKIPALNBBBDNHA-UHFFFAOYSA-N 0 3 389.503 3.234 10 0 GGAEHN C[C@@H](N[C@@H](C)c1ccc(C(F)(F)F)cc1)C(=O)NC(=O)NCC(F)(F)F ZINC000045820677 1404214748 /nfs/dbraw/zinc/21/47/48/1404214748.db2.gz CPRFYENEPNFAAV-DTWKUNHWSA-N 0 3 385.308 3.133 10 0 GGAEHN C[C@H](N[C@@H](C)c1ccc(C(F)(F)F)cc1)C(=O)NC(=O)NCC(F)(F)F ZINC000045820672 1404214882 /nfs/dbraw/zinc/21/48/82/1404214882.db2.gz CPRFYENEPNFAAV-IUCAKERBSA-N 0 3 385.308 3.133 10 0 GGAEHN CCN1CCN(Cc2ccccc2CNC(=O)[C@H]2C[C@H]2c2ccc(F)cc2)CC1 ZINC000046940117 1404644462 /nfs/dbraw/zinc/64/44/62/1404644462.db2.gz FLJVGPDUZNBSJD-GOTSBHOMSA-N 0 3 395.522 3.383 10 0 GGAEHN CN(C)C(=O)COc1cccc(CNCc2cccc(Br)c2)c1 ZINC000048745623 1405280290 /nfs/dbraw/zinc/28/02/90/1405280290.db2.gz IEEAJKZVGFPAIC-UHFFFAOYSA-N 0 3 377.282 3.206 10 0 GGAEHN COc1ccc(CNCc2ccc(CS(C)(=O)=O)cc2)cc1OC(F)F ZINC000048779713 1405290674 /nfs/dbraw/zinc/29/06/74/1405290674.db2.gz HPKGTFWFUSMSQD-UHFFFAOYSA-N 0 3 385.432 3.131 10 0 GGAEHN C[C@@H](C(=O)NCCc1ccc2c(c1)OCCO2)N(C)CCCc1ccccc1 ZINC000052802878 1406175742 /nfs/dbraw/zinc/17/57/42/1406175742.db2.gz IFHIQGOKQBSKQN-SFHVURJKSA-N 0 3 382.504 3.070 10 0 GGAEHN COC(=O)Nc1ccc(CNC(=O)N2CCN(CCC(C)(C)C)CC2)cc1 ZINC000056876169 1407462118 /nfs/dbraw/zinc/46/21/18/1407462118.db2.gz FNAICMPVRRJWPF-UHFFFAOYSA-N 0 3 376.501 3.128 10 0 GGAEHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)[C@H]1CCC(=O)N1c1ccccc1 ZINC000062355643 1408242343 /nfs/dbraw/zinc/24/23/43/1408242343.db2.gz WUQODCSZYGQOGM-RTWAWAEBSA-N 0 3 377.488 3.135 10 0 GGAEHN COc1ccccc1[C@@H](C)NC(=O)[C@@H](C)N1CCN(CC2CCCCC2)CC1 ZINC000064130139 1408491468 /nfs/dbraw/zinc/49/14/68/1408491468.db2.gz BGKMYJCDJJAYBE-RTBURBONSA-N 0 3 387.568 3.459 10 0 GGAEHN COC(=O)CCN(Cc1ccccc1)C[C@H]1CCCN1C(=O)OC(C)(C)C ZINC000065236031 1408656005 /nfs/dbraw/zinc/65/60/05/1408656005.db2.gz ITQWHVPECPWLGT-GOSISDBHSA-N 0 3 376.497 3.451 10 0 GGAEHN O=C(NC1CCN(C[C@@H](O)COc2ccc(Cl)cc2)CC1)C1CCCCC1 ZINC000065963305 1408763385 /nfs/dbraw/zinc/76/33/85/1408763385.db2.gz KEWAMRXTKMHICX-LJQANCHMSA-N 0 3 394.943 3.241 10 0 GGAEHN CCCOc1c(CNCc2cccnc2N2CCN(C)CC2)cccc1OCC ZINC000066877056 1408939566 /nfs/dbraw/zinc/93/95/66/1408939566.db2.gz BKZKWGLGTVPCAT-UHFFFAOYSA-N 0 3 398.551 3.311 10 0 GGAEHN CCOC(=O)c1ccc(C(=O)N(CCCc2ccccc2)CCN(C)C)nc1C ZINC000066946154 1408959978 /nfs/dbraw/zinc/95/99/78/1408959978.db2.gz BLCDHFGTJCANAO-UHFFFAOYSA-N 0 3 397.519 3.203 10 0 GGAEHN Cc1nn(CCO)c(C)c1CN[C@@H](C)c1ccc(OCc2cccnc2)cc1 ZINC000067188102 1409035664 /nfs/dbraw/zinc/03/56/64/1409035664.db2.gz FMTZNSSRZZFKCY-INIZCTEOSA-N 0 3 380.492 3.317 10 0 GGAEHN COc1ccccc1[C@H](C)NC(=O)[C@@H](C)N1CCN(CC2CCCCC2)CC1 ZINC000067649313 1409198154 /nfs/dbraw/zinc/19/81/54/1409198154.db2.gz BGKMYJCDJJAYBE-RBUKOAKNSA-N 0 3 387.568 3.459 10 0 GGAEHN Cc1cccc(N2CCN(CCC(=O)N[C@@H]3CCO[C@H]3c3ccccc3)CC2)c1 ZINC000176629357 1428384956 /nfs/dbraw/zinc/38/49/56/1428384956.db2.gz FHBQWXFYOCHREQ-VWNXMTODSA-N 0 3 393.531 3.154 10 0 GGAEHN CNC(=O)C1CCC(N[C@@H](C(=O)Nc2cccc(OC)c2)c2ccccc2)CC1 ZINC000068839793 1409504914 /nfs/dbraw/zinc/50/49/14/1409504914.db2.gz HDHVMFXIEIRMNM-WIXQSORDSA-N 0 3 395.503 3.269 10 0 GGAEHN CCOc1cc(CN[C@@H](CN2CCN(C)CC2)c2ccccc2)ccc1OC ZINC000069171440 1409580027 /nfs/dbraw/zinc/58/00/27/1409580027.db2.gz DZTJRNRAEINXAP-NRFANRHFSA-N 0 3 383.536 3.172 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1cnn(-c2ccc(C)cc2)c1C(C)C ZINC000069505931 1409645235 /nfs/dbraw/zinc/64/52/35/1409645235.db2.gz GIIOFGQMXLKKHA-IBGZPJMESA-N 0 3 384.524 3.145 10 0 GGAEHN CC[C@@H]1CN(C(=O)CNC(=O)C2CCCC2)[C@H](CC)CN1Cc1ccccc1 ZINC000078869883 1409938690 /nfs/dbraw/zinc/93/86/90/1409938690.db2.gz PRGBXSCJCNYYSE-NHCUHLMSSA-N 0 3 385.552 3.194 10 0 GGAEHN CC[C@@H](NC(=O)NC[C@@H](C)CN1CCN(CC)CC1)c1ccc(C)c(F)c1 ZINC000093135052 1410225287 /nfs/dbraw/zinc/22/52/87/1410225287.db2.gz GVNUKZLDRJCISB-OXQOHEQNSA-N 0 3 378.536 3.158 10 0 GGAEHN CN(C(=O)OC(C)(C)C)C1CCN(Cc2ccccc2N2CCOCC2)CC1 ZINC000093283177 1410230114 /nfs/dbraw/zinc/23/01/14/1410230114.db2.gz HFAUCVVTPFPTDB-UHFFFAOYSA-N 0 3 389.540 3.355 10 0 GGAEHN Cn1cc(CNC[C@H](O)COc2ccc(C(F)(F)F)cc2)c(C(C)(C)C)n1 ZINC000093961396 1410290025 /nfs/dbraw/zinc/29/00/25/1410290025.db2.gz DETLSGSUMDLTRB-HNNXBMFYSA-N 0 3 385.430 3.266 10 0 GGAEHN COc1ccc(CN2CCCN(Cc3cnc4nc(C)cc(C)n34)CC2)cc1 ZINC000095453785 1410312051 /nfs/dbraw/zinc/31/20/51/1410312051.db2.gz GOQZAYHJEHSOLR-UHFFFAOYSA-N 0 3 379.508 3.063 10 0 GGAEHN Cc1nccn1-c1ccc([C@H](C)NCC(=O)Nc2cccc3nsnc32)cc1 ZINC000095462676 1410312611 /nfs/dbraw/zinc/31/26/11/1410312611.db2.gz QPIJNJRBPGSOHQ-ZDUSSCGKSA-N 0 3 392.488 3.475 10 0 GGAEHN COC(=O)[C@@H]1CCCCC[C@@H]1NCC(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000095941459 1410315953 /nfs/dbraw/zinc/31/59/53/1410315953.db2.gz LZGDYCAXOSWHCU-CABCVRRESA-N 0 3 388.386 3.235 10 0 GGAEHN CCN1CCN([C@H](C)CNC(=O)c2csc(-c3cc4ccccc4o3)n2)CC1 ZINC000095958267 1410316636 /nfs/dbraw/zinc/31/66/36/1410316636.db2.gz MTLSAWONUJXRGQ-OAHLLOKOSA-N 0 3 398.532 3.312 10 0 GGAEHN Cc1cc(CN(C)C)cc(NC(=O)[C@@H]2CCn3c(cnc3C(F)(F)F)C2)c1 ZINC000095993273 1410319821 /nfs/dbraw/zinc/31/98/21/1410319821.db2.gz RPDGTDSUOXSRMH-CQSZACIVSA-N 0 3 380.414 3.473 10 0 GGAEHN Cn1cc(CN2CCC3(C[C@H](CC(=O)NC4CC4)c4ccccc43)CC2)cn1 ZINC000096052975 1410322666 /nfs/dbraw/zinc/32/26/66/1410322666.db2.gz OACRJRBLYOUSFQ-SFHVURJKSA-N 0 3 378.520 3.110 10 0 GGAEHN CCN(CC)C[C@H](C)NS(=O)(=O)/C=C/c1ccc(Br)cc1 ZINC000097104246 1410352272 /nfs/dbraw/zinc/35/22/72/1410352272.db2.gz QGNJPNZZHSAPLA-NHAQELONSA-N 0 3 375.332 3.070 10 0 GGAEHN CCN1CCN(Cc2ccc(CNC(=O)/C=C\c3cccc(OC)c3)cc2)CC1 ZINC000098007774 1410393864 /nfs/dbraw/zinc/39/38/64/1410393864.db2.gz BPRBUDGHNXBFID-QXMHVHEDSA-N 0 3 393.531 3.162 10 0 GGAEHN CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)C1(c2ccc(C(C)(C)C)cc2)CC1 ZINC000102162077 1410573903 /nfs/dbraw/zinc/57/39/03/1410573903.db2.gz AYPZHZNJCYSAQR-FQEVSTJZSA-N 0 3 399.579 3.075 10 0 GGAEHN COc1cc(CNC[C@@H](O)COc2ccc(F)c(F)c2)ccc1OC(F)F ZINC000105499996 1411072706 /nfs/dbraw/zinc/07/27/06/1411072706.db2.gz DVVRJUSQFSNHJP-GFCCVEGCSA-N 0 3 389.345 3.104 10 0 GGAEHN O[C@H](CNCc1csc(Br)c1)COc1ccc(F)c(F)c1 ZINC000105499482 1411073067 /nfs/dbraw/zinc/07/30/67/1411073067.db2.gz AVWWBRZSWQYJCB-SNVBAGLBSA-N 0 3 378.238 3.318 10 0 GGAEHN Cc1ccc(N2CCCN(CCOc3ccccc3C(F)(F)F)CC2)nn1 ZINC000106071916 1411164360 /nfs/dbraw/zinc/16/43/60/1411164360.db2.gz LSNXJNSITDXFBW-UHFFFAOYSA-N 0 3 380.414 3.395 10 0 GGAEHN CCN1CCN(Cc2ccc(NC(=O)/C=C/c3ccccc3OC)cc2)CC1 ZINC000107591108 1411390046 /nfs/dbraw/zinc/39/00/46/1411390046.db2.gz MJXZCTHFBAFMHD-JLHYYAGUSA-N 0 3 379.504 3.485 10 0 GGAEHN CCn1c2ccccc2c2cc(CN[C@@H]3CCCN(S(C)(=O)=O)C3)ccc21 ZINC000109310242 1411737814 /nfs/dbraw/zinc/73/78/14/1411737814.db2.gz AUFFNQBQLADZQA-QGZVFWFLSA-N 0 3 385.533 3.328 10 0 GGAEHN C[C@H](NC(=O)N(C)C1CCN(CCn2cccn2)CC1)c1cc2ccccc2o1 ZINC000109392488 1411753749 /nfs/dbraw/zinc/75/37/49/1411753749.db2.gz HIKSWMBSQOHNCZ-KRWDZBQOSA-N 0 3 395.507 3.496 10 0 GGAEHN CCCc1nc(C)c(C(=O)N(CCC(=O)OCC)C[C@H]2CCCN2CC)s1 ZINC000109591707 1411797668 /nfs/dbraw/zinc/79/76/68/1411797668.db2.gz CGVBNTBLBMZDLY-MRXNPFEDSA-N 0 3 395.569 3.284 10 0 GGAEHN CC(C)COc1cccc(C(=O)N(CCN(C)C)CC(=O)OC(C)(C)C)c1 ZINC000110058045 1411828522 /nfs/dbraw/zinc/82/85/22/1411828522.db2.gz HGZQPHXABKFWBC-UHFFFAOYSA-N 0 3 378.513 3.067 10 0 GGAEHN CCc1cc(N2CCC[C@H](NCc3ccc(OC)cc3OC(F)F)C2)ncn1 ZINC000114766496 1412520883 /nfs/dbraw/zinc/52/08/83/1412520883.db2.gz GDDSOHHKPCZXNO-INIZCTEOSA-N 0 3 392.450 3.408 10 0 GGAEHN CN(C)[C@H](CNCc1ccccc1N1CCOCC1)c1c(F)cccc1F ZINC000115623583 1412737103 /nfs/dbraw/zinc/73/71/03/1412737103.db2.gz BIGYGXDVIWHZTI-HXUWFJFHSA-N 0 3 375.463 3.194 10 0 GGAEHN CN(C)C(=O)COc1ccccc1CNC[C@H](O)c1ccc(C(C)(C)C)cc1 ZINC000116368966 1412852871 /nfs/dbraw/zinc/85/28/71/1412852871.db2.gz CRCUTBRDQNZEIZ-FQEVSTJZSA-N 0 3 384.520 3.274 10 0 GGAEHN CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)c1cc2ccc(C(C)(C)C)cc2[nH]1 ZINC000116649753 1412891669 /nfs/dbraw/zinc/89/16/69/1412891669.db2.gz HPDIHMIHLBLARL-FQEVSTJZSA-N 0 3 398.551 3.138 10 0 GGAEHN CC(C)n1c2ccc(C(=O)N3CCO[C@H](CN(C)C)C3)cc2nc1C(F)(F)F ZINC000116797020 1412925397 /nfs/dbraw/zinc/92/53/97/1412925397.db2.gz OBCHLIADFGRSJA-CQSZACIVSA-N 0 3 398.429 3.039 10 0 GGAEHN O=C(CCCc1nnc(-c2ccccc2)o1)N1CCN([C@@H]2C[C@H]3CC[C@@H]2C3)CC1 ZINC000177324812 1428690332 /nfs/dbraw/zinc/69/03/32/1428690332.db2.gz HYMJIGGMILWMSM-DFQSSKMNSA-N 0 3 394.519 3.392 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)Nc3cccc(OCCOC)c3)cc2)CC1 ZINC000118776404 1413218880 /nfs/dbraw/zinc/21/88/80/1413218880.db2.gz VRXHSEXZWINTQS-UHFFFAOYSA-N 0 3 383.492 3.106 10 0 GGAEHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@@H](C)[C@@H]3CCOC3)c2)cc1 ZINC000121696169 1414226846 /nfs/dbraw/zinc/22/68/46/1414226846.db2.gz FFJTWDQEDQLISI-DOTOQJQBSA-N 0 3 390.505 3.011 10 0 GGAEHN Cc1cnn([C@H]2CCCN(Cc3ccccc3OCC(=O)N3CCCC3)C2)c1 ZINC000123081960 1414636480 /nfs/dbraw/zinc/63/64/80/1414636480.db2.gz GXMXEVROVMEOBT-FQEVSTJZSA-N 0 3 382.508 3.030 10 0 GGAEHN C[C@@H](NCc1cc2c(c(Br)c1)OCO2)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000123091700 1414639018 /nfs/dbraw/zinc/63/90/18/1414639018.db2.gz IDFXSTJPCDXZIT-SECBINFHSA-N 0 3 390.237 3.198 10 0 GGAEHN C[C@@H](NCc1cc2ccccc2[nH]c1=O)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000123349705 1414703260 /nfs/dbraw/zinc/70/32/60/1414703260.db2.gz BUBAFJXTGBEGRM-OAHLLOKOSA-N 0 3 391.471 3.449 10 0 GGAEHN COc1ccc(CNc2cccc(CN3CCN(C)CC3)c2)c(OC)c1OC ZINC000123986226 1414862981 /nfs/dbraw/zinc/86/29/81/1414862981.db2.gz HTSHEZIFZKPBJV-UHFFFAOYSA-N 0 3 385.508 3.072 10 0 GGAEHN OCCC[C@H](NCc1c[nH]nc1-c1ccc2c(c1)OCCO2)c1ccccc1 ZINC000124352668 1414947389 /nfs/dbraw/zinc/94/73/89/1414947389.db2.gz CNMYGTLKOPCKDR-IBGZPJMESA-N 0 3 379.460 3.451 10 0 GGAEHN COc1ccccc1CC1CCN(Cc2cnc(N3CCOCC3)s2)CC1 ZINC000130450457 1416379917 /nfs/dbraw/zinc/37/99/17/1416379917.db2.gz RGTPKSICRCGZBW-UHFFFAOYSA-N 0 3 387.549 3.443 10 0 GGAEHN Cc1nccn1CCCN(C)[C@H](C)C(=O)N(C)Cc1c(F)cccc1Cl ZINC000130703943 1416429074 /nfs/dbraw/zinc/42/90/74/1416429074.db2.gz FRMUIVODFVBGMN-CQSZACIVSA-N 0 3 380.895 3.353 10 0 GGAEHN Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)N(C)CCCn1ccnc1C ZINC000130771693 1416447458 /nfs/dbraw/zinc/44/74/58/1416447458.db2.gz HJTNAZRFPAPZGO-SFHVURJKSA-N 0 3 394.523 3.343 10 0 GGAEHN O=C(OCCC(F)(F)F)C1CCN(c2ccccc2Br)C1=O ZINC000130937401 1416484193 /nfs/dbraw/zinc/48/41/93/1416484193.db2.gz GONQACXHVKUSNI-SECBINFHSA-N 0 3 380.160 3.298 10 0 GGAEHN C[C@H](NCc1cnc(N2CCN(C)CC2)nc1)c1ccc(OCC2CC2)c(F)c1 ZINC000134412706 1417066669 /nfs/dbraw/zinc/06/66/69/1417066669.db2.gz DGQXHNDYCWVZBJ-INIZCTEOSA-N 0 3 399.514 3.007 10 0 GGAEHN CC(C)Sc1ccccc1NC(=O)NCCCN1CCC[C@@H]1C(=O)N(C)C ZINC000135375994 1417212662 /nfs/dbraw/zinc/21/26/62/1417212662.db2.gz FMLSNHRCYDOPOC-QGZVFWFLSA-N 0 3 392.569 3.251 10 0 GGAEHN C[C@@H](NC(=O)[C@H](C)N1CCN(C[C@@H]2CCOC2)CC1)c1cccc2ccccc21 ZINC000178831564 1429186899 /nfs/dbraw/zinc/18/68/99/1429186899.db2.gz FQOSTXVUTLBGMM-AABGKKOBSA-N 0 3 395.547 3.060 10 0 GGAEHN O[C@H](CNCc1cnn(-c2ccc(Cl)cc2)c1)COc1cccc(F)c1 ZINC000140071512 1417487590 /nfs/dbraw/zinc/48/75/90/1417487590.db2.gz GQAUCEBBOVWBDD-GOSISDBHSA-N 0 3 375.831 3.194 10 0 GGAEHN C[C@H](NCc1ccc(-n2cncn2)c(F)c1)c1cccc(N2CCOC2=O)c1 ZINC000142697203 1417596529 /nfs/dbraw/zinc/59/65/29/1417596529.db2.gz FRZDQNFDOIKTOG-AWEZNQCLSA-N 0 3 381.411 3.214 10 0 GGAEHN COc1cc(OC)c(OC)cc1CN[C@H]1CCN(c2ncccc2Cl)C1 ZINC000151222943 1417896748 /nfs/dbraw/zinc/89/67/48/1417896748.db2.gz BNWLASUPZDHJTG-AWEZNQCLSA-N 0 3 377.872 3.129 10 0 GGAEHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N1CC[C@@H](Oc2ccncc2)C1 ZINC000151558837 1418023693 /nfs/dbraw/zinc/02/36/93/1418023693.db2.gz FBDINENEIWAQNE-RTWAWAEBSA-N 0 3 380.492 3.081 10 0 GGAEHN CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)N[C@@H](C)c2ccc(OC(C)C)cc2)C1 ZINC000179526789 1429410061 /nfs/dbraw/zinc/41/00/61/1429410061.db2.gz ANYWBGZEAOVDLW-YQVWRLOYSA-N 0 3 390.524 3.315 10 0 GGAEHN CC(C)(C)OC(=O)N1CCC[C@@H](Nc2ccccc2CN2CCC(O)CC2)C1 ZINC000179599293 1429463680 /nfs/dbraw/zinc/46/36/80/1429463680.db2.gz AKCBZPVJPVWSAK-GOSISDBHSA-N 0 3 389.540 3.455 10 0 GGAEHN O=C(CCc1ccccc1)N1CC[C@@H](NCc2cc3ccccc3[nH]c2=O)C1 ZINC000154024556 1422827428 /nfs/dbraw/zinc/82/74/28/1422827428.db2.gz FGIVEWBCTHKEFB-HXUWFJFHSA-N 0 3 375.472 3.264 10 0 GGAEHN O=S(=O)(CCNC1CCN(Cc2ccccc2Cl)CC1)c1ccccc1 ZINC000154124954 1422843655 /nfs/dbraw/zinc/84/36/55/1422843655.db2.gz ALSKHBURFORNHI-UHFFFAOYSA-N 0 3 392.952 3.368 10 0 GGAEHN O=C1C[C@@H](NCc2cc(Br)cc(C(F)(F)F)c2)CN1C1CC1 ZINC000156056325 1423654278 /nfs/dbraw/zinc/65/42/78/1423654278.db2.gz HRLAPKUCBNROHD-GFCCVEGCSA-N 0 3 377.204 3.321 10 0 GGAEHN CN1CCN(c2ncccc2CNCc2cc(Cl)cc3cccnc32)CC1 ZINC000156449484 1423811591 /nfs/dbraw/zinc/81/15/91/1423811591.db2.gz BMQYDYSGSYYWBL-UHFFFAOYSA-N 0 3 381.911 3.325 10 0 GGAEHN CC(C)(C)OC(=O)N1CCC[C@@H](N[C@@H](CO)c2cccc(Br)c2)C1 ZINC000156741280 1423857607 /nfs/dbraw/zinc/85/76/07/1423857607.db2.gz YQLIGGJUIOOURO-CVEARBPZSA-N 0 3 399.329 3.472 10 0 GGAEHN CC(C)c1ccc([C@@H](C)CC(=O)NCCCN2CCC[C@@H]2C(=O)N(C)C)cc1 ZINC000158137634 1424176261 /nfs/dbraw/zinc/17/62/61/1424176261.db2.gz AHXGGPYHCZDVKN-GHTZIAJQSA-N 0 3 387.568 3.363 10 0 GGAEHN CCc1nn(C)c(CC)c1CNC[C@H](O)COc1cccc(C(F)(F)F)c1 ZINC000160932675 1424646363 /nfs/dbraw/zinc/64/63/63/1424646363.db2.gz HBDSXYKRMWTOLX-AWEZNQCLSA-N 0 3 385.430 3.093 10 0 GGAEHN O=C(NC[C@@H]1CCCO1)c1cccc(CNCc2ccc(-n3ccnc3)cc2)c1 ZINC000166066929 1425205570 /nfs/dbraw/zinc/20/55/70/1425205570.db2.gz ABBHYLDKOGGCHG-QFIPXVFZSA-N 0 3 390.487 3.071 10 0 GGAEHN Cc1ncsc1CN1CCC2(CC1)C[C@H](CC(=O)N1CCCC1)CCO2 ZINC000169774173 1425252908 /nfs/dbraw/zinc/25/29/08/1425252908.db2.gz BDKGUHDKRWUNOX-KRWDZBQOSA-N 0 3 377.554 3.225 10 0 GGAEHN Cc1ccc(OCC(=O)N2Cc3ccccc3OC3(CCN(C)CC3)C2)cc1 ZINC000169792859 1425258367 /nfs/dbraw/zinc/25/83/67/1425258367.db2.gz DCQWGQHVDQNMSH-UHFFFAOYSA-N 0 3 380.488 3.259 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)NCc3ccc(OC(F)F)cc3)cc2)CC1 ZINC000172043524 1425880961 /nfs/dbraw/zinc/88/09/61/1425880961.db2.gz TYTZTTORAOHPOK-UHFFFAOYSA-N 0 3 389.446 3.360 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)N[C@H](C)c3nc4ccccc4[nH]3)cc2)CC1 ZINC000172049897 1425882379 /nfs/dbraw/zinc/88/23/79/1425882379.db2.gz MKWGOYQURRVZQP-MRXNPFEDSA-N 0 3 377.492 3.196 10 0 GGAEHN O=S(=O)([N-]Cc1ccc(C[NH+]2CCCC2)cc1)c1cc(F)c(F)c(F)c1 ZINC000172989522 1426297842 /nfs/dbraw/zinc/29/78/42/1426297842.db2.gz SOUUHJMBKZFVTK-UHFFFAOYSA-N 0 3 384.423 3.178 10 0 GGAEHN COCCOC[C@H]1CCN([C@H](C)C(=O)N[C@@H](C)c2cccc3ccccc32)C1 ZINC000173734824 1426834636 /nfs/dbraw/zinc/83/46/36/1426834636.db2.gz DDMPIJLSUFZACG-OTWHNJEPSA-N 0 3 384.520 3.390 10 0 GGAEHN COCCOC[C@H]1CCN([C@@H](C)C(=O)N[C@@H](C)c2cccc3ccccc32)C1 ZINC000173734854 1426834969 /nfs/dbraw/zinc/83/49/69/1426834969.db2.gz DDMPIJLSUFZACG-FHWLQOOXSA-N 0 3 384.520 3.390 10 0 GGAEHN CCn1cnnc1C1CCN(CCOc2ccc(OC(F)(F)F)cc2)CC1 ZINC000173888990 1426882357 /nfs/dbraw/zinc/88/23/57/1426882357.db2.gz HMJLTRGMCBJNDA-UHFFFAOYSA-N 0 3 384.402 3.455 10 0 GGAEHN Cc1cc(F)ccc1S(=O)(=O)N(C)C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000174039833 1426963596 /nfs/dbraw/zinc/96/35/96/1426963596.db2.gz PYSGNEHLPBDOND-SFHVURJKSA-N 0 3 376.497 3.277 10 0 GGAEHN C[C@@H](N[C@@H](C)C(=O)NC(=O)Nc1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000174374960 1427126984 /nfs/dbraw/zinc/12/69/84/1427126984.db2.gz FIFXMTWURYYHPB-CVEARBPZSA-N 0 3 377.448 3.260 10 0 GGAEHN COc1cccc(CS(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)c1 ZINC000175844120 1427926122 /nfs/dbraw/zinc/92/61/22/1427926122.db2.gz NNJYGGLEKWXHOY-YLJYHZDGSA-N 0 3 388.533 3.168 10 0 GGAEHN CN(C)C[C@H]1CN(C(=O)Nc2ccccc2N2CCc3ccccc32)CCO1 ZINC000181163795 1430233094 /nfs/dbraw/zinc/23/30/94/1430233094.db2.gz DNZHJKPMHPFQQF-SFHVURJKSA-N 0 3 380.492 3.175 10 0 GGAEHN Cn1ccnc1CC1CCN([C@@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)CC1 ZINC000182238500 1430434984 /nfs/dbraw/zinc/43/49/84/1430434984.db2.gz ATUPIBUJOKHZBS-GOSISDBHSA-N 0 3 390.890 3.273 10 0 GGAEHN Fc1cc(CN2CCC[C@@H]2CN2CCOCC2)ccc1OCC(F)(F)F ZINC000183293129 1430671549 /nfs/dbraw/zinc/67/15/49/1430671549.db2.gz DLXYCBKQVNZQAE-OAHLLOKOSA-N 0 3 376.394 3.063 10 0 GGAEHN CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(Cc3ccc(N4CCCC4)nc3)C[C@H]12 ZINC000184244766 1430861534 /nfs/dbraw/zinc/86/15/34/1430861534.db2.gz HHMKWAKXDQZQOR-CEXWTWQISA-N 0 3 386.540 3.417 10 0 GGAEHN COc1ccc(C[C@H](C)C[NH2+][C@@H](c2nc(-c3nc[n-]n3)no2)C(C)C)cc1F ZINC000185306962 1431107577 /nfs/dbraw/zinc/10/75/77/1431107577.db2.gz CVJIXAKMVRKPML-BLLLJJGKSA-N 0 3 388.447 3.168 10 0 GGAEHN C[C@@H]1CN(C2CCN(Cc3ccc(OCc4ccccc4F)nc3)CC2)CCO1 ZINC000186726671 1431503013 /nfs/dbraw/zinc/50/30/13/1431503013.db2.gz CLTAGHBLCQLWLW-GOSISDBHSA-N 0 3 399.510 3.485 10 0 GGAEHN COc1ccc2c(c1)CCN2C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000190861112 1432511882 /nfs/dbraw/zinc/51/18/82/1432511882.db2.gz FSVQFCLYWMTCLL-OAQYLSRUSA-N 0 3 395.503 3.058 10 0 GGAEHN COc1cc(S(=O)(=O)[N-]c2ccc(CC[NH+]3CCCC3)cc2)ccc1F ZINC000190989489 1432544530 /nfs/dbraw/zinc/54/45/30/1432544530.db2.gz WQCGNCKLWXKFHF-UHFFFAOYSA-N 0 3 378.469 3.273 10 0 GGAEHN COc1cccc(CN(CCN(C)C)C(=O)Nc2ccc3c(c2)N(C)CCO3)c1 ZINC000192303882 1432829613 /nfs/dbraw/zinc/82/96/13/1432829613.db2.gz BVPPIDYBKLZRAB-UHFFFAOYSA-N 0 3 398.507 3.120 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)c2cc(N3CCCC3)ccn2)C1 ZINC000192600517 1432864602 /nfs/dbraw/zinc/86/46/02/1432864602.db2.gz HXFRHYVTNLOHDO-QGZVFWFLSA-N 0 3 399.564 3.041 10 0 GGAEHN Cc1ccc(OC[C@@H](O)CN2CCC23CCN(C(=O)OC(C)(C)C)CC3)cc1 ZINC000193752119 1433052479 /nfs/dbraw/zinc/05/24/79/1433052479.db2.gz LITUISLHQCCPQO-SFHVURJKSA-N 0 3 390.524 3.210 10 0 GGAEHN Cc1ccccc1OC[C@@H](O)CN1CCC12CCN(C(=O)OC(C)(C)C)CC2 ZINC000193752652 1433052571 /nfs/dbraw/zinc/05/25/71/1433052571.db2.gz IBPSBNJMEFMJLV-SFHVURJKSA-N 0 3 390.524 3.210 10 0 GGAEHN c1csc(-c2nc(CNC[C@]3(N4CCOCC4)CCSC3)cs2)c1 ZINC000236700297 1433376544 /nfs/dbraw/zinc/37/65/44/1433376544.db2.gz CXYQSWJECFBNHX-QGZVFWFLSA-N 0 3 381.592 3.169 10 0 GGAEHN CC(C)(C)OC(=O)N1CC[C@H](NCc2cc3c(c(Br)c2)OCO3)C1 ZINC000236772227 1433378272 /nfs/dbraw/zinc/37/82/72/1433378272.db2.gz AJFJZWQSPRNERJ-LBPRGKRZSA-N 0 3 399.285 3.277 10 0 GGAEHN Cc1nn(C)c(OCC(F)(F)F)c1CNC[C@@H](c1cccs1)N(C)C ZINC000237157123 1433390947 /nfs/dbraw/zinc/39/09/47/1433390947.db2.gz AHQIGCYCWASYND-ZDUSSCGKSA-N 0 3 376.448 3.124 10 0 GGAEHN COc1ccccc1[C@H](CNC(=O)[C@H]1Cc2ccccc2CN1)N1CCCCC1 ZINC000237261718 1433394767 /nfs/dbraw/zinc/39/47/67/1433394767.db2.gz GOGRHACESMCQAL-YADHBBJMSA-N 0 3 393.531 3.053 10 0 GGAEHN COc1ccc(CNCC(=O)N2CCN(c3ccccc3)CC2)c2ccccc12 ZINC000237360680 1433398985 /nfs/dbraw/zinc/39/89/85/1433398985.db2.gz BNTPERVMYKNGGZ-UHFFFAOYSA-N 0 3 389.499 3.287 10 0 GGAEHN O=C(Nc1ccc(CNCc2c[nH]nc2-c2cccnc2)cc1)c1ccncc1 ZINC000238107811 1433443170 /nfs/dbraw/zinc/44/31/70/1433443170.db2.gz AMINKQUZXMAURQ-UHFFFAOYSA-N 0 3 384.443 3.409 10 0 GGAEHN COCCOC[C@@H]1CCN([C@@H](C)C(=O)N[C@@H](C)c2cccc3ccccc32)C1 ZINC000245436051 1433467256 /nfs/dbraw/zinc/46/72/56/1433467256.db2.gz DDMPIJLSUFZACG-GBESFXJTSA-N 0 3 384.520 3.390 10 0 GGAEHN C[C@H](C(=O)N1c2ccccc2CC[C@H]1C)N1CCC[C@@H](Cc2nccn2C)C1 ZINC000245808897 1433520910 /nfs/dbraw/zinc/52/09/10/1433520910.db2.gz BXASEDOWLBMWTF-QRVBRYPASA-N 0 3 380.536 3.431 10 0 GGAEHN CC(=O)N1CC[C@H](CN(C)[C@@H](C)C(=O)N[C@H](C)c2cccc3ccccc32)C1 ZINC000246036196 1433560172 /nfs/dbraw/zinc/56/01/72/1433560172.db2.gz AEIZZZFQFIYQBX-ZIFCJYIRSA-N 0 3 381.520 3.206 10 0 GGAEHN C[C@H](CNC(=O)[C@H]1CCCC[C@H]1C(=O)N1CCCC1)N(C)Cc1ccccc1 ZINC000246540800 1433627980 /nfs/dbraw/zinc/62/79/80/1433627980.db2.gz HXUZXMRCPAKTAO-HLAWJBBLSA-N 0 3 385.552 3.052 10 0 GGAEHN COc1cccc([C@H](O)CN2CCC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)c1 ZINC000246704875 1433652842 /nfs/dbraw/zinc/65/28/42/1433652842.db2.gz FAWNOOHQEDSVGP-QFBILLFUSA-N 0 3 378.513 3.308 10 0 GGAEHN CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(Cc3ccc(N4CCCC4)nc3)C[C@@H]12 ZINC000248591993 1433810246 /nfs/dbraw/zinc/81/02/46/1433810246.db2.gz HHMKWAKXDQZQOR-GUDVDZBRSA-N 0 3 386.540 3.417 10 0 GGAEHN COc1ccc(CN2C[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)[C@@H]3C2)c(OC)c1 ZINC000248650847 1433813699 /nfs/dbraw/zinc/81/36/99/1433813699.db2.gz UVIYBWXVIVPXMZ-BMGDILEWSA-N 0 3 376.497 3.439 10 0 GGAEHN CC(C)(C)OC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C[C@@H](O)COCc1ccco1 ZINC000249392847 1433842516 /nfs/dbraw/zinc/84/25/16/1433842516.db2.gz AJFWVKJUCWOJJW-NBMJBFSESA-N 0 3 379.497 3.132 10 0 GGAEHN C[C@H](CS(=O)(=O)c1ccccc1)N[C@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C ZINC000249530053 1433846416 /nfs/dbraw/zinc/84/64/16/1433846416.db2.gz ASRSCPKPLPJCPY-NUJGCVRESA-N 0 3 396.553 3.226 10 0 GGAEHN COC(=O)C1CCN(CCCNC(=O)[C@@H]2C[C@@H]2c2cccc3ccccc32)CC1 ZINC000264407001 1434108431 /nfs/dbraw/zinc/10/84/31/1434108431.db2.gz DMHRVEGAMRZDEF-FGZHOGPDSA-N 0 3 394.515 3.335 10 0 GGAEHN COC(=O)C1CCN(CCCNC(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)CC1 ZINC000264406999 1434108450 /nfs/dbraw/zinc/10/84/50/1434108450.db2.gz DMHRVEGAMRZDEF-FCHUYYIVSA-N 0 3 394.515 3.335 10 0 GGAEHN CC(C)OCCN1CCC(NC(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)CC1 ZINC000267003672 1434397991 /nfs/dbraw/zinc/39/79/91/1434397991.db2.gz DMVWQTAPTAGFIS-GOSISDBHSA-N 0 3 399.539 3.122 10 0 GGAEHN O=C(NCc1ccccc1CN1CCC(O)CC1)c1cc(F)cc(Cl)c1 ZINC000268061692 1434492088 /nfs/dbraw/zinc/49/20/88/1434492088.db2.gz ADMRYGABHKUPII-UHFFFAOYSA-N 0 3 376.859 3.366 10 0 GGAEHN C[C@H](Oc1cccc(Cl)c1Cl)C(=O)Nc1ccc(=O)n(CCN(C)C)c1 ZINC000270067724 1434698976 /nfs/dbraw/zinc/69/89/76/1434698976.db2.gz GKIKFOLNFQSRAE-LBPRGKRZSA-N 0 3 398.290 3.123 10 0 GGAEHN CC[C@@H](N[C@H](C)C(=O)Nc1cccc(NC(C)=O)c1)c1ccc2c(c1)OCCO2 ZINC000271635817 1434840753 /nfs/dbraw/zinc/84/07/53/1434840753.db2.gz FEHKWPZCTDDSEH-AUUYWEPGSA-N 0 3 397.475 3.484 10 0 GGAEHN C[C@@H](NCc1ccc(N2CCOC2=O)cc1)c1ccc(N2CCOC2=O)cc1 ZINC000272829377 1434934235 /nfs/dbraw/zinc/93/42/35/1434934235.db2.gz HOQONFUJIYMSNF-OAHLLOKOSA-N 0 3 381.432 3.451 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cnc(-c3ccccc3)nc2C)C[C@@H]1N1CCCC1 ZINC000273465193 1434990522 /nfs/dbraw/zinc/99/05/22/1434990522.db2.gz GBLKKYUBZWXXJQ-OALUTQOASA-N 0 3 382.533 3.104 10 0 GGAEHN COc1ccccc1S(=O)(=O)CCCN1CCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@@H]1O ZINC000281293792 1435802699 /nfs/dbraw/zinc/80/26/99/1435802699.db2.gz HAXIHVMZHHDAKI-OKYOBFRVSA-N 0 3 395.565 3.121 10 0 GGAEHN COc1ccccc1S(=O)(=O)CCCN1CCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@H]1O ZINC000281293784 1435802787 /nfs/dbraw/zinc/80/27/87/1435802787.db2.gz HAXIHVMZHHDAKI-INDMIFKZSA-N 0 3 395.565 3.121 10 0 GGAEHN OC[C@]1(NCc2cnc(-c3ccncc3)s2)CCCN(Cc2ccccc2)C1 ZINC000674675752 1126105052 /nfs/dbraw/zinc/10/50/52/1126105052.db2.gz JUMDNJFTJSMFGX-QFIPXVFZSA-N 0 3 394.544 3.322 10 0 GGAEHN OC[C@]1(NCc2cnc([C@H]3CCCO3)s2)CCCN(Cc2ccccc2)C1 ZINC000677322549 1126105393 /nfs/dbraw/zinc/10/53/93/1126105393.db2.gz PTPHDKQCESSRBZ-CTNGQTDRSA-N 0 3 387.549 3.111 10 0 GGAEHN Cc1nn(-c2ccncc2)cc1CN[C@H](Cc1ccccc1)[C@H](O)C(F)(F)F ZINC000680121099 1126105619 /nfs/dbraw/zinc/10/56/19/1126105619.db2.gz QYMJUBHYXDSRSS-MOPGFXCFSA-N 0 3 390.409 3.200 10 0 GGAEHN OC[C@@]1(NCc2cc(F)ncc2F)CCc2cc(Br)ccc2C1 ZINC000862480341 1126112944 /nfs/dbraw/zinc/11/29/44/1126112944.db2.gz CVRVFNLPDQAMJH-QGZVFWFLSA-N 0 3 383.236 3.132 10 0 GGAEHN Cc1nn(C)c2nc(Cl)c(CN[C@@](C)(CO)Cc3ccccc3F)cc12 ZINC000865714210 1126114526 /nfs/dbraw/zinc/11/45/26/1126114526.db2.gz INBJTCVZMHNFGL-LJQANCHMSA-N 0 3 376.863 3.153 10 0 GGAEHN C[C@@H](O)c1ncc(CN[C@](C)(CO)Cc2ccc(Br)cc2)s1 ZINC000865714886 1126114661 /nfs/dbraw/zinc/11/46/61/1126114661.db2.gz FUKJNROBMGXHRG-BZNIZROVSA-N 0 3 385.327 3.042 10 0 GGAEHN COC(=O)c1cc(CN[C@H](Cc2ccccc2)[C@H](O)C(F)(F)F)ccc1C ZINC001308035462 1126162249 /nfs/dbraw/zinc/16/22/49/1126162249.db2.gz QJUXDOQESXIZCS-MSOLQXFVSA-N 0 3 381.394 3.406 10 0 GGAEHN COC(=O)c1cc(CN[C@@](C)(CO)Cc2ccc(Br)cc2)cs1 ZINC001473839779 1126200054 /nfs/dbraw/zinc/20/00/54/1126200054.db2.gz JQPSFTZFMDKFCV-QGZVFWFLSA-N 0 3 398.322 3.381 10 0 GGAEHN C[C@](CO)(Cc1ccc(Cl)cc1)NCc1ccc(Br)nc1N ZINC001560182838 1126208801 /nfs/dbraw/zinc/20/88/01/1126208801.db2.gz IQWXCJVBMZGJKL-MRXNPFEDSA-N 0 3 384.705 3.163 10 0 GGAEHN CCN1CCC[C@@H](CN(C)Cc2ccc([S@](C)=O)cc2)[C@@H]1c1cnn(C)c1 ZINC000328629054 206234444 /nfs/dbraw/zinc/23/44/44/206234444.db2.gz HWBOBFPABXXUKT-OVYPOVDJSA-N 0 3 388.581 3.063 10 0 GGAEHN CCn1cc([C@H]2OCCC[C@@H]2NCc2cc(Cl)c3c(c2)OCCO3)cn1 ZINC000328630360 206234488 /nfs/dbraw/zinc/23/44/88/206234488.db2.gz JHPSUWGZPIXFPV-FUHWJXTLSA-N 0 3 377.872 3.338 10 0 GGAEHN COc1ccc(CN[C@@H]2CCCN(c3cccnn3)C2)cc1Br ZINC000109071227 206247573 /nfs/dbraw/zinc/24/75/73/206247573.db2.gz FQKBPSRVJHYEMK-CQSZACIVSA-N 0 3 377.286 3.006 10 0 GGAEHN CC(C)C[C@@H]1N[C@H](C(=O)NCCCn2ccnc2)Cc2c[nH]c3cccc1c23 ZINC000049171447 206264487 /nfs/dbraw/zinc/26/44/87/206264487.db2.gz DMVCPSZTPKRHEA-PMACEKPBSA-N 0 3 379.508 3.172 10 0 GGAEHN O=C(c1ccco1)N(c1cnccn1)C1CCN(CCc2ccccc2)CC1 ZINC000000538015 206290667 /nfs/dbraw/zinc/29/06/67/206290667.db2.gz BJZZDOLVVLWFHN-UHFFFAOYSA-N 0 3 376.460 3.424 10 0 investigational GGAEHN CCCCNC(=O)N1CCC[C@@H](N(C)CCc2ccc(OC)c(OC)c2)C1 ZINC000012076528 206853579 /nfs/dbraw/zinc/85/35/79/206853579.db2.gz KCAGIGFXMUOQKZ-GOSISDBHSA-N 0 3 377.529 3.152 10 0 GGAEHN CCC(C)(C)NCC(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000013005425 206964031 /nfs/dbraw/zinc/96/40/31/206964031.db2.gz ZBSYGJDMFHNMDO-HOTGVXAUSA-N 0 3 395.569 3.070 10 0 GGAEHN CCOC(=O)C1=C(CN[C@@H]2CCCC[C@@H]2C)NC(=O)N[C@@H]1c1cccs1 ZINC000014122658 207010229 /nfs/dbraw/zinc/01/02/29/207010229.db2.gz OIPNTTZDLKGVMK-OGHNNQOOSA-N 0 3 377.510 3.088 10 0 GGAEHN CCN1CCC(NC(=O)c2ccc(OCc3c(C)noc3C)c(OC)c2)CC1 ZINC000014523549 207022020 /nfs/dbraw/zinc/02/20/20/207022020.db2.gz OMYHFYBKBHLXKI-UHFFFAOYSA-N 0 3 387.480 3.093 10 0 GGAEHN CCN1C(=O)N(Cc2ccccn2)C(=O)C12CCN(Cc1sccc1C)CC2 ZINC000014541526 207023720 /nfs/dbraw/zinc/02/37/20/207023720.db2.gz CQOZUEKIGQTKAW-UHFFFAOYSA-N 0 3 398.532 3.270 10 0 GGAEHN CC(C)Cn1nc(C(=O)N(C)C)c2c1CC[C@H](NCc1ccc(F)c(F)c1)C2 ZINC000014542000 207024226 /nfs/dbraw/zinc/02/42/26/207024226.db2.gz STYGYZMAJGDJOH-HNNXBMFYSA-N 0 3 390.478 3.166 10 0 GGAEHN CCN(Cc1ccncc1)[C@H]1CCc2c(c(C(=O)N3CCCCCC3)nn2C)C1 ZINC000014755087 207028882 /nfs/dbraw/zinc/02/88/82/207028882.db2.gz ULLJWUAOTLVCFE-IBGZPJMESA-N 0 3 395.551 3.211 10 0 GGAEHN CCCn1nc(C(=O)N2CCCCCC2)c2c1CC[C@@H](NCc1ccccn1)C2 ZINC000014540945 207024052 /nfs/dbraw/zinc/02/40/52/207024052.db2.gz NKNQGFIVKKQCGV-GOSISDBHSA-N 0 3 395.551 3.351 10 0 GGAEHN O[C@@H](COc1ccccc1CN1CCCCC1)CN1CCc2ccccc2C1 ZINC000015073022 207044378 /nfs/dbraw/zinc/04/43/78/207044378.db2.gz OXATVEAULSWRBR-HSZRJFAPSA-N 0 3 380.532 3.471 10 0 GGAEHN COc1ccc([C@@H](CNC(=O)c2ccc3c(c2)NC(=O)[C@@H](C)S3)N(C)C)cc1 ZINC000015387852 207051789 /nfs/dbraw/zinc/05/17/89/207051789.db2.gz CCKDCWXGOYKCJJ-FZKQIMNGSA-N 0 3 399.516 3.161 10 0 GGAEHN COc1ccc2c(c1)CCc1c-2n[nH]c1C(=O)NCCN(C)Cc1ccccc1 ZINC000015772891 207059872 /nfs/dbraw/zinc/05/98/72/207059872.db2.gz UZHQGDQCMKUCNT-UHFFFAOYSA-N 0 3 390.487 3.046 10 0 GGAEHN CCC(=O)N1c2ccccc2C[C@@H]1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000015773568 207059958 /nfs/dbraw/zinc/05/99/58/207059958.db2.gz MZQAFOQGOZDRCN-JOCHJYFZSA-N 0 3 391.515 3.135 10 0 GGAEHN O=C([C@H]1CCN(c2ccc(Cl)cc2)C1=O)N1CCN(C2CCCCC2)CC1 ZINC000015782649 207061293 /nfs/dbraw/zinc/06/12/93/207061293.db2.gz GDWUHROVMIQBAS-LJQANCHMSA-N 0 3 389.927 3.170 10 0 GGAEHN CCCN1CCN(c2ncc3c(n2)CCN(Cc2ccc(C)c(C)c2)C3)CC1 ZINC000015779577 207061481 /nfs/dbraw/zinc/06/14/81/207061481.db2.gz JDMDZELTJWYMCK-UHFFFAOYSA-N 0 3 379.552 3.184 10 0 GGAEHN O=C(CCc1ccncc1)N1CC[C@H](C2CCN(Cc3cccnc3)CC2)C1 ZINC000020362853 207190355 /nfs/dbraw/zinc/19/03/55/207190355.db2.gz BDUISGAGULMHMX-QFIPXVFZSA-N 0 3 378.520 3.170 10 0 GGAEHN CCOC(=O)C1=C(CN2C[C@H](C)C[C@H](C)C2)NC(=O)N[C@@H]1c1ccc(C)cc1 ZINC000020560266 207203525 /nfs/dbraw/zinc/20/35/25/207203525.db2.gz JOAZBEZPXLZMIT-GQIGUUNPSA-N 0 3 385.508 3.144 10 0 GGAEHN CC(=O)N1c2ccccc2C(=O)C1N1CCN(c2cc(Cl)ccc2C)CC1 ZINC000020579785 207204060 /nfs/dbraw/zinc/20/40/60/207204060.db2.gz WOQJLYNARDFOEM-OAQYLSRUSA-N 0 3 383.879 3.346 10 0 GGAEHN COc1cccc(-c2cnnc(N(C)C[C@@H]3Cc4ccccc4CN3C)n2)c1 ZINC000020600699 207205543 /nfs/dbraw/zinc/20/55/43/207205543.db2.gz MXKQSCVONKUPAT-IBGZPJMESA-N 0 3 375.476 3.040 10 0 GGAEHN COc1cccc(-c2cnnc(N(C)C[C@H]3Cc4ccccc4CN3C)n2)c1 ZINC000020600700 207205938 /nfs/dbraw/zinc/20/59/38/207205938.db2.gz MXKQSCVONKUPAT-LJQANCHMSA-N 0 3 375.476 3.040 10 0 GGAEHN COc1cccc(N2C(=O)CN([C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]2C)c1 ZINC000020599595 207206594 /nfs/dbraw/zinc/20/65/94/207206594.db2.gz KPXXDRXWXMBHBQ-GHTZIAJQSA-N 0 3 379.504 3.007 10 0 GGAEHN CC(C)n1cc(-c2cc(C(=O)N3CC[C@H](N(C)C)C3)c3ccccc3n2)cn1 ZINC000020862120 207216539 /nfs/dbraw/zinc/21/65/39/207216539.db2.gz ZWNSBYSNOHQHLU-KRWDZBQOSA-N 0 3 377.492 3.455 10 0 GGAEHN Cc1ccc(COc2ccccc2CNCCCSc2nnnn2C)cc1 ZINC000020873687 207216705 /nfs/dbraw/zinc/21/67/05/207216705.db2.gz FPLFQJHQARBKOP-UHFFFAOYSA-N 0 3 383.521 3.370 10 0 GGAEHN O=C(c1ccc([C@@H]2CCCN2C2CCSCC2)s1)N1CCC(O)CC1 ZINC000020776207 207214081 /nfs/dbraw/zinc/21/40/81/207214081.db2.gz VNIKUEKLSQZUTC-INIZCTEOSA-N 0 3 380.579 3.378 10 0 GGAEHN CCc1nc2cccnc2n1-c1ccc(C(=O)NC[C@@H]2CCCN2CC)cc1 ZINC000020934120 207220987 /nfs/dbraw/zinc/22/09/87/207220987.db2.gz MMCRPDQBJXEBLH-SFHVURJKSA-N 0 3 377.492 3.197 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)c1cnn(-c2cccc(C)c2)c1-n1cccc1 ZINC000020979976 207221165 /nfs/dbraw/zinc/22/11/65/207221165.db2.gz MBKACXMGEORAKE-LJQANCHMSA-N 0 3 377.492 3.186 10 0 GGAEHN CC[C@H](C)N(CCNC(=O)Cn1c(=O)oc2ccccc21)Cc1cccs1 ZINC000020994100 207223445 /nfs/dbraw/zinc/22/34/45/207223445.db2.gz GUERMCQXZJEGEE-HNNXBMFYSA-N 0 3 387.505 3.073 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)c1cnc2c(-c3ccccc3)c(C)nn2c1C ZINC000021537970 207231716 /nfs/dbraw/zinc/23/17/16/207231716.db2.gz IDZFKKGLZCUSHX-SFHVURJKSA-N 0 3 377.492 3.227 10 0 GGAEHN Cc1cc(-c2ccc(S(=O)(=O)N3CCC(N4CCCCC4)CC3)s2)on1 ZINC000021535168 207231749 /nfs/dbraw/zinc/23/17/49/207231749.db2.gz CCASWZVLCULRJO-UHFFFAOYSA-N 0 3 395.550 3.351 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)C1CCN(c2ccc(-c3cccs3)nn2)CC1 ZINC000021538828 207232066 /nfs/dbraw/zinc/23/20/66/207232066.db2.gz YXCLDSCUXQZTLX-QGZVFWFLSA-N 0 3 399.564 3.022 10 0 GGAEHN Cc1ccc(C)c(NC(=O)N2CCN(c3cc(N4CCCC4)nc(C)n3)CC2)c1 ZINC000021795075 207237659 /nfs/dbraw/zinc/23/76/59/207237659.db2.gz YEPRVWBARZHMEZ-UHFFFAOYSA-N 0 3 394.523 3.356 10 0 GGAEHN CCN1CCC2(CC1)OC(=O)C(C)=C2C(=O)Nc1ccccc1Br ZINC000021868575 207239080 /nfs/dbraw/zinc/23/90/80/207239080.db2.gz OBIIDGHZAIVPFH-UHFFFAOYSA-N 0 3 393.281 3.115 10 0 biogenic GGAEHN CCN1CCC2(CC1)OC(=O)C(C)=C2C(=O)Nc1ccc(OC)c(Cl)c1 ZINC000021868517 207239736 /nfs/dbraw/zinc/23/97/36/207239736.db2.gz NRDSJTSISVDUES-UHFFFAOYSA-N 0 3 378.856 3.015 10 0 biogenic GGAEHN COc1ccc(Nc2nc(NCCN3CCCCC3)nc3c2cnn3C)cc1 ZINC000021928736 207241527 /nfs/dbraw/zinc/24/15/27/207241527.db2.gz WTHXKQYJTCMJJM-UHFFFAOYSA-N 0 3 381.484 3.013 10 0 GGAEHN O[C@H](CNC[C@H](c1ccco1)N1CCCC1)COCc1ccccc1Cl ZINC000022038995 207247081 /nfs/dbraw/zinc/24/70/81/207247081.db2.gz BNABYTVVRHRFLS-IEBWSBKVSA-N 0 3 378.900 3.237 10 0 GGAEHN COc1ccc([C@H](CNC(=O)c2ccc3nc(C)c(C)nc3c2)N(C)C)cc1 ZINC000022616381 207257871 /nfs/dbraw/zinc/25/78/71/207257871.db2.gz SESSQEIUGNKYIB-NRFANRHFSA-N 0 3 378.476 3.288 10 0 GGAEHN CN(CCc1ccccn1)[C@H]1CCCN(Cc2cccn2-c2ccccn2)C1 ZINC000022851648 207262396 /nfs/dbraw/zinc/26/23/96/207262396.db2.gz WAOHAZVAXBAMRL-NRFANRHFSA-N 0 3 375.520 3.406 10 0 GGAEHN NCc1cn(CC2CCN(C(=O)Nc3ccccc3-c3ccccc3)CC2)nn1 ZINC000023144489 207270250 /nfs/dbraw/zinc/27/02/50/207270250.db2.gz QCQYKVZGRBFKEQ-UHFFFAOYSA-N 0 3 390.491 3.348 10 0 GGAEHN Cc1cc(=O)[n-]c(-c2ccc(C[N@@H+]3CCC[C@@H](OCc4ccccn4)C3)cc2)n1 ZINC000023250868 207272511 /nfs/dbraw/zinc/27/25/11/207272511.db2.gz UPGXMGRKHYBYEK-OAQYLSRUSA-N 0 3 390.487 3.322 10 0 GGAEHN Cc1cc(=O)[n-]c(-c2ccc(C[N@H+]3CCC[C@@H](OCc4ccccn4)C3)cc2)n1 ZINC000023250868 207272517 /nfs/dbraw/zinc/27/25/17/207272517.db2.gz UPGXMGRKHYBYEK-OAQYLSRUSA-N 0 3 390.487 3.322 10 0 GGAEHN Cc1c(=O)[n-]c(-c2cccc(CN3CC[NH+]4CCC3CC4)c2)nc1C(F)(F)F ZINC000023506031 207277458 /nfs/dbraw/zinc/27/74/58/207277458.db2.gz OUAXCDATBBVGEA-UHFFFAOYSA-N 0 3 392.425 3.456 10 0 GGAEHN COC(=O)c1cccc(OC[C@H](O)CN(C)[C@@H](C)c2ccc(F)c(F)c2)c1 ZINC000023674173 207281689 /nfs/dbraw/zinc/28/16/89/207281689.db2.gz OQRDPNFIUUEVEG-XJKSGUPXSA-N 0 3 379.403 3.184 10 0 GGAEHN O=C(CCN1CCC[C@H](C(F)(F)F)C1)Nc1ccc(N2CCOCC2)cc1 ZINC000024841662 207296085 /nfs/dbraw/zinc/29/60/85/207296085.db2.gz NQQAJZJFBTTZAX-HNNXBMFYSA-N 0 3 385.430 3.126 10 0 GGAEHN COc1ccc(C(=O)NCCN2CCN([C@H]3CCCc4ccccc43)CC2)cc1 ZINC000028091807 207335459 /nfs/dbraw/zinc/33/54/59/207335459.db2.gz OYTRPLYAJZHWJP-QHCPKHFHSA-N 0 3 393.531 3.120 10 0 GGAEHN O=C(NC[C@@H]1CCCO1)C1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000028984201 207354053 /nfs/dbraw/zinc/35/40/53/207354053.db2.gz ITUZZXMADBALIA-KRWDZBQOSA-N 0 3 386.414 3.092 10 0 GGAEHN C[C@H](CCN1CCN(c2ccccc2)CC1)NC(=O)NCc1ccc(F)cc1 ZINC000031094653 207379187 /nfs/dbraw/zinc/37/91/87/207379187.db2.gz FNFHUSLKVUSHHI-GOSISDBHSA-N 0 3 384.499 3.226 10 0 GGAEHN Cc1cccc(N2CCN(CC[C@H](C)NC(=O)Cc3ccc(F)cc3)CC2)c1 ZINC000032579784 207396536 /nfs/dbraw/zinc/39/65/36/207396536.db2.gz XEHLJISQNBKSJL-IBGZPJMESA-N 0 3 383.511 3.394 10 0 GGAEHN O=C(CCN1CCC(NC(=O)CCc2ccccc2)CC1)Nc1ccccc1 ZINC000048365697 207700487 /nfs/dbraw/zinc/70/04/87/207700487.db2.gz OFAPXKSWXKSVAT-UHFFFAOYSA-N 0 3 379.504 3.229 10 0 GGAEHN CN(C)CCN(CCc1ccccc1)C(=O)Nc1ccc(-c2nncn2C)cc1 ZINC000058146043 207761853 /nfs/dbraw/zinc/76/18/53/207761853.db2.gz LXOBAJIIQRNRJW-UHFFFAOYSA-N 0 3 392.507 3.120 10 0 GGAEHN O[C@H](c1ccccc1)C1CCN(CCCc2nnnn2-c2ccccc2)CC1 ZINC000058251590 207773156 /nfs/dbraw/zinc/77/31/56/207773156.db2.gz MGWQBZSRYKKKDK-JOCHJYFZSA-N 0 3 377.492 3.041 10 0 GGAEHN CN1CCC(NC(=O)c2cccc3c2CCN3C(=O)Nc2ccc(F)cc2)CC1 ZINC000065210165 207845567 /nfs/dbraw/zinc/84/55/67/207845567.db2.gz FVACLARTZQDGPD-UHFFFAOYSA-N 0 3 396.466 3.244 10 0 GGAEHN CN(C)CCn1nnc2cc(-c3noc(Cc4cccc(Cl)c4)n3)ccc21 ZINC000065254998 207854779 /nfs/dbraw/zinc/85/47/79/207854779.db2.gz GRCFSXVJNJMCDT-UHFFFAOYSA-N 0 3 382.855 3.287 10 0 GGAEHN CCOc1ccc(CC(=O)N2CCCSC[C@@H]2CN2CCCCC2)cc1 ZINC000085473266 208099994 /nfs/dbraw/zinc/09/99/94/208099994.db2.gz XEQWGKPWVSVUFR-IBGZPJMESA-N 0 3 376.566 3.448 10 0 GGAEHN CCN1CC[C@]2(CN(Cc3[nH]c4ccc(C)cc4c3C)CCN2C)CCC1=O ZINC000091326866 208113421 /nfs/dbraw/zinc/11/34/21/208113421.db2.gz WCNCUKHRBASGJE-QHCPKHFHSA-N 0 3 382.552 3.303 10 0 GGAEHN Cc1n[nH]cc1CCCNC(=O)[C@@H](C)CNCc1cccn1Cc1ccccc1 ZINC000095400403 208178614 /nfs/dbraw/zinc/17/86/14/208178614.db2.gz CBOUTMNTTPMJGD-SFHVURJKSA-N 0 3 393.535 3.043 10 0 GGAEHN Clc1cc(CNc2cnn(CCN3CCCCC3)c2)cc2c1OCCO2 ZINC000095462164 208187896 /nfs/dbraw/zinc/18/78/96/208187896.db2.gz IWLPHWUHBAVYOE-UHFFFAOYSA-N 0 3 376.888 3.406 10 0 GGAEHN CN1CC[C@@H]2CCN(C(=O)CCCOc3ccccc3Br)[C@@H]2C1 ZINC000095466169 208189452 /nfs/dbraw/zinc/18/94/52/208189452.db2.gz XUVWVRZVZAWBGP-GDBMZVCRSA-N 0 3 381.314 3.161 10 0 GGAEHN CC(CO)(CO)NCc1cn(-c2ccccc2)nc1-c1cc2ccccc2o1 ZINC000095467763 208191662 /nfs/dbraw/zinc/19/16/62/208191662.db2.gz FLIPTQJFFJQMKG-UHFFFAOYSA-N 0 3 377.444 3.118 10 0 GGAEHN CN(CCCN1CCN(C)CC1)C(=O)c1csc(-c2cc3ccccc3o2)n1 ZINC000095957421 208243863 /nfs/dbraw/zinc/24/38/63/208243863.db2.gz DXJFAZNVUQOCMZ-UHFFFAOYSA-N 0 3 398.532 3.266 10 0 GGAEHN CC1CCN(C[C@@H](O)CNC(=O)C(C)(C)CC(=O)c2ccc(Cl)cc2)CC1 ZINC000096006260 208251683 /nfs/dbraw/zinc/25/16/83/208251683.db2.gz XBKNQAFYCNOLTC-SFHVURJKSA-N 0 3 394.943 3.148 10 0 GGAEHN Cc1cccc(-n2c(CC(=O)NCCN3CCCCC3)c3[nH]cccc-3c2=O)c1 ZINC000096387075 208312376 /nfs/dbraw/zinc/31/23/76/208312376.db2.gz KVNREIJAYQDYOD-FQEVSTJZSA-N 0 3 392.503 3.084 10 0 GGAEHN CN(C)C[C@H](NC(=O)/C=C\c1ccc(N2CCCC2=O)cc1)c1ccccc1 ZINC000096940657 208331581 /nfs/dbraw/zinc/33/15/81/208331581.db2.gz QMTWPFAIMSHBOL-MQGIHEMASA-N 0 3 377.488 3.246 10 0 GGAEHN CN(CCCNC(=O)/C=C\c1ccc(N2CCCC2=O)cc1)Cc1ccccc1 ZINC000096943922 208332060 /nfs/dbraw/zinc/33/20/60/208332060.db2.gz YRQNJOIQNYNCPD-QINSGFPZSA-N 0 3 391.515 3.465 10 0 GGAEHN C[C@@H](N[C@@H]1CCCC[C@H]1NC(=O)OC(C)(C)C)C(=O)N1C[C@H](C)C[C@@H](C)C1 ZINC000097102616 208334919 /nfs/dbraw/zinc/33/49/19/208334919.db2.gz JNRHZMFLPVOTPD-DUQPFJRNSA-N 0 3 381.561 3.305 10 0 GGAEHN C[C@H](N[C@@H](C)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)c1nnc2n1CCCC2 ZINC000097048753 208336563 /nfs/dbraw/zinc/33/65/63/208336563.db2.gz XFTRBDDRZMLNDR-HRCADAONSA-N 0 3 377.533 3.301 10 0 GGAEHN COc1cc(CNCCNC(=O)c2ccc(Cl)c(Cl)c2)cc2c1OCO2 ZINC000097287724 208344014 /nfs/dbraw/zinc/34/40/14/208344014.db2.gz ORPWTEKWQSJGFQ-UHFFFAOYSA-N 0 3 397.258 3.250 10 0 GGAEHN C[C@@H]1C[C@@H](NC(=O)/C=C\c2cc(Cl)c3c(c2)OCCCO3)CN1C1CC1 ZINC000229439119 209002769 /nfs/dbraw/zinc/00/27/69/209002769.db2.gz GXBTXOZAHFRPBR-DFCLBCNGSA-N 0 3 376.884 3.256 10 0 GGAEHN COCCN1CCC[C@@H]1CN[C@@H](C)c1cnccc1NC(=O)OC(C)(C)C ZINC000241590532 209019182 /nfs/dbraw/zinc/01/91/82/209019182.db2.gz PFOPCHLPKUBFQB-JKSUJKDBSA-N 0 3 378.517 3.190 10 0 GGAEHN Nc1ccc(Br)cc1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000255190785 209045453 /nfs/dbraw/zinc/04/54/53/209045453.db2.gz ZJXABBVMMCWTFF-UHFFFAOYSA-N 0 3 388.309 3.426 10 0 GGAEHN CCOc1ccccc1-c1cccc(C(=O)N2CC[C@@H](N(C)CCO)[C@H]2C)c1 ZINC000253419679 209041567 /nfs/dbraw/zinc/04/15/67/209041567.db2.gz FTIKNPQNTUMYED-DYESRHJHSA-N 0 3 382.504 3.279 10 0 GGAEHN C[C@H](C(=O)N1[C@H](C)CCC[C@@H]1C)N1CCC(C(=O)NCc2ccccc2)CC1 ZINC000016396469 221362247 /nfs/dbraw/zinc/36/22/47/221362247.db2.gz FHFCRYKRHKSARB-CEXWTWQISA-N 0 3 385.552 3.193 10 0 GGAEHN Cc1ccc(-c2noc(CCC(=O)NC[C@@H](c3ccccc3)N(C)C)n2)cc1 ZINC000016599862 221366851 /nfs/dbraw/zinc/36/68/51/221366851.db2.gz LWHFEISSOAZBLL-IBGZPJMESA-N 0 3 378.476 3.397 10 0 GGAEHN O=C(c1ccc(N2CCN[C@@H](c3ccccc3)C2)nc1)N1CCc2ccccc2C1 ZINC000039229355 136153729 /nfs/dbraw/zinc/15/37/29/136153729.db2.gz YDCAWDIGDBMNBJ-HSZRJFAPSA-N 0 3 398.510 3.431 10 0 GGAEHN O=C(NCCN1CCCCCC1)c1nc(-c2ccc(N3CCCCC3)cc2)no1 ZINC000064746364 136157561 /nfs/dbraw/zinc/15/75/61/136157561.db2.gz XPADLYCTFFBJBA-UHFFFAOYSA-N 0 3 397.523 3.333 10 0 GGAEHN O=C(/C=C\c1cc(Cl)c2c(c1)OCCCO2)N1CCN(c2ccncc2)CC1 ZINC000096891814 136187686 /nfs/dbraw/zinc/18/76/86/136187686.db2.gz MORQJFILUBXODM-IHWYPQMZSA-N 0 3 399.878 3.258 10 0 GGAEHN COc1ccc(Br)cc1CNC1CCN(c2ncccn2)CC1 ZINC000237129064 136191922 /nfs/dbraw/zinc/19/19/22/136191922.db2.gz GVBXRXOUSUCZFE-UHFFFAOYSA-N 0 3 377.286 3.006 10 0 GGAEHN Cn1cc(S(=O)(=O)c2ccc(Cl)cc2)c2cccc(N3CCNCC3)c21 ZINC000257373388 209080867 /nfs/dbraw/zinc/08/08/67/209080867.db2.gz UYZCMBAATWITHK-UHFFFAOYSA-N 0 3 389.908 3.074 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1ccc(-c2ccnc(N3CCCC3)n2)cc1 ZINC000065171685 222105819 /nfs/dbraw/zinc/10/58/19/222105819.db2.gz GZEATJHODSKWPJ-SFHVURJKSA-N 0 3 393.535 3.348 10 0 GGAEHN CCN(CC)C[C@H](NC(=O)CCN1C(=O)COc2ccccc21)c1ccccc1 ZINC000040007676 520738111 /nfs/dbraw/zinc/73/81/11/520738111.db2.gz ATIRXSCZXJPVNW-IBGZPJMESA-N 0 3 395.503 3.001 10 0 GGAEHN N[C@@H]1CCCN(c2nc3ccsc3c(=O)n2Cc2c(F)cccc2Cl)C1 ZINC000057344562 527347881 /nfs/dbraw/zinc/34/78/81/527347881.db2.gz YBZVUNYBYBCUBZ-LLVKDONJSA-N 0 3 392.887 3.226 10 0 GGAEHN N[C@H]1CCCN(c2nc3ccsc3c(=O)n2Cc2ccc(F)cc2Cl)C1 ZINC000057344568 527401544 /nfs/dbraw/zinc/40/15/44/527401544.db2.gz FLFNUVLSFRXMEO-ZDUSSCGKSA-N 0 3 392.887 3.226 10 0 GGAEHN Cc1cc(Br)c(NC(=O)N2CCO[C@@H](CN(C)C)C2)cc1Cl ZINC000122588543 564420247 /nfs/dbraw/zinc/42/02/47/564420247.db2.gz BATWYBPWAQJMTL-NSHDSACASA-N 0 3 390.709 3.205 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1ccc(F)cc1I ZINC000047144272 564514622 /nfs/dbraw/zinc/51/46/22/564514622.db2.gz NAGBBBLCFIJMGS-LLVKDONJSA-N 0 3 390.240 3.035 10 0 GGAEHN NC(=O)C1CCC(NCc2cc(Cl)ccc2I)CC1 ZINC000405486400 565587197 /nfs/dbraw/zinc/58/71/97/565587197.db2.gz YPWNYHYBGJDBMJ-UHFFFAOYSA-N 0 3 392.668 3.078 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)c1cc(Cl)ccc1I ZINC000219407328 565901694 /nfs/dbraw/zinc/90/16/94/565901694.db2.gz NGVVAJFBHSMWJX-NSHDSACASA-N 0 3 392.668 3.111 10 0 GGAEHN CN1CC[C@H](C[N@H+](C)Cc2cc(Br)c([O-])c(Br)c2)C1 ZINC000234323322 565935719 /nfs/dbraw/zinc/93/57/19/565935719.db2.gz HXVOWCCWBREOLL-JTQLQIEISA-N 0 3 392.135 3.301 10 0 GGAEHN CN1CC[C@H](C[N@@H+](C)Cc2cc(Br)c([O-])c(Br)c2)C1 ZINC000234323322 565935723 /nfs/dbraw/zinc/93/57/23/565935723.db2.gz HXVOWCCWBREOLL-JTQLQIEISA-N 0 3 392.135 3.301 10 0 GGAEHN CN1CC[C@@H](C[N@H+](C)Cc2cc(Br)c([O-])c(Br)c2)C1 ZINC000234350625 565934895 /nfs/dbraw/zinc/93/48/95/565934895.db2.gz HXVOWCCWBREOLL-SNVBAGLBSA-N 0 3 392.135 3.301 10 0 GGAEHN CN1CC[C@@H](C[N@@H+](C)Cc2cc(Br)c([O-])c(Br)c2)C1 ZINC000234350625 565934901 /nfs/dbraw/zinc/93/49/01/565934901.db2.gz HXVOWCCWBREOLL-SNVBAGLBSA-N 0 3 392.135 3.301 10 0 GGAEHN Cc1ccc(I)c(C(=O)N(C)C[C@H]2CCCN(C)C2)c1 ZINC000115432565 564193376 /nfs/dbraw/zinc/19/33/76/564193376.db2.gz ACYAZLMVDRNSGH-ZDUSSCGKSA-N 0 3 386.277 3.013 10 0 GGAEHN Cc1cc(Br)cc(Cl)c1C(=O)Nc1ccn(CCN(C)C)n1 ZINC000538658002 564196581 /nfs/dbraw/zinc/19/65/81/564196581.db2.gz ZXSLACIPRNPSIX-UHFFFAOYSA-N 0 3 385.693 3.421 10 0 GGAEHN Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N1CCO[C@@H](CN(C)C)C1 ZINC000116797219 564217021 /nfs/dbraw/zinc/21/70/21/564217021.db2.gz LMZALDAOWXVNBD-NSHDSACASA-N 0 3 385.942 3.236 10 0 GGAEHN CN(C)C[C@H]1CN(C(=O)C2(c3cccc(Br)c3)CCCC2)CCO1 ZINC000116791667 564217095 /nfs/dbraw/zinc/21/70/95/564217095.db2.gz BIQCAYLDCDRSRC-KRWDZBQOSA-N 0 3 395.341 3.050 10 0 GGAEHN CN(C)C[C@@H]1CN(C(=O)C2(c3ccc(Br)cc3)CCCC2)CCO1 ZINC000116797475 564217119 /nfs/dbraw/zinc/21/71/19/564217119.db2.gz OYVFKWOYIXLKOX-QGZVFWFLSA-N 0 3 395.341 3.050 10 0 GGAEHN CCOC(=O)CCCCCN1CCN(c2ccc(Br)cn2)CC1 ZINC000117872979 564234046 /nfs/dbraw/zinc/23/40/46/564234046.db2.gz XOEYCPCPIXAEIS-UHFFFAOYSA-N 0 3 384.318 3.090 10 0 GGAEHN Cc1c(I)cccc1C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1 ZINC000119132847 564256313 /nfs/dbraw/zinc/25/63/13/564256313.db2.gz YCIYQKUIGUQZRD-YPMHNXCESA-N 0 3 386.277 3.154 10 0 GGAEHN CCOc1c(Cl)cc(CNCCCSc2nnnn2C)cc1Cl ZINC000010475444 564258332 /nfs/dbraw/zinc/25/83/32/564258332.db2.gz WSXGMXAGPHNZOC-UHFFFAOYSA-N 0 3 376.313 3.188 10 0 GGAEHN C[C@H]1C[C@H](NCc2ccc(S(=O)(=O)N3CCOCC3)s2)CC(C)(C)C1 ZINC000119355225 564267060 /nfs/dbraw/zinc/26/70/60/564267060.db2.gz CCIXLWHWPWAQKO-GJZGRUSLSA-N 0 3 386.583 3.073 10 0 GGAEHN COc1ccc(C(=O)[C@@H]2CCCN(C3CSCCSC3)C2)cc1OC ZINC000013594044 564277000 /nfs/dbraw/zinc/27/70/00/564277000.db2.gz BILTUKQTNXCODY-OAHLLOKOSA-N 0 3 381.563 3.447 10 0 GGAEHN C[C@@H](CC(=O)Nc1cnn(CCN(C)C)c1)c1ccc(Br)cc1 ZINC000119572139 564277134 /nfs/dbraw/zinc/27/71/34/564277134.db2.gz NMIIFMVSNNDCGR-ZDUSSCGKSA-N 0 3 379.302 3.340 10 0 GGAEHN C[C@H](CC(=O)Nc1cnn(CCN(C)C)c1)c1ccc(Br)cc1 ZINC000119572257 564277332 /nfs/dbraw/zinc/27/73/32/564277332.db2.gz NMIIFMVSNNDCGR-CYBMUJFWSA-N 0 3 379.302 3.340 10 0 GGAEHN C[C@H](NCCOc1ccc(S(=O)(=O)N(C)C)cc1)c1cccc(Cl)c1 ZINC000119666798 564282096 /nfs/dbraw/zinc/28/20/96/564282096.db2.gz AGHAKKBPAMTPJK-AWEZNQCLSA-N 0 3 382.913 3.320 10 0 GGAEHN CC(C)N(CC(=O)N(C)Cc1ccccc1Br)C1CCOCC1 ZINC000119664714 564282151 /nfs/dbraw/zinc/28/21/51/564282151.db2.gz PAZINRHDXXYMBP-UHFFFAOYSA-N 0 3 383.330 3.297 10 0 GGAEHN C[C@@H](N[C@H]1CCN(c2ncccc2Cl)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000120029095 564300875 /nfs/dbraw/zinc/30/08/75/564300875.db2.gz PLYPKEUMIIJYLJ-HIFRSBDPSA-N 0 3 379.913 3.068 10 0 GGAEHN CN(C)CCN(Cc1ccco1)C(=O)NCc1cc(F)cc(Br)c1 ZINC000120028583 564301233 /nfs/dbraw/zinc/30/12/33/564301233.db2.gz WMHRYRDDSVYIAW-UHFFFAOYSA-N 0 3 398.276 3.455 10 0 GGAEHN Cc1ccc(I)c(C(=O)N(C)[C@@H]2CCN(C)C[C@@H]2C)c1 ZINC000120571620 564326981 /nfs/dbraw/zinc/32/69/81/564326981.db2.gz KDWYQASBGFCEIE-SWLSCSKDSA-N 0 3 386.277 3.012 10 0 GGAEHN CCCc1nc(CS(=O)(=O)C(C)C(=O)N[C@@H](C)c2ccccc2)cs1 ZINC000120630651 564329340 /nfs/dbraw/zinc/32/93/40/564329340.db2.gz ZQSMQAMOJRUFLL-UONOGXRCSA-N 0 3 380.535 3.276 10 0 GGAEHN CCCc1nc(CS(=O)(=O)C(C)C(=O)N[C@H](C)c2ccccc2)cs1 ZINC000120630883 564329469 /nfs/dbraw/zinc/32/94/69/564329469.db2.gz ZQSMQAMOJRUFLL-ZIAGYGMSSA-N 0 3 380.535 3.276 10 0 GGAEHN Cc1ccc(C(=O)N[C@H](Cc2ccccc2)CN(C)C)c(Br)n1 ZINC000121586882 564377061 /nfs/dbraw/zinc/37/70/61/564377061.db2.gz AALDSHODNQDSOO-OAHLLOKOSA-N 0 3 376.298 3.055 10 0 GGAEHN CC(C)C[C@@H](CNS(=O)(=O)c1ccccc1Br)N1CCCC1 ZINC000032916377 564407499 /nfs/dbraw/zinc/40/74/99/564407499.db2.gz URUWBTSTPGWREA-AWEZNQCLSA-N 0 3 389.359 3.238 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)COc2ccc(Br)cc2Cl)CCN1C ZINC000122835228 564428391 /nfs/dbraw/zinc/42/83/91/564428391.db2.gz PGINIWWQLYZYBW-DGCLKSJQSA-N 0 3 389.721 3.422 10 0 GGAEHN CN1CCN([C@H]2CCCCN(Cc3csc(-c4cccs4)n3)C2)CC1 ZINC000122817449 564428987 /nfs/dbraw/zinc/42/89/87/564428987.db2.gz UISPBBRWMDFZRV-KRWDZBQOSA-N 0 3 376.595 3.474 10 0 GGAEHN C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000123142429 564440025 /nfs/dbraw/zinc/44/00/25/564440025.db2.gz VXPKBQHUMKTQLA-DZGCQCFKSA-N 0 3 396.304 3.175 10 0 GGAEHN COc1c(Br)cc(Br)cc1CN[C@H](C)[C@@H](C)CO ZINC000123221584 564442236 /nfs/dbraw/zinc/44/22/36/564442236.db2.gz NVKAHMBBUDBCAR-DTWKUNHWSA-N 0 3 381.108 3.327 10 0 GGAEHN COc1c(Br)cc(Br)cc1CN[C@H](C)[C@H](C)CO ZINC000123221788 564442394 /nfs/dbraw/zinc/44/23/94/564442394.db2.gz NVKAHMBBUDBCAR-RKDXNWHRSA-N 0 3 381.108 3.327 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1OC ZINC000123377926 564446649 /nfs/dbraw/zinc/44/66/49/564446649.db2.gz MBDMBVRVLOKSRX-TZMCWYRMSA-N 0 3 399.329 3.411 10 0 GGAEHN CN1CCC(NC(=O)Nc2nnc(SCc3ccc(F)cc3)s2)CC1 ZINC000043378859 564457391 /nfs/dbraw/zinc/45/73/91/564457391.db2.gz OSGUBZFRFHCNLF-UHFFFAOYSA-N 0 3 381.502 3.185 10 0 GGAEHN COC1CCN(CCNC(=O)C[C@H](C)c2ccc(Br)cc2)CC1 ZINC000123764822 564461678 /nfs/dbraw/zinc/46/16/78/564461678.db2.gz ODNSSQMHHLJKJB-AWEZNQCLSA-N 0 3 383.330 3.170 10 0 GGAEHN Cc1ccc(OCCC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c(Br)c1 ZINC000124035868 564469353 /nfs/dbraw/zinc/46/93/53/564469353.db2.gz ADWNMSIMKMSOFH-HUUCEWRRSA-N 0 3 383.330 3.468 10 0 GGAEHN O=C(COc1cc(Br)ccc1Cl)NC1CCN(C2CC2)CC1 ZINC000124071126 564470553 /nfs/dbraw/zinc/47/05/53/564470553.db2.gz WPTTWALLUJNOBI-UHFFFAOYSA-N 0 3 387.705 3.224 10 0 GGAEHN C[C@@H](NC(C)(C)CNC(=O)c1cc(S(C)(=O)=O)cs1)c1ccccc1 ZINC000124843753 564495187 /nfs/dbraw/zinc/49/51/87/564495187.db2.gz FSKKKDMEGJPKRC-CYBMUJFWSA-N 0 3 380.535 3.011 10 0 GGAEHN CC(C(=O)NCc1cccs1)S(=O)(=O)Cc1csc(C(C)(C)C)n1 ZINC000046184224 564497913 /nfs/dbraw/zinc/49/79/13/564497913.db2.gz MZIRIHNNPQAIGZ-NSHDSACASA-N 0 3 386.564 3.122 10 0 GGAEHN CC(C(=O)NCC1CCCCC1)S(=O)(=O)Cc1csc(C(C)(C)C)n1 ZINC000046184849 564498168 /nfs/dbraw/zinc/49/81/68/564498168.db2.gz MSBCHECPOMAEKF-ZDUSSCGKSA-N 0 3 386.583 3.440 10 0 GGAEHN CN1CCN([C@H]2CCCCN(C(=O)Nc3ccccc3Br)C2)CC1 ZINC000124963557 564498859 /nfs/dbraw/zinc/49/88/59/564498859.db2.gz PBUJLMQKDRAIDF-HNNXBMFYSA-N 0 3 395.345 3.083 10 0 GGAEHN C[NH+](C)CC1CCC(NC(=O)NCc2ccc([O-])c(Br)c2)CC1 ZINC000125169022 564505852 /nfs/dbraw/zinc/50/58/52/564505852.db2.gz FNTHWAHKVSVSMV-UHFFFAOYSA-N 0 3 384.318 3.074 10 0 GGAEHN C[C@@H]1[C@@H](c2ccc(Br)cc2)OCCN1C(=O)NC[C@@H]1CCCN1C ZINC000125284162 564509128 /nfs/dbraw/zinc/50/91/28/564509128.db2.gz UFBKKNGRAJTMHS-COXVUDFISA-N 0 3 396.329 3.015 10 0 GGAEHN CN(C)C[C@@H](NC(=O)[C@H]1COc2ccc(Br)cc21)c1ccccc1 ZINC000125388424 564513085 /nfs/dbraw/zinc/51/30/85/564513085.db2.gz CICYRVGQZUGFIE-DLBZAZTESA-N 0 3 389.293 3.344 10 0 GGAEHN C[NH+](C)CCOc1ccccc1C(=O)Nc1ccc(Br)cc1[O-] ZINC000126008270 564534061 /nfs/dbraw/zinc/53/40/61/564534061.db2.gz JTCHVGWHGZSKEV-UHFFFAOYSA-N 0 3 379.254 3.347 10 0 GGAEHN CN1CCC[C@H](NC(=O)Nc2ccc(I)cc2Cl)C1 ZINC000048770500 564545811 /nfs/dbraw/zinc/54/58/11/564545811.db2.gz OQIQXACWTYHAFZ-JTQLQIEISA-N 0 3 393.656 3.160 10 0 GGAEHN C[C@H](NC(=O)NC[C@@H](O)CN1CCCCC1)c1cc(F)c(Cl)cc1Cl ZINC000049174913 564549729 /nfs/dbraw/zinc/54/97/29/564549729.db2.gz KCTINWCDQZHHDT-NWDGAFQWSA-N 0 3 392.302 3.340 10 0 GGAEHN O=C(C(=O)N1CC[C@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(Br)cc1 ZINC000126754252 564560905 /nfs/dbraw/zinc/56/09/05/564560905.db2.gz BKHXIKPEGXIPBY-YOEHRIQHSA-N 0 3 391.309 3.107 10 0 GGAEHN CCN1CCC(NC(=O)[C@H](Oc2ccc(Br)cc2)C(C)C)CC1 ZINC000051283388 564562983 /nfs/dbraw/zinc/56/29/83/564562983.db2.gz FDHWTFXRSIEWHD-QGZVFWFLSA-N 0 3 383.330 3.453 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)CSCc1ccc(Br)cc1F ZINC000051383514 564564131 /nfs/dbraw/zinc/56/41/31/564564131.db2.gz MEFBYXZVIQOYAS-ZDUSSCGKSA-N 0 3 375.307 3.032 10 0 GGAEHN Cc1c(I)cccc1C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C ZINC000127359641 564582022 /nfs/dbraw/zinc/58/20/22/564582022.db2.gz HLXIUKPSFSSZJH-XHDPSFHLSA-N 0 3 386.277 3.058 10 0 GGAEHN CCN1CCC[C@H]1CNC(=S)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000053537738 564590092 /nfs/dbraw/zinc/59/00/92/564590092.db2.gz YAULMRJFSSUCQG-DZGCQCFKSA-N 0 3 398.370 3.221 10 0 GGAEHN NS(=O)(=O)c1ccc(CCN[C@@H]2CCCOc3ccc(Cl)cc32)cc1 ZINC000127974409 564602751 /nfs/dbraw/zinc/60/27/51/564602751.db2.gz HQLGGMMRPXSFQL-QGZVFWFLSA-N 0 3 380.897 3.033 10 0 GGAEHN CC(C(=O)NCc1ccccc1)S(=O)(=O)Cc1nc(C(C)(C)C)cs1 ZINC000127962214 564602826 /nfs/dbraw/zinc/60/28/26/564602826.db2.gz SZIKAEFCQQXDHY-CYBMUJFWSA-N 0 3 380.535 3.060 10 0 GGAEHN CC(C)COC1CCN(C[C@@H](O)COc2ccc(Br)cc2)CC1 ZINC000054325164 564603654 /nfs/dbraw/zinc/60/36/54/564603654.db2.gz NOLNAPXHZAIZQW-MRXNPFEDSA-N 0 3 386.330 3.326 10 0 GGAEHN CC(C(=O)NC1CCC(C)CC1)S(=O)(=O)Cc1nc(C(C)(C)C)cs1 ZINC000128026715 564604585 /nfs/dbraw/zinc/60/45/85/564604585.db2.gz YLNSDPJUKAFXBY-ROKHWSDSSA-N 0 3 386.583 3.439 10 0 GGAEHN CN(C)C[C@H]1CN(Cc2csc(COc3ccc(Cl)cc3)n2)CCO1 ZINC000128087618 564606326 /nfs/dbraw/zinc/60/63/26/564606326.db2.gz UEOCZSQNACWYKC-KRWDZBQOSA-N 0 3 381.929 3.138 10 0 GGAEHN O=C(NCCN1CCCCC1)N[C@H]1CCOc2ccc(Br)cc21 ZINC000054816663 564610303 /nfs/dbraw/zinc/61/03/03/564610303.db2.gz ZBIJLWUQGVVIEM-HNNXBMFYSA-N 0 3 382.302 3.058 10 0 GGAEHN Brc1ccc2c(c1)C=C(CN1CCC[C@H](Cn3cncn3)C1)CO2 ZINC000128532978 564621172 /nfs/dbraw/zinc/62/11/72/564621172.db2.gz BOYMGLFZPSZYPR-AWEZNQCLSA-N 0 3 389.297 3.229 10 0 GGAEHN O=C(CN[C@@H]1CCCC[C@H]1n1cccn1)Nc1ccccc1Br ZINC000129119469 564638539 /nfs/dbraw/zinc/63/85/39/564638539.db2.gz LATXKGVYBKMDRM-HZPDHXFCSA-N 0 3 377.286 3.358 10 0 GGAEHN O=C(CN1CCCSCC1)NC[C@H](c1ccccc1Cl)N1CCCC1 ZINC000129274170 564643248 /nfs/dbraw/zinc/64/32/48/564643248.db2.gz HEICOELSRBPLIS-GOSISDBHSA-N 0 3 381.973 3.032 10 0 GGAEHN CCOc1c(Br)cc(CNCC[C@H](C)[S@@](C)=O)cc1OC ZINC000129434277 564648489 /nfs/dbraw/zinc/64/84/89/564648489.db2.gz ASDSJBXOKZWSDB-MQJDWESPSA-N 0 3 378.332 3.103 10 0 GGAEHN O=C(NCc1cc(F)cc(Br)c1)N1CCN(c2ccncc2)CC1 ZINC000056484072 564650080 /nfs/dbraw/zinc/65/00/80/564650080.db2.gz UKJYSYZNOPAMBA-UHFFFAOYSA-N 0 3 393.260 3.015 10 0 GGAEHN CCOC(=O)CC1CCN(C[C@@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000130376892 564679362 /nfs/dbraw/zinc/67/93/62/564679362.db2.gz GMZWWBRVFMHVED-CQSZACIVSA-N 0 3 390.307 3.398 10 0 GGAEHN Brc1ccccc1-c1nnc(CN2CCCN(C3CC3)CC2)o1 ZINC000061041357 564704050 /nfs/dbraw/zinc/70/40/50/564704050.db2.gz HQAMQMQKJPYNCQ-UHFFFAOYSA-N 0 3 377.286 3.169 10 0 GGAEHN CN(Cc1ccc(Br)cc1)C[C@H](O)COc1ccc2c(c1)OCO2 ZINC000063482361 564717517 /nfs/dbraw/zinc/71/75/17/564717517.db2.gz XGUDMMHIAVCXAO-HNNXBMFYSA-N 0 3 394.265 3.050 10 0 GGAEHN CC(C)c1csc([C@H]2CCCN(C[C@@H]3CCCN(S(C)(=O)=O)C3)C2)n1 ZINC000131944974 564729275 /nfs/dbraw/zinc/72/92/75/564729275.db2.gz WNVVYLREUXWOSO-HOTGVXAUSA-N 0 3 385.599 3.118 10 0 GGAEHN OC[C@]1(NC[C@@H](O)COc2c(Cl)cccc2Cl)CCc2ccccc21 ZINC000132316819 564739271 /nfs/dbraw/zinc/73/92/71/564739271.db2.gz YGCDLOKNQIPRLO-AUUYWEPGSA-N 0 3 382.287 3.157 10 0 GGAEHN CN1CCC(NC(=O)CSCc2ccc(Br)cc2F)CC1 ZINC000065308489 564743227 /nfs/dbraw/zinc/74/32/27/564743227.db2.gz ZUKNXLFPFFAOKH-UHFFFAOYSA-N 0 3 375.307 3.032 10 0 GGAEHN C[C@H]1CN(CCCCNC(=O)Nc2cccc(Br)c2)C[C@H](C)O1 ZINC000132645469 564749166 /nfs/dbraw/zinc/74/91/66/564749166.db2.gz FXEMLSFKQQUKPV-KBPBESRZSA-N 0 3 384.318 3.460 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)NCCOc1ccc(Br)cc1 ZINC000065983895 564753843 /nfs/dbraw/zinc/75/38/43/564753843.db2.gz ZRVJDBVNCZYGNY-AWEZNQCLSA-N 0 3 384.318 3.002 10 0 GGAEHN O=C(N[C@@H]1CCOc2ccc(Br)cc21)N1CC[C@@H](N2CCCC2)C1 ZINC000066188034 564757137 /nfs/dbraw/zinc/75/71/37/564757137.db2.gz DNIFRZGNBXBTQF-GDBMZVCRSA-N 0 3 394.313 3.152 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)N1CC[C@H](N2CCCC2)C1 ZINC000066186695 564757154 /nfs/dbraw/zinc/75/71/54/564757154.db2.gz AQDYXCOZOLYORX-YOEHRIQHSA-N 0 3 380.330 3.260 10 0 GGAEHN C[C@H]1CN(C2CCN(CC(=O)Nc3cccc(Cl)c3Cl)CC2)CCO1 ZINC000066562161 564768981 /nfs/dbraw/zinc/76/89/81/564768981.db2.gz LRSGXEHXKIXNPE-ZDUSSCGKSA-N 0 3 386.323 3.117 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNCC[C@H](C)[S@@](C)=O ZINC000133436075 564774214 /nfs/dbraw/zinc/77/42/14/564774214.db2.gz AHRXUAJKRLVDRA-MYODQAERSA-N 0 3 398.370 3.498 10 0 GGAEHN COc1c(Br)cc(Br)cc1CN[C@H]1CCO[C@@H]1C ZINC000134244300 564797526 /nfs/dbraw/zinc/79/75/26/564797526.db2.gz BMHDJVZIYHDEGN-PELKAZGASA-N 0 3 379.092 3.487 10 0 GGAEHN C[C@H](NC[C@H](O)c1ccc(Cl)cc1Cl)c1ccc(S(N)(=O)=O)cc1 ZINC000134284755 564799228 /nfs/dbraw/zinc/79/92/28/564799228.db2.gz SNKKGGSSBVMTLZ-QFYYESIMSA-N 0 3 389.304 3.025 10 0 GGAEHN C[C@@H](NC[C@H](O)c1ccc(Cl)cc1Cl)c1ccc(S(N)(=O)=O)cc1 ZINC000134284770 564799296 /nfs/dbraw/zinc/79/92/96/564799296.db2.gz SNKKGGSSBVMTLZ-HWPZZCPQSA-N 0 3 389.304 3.025 10 0 GGAEHN O[C@@H](COC[C@H]1CCCO1)CN1CCC(Sc2ccc(Cl)cc2)CC1 ZINC000134855014 564817177 /nfs/dbraw/zinc/81/71/77/564817177.db2.gz WVEMGUMYQMHSBR-IAGOWNOFSA-N 0 3 385.957 3.453 10 0 GGAEHN COCCN1CC[C@H](CNC(=O)Nc2ccc(SC(F)(F)F)cc2)C1 ZINC000068545127 564821461 /nfs/dbraw/zinc/82/14/61/564821461.db2.gz KVJJWSOQINDKJK-GFCCVEGCSA-N 0 3 377.432 3.388 10 0 GGAEHN CN(C[C@H](O)COc1c(Cl)cccc1Cl)[C@@H]1CCCc2c1cnn2C ZINC000135589945 564836621 /nfs/dbraw/zinc/83/66/21/564836621.db2.gz ABNBLMGETLKHJH-BLLLJJGKSA-N 0 3 384.307 3.476 10 0 GGAEHN CN1CCC(Oc2ccc(NC(=O)c3ccc(Br)o3)cn2)CC1 ZINC000071564909 564856925 /nfs/dbraw/zinc/85/69/25/564856925.db2.gz CGTCSIADXKYXDJ-UHFFFAOYSA-N 0 3 380.242 3.162 10 0 GGAEHN CCN1CCCC[C@H]1CNC(=O)c1cc(C)ccc1I ZINC000078917285 564864713 /nfs/dbraw/zinc/86/47/13/564864713.db2.gz AMVPACUYTPGJNP-ZDUSSCGKSA-N 0 3 386.277 3.204 10 0 GGAEHN CCN1CCCC[C@@H]1CNC(=O)c1cc(C)ccc1I ZINC000078917283 564864729 /nfs/dbraw/zinc/86/47/29/564864729.db2.gz AMVPACUYTPGJNP-CYBMUJFWSA-N 0 3 386.277 3.204 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN[C@@H]1CCCN(C)C1 ZINC000139858797 564870325 /nfs/dbraw/zinc/87/03/25/564870325.db2.gz FXBAHHJQTKFFJL-MRXNPFEDSA-N 0 3 377.330 3.435 10 0 GGAEHN NC(=O)c1c(F)cc(Br)cc1N1CCN(C2CCCCC2)CC1 ZINC000091743316 564871583 /nfs/dbraw/zinc/87/15/83/564871583.db2.gz COYPEWTWRZGSKT-UHFFFAOYSA-N 0 3 384.293 3.142 10 0 GGAEHN CC[C@@H]1CCCCN1CCNC(=O)N[C@@H](CO)c1cccc(Br)c1 ZINC000141417195 564873283 /nfs/dbraw/zinc/87/32/83/564873283.db2.gz DJAJCEARBZMTCF-SJORKVTESA-N 0 3 398.345 3.046 10 0 GGAEHN CC[C@H]1CCCCN1CCNC(=O)N[C@@H](CO)c1cccc(Br)c1 ZINC000141417373 564873440 /nfs/dbraw/zinc/87/34/40/564873440.db2.gz DJAJCEARBZMTCF-IRXDYDNUSA-N 0 3 398.345 3.046 10 0 GGAEHN CN(C)CCn1cc(NCc2ccc(OC(F)F)c(Br)c2)cn1 ZINC000092564858 564878285 /nfs/dbraw/zinc/87/82/85/564878285.db2.gz RCKRYBIMQQUKSK-UHFFFAOYSA-N 0 3 389.244 3.421 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CCCC[C@H]1CC(N)=O ZINC000092588370 564878658 /nfs/dbraw/zinc/87/86/58/564878658.db2.gz GTFMCFKEWAWTIR-KRWDZBQOSA-N 0 3 391.313 3.173 10 0 GGAEHN CN(C)[C@H](CNc1cc(Br)cc(F)c1C(N)=O)c1ccccc1 ZINC000092826730 564882145 /nfs/dbraw/zinc/88/21/45/564882145.db2.gz QNJQGCGIJUVVKG-OAHLLOKOSA-N 0 3 380.261 3.402 10 0 GGAEHN CN(C)[C@@H](CNc1cc(Br)cc(F)c1C(N)=O)c1cccs1 ZINC000092826925 564882564 /nfs/dbraw/zinc/88/25/64/564882564.db2.gz VKMXOSMJRIUOOG-LBPRGKRZSA-N 0 3 386.290 3.463 10 0 GGAEHN CN(C)[C@@H](CNc1cc(Br)cc(F)c1C(N)=O)c1ccccc1 ZINC000092826729 564882596 /nfs/dbraw/zinc/88/25/96/564882596.db2.gz QNJQGCGIJUVVKG-HNNXBMFYSA-N 0 3 380.261 3.402 10 0 GGAEHN CN(Cc1ccc(-n2cncn2)cc1)[C@@H](CO)c1cccc(Br)c1 ZINC000093815631 564890575 /nfs/dbraw/zinc/89/05/75/564890575.db2.gz GFHATDWNJSFUPX-SFHVURJKSA-N 0 3 387.281 3.195 10 0 GGAEHN CC(C)N1C[C@@H](C)[C@@H](NC(=O)C(=O)Nc2cc(Cl)c(Cl)cc2Cl)C1 ZINC000150785313 564891418 /nfs/dbraw/zinc/89/14/18/564891418.db2.gz QNBMFZQRNKVRIG-OTYXRUKQSA-N 0 3 392.714 3.430 10 0 GGAEHN CC[C@@H](N[C@@H]1CCN(C2CCOCC2)C1=O)c1ccc(Br)cc1 ZINC000150981397 564899742 /nfs/dbraw/zinc/89/97/42/564899742.db2.gz MDKSXTYGVXYXBM-IAGOWNOFSA-N 0 3 381.314 3.270 10 0 GGAEHN CCCC(=O)N[C@H]1CCCN(CCC(=O)Nc2ccccc2Br)C1 ZINC000101563574 564917704 /nfs/dbraw/zinc/91/77/04/564917704.db2.gz PQGRVVAPTHPMFV-AWEZNQCLSA-N 0 3 396.329 3.158 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CCC[C@H](N3CCCC3)C2)c1 ZINC000101688196 564920765 /nfs/dbraw/zinc/92/07/65/564920765.db2.gz QRHLRPZKMWKCJN-AWEZNQCLSA-N 0 3 398.288 3.300 10 0 GGAEHN CN(C)CCn1cc(NC(=O)N2CCc3c(Cl)cc(Cl)cc3C2)cn1 ZINC000151464779 564921502 /nfs/dbraw/zinc/92/15/02/564921502.db2.gz FMSVFNXUXXREEQ-UHFFFAOYSA-N 0 3 382.295 3.342 10 0 GGAEHN CCCN1CCC[C@H]1C(=O)NCCC(=O)Nc1ccc(Br)cc1C ZINC000101881919 564923335 /nfs/dbraw/zinc/92/33/35/564923335.db2.gz CPSIQFDVAFCACR-INIZCTEOSA-N 0 3 396.329 3.077 10 0 GGAEHN COc1cc(Cl)c(S(=O)(=O)[N-]C2CCC(C[NH+](C)C)CC2)cc1Cl ZINC000151726393 564934315 /nfs/dbraw/zinc/93/43/15/564934315.db2.gz UBMTZQUTROQRPD-UHFFFAOYSA-N 0 3 395.352 3.401 10 0 GGAEHN Cc1cc(S(=O)(=O)[N-]C2CCC(C[NH+](C)C)CC2)sc1Br ZINC000151759221 564935961 /nfs/dbraw/zinc/93/59/61/564935961.db2.gz IBTDJAGPZNDDFG-UHFFFAOYSA-N 0 3 395.388 3.218 10 0 GGAEHN Cc1cc(C(=O)N(CCN(C)C)C(C)C)nn1-c1ccc(Br)cc1 ZINC000152019307 564944263 /nfs/dbraw/zinc/94/42/63/564944263.db2.gz MSYUKYKUQROJKD-UHFFFAOYSA-N 0 3 393.329 3.355 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000152046249 564945013 /nfs/dbraw/zinc/94/50/13/564945013.db2.gz LJPBEYVKMMZTPC-KRWDZBQOSA-N 0 3 391.309 3.419 10 0 GGAEHN O=C(CCN1CC[C@H](Oc2cccnc2)C1)Nc1cccc(Br)c1 ZINC000152511051 564962674 /nfs/dbraw/zinc/96/26/74/564962674.db2.gz KEEYPKNKNQSIPU-KRWDZBQOSA-N 0 3 390.281 3.326 10 0 GGAEHN Cc1nc(CS(=O)(=O)C(C)C(=O)N[C@H](C)c2ccc(Cl)cc2)cs1 ZINC000105523175 564967872 /nfs/dbraw/zinc/96/78/72/564967872.db2.gz DKZCLUIZTGIZNJ-GHMZBOCLSA-N 0 3 386.926 3.286 10 0 GGAEHN CC(C)c1cc(Br)ccc1NC(=O)NCC1CCN(CCO)CC1 ZINC000152841528 564974146 /nfs/dbraw/zinc/97/41/46/564974146.db2.gz AIMXVUHLPIHXMY-UHFFFAOYSA-N 0 3 398.345 3.398 10 0 GGAEHN CC[C@H]1CN(CCC(=O)Nc2c(Cl)cccc2Cl)CCN1C[C@@H](C)O ZINC000106102753 564977936 /nfs/dbraw/zinc/97/79/36/564977936.db2.gz SYDREPRJGHLYFJ-KGLIPLIRSA-N 0 3 388.339 3.099 10 0 GGAEHN CC[C@@H]1CN(CCC(=O)Nc2c(Cl)cccc2Cl)CCN1CCOC ZINC000106114524 564977948 /nfs/dbraw/zinc/97/79/48/564977948.db2.gz KJCXHKWRFRHIEB-CQSZACIVSA-N 0 3 388.339 3.365 10 0 GGAEHN CC[C@H]1CN(CCC(=O)Nc2cc(Cl)ccc2Cl)CCN1CCOC ZINC000106114532 564978077 /nfs/dbraw/zinc/97/80/77/564978077.db2.gz ZXKHHGJOXVAPEE-HNNXBMFYSA-N 0 3 388.339 3.365 10 0 GGAEHN O[C@@H](COc1ccc(Cl)cc1Cl)CN1CCC(Cn2cccn2)CC1 ZINC000106182429 564980147 /nfs/dbraw/zinc/98/01/47/564980147.db2.gz MEMBZFSKANQKSE-MRXNPFEDSA-N 0 3 384.307 3.342 10 0 GGAEHN COCCCN(C)CCNC(=O)N[C@H](c1ccc(Cl)cc1)C(F)(F)F ZINC000153461524 564995983 /nfs/dbraw/zinc/99/59/83/564995983.db2.gz XRTOPFGPJGZVKM-CQSZACIVSA-N 0 3 381.826 3.211 10 0 GGAEHN C[C@@H](Oc1ccc(F)cc1Br)C(=O)NCCN1CCCC[C@@H]1C ZINC000107628624 565000414 /nfs/dbraw/zinc/00/04/14/565000414.db2.gz CHMGZRWXUDBWFG-QWHCGFSZSA-N 0 3 387.293 3.346 10 0 GGAEHN O=S(=O)(c1ccccc1C(F)(F)F)N1CCCC[C@@H](N2CCCC2)C1 ZINC000107708011 565002350 /nfs/dbraw/zinc/00/23/50/565002350.db2.gz UKNDCYCNMYKOIR-CQSZACIVSA-N 0 3 376.444 3.344 10 0 GGAEHN CCc1nc(CNC(=O)NC[C@H]2CCCN(Cc3cccs3)C2)cs1 ZINC000107741763 565002486 /nfs/dbraw/zinc/00/24/86/565002486.db2.gz OJCCAKQXFJVHMR-CQSZACIVSA-N 0 3 378.567 3.478 10 0 GGAEHN O=C(CSCc1cc(-c2cccs2)on1)N[C@H]1CCN(CC2CC2)C1 ZINC000108302686 565009926 /nfs/dbraw/zinc/00/99/26/565009926.db2.gz COTIMVZEDKSYHU-AWEZNQCLSA-N 0 3 377.535 3.237 10 0 GGAEHN NC(=O)C[C@@H]1CCCCN1Cc1ccnc(-c2ccc(Br)cc2)n1 ZINC000153985222 565020480 /nfs/dbraw/zinc/02/04/80/565020480.db2.gz YZOHADAPABYFQA-INIZCTEOSA-N 0 3 389.297 3.136 10 0 GGAEHN CCn1cc(Br)cc1C(=O)N[C@@H](Cc1ccccc1)CN(C)C ZINC000110227120 565037549 /nfs/dbraw/zinc/03/75/49/565037549.db2.gz DCLXKASSKDMLBM-INIZCTEOSA-N 0 3 378.314 3.173 10 0 GGAEHN CCCN1CCC(CNS(=O)(=O)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000110244235 565037572 /nfs/dbraw/zinc/03/75/72/565037572.db2.gz FPSMRKSUFCXXTL-UHFFFAOYSA-N 0 3 378.460 3.247 10 0 GGAEHN CCn1cc(Br)cc1C(=O)N[C@H](Cc1ccccc1)CN(C)C ZINC000110227121 565037684 /nfs/dbraw/zinc/03/76/84/565037684.db2.gz DCLXKASSKDMLBM-MRXNPFEDSA-N 0 3 378.314 3.173 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)[C@H]1CCCN1c1nccs1)c1ccsc1 ZINC000110629049 565043080 /nfs/dbraw/zinc/04/30/80/565043080.db2.gz QBVFMUJBZGXXSA-CVEARBPZSA-N 0 3 378.567 3.373 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N1CCC[C@@H](N(C)C)C1 ZINC000110788712 565045947 /nfs/dbraw/zinc/04/59/47/565045947.db2.gz ISFULQWGZISARR-CQSZACIVSA-N 0 3 378.314 3.265 10 0 GGAEHN O=C(CCN1CC[C@@H](Oc2cccnc2)C1)Nc1ccccc1Br ZINC000154659722 565048195 /nfs/dbraw/zinc/04/81/95/565048195.db2.gz NWQSKDQINIYOSL-OAHLLOKOSA-N 0 3 390.281 3.326 10 0 GGAEHN Brc1cccc(OCCN2CCCC[C@@H]2CN2CCOCC2)c1 ZINC000111302254 565051651 /nfs/dbraw/zinc/05/16/51/565051651.db2.gz FURPMSGKTCZISD-QGZVFWFLSA-N 0 3 383.330 3.015 10 0 GGAEHN O=C1[C@H](NC2(c3ccc(Cl)cc3)CCOCC2)CCN1CC(F)(F)F ZINC000111232207 565052342 /nfs/dbraw/zinc/05/23/42/565052342.db2.gz LQPGCZBAXMIJQF-CQSZACIVSA-N 0 3 376.806 3.099 10 0 GGAEHN O=C(NC[C@@H](O)CN1CCCCC1)Nc1ccc(C(F)(F)F)cc1Cl ZINC000111768026 565057533 /nfs/dbraw/zinc/05/75/33/565057533.db2.gz QZPXVWJVRQTOQO-GFCCVEGCSA-N 0 3 379.810 3.327 10 0 GGAEHN CC(C)C[C@H](CN(C)C)NC(=O)c1csc(I)c1 ZINC000113426427 565069860 /nfs/dbraw/zinc/06/98/60/565069860.db2.gz ACBJUDMRVURXNT-LLVKDONJSA-N 0 3 380.295 3.059 10 0 GGAEHN COCCN1CCC[C@H]1CNCc1nc(-c2ccc(Br)cc2)c[nH]1 ZINC000112373719 565063390 /nfs/dbraw/zinc/06/33/90/565063390.db2.gz KRYVATMBKNINPD-INIZCTEOSA-N 0 3 393.329 3.040 10 0 GGAEHN Brc1ccc(-c2c[nH]c(CNCCCCN3CCOCC3)n2)cc1 ZINC000112372009 565063617 /nfs/dbraw/zinc/06/36/17/565063617.db2.gz UXLQPNSWVPXMIT-UHFFFAOYSA-N 0 3 393.329 3.041 10 0 GGAEHN COCCCN1CCC(NC(=O)c2c[nH]c3cccc(Br)c23)CC1 ZINC000155434085 565067419 /nfs/dbraw/zinc/06/74/19/565067419.db2.gz HZLFZCSJGKHKKK-UHFFFAOYSA-N 0 3 394.313 3.161 10 0 GGAEHN CCOC(=O)[C@@H]1CCCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000155534218 565068680 /nfs/dbraw/zinc/06/86/80/565068680.db2.gz NRZXTYYBDZDQFM-CHWSQXEVSA-N 0 3 376.280 3.008 10 0 GGAEHN CC(C)(C)CNC(=O)C(C)(C)NC[C@@H](O)COc1c(Cl)cccc1Cl ZINC000155564383 565069190 /nfs/dbraw/zinc/06/91/90/565069190.db2.gz BPZAHUBSLRIRKO-GFCCVEGCSA-N 0 3 391.339 3.264 10 0 GGAEHN Cc1ccc([O-])c(C[NH2+]CCC(=O)Nc2cc(Br)ccc2C)n1 ZINC000113353740 565069427 /nfs/dbraw/zinc/06/94/27/565069427.db2.gz AMKWTWGJPYVCCG-UHFFFAOYSA-N 0 3 378.270 3.285 10 0 GGAEHN Cc1sc2ncnc(SCC(=O)N[C@@H]3CN(C(C)C)C[C@@H]3C)c2c1C ZINC000155624442 565070015 /nfs/dbraw/zinc/07/00/15/565070015.db2.gz RVJFBDKGOSWQJS-SMDDNHRTSA-N 0 3 378.567 3.245 10 0 GGAEHN COCCN1CCC(NC(=O)N[C@@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000113604647 565070591 /nfs/dbraw/zinc/07/05/91/565070591.db2.gz WKBZMBVMEJQBKD-MRXNPFEDSA-N 0 3 386.323 3.391 10 0 GGAEHN CN(C[C@@H]1CCN(C)C1)C(=O)c1ccc(Br)cc1Br ZINC000156051457 565074507 /nfs/dbraw/zinc/07/45/07/565074507.db2.gz PMZYXSSXRLNKPC-SNVBAGLBSA-N 0 3 390.119 3.235 10 0 GGAEHN CN(C)Cc1ccc(N2CCN(C(=O)c3cc(Cl)sc3Cl)CC2)nc1 ZINC000114415027 565074161 /nfs/dbraw/zinc/07/41/61/565074161.db2.gz HXMYZHBXSAWVEY-UHFFFAOYSA-N 0 3 399.347 3.474 10 0 GGAEHN C[C@H]1CN2CCC[C@@H]2CN1Cc1nc(-c2ccc(Br)s2)no1 ZINC000114481340 565074624 /nfs/dbraw/zinc/07/46/24/565074624.db2.gz CKEGYXGSNHRKAD-WDEREUQCSA-N 0 3 383.315 3.229 10 0 GGAEHN Cc1ccc(I)cc1C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000156316162 565080501 /nfs/dbraw/zinc/08/05/01/565080501.db2.gz DRDSIWUDAYPYTL-TZMCWYRMSA-N 0 3 386.277 3.154 10 0 GGAEHN C[C@@H](NCCCN(C)CC(F)(F)F)c1ccc(-n2cncn2)cc1Cl ZINC000156393912 565084009 /nfs/dbraw/zinc/08/40/09/565084009.db2.gz UAZUSDDOGIKOSP-GFCCVEGCSA-N 0 3 375.826 3.456 10 0 GGAEHN O=C(NCCc1nc2cc(Cl)ccc2s1)N1CC[C@H](N2CC=CC2)C1 ZINC000266669787 565088047 /nfs/dbraw/zinc/08/80/47/565088047.db2.gz NCQCBPRYCURNLZ-AWEZNQCLSA-N 0 3 376.913 3.148 10 0 GGAEHN CCC(CC)NC(=O)C(C)S(=O)(=O)Cc1sc(C)nc1C(F)(F)F ZINC000183709126 565090094 /nfs/dbraw/zinc/09/00/94/565090094.db2.gz FKYOETZGUZEBDA-MRVPVSSYSA-N 0 3 386.461 3.078 10 0 GGAEHN CCC[C@H](C)NC(=O)C(C)S(=O)(=O)Cc1sc(C)nc1C(F)(F)F ZINC000183711687 565090158 /nfs/dbraw/zinc/09/01/58/565090158.db2.gz OYYFEKRRWBICME-IUCAKERBSA-N 0 3 386.461 3.078 10 0 GGAEHN COc1ccc(Br)c(CC(=O)N[C@H](CN(C)C)c2ccccc2)c1 ZINC000156519720 565092475 /nfs/dbraw/zinc/09/24/75/565092475.db2.gz SQOQXINNFOUTNH-GOSISDBHSA-N 0 3 391.309 3.419 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)N[C@H]2CCOc3ccc(Br)cc32)CCN1C ZINC000266833206 565092899 /nfs/dbraw/zinc/09/28/99/565092899.db2.gz ZQFQRFNXAUQALZ-INWMFGNUSA-N 0 3 396.329 3.397 10 0 GGAEHN CC(C)OCCN1CCC(NC(=O)c2csc(Br)c2)CC1 ZINC000266996620 565100286 /nfs/dbraw/zinc/10/02/86/565100286.db2.gz MELZSFSZGQNPIG-UHFFFAOYSA-N 0 3 375.332 3.130 10 0 GGAEHN Cc1ccc(C)c(OC[C@@H](O)CN[C@H](CO)c2cccc(Br)c2)c1 ZINC000183886054 565101799 /nfs/dbraw/zinc/10/17/99/565101799.db2.gz AJRLHQHTNRKVMZ-ZWKOTPCHSA-N 0 3 394.309 3.129 10 0 GGAEHN O=C1[C@@H](NC2CC(c3cccc(Br)c3)C2)CCN1C1CCOCC1 ZINC000369732775 565110188 /nfs/dbraw/zinc/11/01/88/565110188.db2.gz QXFSXQLJIXILEN-PVARCSIZSA-N 0 3 393.325 3.065 10 0 GGAEHN Brc1cccc(-c2nc(CNCCCn3ccnn3)cs2)c1 ZINC000184248195 565122509 /nfs/dbraw/zinc/12/25/09/565122509.db2.gz COXXVFOSISJWFZ-UHFFFAOYSA-N 0 3 378.299 3.344 10 0 GGAEHN C[C@](O)(CN1CCC(c2ncc[nH]2)CC1)c1ccc(Br)cc1F ZINC000292670919 565128226 /nfs/dbraw/zinc/12/82/26/565128226.db2.gz BDVVXFYGWVOBHM-KRWDZBQOSA-N 0 3 382.277 3.398 10 0 GGAEHN Cc1noc([C@H]2CCCN(C[C@@](C)(O)c3ccc(Br)cc3F)C2)n1 ZINC000292689009 565129238 /nfs/dbraw/zinc/12/92/38/565129238.db2.gz AHZYSMZYMYNEFF-YVEFUNNKSA-N 0 3 398.276 3.367 10 0 GGAEHN C[C@H](CCN1CCN(C)CC1)NC(=O)C[C@@H](C)c1ccc(Br)cc1 ZINC000184334373 565129698 /nfs/dbraw/zinc/12/96/98/565129698.db2.gz TVVGOIPYBLVXEK-HZPDHXFCSA-N 0 3 396.373 3.085 10 0 GGAEHN C[C@@H](NC[C@H]1CCCN(S(C)(=O)=O)C1)c1nc(-c2ccccc2)cs1 ZINC000184517017 565140429 /nfs/dbraw/zinc/14/04/29/565140429.db2.gz FCWDNGKPKXGFRP-HUUCEWRRSA-N 0 3 379.551 3.132 10 0 GGAEHN CCN1CCN(C(=O)CC2CCN(CCC(Cl)(Cl)Cl)CC2)CC1 ZINC000184541674 565142425 /nfs/dbraw/zinc/14/24/25/565142425.db2.gz YVVJWYKQKWVUSF-UHFFFAOYSA-N 0 3 384.779 3.013 10 0 GGAEHN Cc1cnc(CCN(C)C[C@@H](O)COc2ccc(Br)cc2)s1 ZINC000157839106 565145478 /nfs/dbraw/zinc/14/54/78/565145478.db2.gz PHKYFPSKQHGSBA-CQSZACIVSA-N 0 3 385.327 3.128 10 0 GGAEHN COC(=O)Cc1csc(NC(=O)CN[C@@H](CC(C)C)c2cccs2)n1 ZINC000158081052 565155582 /nfs/dbraw/zinc/15/55/82/565155582.db2.gz MEHQFNXJMPBQKW-ZDUSSCGKSA-N 0 3 381.523 3.236 10 0 GGAEHN COC(=O)Cc1csc(NC(=O)CN[C@H](CC(C)C)c2cccs2)n1 ZINC000158081212 565156279 /nfs/dbraw/zinc/15/62/79/565156279.db2.gz MEHQFNXJMPBQKW-CYBMUJFWSA-N 0 3 381.523 3.236 10 0 GGAEHN COc1ccc(-c2nc(C)c([C@@H](C)NC[C@H](C)CS(C)(=O)=O)s2)cc1 ZINC000184787737 565156685 /nfs/dbraw/zinc/15/66/85/565156685.db2.gz CUTQRPOEHYPAPO-QWHCGFSZSA-N 0 3 382.551 3.458 10 0 GGAEHN CNC(=O)C1CCC(N[C@H](C)c2ccccc2I)CC1 ZINC000268868435 565170660 /nfs/dbraw/zinc/17/06/60/565170660.db2.gz CSQDXINMANEDJU-PNESKVBLSA-N 0 3 386.277 3.247 10 0 GGAEHN C[C@H](CCN1CCN(C)CC1)NC(=O)N[C@H]1CCCc2sc(Cl)cc21 ZINC000293596972 565175991 /nfs/dbraw/zinc/17/59/91/565175991.db2.gz ZLZRPRDKQMSRKK-HIFRSBDPSA-N 0 3 384.977 3.104 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)c2csc(-c3ccc(Br)s3)n2)C1 ZINC000158675337 565178018 /nfs/dbraw/zinc/17/80/18/565178018.db2.gz OVEFZMSHUQRGNC-VIFPVBQESA-N 0 3 386.340 3.410 10 0 GGAEHN Cc1ccc(CN2CCCC2)cc1NC(=O)c1cc(S(C)(=O)=O)cs1 ZINC000158767472 565181451 /nfs/dbraw/zinc/18/14/51/565181451.db2.gz FDEFYJWDLMGOBM-UHFFFAOYSA-N 0 3 378.519 3.308 10 0 GGAEHN C[C@](O)(CN1CCC[C@@H](c2ncc[nH]2)C1)c1ccc(Br)cc1F ZINC000293836402 565185873 /nfs/dbraw/zinc/18/58/73/565185873.db2.gz QECSLLIXUWWOFC-PXAZEXFGSA-N 0 3 382.277 3.398 10 0 GGAEHN CN1CCC2(CCCN2C(=O)NCc2cc(F)cc(Br)c2)CC1 ZINC000371403914 565191124 /nfs/dbraw/zinc/19/11/24/565191124.db2.gz DWBBKVOCQMBQQV-UHFFFAOYSA-N 0 3 384.293 3.358 10 0 GGAEHN CCN(CCc1nccs1)C[C@H](O)COc1ccc(Br)cc1 ZINC000159307060 565201460 /nfs/dbraw/zinc/20/14/60/565201460.db2.gz RDMONVNRHZPWJY-AWEZNQCLSA-N 0 3 385.327 3.210 10 0 GGAEHN C[C@H](NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1)c1cn[nH]c1 ZINC000270222387 565212618 /nfs/dbraw/zinc/21/26/18/565212618.db2.gz HLKMGDZRFUZZMY-ZDUSSCGKSA-N 0 3 394.317 3.007 10 0 GGAEHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000371911880 565215886 /nfs/dbraw/zinc/21/58/86/565215886.db2.gz PXMIXERIZBDMGU-UHOFOFEASA-N 0 3 396.329 3.254 10 0 GGAEHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000371911878 565215996 /nfs/dbraw/zinc/21/59/96/565215996.db2.gz PXMIXERIZBDMGU-DAXOMENPSA-N 0 3 396.329 3.254 10 0 GGAEHN C[C@H](NCc1cc(Br)cc(Br)c1N)[C@@H]1CCCO1 ZINC000185776343 565220749 /nfs/dbraw/zinc/22/07/49/565220749.db2.gz LPYVAKVJMKDZRK-UFBFGSQYSA-N 0 3 378.108 3.451 10 0 GGAEHN C[C@H]1CN(CCCCNC(=O)Cc2cscc2Br)C[C@H](C)O1 ZINC000294856343 565231736 /nfs/dbraw/zinc/23/17/36/565231736.db2.gz GIQPJSMISUQIPY-STQMWFEESA-N 0 3 389.359 3.059 10 0 GGAEHN CCN(CCN[C@@H](c1ccc(Br)cc1)c1cncnc1)C1CC1 ZINC000186162353 565243336 /nfs/dbraw/zinc/24/33/36/565243336.db2.gz JZQROALXJCGHRM-SFHVURJKSA-N 0 3 375.314 3.402 10 0 GGAEHN C[C@@H](CN[C@H](c1ccc(Br)cc1)c1cncnc1)N(C)C1CC1 ZINC000186177671 565244668 /nfs/dbraw/zinc/24/46/68/565244668.db2.gz YLGDXGHEVCIOCK-SCLBCKFNSA-N 0 3 375.314 3.401 10 0 GGAEHN Brc1ccc([C@@H](NCCCO[C@@H]2CCOC2)c2cncnc2)cc1 ZINC000186246030 565250017 /nfs/dbraw/zinc/25/00/17/565250017.db2.gz CRFKYXMHURKUPV-QZTJIDSGSA-N 0 3 392.297 3.114 10 0 GGAEHN CN(C[C@@H]1CCN(C)C1)C(=O)c1cc(Br)ccc1Br ZINC000160550021 565250425 /nfs/dbraw/zinc/25/04/25/565250425.db2.gz VULBTCHIMXKOPN-SNVBAGLBSA-N 0 3 390.119 3.235 10 0 GGAEHN CCO[C@@H]1C[C@@H](NCc2cc3c(c(Br)c2)OCO3)C12CCOCC2 ZINC000186277966 565251282 /nfs/dbraw/zinc/25/12/82/565251282.db2.gz MEEJCMSOKJZWKI-HZPDHXFCSA-N 0 3 398.297 3.242 10 0 GGAEHN CCOC(=O)c1nn(C)cc1CN[C@H](C)Cc1ccc(Br)cc1 ZINC000186310248 565254596 /nfs/dbraw/zinc/25/45/96/565254596.db2.gz BRMFKBWWGLBMHX-GFCCVEGCSA-N 0 3 380.286 3.080 10 0 GGAEHN CS(=O)(=O)[C@@H]1CCC[C@H](N[C@H]2CCOc3c(Br)cccc32)C1 ZINC000271496363 565255897 /nfs/dbraw/zinc/25/58/97/565255897.db2.gz MLADHOVTYVKFHK-ZOWXZIJZSA-N 0 3 388.327 3.218 10 0 GGAEHN CCOC(=O)c1nn(C)cc1CNCCCc1ccc(Br)cc1F ZINC000186352476 565257562 /nfs/dbraw/zinc/25/75/62/565257562.db2.gz CNBVJUAUAHEJJO-UHFFFAOYSA-N 0 3 398.276 3.221 10 0 GGAEHN CCOC(=O)c1nn(C)cc1CN[C@H](C)Cc1ccccc1Br ZINC000186381354 565258615 /nfs/dbraw/zinc/25/86/15/565258615.db2.gz DFLRWLCGCMMXFQ-GFCCVEGCSA-N 0 3 380.286 3.080 10 0 GGAEHN COc1nc(C)c(Br)cc1C(=O)N1CCCC[C@@H](N2CCCC2)C1 ZINC000186472008 565261758 /nfs/dbraw/zinc/26/17/58/565261758.db2.gz RJYWMLQSCOWUHA-CQSZACIVSA-N 0 3 396.329 3.252 10 0 GGAEHN COc1c(Br)cc(CNC(C)(C)[C@H](C)O)cc1Br ZINC000161149870 565275459 /nfs/dbraw/zinc/27/54/59/565275459.db2.gz DWVPHPPAESIULU-QMMMGPOBSA-N 0 3 381.108 3.469 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N(C)[C@@H](C)C1CCN(C)CC1 ZINC000272243510 565282117 /nfs/dbraw/zinc/28/21/17/565282117.db2.gz XXKKEHJSABBOAA-ZDUSSCGKSA-N 0 3 383.330 3.189 10 0 GGAEHN Cc1[nH]c(=S)sc1CC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000373484280 565287299 /nfs/dbraw/zinc/28/72/99/565287299.db2.gz XFHONSBIOIYZGD-UHFFFAOYSA-N 0 3 393.500 3.204 10 0 GGAEHN CCC[C@H](C(=O)NCC1(c2cccc(Br)c2)CCOCC1)N(C)C ZINC000161682289 565289921 /nfs/dbraw/zinc/28/99/21/565289921.db2.gz ILMGAFCSTJLGCM-QGZVFWFLSA-N 0 3 397.357 3.344 10 0 GGAEHN O[C@@H](COc1c(Cl)cccc1Cl)CN1CCSC2(CCOCC2)C1 ZINC000186848899 565290089 /nfs/dbraw/zinc/29/00/89/565290089.db2.gz NGXBHGIFNNUICJ-CYBMUJFWSA-N 0 3 392.348 3.331 10 0 GGAEHN CS(=O)(=O)CCCCCN[C@@H]1CCCOc2ccc(Br)cc21 ZINC000186866724 565291372 /nfs/dbraw/zinc/29/13/72/565291372.db2.gz SWNHKGVOYHGDLO-OAHLLOKOSA-N 0 3 390.343 3.467 10 0 GGAEHN CNC(=O)[C@@H](C)Oc1ccc(Br)cc1CNCCCC(C)(F)F ZINC000295968135 565296218 /nfs/dbraw/zinc/29/62/18/565296218.db2.gz IHELZDFULSUTIF-LLVKDONJSA-N 0 3 393.272 3.487 10 0 GGAEHN NC(=O)C[C@H](NCc1nc2cc(Br)ccc2[nH]1)C1CCCCC1 ZINC000161924103 565297850 /nfs/dbraw/zinc/29/78/50/565297850.db2.gz MGVNVUFSQUFAAJ-AWEZNQCLSA-N 0 3 379.302 3.239 10 0 GGAEHN NC(=O)C[C@H](NCc1nc2ccc(Br)cc2[nH]1)C1CCCCC1 ZINC000161924103 565297853 /nfs/dbraw/zinc/29/78/53/565297853.db2.gz MGVNVUFSQUFAAJ-AWEZNQCLSA-N 0 3 379.302 3.239 10 0 GGAEHN CCN1CCN(CCCNC(=O)C[C@H](C)c2ccc(Br)cc2)CC1 ZINC000162068728 565303854 /nfs/dbraw/zinc/30/38/54/565303854.db2.gz XYVJJXXDPYNULY-INIZCTEOSA-N 0 3 396.373 3.087 10 0 GGAEHN C[C@H]1CCSCCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000373842452 565305856 /nfs/dbraw/zinc/30/58/56/565305856.db2.gz QUGDUUDOLVYJBH-GRTSSRMGSA-N 0 3 379.492 3.329 10 0 GGAEHN NC(=O)[C@@H](NCCc1c[nH]c2ccc(F)cc12)c1cccc(Br)c1 ZINC000162134140 565306481 /nfs/dbraw/zinc/30/64/81/565306481.db2.gz KEGPFYPBSALYEH-KRWDZBQOSA-N 0 3 390.256 3.428 10 0 GGAEHN NC(=O)[C@@H](N[C@@H]1CCOC2(CCCCC2)C1)c1cccc(Br)c1 ZINC000162285791 565310886 /nfs/dbraw/zinc/31/08/86/565310886.db2.gz QKRSNEBWDSJAQX-CVEARBPZSA-N 0 3 381.314 3.447 10 0 GGAEHN NC(=O)[C@H](N[C@@H]1CCOC2(CCCCC2)C1)c1cccc(Br)c1 ZINC000162285924 565311048 /nfs/dbraw/zinc/31/10/48/565311048.db2.gz QKRSNEBWDSJAQX-HZPDHXFCSA-N 0 3 381.314 3.447 10 0 GGAEHN NC(=O)[C@@H](N[C@H]1CCOC2(CCCCC2)C1)c1cccc(Br)c1 ZINC000162286038 565311240 /nfs/dbraw/zinc/31/12/40/565311240.db2.gz QKRSNEBWDSJAQX-HOTGVXAUSA-N 0 3 381.314 3.447 10 0 GGAEHN CN1CCC(CC(=O)Nc2nccn2Cc2ccc(Br)cc2)CC1 ZINC000273246202 565314414 /nfs/dbraw/zinc/31/44/14/565314414.db2.gz QYHXRTBFDZHMFM-UHFFFAOYSA-N 0 3 391.313 3.364 10 0 GGAEHN Cc1ccc(OC[C@@H](O)CN2CCC(n3cc(Br)cn3)CC2)cc1 ZINC000374010287 565315466 /nfs/dbraw/zinc/31/54/66/565315466.db2.gz NUCYOFGQTBJRKM-KRWDZBQOSA-N 0 3 394.313 3.031 10 0 GGAEHN C[C@H](C1CCN(C)CC1)N(C)C(=O)NCc1cc(F)cc(Br)c1 ZINC000273482835 565322843 /nfs/dbraw/zinc/32/28/43/565322843.db2.gz QSURODAHWBSWBC-GFCCVEGCSA-N 0 3 386.309 3.460 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(C)cc(Br)c2)[C@H](C)C1 ZINC000187337438 565324331 /nfs/dbraw/zinc/32/43/31/565324331.db2.gz HIAGHSKINUYQMN-CZUORRHYSA-N 0 3 389.359 3.108 10 0 GGAEHN Cc1ccc(S(=O)(=O)C[C@H](C)N[C@@H]2CCOC3(CCSCC3)C2)cc1 ZINC000273539672 565325182 /nfs/dbraw/zinc/32/51/82/565325182.db2.gz YCVSZTSQXSPXRQ-DLBZAZTESA-N 0 3 383.579 3.192 10 0 GGAEHN CCS(=O)(=O)CCCCCN[C@H]1CCOc2c(Br)cccc21 ZINC000374300329 565331669 /nfs/dbraw/zinc/33/16/69/565331669.db2.gz CYMIDSXQRXXQFW-HNNXBMFYSA-N 0 3 390.343 3.467 10 0 GGAEHN O=C(N[C@H]1CCOc2c(Br)cccc21)N1CC[C@H](N2CCCC2)C1 ZINC000374392358 565336752 /nfs/dbraw/zinc/33/67/52/565336752.db2.gz AESJAHVVIAPJBO-BBRMVZONSA-N 0 3 394.313 3.152 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1cc(Br)c(C)cc1C ZINC000187564720 565341704 /nfs/dbraw/zinc/34/17/04/565341704.db2.gz FEZKVHNGKZOSDD-CQSZACIVSA-N 0 3 384.318 3.298 10 0 GGAEHN COc1cc(Br)ccc1CNC[C@@H]1CCC2(CCOCC2)[C@H]1O ZINC000374724127 565352976 /nfs/dbraw/zinc/35/29/76/565352976.db2.gz UEOKMMAZDVWIFS-YOEHRIQHSA-N 0 3 384.314 3.115 10 0 GGAEHN CS(=O)(=O)C1(CN[C@H]2CCc3c2ccc(F)c3Br)CCC1 ZINC000297065504 565353922 /nfs/dbraw/zinc/35/39/22/565353922.db2.gz ZFEGROWJAPBMSR-ZDUSSCGKSA-N 0 3 376.291 3.132 10 0 GGAEHN O=C(N[C@H](c1nccs1)C(F)(F)F)N1CCN(C2CCCCC2)CC1 ZINC000297085994 565354897 /nfs/dbraw/zinc/35/48/97/565354897.db2.gz VHKHZBSKMNODDY-CYBMUJFWSA-N 0 3 376.448 3.406 10 0 GGAEHN C[C@H](CO)[C@H](C)NCC(=O)N1N=C(c2cccs2)C[C@H]1c1cccs1 ZINC000274104636 565357434 /nfs/dbraw/zinc/35/74/34/565357434.db2.gz VCVTWRFKIKNTRO-IPYPFGDCSA-N 0 3 377.535 3.094 10 0 GGAEHN CC(C)N1C[C@H](NC(=O)Nc2ccccc2I)[C@@H](C)C1 ZINC000164264842 565358022 /nfs/dbraw/zinc/35/80/22/565358022.db2.gz BXGKTKXJUKKMFF-FZMZJTMJSA-N 0 3 387.265 3.141 10 0 GGAEHN CN(C)CCN(Cc1ccco1)C(=O)N[C@H](c1nccs1)C(F)(F)F ZINC000297142044 565358176 /nfs/dbraw/zinc/35/81/76/565358176.db2.gz ZLDXVPMURNCIMS-GFCCVEGCSA-N 0 3 376.404 3.113 10 0 GGAEHN O=C1C[C@H]([C@H]2CCCCN2Cc2ccc(Br)c3cccnc23)CN1 ZINC000374894854 565359619 /nfs/dbraw/zinc/35/96/19/565359619.db2.gz LTBXZSHDMYBWET-WMLDXEAASA-N 0 3 388.309 3.488 10 0 GGAEHN CC(C)N1CCC[C@@H](NC(=O)c2c(F)cccc2I)C1 ZINC000274442966 565370949 /nfs/dbraw/zinc/37/09/49/565370949.db2.gz HRUKOWHEYJUKPZ-LLVKDONJSA-N 0 3 390.240 3.033 10 0 GGAEHN COCc1nc2n(n1)CCC[C@@H]2N[C@H](C)Cc1ccc(Br)cc1 ZINC000188248768 565391194 /nfs/dbraw/zinc/39/11/94/565391194.db2.gz OIYRTSWQKJAHJT-DOMZBBRYSA-N 0 3 379.302 3.243 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)NCC2(c3cccc(Br)c3)CCC2)C1 ZINC000170833156 565394100 /nfs/dbraw/zinc/39/41/00/565394100.db2.gz RCTQYXCBDARYTF-MRXNPFEDSA-N 0 3 380.330 3.216 10 0 GGAEHN Cc1csc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1I ZINC000188321833 565394578 /nfs/dbraw/zinc/39/45/78/565394578.db2.gz RWVGXHOVADWOBP-ONGXEEELSA-N 0 3 392.306 3.120 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)NCC2(c3ccc(Br)cc3)CCC2)C1 ZINC000170833154 565394977 /nfs/dbraw/zinc/39/49/77/565394977.db2.gz ANFAZDUUWYBTLQ-INIZCTEOSA-N 0 3 380.330 3.216 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)c2ccc(COc3ccc(Br)cc3)o2)C1 ZINC000170865472 565395556 /nfs/dbraw/zinc/39/55/56/565395556.db2.gz VRLYGIWDCUIRSU-CQSZACIVSA-N 0 3 393.281 3.397 10 0 GGAEHN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1CC[C@H](N(C)C)C1 ZINC000170857553 565395573 /nfs/dbraw/zinc/39/55/73/565395573.db2.gz YTWTWMGXYVVFNY-AWEZNQCLSA-N 0 3 379.913 3.460 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)C1 ZINC000170862747 565395608 /nfs/dbraw/zinc/39/56/08/565395608.db2.gz NTNXJSQJILHWCR-ZDUSSCGKSA-N 0 3 377.897 3.430 10 0 GGAEHN CSc1ccc([C@H](CNC(=O)NCCCc2nccs2)N(C)C)cc1 ZINC000298013165 565396255 /nfs/dbraw/zinc/39/62/55/565396255.db2.gz PBCHZRWOYHXMLO-INIZCTEOSA-N 0 3 378.567 3.400 10 0 GGAEHN CC(C)[C@H](C)NC(=O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000170913587 565398499 /nfs/dbraw/zinc/39/84/99/565398499.db2.gz QVWOGXSZJHXWEY-AWEZNQCLSA-N 0 3 383.330 3.205 10 0 GGAEHN Cc1nc(CS(=O)(=O)C(C)C(=O)N(Cc2ccccc2)C(C)C)cs1 ZINC000170925922 565399664 /nfs/dbraw/zinc/39/96/64/565399664.db2.gz XKZNJDNRSYATAH-AWEZNQCLSA-N 0 3 380.535 3.192 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)Nc2ccc(I)cc2Cl)C1 ZINC000171075056 565407557 /nfs/dbraw/zinc/40/75/57/565407557.db2.gz NIAMFENJFCWPOH-SNVBAGLBSA-N 0 3 393.656 3.112 10 0 GGAEHN O=C(CCc1nc2cc(Br)ccc2s1)N1CCN2CCC1CC2 ZINC000188608804 565412529 /nfs/dbraw/zinc/41/25/29/565412529.db2.gz ARGYRZJRPBWSDT-UHFFFAOYSA-N 0 3 394.338 3.298 10 0 GGAEHN Cc1ccc(I)c(C(=O)NCc2ccc3c(c2)CNC3)c1 ZINC000188685344 565416353 /nfs/dbraw/zinc/41/63/53/565416353.db2.gz KACNKCPGJQCMKQ-UHFFFAOYSA-N 0 3 392.240 3.133 10 0 GGAEHN Brc1ccc(N2CC[C@H](CNCc3cn4cccnc4n3)C2)cc1 ZINC000298532749 565419567 /nfs/dbraw/zinc/41/95/67/565419567.db2.gz SGNXGWZHIDIVPY-CQSZACIVSA-N 0 3 386.297 3.108 10 0 GGAEHN COC(=O)[C@@H](C)CN(C[C@H](O)COc1c(Cl)cccc1Cl)C1CC1 ZINC000171300296 565425447 /nfs/dbraw/zinc/42/54/47/565425447.db2.gz CVLJGVPGYPZZAL-AAEUAGOBSA-N 0 3 376.280 3.007 10 0 GGAEHN C[C@H]1CSCCN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C1 ZINC000376232286 565427274 /nfs/dbraw/zinc/42/72/74/565427274.db2.gz MQWXGOHUTFSAHG-LRVUVFPRSA-N 0 3 379.492 3.186 10 0 GGAEHN Cn1cc([C@H]2CCCN2CCC(=O)Nc2ccc(Br)cc2F)cn1 ZINC000171412514 565430583 /nfs/dbraw/zinc/43/05/83/565430583.db2.gz MRUNYNRIRWIWHF-MRXNPFEDSA-N 0 3 395.276 3.487 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2cccc(Br)c2OC)n1 ZINC000276067627 565434927 /nfs/dbraw/zinc/43/49/27/565434927.db2.gz CSFKQNBNCWIQLB-UHFFFAOYSA-N 0 3 399.310 3.423 10 0 GGAEHN COc1cc(C[NH2+][C@@H](CO)Cc2cccc(C)c2)cc(Br)c1[O-] ZINC000189026691 565438436 /nfs/dbraw/zinc/43/84/36/565438436.db2.gz AMODHGSDGPBJNU-OAHLLOKOSA-N 0 3 380.282 3.165 10 0 GGAEHN O[C@@H](CN[C@H](c1cccc(Br)c1)C1CCOCC1)C(F)(F)F ZINC000276176991 565439146 /nfs/dbraw/zinc/43/91/46/565439146.db2.gz UHSDGSLCYYRZBP-KBPBESRZSA-N 0 3 382.220 3.430 10 0 GGAEHN CN(C)Cc1cccc(CNC(=O)c2[nH]nc3ccc(Br)cc32)c1 ZINC000171953556 565458785 /nfs/dbraw/zinc/45/87/85/565458785.db2.gz MYANDSVXTKXPTL-UHFFFAOYSA-N 0 3 387.281 3.317 10 0 GGAEHN O=C(C[C@H]1CSCCS1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000376973629 565461773 /nfs/dbraw/zinc/46/17/73/565461773.db2.gz XJXMRRFIDIIVHH-RUXDESIVSA-N 0 3 382.517 3.147 10 0 GGAEHN Brc1ccc(-c2noc(CN3CCCN(C4CC4)CC3)n2)s1 ZINC000172053319 565463734 /nfs/dbraw/zinc/46/37/34/565463734.db2.gz PSCLFALNMIPDIU-UHFFFAOYSA-N 0 3 383.315 3.231 10 0 GGAEHN O=S(=O)(c1cc(F)ccc1N1CCC(N2CCCC2)CC1)C(F)(F)F ZINC000301195806 565472073 /nfs/dbraw/zinc/47/20/73/565472073.db2.gz UHQMZPKGAOOOMV-UHFFFAOYSA-N 0 3 380.407 3.184 10 0 GGAEHN O=C(c1cc(Br)sc1Br)N1CCN2CCC[C@@H]2C1 ZINC000172291281 565476693 /nfs/dbraw/zinc/47/66/93/565476693.db2.gz AHUASYHRTAYKHU-MRVPVSSYSA-N 0 3 394.132 3.193 10 0 GGAEHN Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)N1CCO[C@@H](CN(C)C)C1 ZINC000172305053 565477031 /nfs/dbraw/zinc/47/70/31/565477031.db2.gz YCKNJGVJHYBRLW-HNNXBMFYSA-N 0 3 379.913 3.175 10 0 GGAEHN CN(C)CCOc1cc(CNC(=O)c2c(Cl)cc(F)cc2Cl)ccn1 ZINC000277227729 565483439 /nfs/dbraw/zinc/48/34/39/565483439.db2.gz AELLYUIPNZIYPP-UHFFFAOYSA-N 0 3 386.254 3.398 10 0 GGAEHN CCN(CC)C(=O)[C@@H]1CCCN1CCC(=O)Nc1cccc(Br)c1 ZINC000172418971 565484995 /nfs/dbraw/zinc/48/49/95/565484995.db2.gz YNPAAQUIWNOZGX-INIZCTEOSA-N 0 3 396.329 3.111 10 0 GGAEHN C[C@@H]1COCC[C@@H]1NCc1coc(-c2ccc(I)cc2)n1 ZINC000277302075 565488085 /nfs/dbraw/zinc/48/80/85/565488085.db2.gz CLPJAIHTPJMHJJ-ABAIWWIYSA-N 0 3 398.244 3.461 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(CC(F)(F)F)cc2)[C@H](C)C1 ZINC000190007434 565501559 /nfs/dbraw/zinc/50/15/59/565501559.db2.gz RRRBGXFLTXJICJ-CJNGLKHVSA-N 0 3 378.460 3.142 10 0 GGAEHN C[C@@H]1C[C@H](N(C)c2ncnc3ccc(I)cc32)CCN1C ZINC000172765325 565503706 /nfs/dbraw/zinc/50/37/06/565503706.db2.gz BHBNHBRJHABPEW-DGCLKSJQSA-N 0 3 396.276 3.153 10 0 GGAEHN Cc1nc2ccc(Br)cc2c(N2C[C@H]3OCCN(C)[C@H]3C2)c1C ZINC000301687358 565504206 /nfs/dbraw/zinc/50/42/06/565504206.db2.gz XHUVYFQNNIASBI-DLBZAZTESA-N 0 3 376.298 3.133 10 0 GGAEHN CN(C)CCN1CCC(Nc2ccc3cccc(Br)c3n2)CC1 ZINC000301691315 565504496 /nfs/dbraw/zinc/50/44/96/565504496.db2.gz NTHFLVVKGXCXAN-UHFFFAOYSA-N 0 3 377.330 3.435 10 0 GGAEHN CCN1CCc2c(cccc2Nc2ncnc3c2c(Br)nn3C)C1 ZINC000301718277 565507147 /nfs/dbraw/zinc/50/71/47/565507147.db2.gz YTFLLKPMVVBYBM-UHFFFAOYSA-N 0 3 387.285 3.247 10 0 GGAEHN CN(C)CCOc1ccc(CNC(=O)[C@H]2SCCc3sccc32)cc1 ZINC000173031205 565521081 /nfs/dbraw/zinc/52/10/81/565521081.db2.gz FXERLCYDQZXOHM-SFHVURJKSA-N 0 3 376.547 3.335 10 0 GGAEHN C[C@@H](CN(C)Cc1ccccc1)Nc1ncnc2c1c(Br)nn2C ZINC000302047532 565526906 /nfs/dbraw/zinc/52/69/06/565526906.db2.gz YWDIPKUJSNLFJU-LBPRGKRZSA-N 0 3 389.301 3.058 10 0 GGAEHN O=C(CCc1nc2cc(Br)ccc2s1)N1CCN2CCC[C@H]2C1 ZINC000173098207 565526926 /nfs/dbraw/zinc/52/69/26/565526926.db2.gz WJMIPSCEMHENMT-ZDUSSCGKSA-N 0 3 394.338 3.298 10 0 GGAEHN Cc1csc(C(=O)N[C@H](CC(C)C)CN(C)C)c1I ZINC000190381171 565527711 /nfs/dbraw/zinc/52/77/11/565527711.db2.gz VDSRAMLYSUXFDA-LLVKDONJSA-N 0 3 394.322 3.367 10 0 GGAEHN CO[C@@H]1CC[C@@H](NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)C1 ZINC000190393101 565528642 /nfs/dbraw/zinc/52/86/42/565528642.db2.gz MPJXEYUQUFRTRI-IAGOWNOFSA-N 0 3 398.345 3.090 10 0 GGAEHN COC[C@@H](O)CN1CCC(Nc2nc(-c3ccccc3Cl)cs2)CC1 ZINC000302116045 565531252 /nfs/dbraw/zinc/53/12/52/565531252.db2.gz CAEWDMMCVAPJBU-AWEZNQCLSA-N 0 3 381.929 3.347 10 0 GGAEHN O=C(CN[C@@H](c1ccccc1)[C@@H]1CCOC1)Nc1ccc(Br)cn1 ZINC000378504949 565531449 /nfs/dbraw/zinc/53/14/49/565531449.db2.gz CLAGEHJUOVYCKL-KDOFPFPSSA-N 0 3 390.281 3.150 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NCCC(=O)Nc1cc(C)on1 ZINC000190433753 565532089 /nfs/dbraw/zinc/53/20/89/565532089.db2.gz FVZNBIMYSKZFRI-LLVKDONJSA-N 0 3 382.258 3.434 10 0 GGAEHN CCc1nn(C)c(Cl)c1CN1CC[C@H](CN(C)Cc2scnc2C)C1 ZINC000190464338 565534830 /nfs/dbraw/zinc/53/48/30/565534830.db2.gz KUHLJJPOVOWBPB-CQSZACIVSA-N 0 3 381.977 3.355 10 0 GGAEHN CCN(CC)CC(=O)N1CCC[C@@H]1c1ccc(I)cc1 ZINC000173182362 565535338 /nfs/dbraw/zinc/53/53/38/565535338.db2.gz IFCSLCPJDCQSBQ-OAHLLOKOSA-N 0 3 386.277 3.297 10 0 GGAEHN CN(Cc1cccnc1)C[C@@H]1CCN(Cc2cncc(Br)c2)C1 ZINC000190481162 565535473 /nfs/dbraw/zinc/53/54/73/565535473.db2.gz SYSXFCCYXMOKDP-INIZCTEOSA-N 0 3 375.314 3.193 10 0 GGAEHN Cc1nc(CC(=O)N2CC[C@@H](CN(C)Cc3scnc3C)C2)c(C)s1 ZINC000190549443 565541367 /nfs/dbraw/zinc/54/13/67/565541367.db2.gz PWKGUOBGONNMAV-HNNXBMFYSA-N 0 3 378.567 3.048 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(OC(F)F)c(Cl)c2)[C@H](C)C1 ZINC000173260587 565541651 /nfs/dbraw/zinc/54/16/51/565541651.db2.gz AVVVHIFLXUBLJO-BXUZGUMPSA-N 0 3 396.887 3.292 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(Br)ccc2C)[C@H](C)C1 ZINC000173256770 565541857 /nfs/dbraw/zinc/54/18/57/565541857.db2.gz KEFUTZDGXIOKFV-HIFRSBDPSA-N 0 3 389.359 3.108 10 0 GGAEHN Cc1nc2ccc(Br)cc2c(N2CCN(CCO)[C@H](C)C2)c1C ZINC000302443736 565542444 /nfs/dbraw/zinc/54/24/44/565542444.db2.gz QZKYJRQRSOJKGY-GFCCVEGCSA-N 0 3 378.314 3.117 10 0 GGAEHN COC[C@](C)(O)CN[C@H](C)c1ccc(Br)cc1Br ZINC000382575241 565542751 /nfs/dbraw/zinc/54/27/51/565542751.db2.gz VJFXVJWQHIKIKZ-NOZJJQNGSA-N 0 3 381.108 3.260 10 0 GGAEHN CSc1cc(C(=O)N2CC[C@H](CN(C)Cc3scnc3C)C2)ccn1 ZINC000190568962 565542772 /nfs/dbraw/zinc/54/27/72/565542772.db2.gz ONNASJPWGAOATE-CQSZACIVSA-N 0 3 376.551 3.163 10 0 GGAEHN CN(Cc1cccnc1)C[C@H]1CCN(C(=O)c2cc(Br)cs2)C1 ZINC000190579009 565543699 /nfs/dbraw/zinc/54/36/99/565543699.db2.gz JDRBFZFCFHJYNV-CQSZACIVSA-N 0 3 394.338 3.500 10 0 GGAEHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)c2cc(Br)cs2)C1 ZINC000190578987 565543794 /nfs/dbraw/zinc/54/37/94/565543794.db2.gz JDRBFZFCFHJYNV-AWEZNQCLSA-N 0 3 394.338 3.500 10 0 GGAEHN CN1CCN([C@@H]2CCCCN(C(=O)Cc3ccc(Cl)cc3Cl)C2)CC1 ZINC000173288795 565544739 /nfs/dbraw/zinc/54/47/39/565544739.db2.gz BNCFLZPIONFRCT-QGZVFWFLSA-N 0 3 384.351 3.164 10 0 GGAEHN COCCCN1CCC(NC(=O)C2(c3ccccc3Br)CC2)CC1 ZINC000190604255 565545358 /nfs/dbraw/zinc/54/53/58/565545358.db2.gz WPOUVLGSZGEYEN-UHFFFAOYSA-N 0 3 395.341 3.098 10 0 GGAEHN CCN1CCN(C[C@H](C)CNC(=O)NCc2ccc(Cl)cc2Cl)CC1 ZINC000173304065 565545962 /nfs/dbraw/zinc/54/59/62/565545962.db2.gz YAUZIUBVUROFKD-CQSZACIVSA-N 0 3 387.355 3.066 10 0 GGAEHN CN(Cc1cccnc1)C[C@H]1CCN(C(=O)c2ccc(Br)o2)C1 ZINC000190611476 565546317 /nfs/dbraw/zinc/54/63/17/565546317.db2.gz CXJMLGQJURMUMZ-CQSZACIVSA-N 0 3 378.270 3.031 10 0 GGAEHN O=S(=O)([N-][C@H]1CC[N@@H+]2CCCC[C@@H]12)c1c(Cl)cccc1Br ZINC000385913426 565546821 /nfs/dbraw/zinc/54/68/21/565546821.db2.gz HUYUCAXKQWYJDF-STQMWFEESA-N 0 3 393.734 3.008 10 0 GGAEHN O=S(=O)([N-][C@H]1CC[N@H+]2CCCC[C@@H]12)c1c(Cl)cccc1Br ZINC000385913426 565546823 /nfs/dbraw/zinc/54/68/23/565546823.db2.gz HUYUCAXKQWYJDF-STQMWFEESA-N 0 3 393.734 3.008 10 0 GGAEHN CN(Cc1cccnc1)C[C@H]1CCN(C(=O)c2sccc2Br)C1 ZINC000190664433 565550437 /nfs/dbraw/zinc/55/04/37/565550437.db2.gz SAGCHSPEWABUKS-CQSZACIVSA-N 0 3 394.338 3.500 10 0 GGAEHN CN(Cc1cccnc1)C[C@H]1CCN(C(=O)c2occc2Br)C1 ZINC000190669464 565550920 /nfs/dbraw/zinc/55/09/20/565550920.db2.gz VAYRSJXCOOHMIZ-CQSZACIVSA-N 0 3 378.270 3.031 10 0 GGAEHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)NCc2ccc(Cl)s2)C1 ZINC000190695714 565552480 /nfs/dbraw/zinc/55/24/80/565552480.db2.gz KNTJRPZUZZSSHT-HNNXBMFYSA-N 0 3 378.929 3.460 10 0 GGAEHN CCc1n[nH]c(C2CCN(CCOc3ccccc3Br)CC2)n1 ZINC000190699191 565552678 /nfs/dbraw/zinc/55/26/78/565552678.db2.gz VWFXXVRXJHMEAU-UHFFFAOYSA-N 0 3 379.302 3.388 10 0 GGAEHN CCc1nc(C2CCN(CCOc3ccccc3Br)CC2)n[nH]1 ZINC000190699191 565552681 /nfs/dbraw/zinc/55/26/81/565552681.db2.gz VWFXXVRXJHMEAU-UHFFFAOYSA-N 0 3 379.302 3.388 10 0 GGAEHN CCc1nnc(C2CCN(CCOc3ccccc3Br)CC2)[nH]1 ZINC000190699191 565552685 /nfs/dbraw/zinc/55/26/85/565552685.db2.gz VWFXXVRXJHMEAU-UHFFFAOYSA-N 0 3 379.302 3.388 10 0 GGAEHN Cc1ccc(CN[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1Br ZINC000389189703 565553612 /nfs/dbraw/zinc/55/36/12/565553612.db2.gz UNTJAULMOBTMRC-LBPRGKRZSA-N 0 3 383.311 3.256 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)NC[C@]2(C)CCCS2)C1 ZINC000190726291 565555006 /nfs/dbraw/zinc/55/50/06/565555006.db2.gz LCAKCMNAPNYERY-QAPCUYQASA-N 0 3 382.599 3.201 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)NC[C@]2(C)CCCS2)C1 ZINC000190726271 565555490 /nfs/dbraw/zinc/55/54/90/565555490.db2.gz LCAKCMNAPNYERY-YJBOKZPZSA-N 0 3 382.599 3.201 10 0 GGAEHN CCc1cnc(CCNC(=O)NC[C@@H](c2cccs2)N2CCCC2)s1 ZINC000173414443 565556262 /nfs/dbraw/zinc/55/62/62/565556262.db2.gz NMVITISGKGLDGH-HNNXBMFYSA-N 0 3 378.567 3.446 10 0 GGAEHN Cc1c([C@H](C)N[C@@H]2CCOC[C@H]2C)nnn1-c1cccc(Br)c1 ZINC000278467670 565560311 /nfs/dbraw/zinc/56/03/11/565560311.db2.gz JOPNNUFOHDIFGP-BFQNTYOBSA-N 0 3 379.302 3.414 10 0 GGAEHN Cc1c([C@H](C)N[C@H]2CCOC[C@H]2C)nnn1-c1cccc(Br)c1 ZINC000278467673 565561197 /nfs/dbraw/zinc/56/11/97/565561197.db2.gz JOPNNUFOHDIFGP-WQGACYEGSA-N 0 3 379.302 3.414 10 0 GGAEHN COc1ccc(C2(CNCc3c(Br)cnn3C)CCOCC2)cc1 ZINC000278481990 565561414 /nfs/dbraw/zinc/56/14/14/565561414.db2.gz KUHNNFLDPAYFSA-UHFFFAOYSA-N 0 3 394.313 3.029 10 0 GGAEHN N#Cc1cccc(S(=O)(=O)CCNCCc2ccc(Cl)cc2Cl)c1 ZINC000392067170 565562986 /nfs/dbraw/zinc/56/29/86/565562986.db2.gz YVUMLZUSARZQNW-UHFFFAOYSA-N 0 3 383.300 3.471 10 0 GGAEHN Cc1cc(N2CCC[C@@H](N[C@@H](C)c3cc(Br)ncc3F)C2)n(C)n1 ZINC000278530394 565564192 /nfs/dbraw/zinc/56/41/92/565564192.db2.gz UBOSYBCWYOTQJN-QWHCGFSZSA-N 0 3 396.308 3.345 10 0 GGAEHN Cc1cc(N2CCC[C@H](N[C@@H](C)c3cc(Br)ncc3F)C2)n(C)n1 ZINC000278530397 565564269 /nfs/dbraw/zinc/56/42/69/565564269.db2.gz UBOSYBCWYOTQJN-STQMWFEESA-N 0 3 396.308 3.345 10 0 GGAEHN CN(c1ccc(NCc2c(Br)cnn2C)cc1)C1CCN(C)CC1 ZINC000278528106 565564940 /nfs/dbraw/zinc/56/49/40/565564940.db2.gz RFTGEXAPCAGJBM-UHFFFAOYSA-N 0 3 392.345 3.325 10 0 GGAEHN Cn1ncc(Br)c1CNCC1(c2ccc(F)cc2)CCOCC1 ZINC000278552978 565566311 /nfs/dbraw/zinc/56/63/11/565566311.db2.gz VGNAWKHEQVHGKQ-UHFFFAOYSA-N 0 3 382.277 3.160 10 0 GGAEHN C[C@@H](CCNCc1cc(Br)cc(Br)c1)[S@](C)=O ZINC000394524218 565570785 /nfs/dbraw/zinc/57/07/85/565570785.db2.gz JQBIRCNDXYVXDT-XYZCENFISA-N 0 3 383.149 3.458 10 0 GGAEHN CC[C@@H](Cc1cccc(Br)c1)C(=O)NC[C@H]1CCCN1CCOC ZINC000303679879 565573975 /nfs/dbraw/zinc/57/39/75/565573975.db2.gz MBOSZSXXNSTVQZ-FUHWJXTLSA-N 0 3 397.357 3.245 10 0 GGAEHN OC1(CNc2ncccc2Br)CCN(Cc2ccccc2)CC1 ZINC000397558610 565574738 /nfs/dbraw/zinc/57/47/38/565574738.db2.gz RHMZVFANOVNJLG-UHFFFAOYSA-N 0 3 376.298 3.283 10 0 GGAEHN OC1(CNCc2ccc(Br)o2)CCN(Cc2ccccc2)CC1 ZINC000397628078 565576648 /nfs/dbraw/zinc/57/66/48/565576648.db2.gz YXWCPKAETLGIMX-UHFFFAOYSA-N 0 3 379.298 3.159 10 0 GGAEHN CNC(=O)CCCN[C@H](C)c1ccc(Br)cc1Br ZINC000398357201 565577799 /nfs/dbraw/zinc/57/77/99/565577799.db2.gz LHGQIBMWJDUBSQ-SECBINFHSA-N 0 3 378.108 3.388 10 0 GGAEHN CC(C)(CN1CCCC1)NS(=O)(=O)c1c(Cl)cccc1Br ZINC000308684657 565578066 /nfs/dbraw/zinc/57/80/66/565578066.db2.gz XGKYDPHCKJUCFL-UHFFFAOYSA-N 0 3 395.750 3.255 10 0 GGAEHN C[C@@H]1C[C@H](NCc2c(Br)cnn2C)CCN1C(=O)OC(C)(C)C ZINC000278824107 565579816 /nfs/dbraw/zinc/57/98/16/565579816.db2.gz UGQKFLAJMOUWLX-VXGBXAGGSA-N 0 3 387.322 3.060 10 0 GGAEHN COc1c(Br)c(C)sc1C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000173749360 565581387 /nfs/dbraw/zinc/58/13/87/565581387.db2.gz CMXNKEMBSTWZDB-MWLCHTKSSA-N 0 3 375.332 3.382 10 0 GGAEHN NC[C@H](NC(=O)c1ccc(Br)c(C(F)(F)F)c1)C(F)(F)F ZINC000401748638 565582000 /nfs/dbraw/zinc/58/20/00/565582000.db2.gz MBYQTNZDJSYCOY-QMMMGPOBSA-N 0 3 379.098 3.087 10 0 GGAEHN COC(=O)c1cc(NC(=O)C2CCN(C3CC3)CC2)ccc1Br ZINC000278871165 565582142 /nfs/dbraw/zinc/58/21/42/565582142.db2.gz ZIAVBFPEWQALSZ-UHFFFAOYSA-N 0 3 381.270 3.049 10 0 GGAEHN CCCOc1c(Br)cc(CNCCc2cn(C)cn2)cc1OC ZINC000313250881 565584508 /nfs/dbraw/zinc/58/45/08/565584508.db2.gz DTJNJYHGGOPBDS-UHFFFAOYSA-N 0 3 382.302 3.312 10 0 GGAEHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1nscc1Br ZINC000404858447 565584584 /nfs/dbraw/zinc/58/45/84/565584584.db2.gz TUICZOCZHRPXMJ-RISCZKNCSA-N 0 3 380.311 3.156 10 0 GGAEHN CC[NH+]1CCC(C[N-]S(=O)(=O)c2c(Cl)cccc2Br)CC1 ZINC000314029385 565585702 /nfs/dbraw/zinc/58/57/02/565585702.db2.gz NXIKQHWCTYZROA-UHFFFAOYSA-N 0 3 395.750 3.113 10 0 GGAEHN C[C@@H](NC(=O)N(CCN(C)C)C[C@@H]1CCCO1)c1cccc(Br)c1 ZINC000173792399 565585783 /nfs/dbraw/zinc/58/57/83/565585783.db2.gz QCUONYLVECBQBQ-PBHICJAKSA-N 0 3 398.345 3.262 10 0 GGAEHN C[C@@H](NC(=O)N(CCN(C)C)C[C@H]1CCCO1)c1cccc(Br)c1 ZINC000173792420 565586593 /nfs/dbraw/zinc/58/65/93/565586593.db2.gz QCUONYLVECBQBQ-RHSMWYFYSA-N 0 3 398.345 3.262 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)N[C@@H]2CCOc3c(Br)cccc32)CN1C1CC1 ZINC000407954825 565587031 /nfs/dbraw/zinc/58/70/31/565587031.db2.gz FNYRGRZATBURLX-BFQNTYOBSA-N 0 3 394.313 3.197 10 0 GGAEHN CC[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc(F)cc1C(F)(F)F ZINC000173829894 565591035 /nfs/dbraw/zinc/59/10/35/565591035.db2.gz JVPMVFVTJLLXMY-QWHCGFSZSA-N 0 3 380.407 3.092 10 0 GGAEHN O=C(NCCCNCc1cccnc1)c1ccc(Br)c(Cl)c1 ZINC000317430341 565593900 /nfs/dbraw/zinc/59/39/00/565593900.db2.gz HOJXVMRBCVTBBC-UHFFFAOYSA-N 0 3 382.689 3.407 10 0 GGAEHN O=C(c1n[nH]c2ccc(Br)cc21)N1CCC[C@H](N2CCCC2)C1 ZINC000408127572 565595762 /nfs/dbraw/zinc/59/57/62/565595762.db2.gz WYOYAKMBVWHXCE-ZDUSSCGKSA-N 0 3 377.286 3.026 10 0 GGAEHN O=C(NCCCNCc1cccnc1)c1ccc(Cl)c(Br)c1 ZINC000318526275 565596953 /nfs/dbraw/zinc/59/69/53/565596953.db2.gz SHMYMAFLFLAOJA-UHFFFAOYSA-N 0 3 382.689 3.407 10 0 GGAEHN CCOc1cc(CN2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)cc(Br)c1[O-] ZINC000321827374 565606622 /nfs/dbraw/zinc/60/66/22/565606622.db2.gz BQKYAKRTTIIXMK-GOEBONIOSA-N 0 3 383.330 3.470 10 0 GGAEHN CCOc1cc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc(Br)c1[O-] ZINC000321827374 565606627 /nfs/dbraw/zinc/60/66/27/565606627.db2.gz BQKYAKRTTIIXMK-GOEBONIOSA-N 0 3 383.330 3.470 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)NCCc2ccc(F)c(Br)c2)CCN1C ZINC000174183171 565619799 /nfs/dbraw/zinc/61/97/99/565619799.db2.gz AYKHZXIPSMZLDU-OCCSQVGLSA-N 0 3 386.309 3.255 10 0 GGAEHN O[C@@H](COc1cccc(Br)c1)CN1CCC(c2ccncc2)CC1 ZINC000191677534 565620760 /nfs/dbraw/zinc/62/07/60/565620760.db2.gz WTSHRMSUMCFGBK-GOSISDBHSA-N 0 3 391.309 3.463 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)Nc2ccccc2I)CCN1C ZINC000174234834 565622136 /nfs/dbraw/zinc/62/21/36/565622136.db2.gz RHPKSNWFVUDEQK-RYUDHWBXSA-N 0 3 387.265 3.238 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)Nc2ccccc2I)CCN1C ZINC000174234794 565622221 /nfs/dbraw/zinc/62/22/21/565622221.db2.gz RHPKSNWFVUDEQK-VXGBXAGGSA-N 0 3 387.265 3.238 10 0 GGAEHN C[C@H](CCc1ccc(Br)cc1)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000174255885 565625157 /nfs/dbraw/zinc/62/51/57/565625157.db2.gz RVHHWWWEFCITCD-CRAIPNDOSA-N 0 3 392.341 3.426 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)Nc2ccc(I)cc2)CCN1C ZINC000174288780 565627091 /nfs/dbraw/zinc/62/70/91/565627091.db2.gz PFOQJZUAVDHQRB-RISCZKNCSA-N 0 3 387.265 3.238 10 0 GGAEHN C[C@@H](Cc1cccc(Br)c1)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000174349111 565631147 /nfs/dbraw/zinc/63/11/47/565631147.db2.gz FPWUBQTUXQWVCO-WMLDXEAASA-N 0 3 378.314 3.036 10 0 GGAEHN O=C(NCc1ccc(Br)cc1Cl)N1CC[C@H](N2CC=CC2)C1 ZINC000174383004 565632175 /nfs/dbraw/zinc/63/21/75/565632175.db2.gz FRPUHGZSXAJMET-AWEZNQCLSA-N 0 3 384.705 3.258 10 0 GGAEHN O=C(NCc1ccc(Br)cc1Cl)N1CC[C@@H](N2CC=CC2)C1 ZINC000174383017 565632551 /nfs/dbraw/zinc/63/25/51/565632551.db2.gz FRPUHGZSXAJMET-CQSZACIVSA-N 0 3 384.705 3.258 10 0 GGAEHN CCN1CCCC[C@H]1CNC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000409677383 565632743 /nfs/dbraw/zinc/63/27/43/565632743.db2.gz AIWCOLSIPMKGFL-XJKSGUPXSA-N 0 3 396.329 3.446 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)C1(c2cncc(Br)c2)CC1 ZINC000409673778 565632799 /nfs/dbraw/zinc/63/27/99/565632799.db2.gz VINJXWRWGZVBFA-KBPBESRZSA-N 0 3 380.330 3.255 10 0 GGAEHN C[C@@H]1C[C@@H](NC(=O)N[C@H]2CCOc3c(Br)cccc32)CCN1C ZINC000409697767 565633952 /nfs/dbraw/zinc/63/39/52/565633952.db2.gz NKQZWEVDNCZURU-XUJVJEKNSA-N 0 3 382.302 3.055 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)Nc2cccc(I)c2)CCN1C ZINC000174425815 565634413 /nfs/dbraw/zinc/63/44/13/565634413.db2.gz VAOZGKUJIOTQLC-BXUZGUMPSA-N 0 3 387.265 3.238 10 0 GGAEHN CN(C)C1(CN(C)C(=O)N[C@H]2CCOc3c(Br)cccc32)CCC1 ZINC000409705768 565635707 /nfs/dbraw/zinc/63/57/07/565635707.db2.gz IWNNHFCPZWFEIY-HNNXBMFYSA-N 0 3 396.329 3.398 10 0 GGAEHN C[C@@H](CN1CCCCC1)NC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000409748686 565638984 /nfs/dbraw/zinc/63/89/84/565638984.db2.gz QNKMCKCPDGMPEI-XJKSGUPXSA-N 0 3 396.329 3.446 10 0 GGAEHN C[C@H](CN1CCCCC1)NC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000409748682 565639117 /nfs/dbraw/zinc/63/91/17/565639117.db2.gz QNKMCKCPDGMPEI-CJNGLKHVSA-N 0 3 396.329 3.446 10 0 GGAEHN Cc1cc(S(=O)(=O)[N-]Cc2ccc(OCC[NH+](C)C)cc2)sc1Cl ZINC000191898551 565641330 /nfs/dbraw/zinc/64/13/30/565641330.db2.gz BMMLKWVMKCSNGN-UHFFFAOYSA-N 0 3 388.942 3.129 10 0 GGAEHN CC(C)(CNC(=O)N1CC[C@@H](N2CC=CC2)C1)c1cccc(Br)c1 ZINC000174572589 565644108 /nfs/dbraw/zinc/64/41/08/565644108.db2.gz QNXIWFIDCPGPCF-QGZVFWFLSA-N 0 3 392.341 3.382 10 0 GGAEHN O=C(N[C@H]1CCc2c1cccc2Br)N1CC[C@H](N2CC=CC2)C1 ZINC000174666549 565650502 /nfs/dbraw/zinc/65/05/02/565650502.db2.gz WSXFMPNFRBGVHK-GUYCJALGSA-N 0 3 376.298 3.092 10 0 GGAEHN C[C@@H](NC(=O)c1ccccc1OCCN(C)C)c1ccc(Br)cn1 ZINC000280159182 565655123 /nfs/dbraw/zinc/65/51/23/565655123.db2.gz YKTUUAZYMBWTIB-CYBMUJFWSA-N 0 3 392.297 3.276 10 0 GGAEHN O=C1[C@@H](N2CCC[C@@H](c3nc[nH]n3)C2)CCN1c1ccc(Cl)c(Cl)c1 ZINC000329235703 565659319 /nfs/dbraw/zinc/65/93/19/565659319.db2.gz IUCQIJGWKMRBJU-ABAIWWIYSA-N 0 3 380.279 3.096 10 0 GGAEHN O=C(c1n[nH]c2ccc(Br)cc21)N1CC[C@@H](N2CCCCC2)C1 ZINC000329369695 565664510 /nfs/dbraw/zinc/66/45/10/565664510.db2.gz LPTOMURTCFUPDN-CYBMUJFWSA-N 0 3 377.286 3.026 10 0 GGAEHN O=C(NCCCc1ccc(Br)cc1F)N1CC[C@@H](N2CC=CC2)C1 ZINC000175021115 565674806 /nfs/dbraw/zinc/67/48/06/565674806.db2.gz IHYYFXQDHPHIBP-MRXNPFEDSA-N 0 3 396.304 3.177 10 0 GGAEHN C[C@H](NC[C@@]1(C)CCCS1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280556880 565679905 /nfs/dbraw/zinc/67/99/05/565679905.db2.gz JHMIJUGECSJRHM-IINYFYTJSA-N 0 3 393.372 3.033 10 0 GGAEHN C[C@@H](NC[C@@]1(C)CCCS1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280558481 565680400 /nfs/dbraw/zinc/68/04/00/565680400.db2.gz JHMIJUGECSJRHM-QMTHXVAHSA-N 0 3 393.372 3.033 10 0 GGAEHN C[C@@H](NCCc1cccs1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280572024 565680843 /nfs/dbraw/zinc/68/08/43/565680843.db2.gz KNEZPHIXLRRCLZ-SNVBAGLBSA-N 0 3 389.340 3.051 10 0 GGAEHN Cc1cc(NC(=O)NC[C@@H](O)CN2CCCCC2)cc(C)c1Br ZINC000192418123 565686678 /nfs/dbraw/zinc/68/66/78/565686678.db2.gz ABUISZRIYNAQGB-OAHLLOKOSA-N 0 3 384.318 3.034 10 0 GGAEHN COC(=O)c1cccc(NC(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1Br ZINC000192424952 565689908 /nfs/dbraw/zinc/68/99/08/565689908.db2.gz FPKIBFWUBVLPIY-RISCZKNCSA-N 0 3 398.301 3.086 10 0 GGAEHN COC(=O)C1CCC([NH2+]Cc2nnc(-c3ccc(Br)cc3)[n-]2)CC1 ZINC000192445732 565691882 /nfs/dbraw/zinc/69/18/82/565691882.db2.gz WBUOMOBNHAYUSI-UHFFFAOYSA-N 0 3 393.285 3.056 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)N[C@@H]2C[C@H]2c2ccccc2Br)CCN1C ZINC000280743191 565692157 /nfs/dbraw/zinc/69/21/57/565692157.db2.gz PGFAGVJVWWKAHD-UICACZKSSA-N 0 3 380.330 3.429 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)Cc1noc(Cc2ccc(Br)cc2)n1 ZINC000175338996 565693589 /nfs/dbraw/zinc/69/35/89/565693589.db2.gz BCRFYEWPDSXCCN-MRXNPFEDSA-N 0 3 393.329 3.339 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)Cc1nc(-c2cc(Br)cs2)no1 ZINC000175356770 565694964 /nfs/dbraw/zinc/69/49/64/565694964.db2.gz CZKDHNONQVGQHW-GFCCVEGCSA-N 0 3 385.331 3.477 10 0 GGAEHN O=C(NC[C@@H](c1cccs1)N1CCCC1)[C@@H]1CCCN1c1nccs1 ZINC000192516405 565696977 /nfs/dbraw/zinc/69/69/77/565696977.db2.gz ZGSNLSMRYXGPCM-GJZGRUSLSA-N 0 3 376.551 3.127 10 0 GGAEHN Cn1c2ccc(CNCCOc3ncc(Cl)cc3Cl)cc2sc1=O ZINC000192622726 565702546 /nfs/dbraw/zinc/70/25/46/565702546.db2.gz CIFDVXNMFFUBHA-UHFFFAOYSA-N 0 3 384.288 3.470 10 0 GGAEHN CCOC(=O)[C@@H]1CC[C@H](N[C@H](C)c2ccc(S(=O)(=O)C(F)F)cc2)C1 ZINC000280979952 565707045 /nfs/dbraw/zinc/70/70/45/565707045.db2.gz JAPJEPNKDQQIPI-BNOWGMLFSA-N 0 3 375.437 3.065 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)N[C@H]1CCC[C@H](S(C)(=O)=O)C1 ZINC000330493505 565708749 /nfs/dbraw/zinc/70/87/49/565708749.db2.gz MUCHPNQTLCAXSI-UBHSHLNASA-N 0 3 390.343 3.464 10 0 GGAEHN CC(C)C(=O)N1CCC(N[C@@H](C)C(=O)Nc2cccc(Br)c2)CC1 ZINC000192884649 565717600 /nfs/dbraw/zinc/71/76/00/565717600.db2.gz VWDJPVSVJLTYMK-ZDUSSCGKSA-N 0 3 396.329 3.013 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(S(=O)(=O)c2ccccc2Cl)C1 ZINC000192934587 565719802 /nfs/dbraw/zinc/71/98/02/565719802.db2.gz GAUVTMNJDNBVSN-AWEZNQCLSA-N 0 3 399.969 3.248 10 0 GGAEHN C[C@@H](NCCCN1CCN(C)CC1)c1cc2cc(Br)ccc2o1 ZINC000192924330 565720044 /nfs/dbraw/zinc/72/00/44/565720044.db2.gz AWYUQOYMXQISOX-CQSZACIVSA-N 0 3 380.330 3.483 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(S(=O)(=O)c2ccccc2Cl)C1 ZINC000192934602 565720068 /nfs/dbraw/zinc/72/00/68/565720068.db2.gz GAUVTMNJDNBVSN-CQSZACIVSA-N 0 3 399.969 3.248 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(S(=O)(=O)c2cccc(Cl)c2)C1 ZINC000192931498 565720084 /nfs/dbraw/zinc/72/00/84/565720084.db2.gz SUEGUSVTLPZOEM-CQSZACIVSA-N 0 3 399.969 3.248 10 0 GGAEHN CSCCN1CCC(Oc2ccccc2I)CC1 ZINC000175792490 565724187 /nfs/dbraw/zinc/72/41/87/565724187.db2.gz CJCDJQKSUQWFNM-UHFFFAOYSA-N 0 3 377.291 3.497 10 0 GGAEHN CN(C(=O)CCN[C@@H](CO)c1cccc(Br)c1)c1ccccc1 ZINC000411504900 565733317 /nfs/dbraw/zinc/73/33/17/565733317.db2.gz MJFQRBSEZHNLBO-KRWDZBQOSA-N 0 3 377.282 3.125 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)C(=O)Nc2cc(Cl)c(Cl)cc2F)CCN1C ZINC000281528052 565735742 /nfs/dbraw/zinc/73/57/42/565735742.db2.gz SUXKCCYZUCWJNX-UWVGGRQHSA-N 0 3 376.259 3.012 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)C(=O)Nc2cc(Cl)c(Cl)cc2F)CCN1C ZINC000281528059 565735979 /nfs/dbraw/zinc/73/59/79/565735979.db2.gz SUXKCCYZUCWJNX-ZJUUUORDSA-N 0 3 376.259 3.012 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)C(=O)Nc2cc(Cl)c(Cl)cc2F)CCN1C ZINC000281528055 565736096 /nfs/dbraw/zinc/73/60/96/565736096.db2.gz SUXKCCYZUCWJNX-VHSXEESVSA-N 0 3 376.259 3.012 10 0 GGAEHN Cc1ccsc1[C@@H](CO)NCCC(=O)Nc1ccc(Br)cc1 ZINC000411561566 565736987 /nfs/dbraw/zinc/73/69/87/565736987.db2.gz BBQDPMCITXSVIT-CQSZACIVSA-N 0 3 383.311 3.471 10 0 GGAEHN C[C@H](CNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1)Oc1ccccc1Br ZINC000175975754 565737933 /nfs/dbraw/zinc/73/79/33/565737933.db2.gz NWFJYSOMKJAKIX-RBSFLKMASA-N 0 3 398.345 3.341 10 0 GGAEHN CC(C)N1CC[C@H](NC[C@H](C)S(C)(=O)=O)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000411645904 565742312 /nfs/dbraw/zinc/74/23/12/565742312.db2.gz LQTFWXMRGAZVSA-ZLIFDBKOSA-N 0 3 376.925 3.026 10 0 GGAEHN C[C@H](CN[C@H]1CCN(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1)S(C)(=O)=O ZINC000411702594 565746906 /nfs/dbraw/zinc/74/69/06/565746906.db2.gz ZJYSRUVBBZPNQV-DQYPLSBCSA-N 0 3 390.952 3.416 10 0 GGAEHN O=C(N[C@H]1CCOc2c(Br)cccc21)C1CCN(C2CC2)CC1 ZINC000281809434 565748992 /nfs/dbraw/zinc/74/89/92/565748992.db2.gz RNBWEPCZTXVJGC-INIZCTEOSA-N 0 3 379.298 3.263 10 0 GGAEHN CCN1CC[C@H]2OCCN(CCC(=O)Nc3c(Cl)cccc3Cl)[C@H]2C1 ZINC000411765763 565751082 /nfs/dbraw/zinc/75/10/82/565751082.db2.gz GESIBEMTMBFYNY-JKSUJKDBSA-N 0 3 386.323 3.117 10 0 GGAEHN O=C1NC(=O)[C@@]2(CCCN(Cc3ccc(-c4ccccc4Cl)s3)C2)N1 ZINC000193464768 565754209 /nfs/dbraw/zinc/75/42/09/565754209.db2.gz DCQSFULXRQHBDB-SFHVURJKSA-N 0 3 375.881 3.243 10 0 GGAEHN C[C@H](NCc1ccc(-c2cnn(C)c2)s1)c1ccc(S(C)(=O)=O)cc1 ZINC000282143601 565766219 /nfs/dbraw/zinc/76/62/19/565766219.db2.gz BAVMBICGIFODFK-ZDUSSCGKSA-N 0 3 375.519 3.403 10 0 GGAEHN COC(=O)[C@@H]1CSCCN(CCC(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000412079447 565769890 /nfs/dbraw/zinc/76/98/90/565769890.db2.gz PAGFGFAWZVTOAM-NSHDSACASA-N 0 3 391.320 3.160 10 0 GGAEHN Cc1cc(NC(=O)CCN[C@H]2CCOc3c(Br)cccc32)no1 ZINC000282223032 565770536 /nfs/dbraw/zinc/77/05/36/565770536.db2.gz YUPGMXBQZBQECN-ZDUSSCGKSA-N 0 3 380.242 3.188 10 0 GGAEHN Cc1cc(NC(=O)CCN[C@@H]2CCOc3c(Br)cccc32)no1 ZINC000282223028 565770710 /nfs/dbraw/zinc/77/07/10/565770710.db2.gz YUPGMXBQZBQECN-CYBMUJFWSA-N 0 3 380.242 3.188 10 0 GGAEHN C[C@@H](NC(=O)NC[C@H](O)CN1CCCCC1)c1c(Cl)ccc(F)c1Cl ZINC000193902002 565781681 /nfs/dbraw/zinc/78/16/81/565781681.db2.gz OXCYXKCVXDPRAW-NEPJUHHUSA-N 0 3 392.302 3.340 10 0 GGAEHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000282497991 565782793 /nfs/dbraw/zinc/78/27/93/565782793.db2.gz OPFGKTMKQNPZLD-UHOFOFEASA-N 0 3 396.329 3.254 10 0 GGAEHN CN1CCC[C@H](CNC(=O)NC[C@@H]2CSCCS2)[C@@H]1c1cccs1 ZINC000176547728 565784309 /nfs/dbraw/zinc/78/43/09/565784309.db2.gz DVLRNYRLFRZOMB-IIAWOOMASA-N 0 3 385.624 3.279 10 0 GGAEHN COc1c(Br)cccc1CNC[C@H]1CCC2(CCOCC2)[C@@H]1O ZINC000282580189 565787442 /nfs/dbraw/zinc/78/74/42/565787442.db2.gz BIMQSRYKWRGRJQ-RHSMWYFYSA-N 0 3 384.314 3.115 10 0 GGAEHN COc1sc(CNC[C@H]2CCC3(CCOCC3)[C@H]2O)cc1Br ZINC000282692937 565792299 /nfs/dbraw/zinc/79/22/99/565792299.db2.gz LIGBDKQRDZBCNL-RISCZKNCSA-N 0 3 390.343 3.177 10 0 GGAEHN C[C@@H](NCC1(OCCO)CCOCC1)c1cc2cc(Br)ccc2o1 ZINC000282737410 565793820 /nfs/dbraw/zinc/79/38/20/565793820.db2.gz MYGOKDDCFYDPMG-CYBMUJFWSA-N 0 3 398.297 3.404 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N(C)C1CCN(C)CC1 ZINC000194273727 565805663 /nfs/dbraw/zinc/80/56/63/565805663.db2.gz UKKMTULEPJWEJB-UHFFFAOYSA-N 0 3 378.314 3.265 10 0 GGAEHN C[C@H]1COCC[C@@H]1C(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000194353693 565810707 /nfs/dbraw/zinc/81/07/07/565810707.db2.gz LESGAHKAMAFXGI-YOEHRIQHSA-N 0 3 383.330 3.012 10 0 GGAEHN CCN(CC)C(=O)[C@@H]1CCCN1CCC(=O)Nc1ccc(Br)cc1 ZINC000194403283 565812598 /nfs/dbraw/zinc/81/25/98/565812598.db2.gz GJJKREBYUOJQTM-INIZCTEOSA-N 0 3 396.329 3.111 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(C)c(Br)s2)[C@H](C)C1 ZINC000176936188 565816223 /nfs/dbraw/zinc/81/62/23/565816223.db2.gz NKHPCYNRNYXZFV-NEPJUHHUSA-N 0 3 395.388 3.170 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O ZINC000176987020 565820557 /nfs/dbraw/zinc/82/05/57/565820557.db2.gz SZEYSGOAMPIJFW-XJKSGUPXSA-N 0 3 381.929 3.086 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)c1cccc(C)c1I ZINC000177009558 565822977 /nfs/dbraw/zinc/82/29/77/565822977.db2.gz SENATDPJOBSPSE-ZDUSSCGKSA-N 0 3 386.277 3.156 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)c1cccc(C)c1I ZINC000177009545 565823134 /nfs/dbraw/zinc/82/31/34/565823134.db2.gz SENATDPJOBSPSE-CYBMUJFWSA-N 0 3 386.277 3.156 10 0 GGAEHN O=C(Cc1csc(Cc2cccc(Cl)c2)n1)N1CCN2CCC[C@H]2C1 ZINC000194580790 565824068 /nfs/dbraw/zinc/82/40/68/565824068.db2.gz FJYUDMUEWFFHDV-KRWDZBQOSA-N 0 3 375.925 3.236 10 0 GGAEHN COc1cc(CN(C)C[C@H](O)COc2cccc(Br)c2)ccc1O ZINC000177055722 565825230 /nfs/dbraw/zinc/82/52/30/565825230.db2.gz USSPSYGYXCCJJE-HNNXBMFYSA-N 0 3 396.281 3.035 10 0 GGAEHN O=C1CCCN1C[C@@H](O)CN1CCC(Cc2cc(Cl)ccc2Cl)CC1 ZINC000177064639 565826528 /nfs/dbraw/zinc/82/65/28/565826528.db2.gz LODJXKVVRDSIDI-KRWDZBQOSA-N 0 3 385.335 3.231 10 0 GGAEHN CC(C)OCCN1CCC(NC(=O)Nc2ncc(C(F)(F)F)s2)CC1 ZINC000283694196 565826964 /nfs/dbraw/zinc/82/69/64/565826964.db2.gz WDDHDGOOQPZECL-UHFFFAOYSA-N 0 3 380.436 3.173 10 0 GGAEHN O=C(COc1ccc(Br)c(Cl)c1)NC1CCN(C2CC2)CC1 ZINC000413023775 565830624 /nfs/dbraw/zinc/83/06/24/565830624.db2.gz SYXIMAQTNNUVLE-UHFFFAOYSA-N 0 3 387.705 3.224 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)CCc1ncc(-c2ccccc2Br)o1 ZINC000194689058 565831210 /nfs/dbraw/zinc/83/12/10/565831210.db2.gz UJJMXGXDBNYYJS-ZDUSSCGKSA-N 0 3 392.297 3.247 10 0 GGAEHN CCN1CCN(C[C@@H](C)CNc2nccc3cc(Br)ccc32)CC1 ZINC000413082114 565832922 /nfs/dbraw/zinc/83/29/22/565832922.db2.gz QJJIXMXRUMOWFA-HNNXBMFYSA-N 0 3 391.357 3.105 10 0 GGAEHN CN1CC[C@@H](NCC(=O)Nc2ccccc2Br)[C@H]1c1ccccc1 ZINC000283918586 565834938 /nfs/dbraw/zinc/83/49/38/565834938.db2.gz GIFAUJAHZBZPBU-IEBWSBKVSA-N 0 3 388.309 3.423 10 0 GGAEHN Brc1ccc2c(ccnc2N2CCN(C[C@@H]3CCOC3)CC2)c1 ZINC000413184518 565838503 /nfs/dbraw/zinc/83/85/03/565838503.db2.gz XRGOSEVTFUMDME-AWEZNQCLSA-N 0 3 376.298 3.156 10 0 GGAEHN Brc1ccc2c(ccnc2N2CCN(C[C@H]3CCOC3)CC2)c1 ZINC000413184519 565838722 /nfs/dbraw/zinc/83/87/22/565838722.db2.gz XRGOSEVTFUMDME-CQSZACIVSA-N 0 3 376.298 3.156 10 0 GGAEHN CCN1CCC[C@H](NC(=O)Nc2ccc(F)cc2I)C1 ZINC000177279250 565841051 /nfs/dbraw/zinc/84/10/51/565841051.db2.gz DBZMSNVMNCZKMP-NSHDSACASA-N 0 3 391.228 3.036 10 0 GGAEHN C[C@@H]1CN(c2nccc3cc(Br)ccc32)CCN1CC(C)(C)O ZINC000413253127 565842252 /nfs/dbraw/zinc/84/22/52/565842252.db2.gz YMHVHYBOJRBEFD-CYBMUJFWSA-N 0 3 378.314 3.279 10 0 GGAEHN C[C@H](NC(=O)C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1)c1ccc(Cl)cc1Cl ZINC000284370239 565851352 /nfs/dbraw/zinc/85/13/52/565851352.db2.gz LQGUSGPDBMNXPU-MBNYWOFBSA-N 0 3 386.323 3.112 10 0 GGAEHN CC[C@@H](C(=O)N1CCC[C@@H]1c1ccccc1I)N(C)C ZINC000413450408 565852570 /nfs/dbraw/zinc/85/25/70/565852570.db2.gz FYRUYEZPVFBSKX-LSDHHAIUSA-N 0 3 386.277 3.295 10 0 GGAEHN CN(CC1CCN(C[C@@H](O)c2ccccc2)CC1)C(=O)[C@@H]1CC1(Cl)Cl ZINC000177467533 565852739 /nfs/dbraw/zinc/85/27/39/565852739.db2.gz IWBMGUBZZQIDDT-DLBZAZTESA-N 0 3 385.335 3.084 10 0 GGAEHN CCCCOC[C@H](O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000195186012 565863841 /nfs/dbraw/zinc/86/38/41/565863841.db2.gz BUINQEMYACTSHU-QGZVFWFLSA-N 0 3 386.330 3.222 10 0 GGAEHN CN(C(=O)NCc1cccc(Br)c1Cl)[C@H]1CCN(C2CC2)C1 ZINC000413662241 565866786 /nfs/dbraw/zinc/86/67/86/565866786.db2.gz ZEMUUQVMYPNRRE-ZDUSSCGKSA-N 0 3 386.721 3.481 10 0 GGAEHN CCN1CCC[C@H]1CN(C)CC(=O)Nc1ccc(Br)cc1Cl ZINC000177704011 565867387 /nfs/dbraw/zinc/86/73/87/565867387.db2.gz NZIKCJYWJPPKGK-ZDUSSCGKSA-N 0 3 388.737 3.457 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)CC(=O)Nc1ccc(Br)cc1Cl ZINC000177703999 565867479 /nfs/dbraw/zinc/86/74/79/565867479.db2.gz NZIKCJYWJPPKGK-CYBMUJFWSA-N 0 3 388.737 3.457 10 0 GGAEHN CN(C(=O)NCc1cc(Cl)cc(Br)c1)[C@H]1CCN(C2CC2)C1 ZINC000413701010 565868604 /nfs/dbraw/zinc/86/86/04/565868604.db2.gz LGBITAIOHOVZML-HNNXBMFYSA-N 0 3 386.721 3.481 10 0 GGAEHN COC(=O)c1ccc(CN2CC[C@@H](CN(C)Cc3scnc3C)C2)s1 ZINC000195249198 565869708 /nfs/dbraw/zinc/86/97/08/565869708.db2.gz QCJWBHUMCXASTR-AWEZNQCLSA-N 0 3 379.551 3.254 10 0 GGAEHN CCCOc1c(Br)cc(C(=O)N2CCN3CCC[C@@H]3C2)cc1OC ZINC000195309402 565875325 /nfs/dbraw/zinc/87/53/25/565875325.db2.gz TTYSIVJDULOTOC-CQSZACIVSA-N 0 3 397.313 3.167 10 0 GGAEHN CC(C)(CNC(=O)N[C@H](CO)c1cccc(Br)c1)N1CCCCC1 ZINC000177871579 565879384 /nfs/dbraw/zinc/87/93/84/565879384.db2.gz NCASBGAIFSIAPV-MRXNPFEDSA-N 0 3 398.345 3.046 10 0 GGAEHN Cn1nccc1C1CCN(C[C@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000195502042 565888306 /nfs/dbraw/zinc/88/83/06/565888306.db2.gz OPUPMPGWLAZWQK-AWEZNQCLSA-N 0 3 384.307 3.346 10 0 GGAEHN Cn1nccc1C1CCN(C[C@@H](O)COc2ccc(Cl)cc2Cl)CC1 ZINC000195504000 565888733 /nfs/dbraw/zinc/88/87/33/565888733.db2.gz MCAHYUDDVNGULU-OAHLLOKOSA-N 0 3 384.307 3.346 10 0 GGAEHN Cn1nccc1C1CCN(C[C@H](O)COc2cc(Cl)ccc2Cl)CC1 ZINC000195504017 565889536 /nfs/dbraw/zinc/88/95/36/565889536.db2.gz VXYGQTLYRCATKW-HNNXBMFYSA-N 0 3 384.307 3.346 10 0 GGAEHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)Nc1cc(N(C)C)c(Br)cn1 ZINC000333647144 565890453 /nfs/dbraw/zinc/89/04/53/565890453.db2.gz JWZNBGOAMXVOPZ-QWHCGFSZSA-N 0 3 396.333 3.001 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NC[C@H](c1cccc(F)c1)N(C)C ZINC000414052163 565890739 /nfs/dbraw/zinc/89/07/39/565890739.db2.gz KSKWBRMMHDIBBT-CXAGYDPISA-N 0 3 396.304 3.031 10 0 GGAEHN COc1ccc(OC)c([C@@H](C)N[C@H](C)Cn2cc(Br)ccc2=O)c1 ZINC000414058278 565890800 /nfs/dbraw/zinc/89/08/00/565890800.db2.gz GXHGYERRLKSAHB-CHWSQXEVSA-N 0 3 395.297 3.367 10 0 GGAEHN Cc1ccc2c(c1C)OC[C@@H]2N[C@@H](C)Cn1cc(Br)ccc1=O ZINC000414068562 565891858 /nfs/dbraw/zinc/89/18/58/565891858.db2.gz BFZOPLZFIBHALN-LRDDRELGSA-N 0 3 377.282 3.339 10 0 GGAEHN CC(=O)Nc1cccc([C@@H](C)N[C@@H](C)Cn2cc(Br)ccc2=O)c1 ZINC000414063277 565891999 /nfs/dbraw/zinc/89/19/99/565891999.db2.gz MEYSSVHIZDBOGK-QWHCGFSZSA-N 0 3 392.297 3.309 10 0 GGAEHN C[C@H](NCc1cccnc1-n1cncn1)c1ccc(F)c(Br)c1 ZINC000178049299 565892143 /nfs/dbraw/zinc/89/21/43/565892143.db2.gz KXBUMIIPDLPABC-NSHDSACASA-N 0 3 376.233 3.415 10 0 GGAEHN CCOCc1ccc(CN[C@@H](C)Cn2cc(Br)ccc2=O)cc1 ZINC000414071271 565892366 /nfs/dbraw/zinc/89/23/66/565892366.db2.gz SZBMJFMVVJYCNU-AWEZNQCLSA-N 0 3 379.298 3.326 10 0 GGAEHN CC(=O)Nc1cccc([C@H](C)N[C@@H](C)Cn2cc(Br)ccc2=O)c1 ZINC000414063279 565892614 /nfs/dbraw/zinc/89/26/14/565892614.db2.gz MEYSSVHIZDBOGK-STQMWFEESA-N 0 3 392.297 3.309 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@@H]1CCOc2ccc(F)cc21 ZINC000414093065 565894243 /nfs/dbraw/zinc/89/42/43/565894243.db2.gz LXYDSXWMXUPGIL-IAQYHMDHSA-N 0 3 381.245 3.252 10 0 GGAEHN CN(C)c1cc(NC(=O)N2CC[C@@H](N3CCCCC3)C2)ncc1Br ZINC000333716913 565894511 /nfs/dbraw/zinc/89/45/11/565894511.db2.gz UOWXVJGUURSMNO-CYBMUJFWSA-N 0 3 396.333 3.002 10 0 GGAEHN CN(C)c1cc(NC(=O)N2CC[C@H](N3CCCCC3)C2)ncc1Br ZINC000333716921 565894675 /nfs/dbraw/zinc/89/46/75/565894675.db2.gz UOWXVJGUURSMNO-ZDUSSCGKSA-N 0 3 396.333 3.002 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@H]1CCOc2ccc(F)cc21 ZINC000414093066 565894893 /nfs/dbraw/zinc/89/48/93/565894893.db2.gz LXYDSXWMXUPGIL-NHYWBVRUSA-N 0 3 381.245 3.252 10 0 GGAEHN CCCCn1cc(CN[C@H](C)Cn2cc(Br)ccc2=O)c(C)n1 ZINC000414093159 565894964 /nfs/dbraw/zinc/89/49/64/565894964.db2.gz FONVJACJDZNHHX-CYBMUJFWSA-N 0 3 381.318 3.094 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@@H](CCO)c1ccc(Cl)cc1 ZINC000414123906 565897124 /nfs/dbraw/zinc/89/71/24/565897124.db2.gz CAUNNPJHQOCMHS-WBMJQRKESA-N 0 3 399.716 3.366 10 0 GGAEHN CO[C@](C)(CN[C@H](C)Cn1cc(Br)ccc1=O)c1ccccc1 ZINC000414146443 565899377 /nfs/dbraw/zinc/89/93/77/565899377.db2.gz LEYZXDRTQAZYOQ-RDTXWAMCSA-N 0 3 379.298 3.151 10 0 GGAEHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC[C@H](O)Cn1ccnn1 ZINC000414172342 565900241 /nfs/dbraw/zinc/90/02/41/565900241.db2.gz DXCDJLZYYACKAB-NHYWBVRUSA-N 0 3 377.901 3.075 10 0 GGAEHN O[C@H](CN[C@H](c1sccc1Br)C1CCCCC1)Cn1ccnn1 ZINC000414198109 565902816 /nfs/dbraw/zinc/90/28/16/565902816.db2.gz WBAPVBPQCFRCHL-HIFRSBDPSA-N 0 3 399.358 3.374 10 0 GGAEHN C[C@@H](NC[C@]1(O)CCOC1)c1ccc(Br)cc1Br ZINC000222427479 565904680 /nfs/dbraw/zinc/90/46/80/565904680.db2.gz ODGFYOWWHPGYML-NOZJJQNGSA-N 0 3 379.092 3.014 10 0 GGAEHN CN(C)C[C@H]1CN(Cc2csc(-c3ccc(Br)cc3)n2)CCO1 ZINC000178200521 565905345 /nfs/dbraw/zinc/90/53/45/565905345.db2.gz NYYHQNZWNRAAGK-INIZCTEOSA-N 0 3 396.354 3.335 10 0 GGAEHN C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)N1CCN2CCC[C@@H]2C1 ZINC000178225583 565906715 /nfs/dbraw/zinc/90/67/15/565906715.db2.gz SNGKSWRINBVDOO-GXTWGEPZSA-N 0 3 384.293 3.009 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1Cc1ccc(I)cc1 ZINC000178325568 565911847 /nfs/dbraw/zinc/91/18/47/565911847.db2.gz VIJNUVFCLHDJAQ-INIZCTEOSA-N 0 3 381.261 3.461 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1CC(=O)Nc1ccc(Br)c(C)c1 ZINC000178303041 565912202 /nfs/dbraw/zinc/91/22/02/565912202.db2.gz MBRVHSRNAUAZPC-INIZCTEOSA-N 0 3 391.313 3.366 10 0 GGAEHN CCN1CCC[C@H](NC(=O)c2ccc(I)c(Cl)c2)C1 ZINC000226789998 565920392 /nfs/dbraw/zinc/92/03/92/565920392.db2.gz GAPXHYODYOZYPS-NSHDSACASA-N 0 3 392.668 3.159 10 0 GGAEHN C[C@H]1Cc2ccccc2[C@H]1NCc1ccc(S(N)(=O)=O)c(Br)c1 ZINC000414350576 565913128 /nfs/dbraw/zinc/91/31/28/565913128.db2.gz LTKBMBJYZYFMAY-GTNSWQLSSA-N 0 3 395.322 3.120 10 0 GGAEHN CN1CCC[C@@H](CNCc2ccc(S(C)(=O)=O)s2)[C@H]1c1cccs1 ZINC000414359406 565914618 /nfs/dbraw/zinc/91/46/18/565914618.db2.gz OFAIRGJSDOZUEV-GUYCJALGSA-N 0 3 384.592 3.386 10 0 GGAEHN C[C@H](NCc1ccc(S(N)(=O)=O)c(Cl)c1)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000414364938 565915940 /nfs/dbraw/zinc/91/59/40/565915940.db2.gz NGMOEPWOUBEIPL-OAVHHTNSSA-N 0 3 380.897 3.030 10 0 GGAEHN C[C@H](NCc1ccc(S(N)(=O)=O)c(Cl)c1)[C@H]1Oc2ccccc2[C@H]1C ZINC000414364940 565916504 /nfs/dbraw/zinc/91/65/04/565916504.db2.gz NGMOEPWOUBEIPL-SOZUMNATSA-N 0 3 380.897 3.030 10 0 GGAEHN C[C@H](Oc1ccc(F)cc1Br)C(=O)NCCN1CCCC[C@@H]1C ZINC000226497594 565920855 /nfs/dbraw/zinc/92/08/55/565920855.db2.gz CHMGZRWXUDBWFG-STQMWFEESA-N 0 3 387.293 3.346 10 0 GGAEHN C[C@H](NCCCOCCO)c1ccc(Br)cc1Br ZINC000227500511 565923235 /nfs/dbraw/zinc/92/32/35/565923235.db2.gz TULPUFAIDHGCKY-JTQLQIEISA-N 0 3 381.108 3.261 10 0 GGAEHN CC(C)COC[C@@H](O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000178513445 565923268 /nfs/dbraw/zinc/92/32/68/565923268.db2.gz OREAJSVFYYEKDP-KRWDZBQOSA-N 0 3 386.330 3.078 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)c1ccc(I)c(Cl)c1 ZINC000229043746 565925990 /nfs/dbraw/zinc/92/59/90/565925990.db2.gz ZBPRIGYICAQLIF-NSHDSACASA-N 0 3 392.668 3.111 10 0 GGAEHN Cc1ccc(F)c(CS(=O)(=O)C(C)C(=O)NCc2ccccc2Cl)c1 ZINC000414430097 565931125 /nfs/dbraw/zinc/93/11/25/565931125.db2.gz WGTIDXBGOLOUPR-ZDUSSCGKSA-N 0 3 383.872 3.407 10 0 GGAEHN COc1ccc(CNC[C@@H]2CCC3(CCOCC3)[C@@H]2O)c(Br)c1 ZINC000285932122 565933891 /nfs/dbraw/zinc/93/38/91/565933891.db2.gz LUMZPICXBQVDRH-WMLDXEAASA-N 0 3 384.314 3.115 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1CC(=O)Nc1ccc(Br)cc1 ZINC000178750015 565934920 /nfs/dbraw/zinc/93/49/20/565934920.db2.gz MKIBFVQBRBBPIU-INIZCTEOSA-N 0 3 377.286 3.057 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1CC(=O)Nc1ccc(Br)cc1C ZINC000178748645 565935304 /nfs/dbraw/zinc/93/53/04/565935304.db2.gz ZJNFINPWINJKTG-MRXNPFEDSA-N 0 3 391.313 3.366 10 0 GGAEHN COC[C@@H](O)CN[C@@H](c1ccccc1)c1ccc(OC)c(Br)c1 ZINC000178830195 565940169 /nfs/dbraw/zinc/94/01/69/565940169.db2.gz OIDLAWSUDZARCS-YJBOKZPZSA-N 0 3 380.282 3.144 10 0 GGAEHN CSCc1cnc(CNCC2(O)CCN(Cc3ccccc3)CC2)s1 ZINC000414520924 565944973 /nfs/dbraw/zinc/94/49/73/565944973.db2.gz DQCJVUJNEMGEKF-UHFFFAOYSA-N 0 3 377.579 3.123 10 0 GGAEHN OC[C@H](NCc1cnc(-c2ccc(Br)cc2)s1)[C@H]1CCCOC1 ZINC000414544770 565946719 /nfs/dbraw/zinc/94/67/19/565946719.db2.gz FHEJFHILGYRDQQ-BBRMVZONSA-N 0 3 397.338 3.450 10 0 GGAEHN CC(C)N(Cc1cc(Br)c2c(c1)OCCCO2)C[C@@H]1CCC(=O)N1 ZINC000414557519 565947954 /nfs/dbraw/zinc/94/79/54/565947954.db2.gz LRZDFQKIUBDVFG-AWEZNQCLSA-N 0 3 397.313 3.099 10 0 GGAEHN CC(C)N(CC1=Cc2cc(Br)ccc2OC1)C[C@@H]1CCC(=O)N1 ZINC000414565904 565949416 /nfs/dbraw/zinc/94/94/16/565949416.db2.gz ZNQRCGSWPLTMKO-INIZCTEOSA-N 0 3 379.298 3.214 10 0 GGAEHN CCN(CCc1nccs1)C[C@H](O)COc1cccc(Br)c1 ZINC000179040135 565954760 /nfs/dbraw/zinc/95/47/60/565954760.db2.gz COACDEMBBIOGIF-AWEZNQCLSA-N 0 3 385.327 3.210 10 0 GGAEHN Cc1cc(NC(=O)NCCCNCc2cccnc2)ccc1Br ZINC000414713630 565956934 /nfs/dbraw/zinc/95/69/34/565956934.db2.gz WADDMIUZPJFCCY-UHFFFAOYSA-N 0 3 377.286 3.454 10 0 GGAEHN CN(C[C@H]1CCCN(C(=O)CN)C1)[C@@H](c1ccc(Cl)cc1)C(F)(F)F ZINC000414742873 565957667 /nfs/dbraw/zinc/95/76/67/565957667.db2.gz GMKBNKRALAATRN-WBMJQRKESA-N 0 3 377.838 3.073 10 0 GGAEHN Cc1ccc(NC(=O)NCCCNCc2cccnc2)cc1Br ZINC000414781737 565960156 /nfs/dbraw/zinc/96/01/56/565960156.db2.gz CORJENANQHFXMV-UHFFFAOYSA-N 0 3 377.286 3.454 10 0 GGAEHN Cc1noc(CCN[C@@H]2CCCOc3ccc(I)cc32)n1 ZINC000360811250 565961602 /nfs/dbraw/zinc/96/16/02/565961602.db2.gz RHFHDDWPNGGLOF-CYBMUJFWSA-N 0 3 399.232 3.029 10 0 GGAEHN O=C(NCCCNCc1cccnc1)Nc1ccc(F)cc1Br ZINC000414886407 565963344 /nfs/dbraw/zinc/96/33/44/565963344.db2.gz YBKMNRWEESZIMZ-UHFFFAOYSA-N 0 3 381.249 3.285 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN[C@H]1CNCCC1(F)F ZINC000415008535 565969626 /nfs/dbraw/zinc/96/96/26/565969626.db2.gz WDOFRPARWNMAJJ-INIZCTEOSA-N 0 3 399.283 3.338 10 0 GGAEHN FC1(F)CCNC[C@H]1NCc1ccc(Br)c(Br)c1 ZINC000415008438 565969796 /nfs/dbraw/zinc/96/97/96/565969796.db2.gz WAFCBENQXCKLIX-LLVKDONJSA-N 0 3 384.062 3.298 10 0 GGAEHN [NH3+]C1(CNC(=O)c2cc(=O)c3cc(Br)ccc3[n-]2)CCCCCC1 ZINC000237769939 565970169 /nfs/dbraw/zinc/97/01/69/565970169.db2.gz GXOPQHGXHNZHAL-UHFFFAOYSA-N 0 3 392.297 3.072 10 0 GGAEHN CC(C)Oc1cc(Br)cc(NC(=O)N[C@@H]2CNCCC2(F)F)c1 ZINC000415240501 565980908 /nfs/dbraw/zinc/98/09/08/565980908.db2.gz ADJYEWJTQFAMSG-CYBMUJFWSA-N 0 3 392.244 3.355 10 0 GGAEHN CCC[C@@H](C(=O)N[C@H](C)c1cc2c(cc1Br)OCCO2)N(C)C ZINC000179562509 565989144 /nfs/dbraw/zinc/98/91/44/565989144.db2.gz QFINEZTVXIPOJP-RISCZKNCSA-N 0 3 385.302 3.128 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)[C@H](C)NC(=O)c1cccc(Cl)c1Cl ZINC000245424447 565989310 /nfs/dbraw/zinc/98/93/10/565989310.db2.gz CMUAQFAHTHDDQV-QWHCGFSZSA-N 0 3 386.323 3.054 10 0 GGAEHN CCN1CC[C@@H](N(C)C(=O)CSCC(=O)c2ccc(Cl)cc2)[C@@H](C)C1 ZINC000245415801 565989371 /nfs/dbraw/zinc/98/93/71/565989371.db2.gz GYZMJNPDEFOWMX-WMLDXEAASA-N 0 3 382.957 3.445 10 0 GGAEHN O=S1(=O)CCC[C@@H](CN[C@@H]2CCCOc3ccc(Br)cc32)C1 ZINC000287043199 565994179 /nfs/dbraw/zinc/99/41/79/565994179.db2.gz MKGWVSWATRDOPK-SWLSCSKDSA-N 0 3 388.327 3.077 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)Cc2ccc(Cl)cc2Cl)[C@@H](C)C1 ZINC000245741312 566004669 /nfs/dbraw/zinc/00/46/69/566004669.db2.gz RQJQZDCGVPQCOO-BLLLJJGKSA-N 0 3 379.353 3.485 10 0 GGAEHN CN1CC[C@@H]2[C@@H](CCCN2S(=O)(=O)Cc2ccc(Cl)cc2Cl)C1 ZINC000245738770 566004951 /nfs/dbraw/zinc/00/49/51/566004951.db2.gz REFNORMFFJJEJS-BLLLJJGKSA-N 0 3 377.337 3.239 10 0 GGAEHN CN1CCC(NC(=O)Nc2cc(C(F)(F)F)cc(Br)n2)CC1 ZINC000287234595 566005769 /nfs/dbraw/zinc/00/57/69/566005769.db2.gz AQEZYZQDFAKJSM-UHFFFAOYSA-N 0 3 381.196 3.079 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)N1CCOC[C@@H]1CC(F)F)c1ccsc1 ZINC000287280324 566009366 /nfs/dbraw/zinc/00/93/66/566009366.db2.gz VCWRVMRHWNXWHQ-LSDHHAIUSA-N 0 3 375.485 3.197 10 0 GGAEHN O=C(CCN1CCC[C@H](c2ccncn2)C1)Nc1cccc(Br)c1 ZINC000363550279 566009644 /nfs/dbraw/zinc/00/96/44/566009644.db2.gz ZKYYIGHCNSWODK-AWEZNQCLSA-N 0 3 389.297 3.447 10 0 GGAEHN COc1ccc(CNC(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)cc1Br ZINC000245918328 566010835 /nfs/dbraw/zinc/01/08/35/566010835.db2.gz GRPCXYAEFFUVBA-HOCLYGCPSA-N 0 3 396.329 3.083 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(F)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC000246118506 566017669 /nfs/dbraw/zinc/01/76/69/566017669.db2.gz IWTVQPIFOIJHBZ-NHYWBVRUSA-N 0 3 382.423 3.195 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(Br)ccc2C)[C@@H](C)C1 ZINC000246138453 566018915 /nfs/dbraw/zinc/01/89/15/566018915.db2.gz KEFUTZDGXIOKFV-ZFWWWQNUSA-N 0 3 389.359 3.108 10 0 GGAEHN O=C(Nc1cccc2c(Br)ccnc12)N[C@H]1CNCCC1(F)F ZINC000415783137 566018955 /nfs/dbraw/zinc/01/89/55/566018955.db2.gz CFTSXCFONRRZKP-LBPRGKRZSA-N 0 3 385.212 3.116 10 0 GGAEHN CN1CC=C(CNC(=O)Nc2cc(C(F)(F)F)cc(Br)n2)CC1 ZINC000287472620 566020202 /nfs/dbraw/zinc/02/02/02/566020202.db2.gz FWZUZDHPBOBEST-UHFFFAOYSA-N 0 3 393.207 3.246 10 0 GGAEHN O=c1c(Cl)c(N2CCN3CCC[C@H]3C2)cnn1-c1ccc(Cl)cc1Cl ZINC000246206496 566021350 /nfs/dbraw/zinc/02/13/50/566021350.db2.gz WDPDVQVZTNLZGW-LBPRGKRZSA-N 0 3 399.709 3.477 10 0 GGAEHN CNCc1ccccc1NC(=O)N[C@H](CCO)c1ccccc1Br ZINC000415918175 566022480 /nfs/dbraw/zinc/02/24/80/566022480.db2.gz FLDXOBJUXSYLJA-QGZVFWFLSA-N 0 3 392.297 3.414 10 0 GGAEHN CNCc1cccc(NC(=O)N[C@](C)(CO)c2ccc(Br)cc2)c1 ZINC000415929723 566022902 /nfs/dbraw/zinc/02/29/02/566022902.db2.gz JLLWDDNIISVNKY-GOSISDBHSA-N 0 3 392.297 3.198 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2F)[C@@H](C)C1 ZINC000246274692 566024514 /nfs/dbraw/zinc/02/45/14/566024514.db2.gz VEJKOOVXBPVYLT-FZMZJTMJSA-N 0 3 382.423 3.195 10 0 GGAEHN CCN(CC)[C@@H](CN[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccsc1 ZINC000180014908 566025325 /nfs/dbraw/zinc/02/53/25/566025325.db2.gz LRRINLOMSCYALP-KDOFPFPSSA-N 0 3 381.567 3.129 10 0 GGAEHN CN1CCC[C@H](CNC(=O)NC[C@@H](O)c2ccsc2)[C@@H]1c1cccs1 ZINC000246429780 566028069 /nfs/dbraw/zinc/02/80/69/566028069.db2.gz SWQGSYSHJXDRTB-FRFSOERESA-N 0 3 379.551 3.225 10 0 GGAEHN COCCN(CC(F)F)C(=O)NC[C@@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000246412113 566028602 /nfs/dbraw/zinc/02/86/02/566028602.db2.gz SBXIBEAAVVVPSR-BBRMVZONSA-N 0 3 375.485 3.054 10 0 GGAEHN CC(C)N1C[C@@H](C)[C@H](NC(=O)C(=O)Nc2cc(Cl)c(Cl)cc2Cl)C1 ZINC000246478291 566031148 /nfs/dbraw/zinc/03/11/48/566031148.db2.gz QNBMFZQRNKVRIG-YMTOWFKASA-N 0 3 392.714 3.430 10 0 GGAEHN C[C@@H](NC[C@H](O)c1cc(Cl)cc(Cl)c1)c1ccc(S(N)(=O)=O)cc1 ZINC000180123237 566033758 /nfs/dbraw/zinc/03/37/58/566033758.db2.gz JDRGJUNHDVRVFI-HWPZZCPQSA-N 0 3 389.304 3.025 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1ccc(Cl)c(OC(F)F)c1 ZINC000180133039 566035499 /nfs/dbraw/zinc/03/54/99/566035499.db2.gz QJUYUPOUHKLYLH-LBPRGKRZSA-N 0 3 377.819 3.174 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)Cc2ccc(Cl)c(Cl)c2)[C@@H](C)C1 ZINC000246698667 566036531 /nfs/dbraw/zinc/03/65/31/566036531.db2.gz ZGRLURAPVCYLLL-BLLLJJGKSA-N 0 3 379.353 3.485 10 0 GGAEHN CC[C@H](CN[C@H](C)c1ccc(S(N)(=O)=O)cc1)Oc1ccccc1Cl ZINC000180142664 566036700 /nfs/dbraw/zinc/03/67/00/566036700.db2.gz CGLOIHTYAMVDFK-UKRRQHHQSA-N 0 3 382.913 3.496 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(Cl)c(OC)cc2Cl)[C@@H](C)C1 ZINC000246711488 566037873 /nfs/dbraw/zinc/03/78/73/566037873.db2.gz ZZGSLPTWRFYGCO-SMDDNHRTSA-N 0 3 395.352 3.353 10 0 GGAEHN CO[C@H](c1ccc(Cl)cc1)[C@H](C)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000180179617 566041183 /nfs/dbraw/zinc/04/11/83/566041183.db2.gz FIPQALNQDXVLRB-LXIYXOSZSA-N 0 3 382.913 3.414 10 0 GGAEHN O=C(CN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)Nc1ccccc1Br ZINC000246796699 566041247 /nfs/dbraw/zinc/04/12/47/566041247.db2.gz MPFVEFPRQVWBMU-KBXCAEBGSA-N 0 3 392.341 3.336 10 0 GGAEHN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000180179650 566041242 /nfs/dbraw/zinc/04/12/42/566041242.db2.gz FIPQALNQDXVLRB-JCGVRSQUSA-N 0 3 382.913 3.414 10 0 GGAEHN C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1 ZINC000246801216 566041380 /nfs/dbraw/zinc/04/13/80/566041380.db2.gz BUNHZJYYFADIEM-DOMZBBRYSA-N 0 3 379.291 3.488 10 0 GGAEHN O=C(CN1CC[C@H]2[C@@H](CCCN2C2CC2)C1)Nc1ccccc1Br ZINC000246796717 566041428 /nfs/dbraw/zinc/04/14/28/566041428.db2.gz MPFVEFPRQVWBMU-KSSFIOAISA-N 0 3 392.341 3.336 10 0 GGAEHN C[C@@H](NC(=O)CCN1CCc2ccccc2C1)c1ccc(Br)cn1 ZINC000416220144 566045685 /nfs/dbraw/zinc/04/56/85/566045685.db2.gz WOWSMEKGINHKSV-CQSZACIVSA-N 0 3 388.309 3.470 10 0 GGAEHN C[C@@H]1CN(Cc2ccc(Br)c3cccnc23)C[C@@H]1N1CCOCC1 ZINC000180248717 566047401 /nfs/dbraw/zinc/04/74/01/566047401.db2.gz MXHBDSCRJJZMSQ-KDOFPFPSSA-N 0 3 390.325 3.150 10 0 GGAEHN C[C@H](NC(=O)C[C@@H](c1ccccc1)N(C)C)c1ncc(Br)cn1 ZINC000416240292 566048507 /nfs/dbraw/zinc/04/85/07/566048507.db2.gz NAFJBZKSKKTDIT-WFASDCNBSA-N 0 3 377.286 3.109 10 0 GGAEHN CCOCCCN1CC[C@H](NS(=O)(=O)c2cccc(Cl)c2C)[C@@H](C)C1 ZINC000247079149 566051687 /nfs/dbraw/zinc/05/16/87/566051687.db2.gz CXWDQKSIHFSDQX-YOEHRIQHSA-N 0 3 388.961 3.064 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1[C@H](C)C(=O)Nc1cccc(Br)c1 ZINC000247056207 566052004 /nfs/dbraw/zinc/05/20/04/566052004.db2.gz NUKTYOULGOBBEG-DYVFJYSZSA-N 0 3 391.313 3.446 10 0 GGAEHN Cc1ccc(OCCC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c(Br)c1 ZINC000247152263 566053639 /nfs/dbraw/zinc/05/36/39/566053639.db2.gz ADWNMSIMKMSOFH-LSDHHAIUSA-N 0 3 383.330 3.468 10 0 GGAEHN Cc1ccc(C(=O)N(C)[C@@H]2CCN(C)C[C@H]2C)cc1I ZINC000247155946 566054006 /nfs/dbraw/zinc/05/40/06/566054006.db2.gz AGZGVCLLXXIYQC-IUODEOHRSA-N 0 3 386.277 3.012 10 0 GGAEHN Cc1nn(CC(=O)NC[C@H]2CCCN(C)[C@H]2c2cccs2)c(C)c1Cl ZINC000247181565 566054687 /nfs/dbraw/zinc/05/46/87/566054687.db2.gz BCFJNIFSBBJZHE-RDTXWAMCSA-N 0 3 380.945 3.414 10 0 GGAEHN C[C@H](CC(=O)c1cccc(Br)c1)C(=O)N1C[C@@H]2CCCN2C[C@@H]1C ZINC000247298931 566057749 /nfs/dbraw/zinc/05/77/49/566057749.db2.gz GVQGGFUBCDLVSX-KEYYUXOJSA-N 0 3 393.325 3.353 10 0 GGAEHN C[C@H](CC(=O)c1cccc(Br)c1)C(=O)N1C[C@H]2CCCN2C[C@H]1C ZINC000247298884 566057898 /nfs/dbraw/zinc/05/78/98/566057898.db2.gz GVQGGFUBCDLVSX-CKEIUWERSA-N 0 3 393.325 3.353 10 0 GGAEHN Cc1ccc(O[C@H](C)C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c(Br)c1 ZINC000247369570 566059251 /nfs/dbraw/zinc/05/92/51/566059251.db2.gz KRJPFIPKBWKIBN-ZNMIVQPWSA-N 0 3 383.330 3.466 10 0 GGAEHN CC(C)N1C[C@H](C)[C@H](NC(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)C1 ZINC000247368617 566059455 /nfs/dbraw/zinc/05/94/55/566059455.db2.gz PAODHZHFKVWCCX-WDEREUQCSA-N 0 3 375.357 3.241 10 0 GGAEHN Cc1cccc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1I ZINC000247403961 566060183 /nfs/dbraw/zinc/06/01/83/566060183.db2.gz MUNDJIDMKXAXAR-STQMWFEESA-N 0 3 386.277 3.154 10 0 GGAEHN Cc1cccc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1I ZINC000247403954 566060387 /nfs/dbraw/zinc/06/03/87/566060387.db2.gz MUNDJIDMKXAXAR-QWHCGFSZSA-N 0 3 386.277 3.154 10 0 GGAEHN Cc1sc2ncnc(SCC(=O)N(C)[C@@H]3CCN(C)[C@@H](C)C3)c2c1C ZINC000247479771 566061412 /nfs/dbraw/zinc/06/14/12/566061412.db2.gz SQYSOTWYDDVWBA-SMDDNHRTSA-N 0 3 378.567 3.341 10 0 GGAEHN C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1 ZINC000247470946 566061664 /nfs/dbraw/zinc/06/16/64/566061664.db2.gz RQQXLRUDVINRML-OCCSQVGLSA-N 0 3 379.291 3.488 10 0 GGAEHN C[C@@H](CCc1ccc(Br)cc1)NC(=O)N1CCN2CCC[C@H]2C1 ZINC000247470389 566061756 /nfs/dbraw/zinc/06/17/56/566061756.db2.gz GXBKBRNYCUXIOA-YOEHRIQHSA-N 0 3 380.330 3.260 10 0 GGAEHN CN1CC[C@@H]2[C@H](CCCN2C(=O)c2c[nH]c3cccc(Br)c23)C1 ZINC000180423158 566061793 /nfs/dbraw/zinc/06/17/93/566061793.db2.gz NHVLUSNVAOOUMR-MLGOLLRUSA-N 0 3 376.298 3.487 10 0 GGAEHN Cc1cc(C(=O)N2CCN3CCC[C@H]3C2)nn1-c1ccc(Cl)cc1Cl ZINC000180449334 566062289 /nfs/dbraw/zinc/06/22/89/566062289.db2.gz QPXSKAUQVPZLOW-AWEZNQCLSA-N 0 3 379.291 3.408 10 0 GGAEHN C[C@H](CS(C)(=O)=O)N[C@H]1CCN(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000180448015 566062444 /nfs/dbraw/zinc/06/24/44/566062444.db2.gz KEXKPFKOZJSZAL-OAUYIBNBSA-N 0 3 390.952 3.416 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)N[C@H]1CCSc2ccc(Cl)cc21 ZINC000247650687 566063938 /nfs/dbraw/zinc/06/39/38/566063938.db2.gz WNDWMYRMVWVLGN-ZBFHGGJFSA-N 0 3 383.945 3.287 10 0 GGAEHN CN(Cc1c(F)cccc1Br)C1CCN(CCn2cccn2)CC1 ZINC000180478142 566065698 /nfs/dbraw/zinc/06/56/98/566065698.db2.gz UEQCQODJAAVOED-UHFFFAOYSA-N 0 3 395.320 3.381 10 0 GGAEHN CN(Cc1ccc(Br)s1)C(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C ZINC000364728312 566066792 /nfs/dbraw/zinc/06/67/92/566066792.db2.gz AFSPOAAFXUHOSX-PVXIVEMSSA-N 0 3 387.343 3.002 10 0 GGAEHN Cc1c([C@@H](C)NC[C@H]2CN(C)CCO2)cnn1-c1ccc(Cl)cc1Cl ZINC000180501427 566067737 /nfs/dbraw/zinc/06/77/37/566067737.db2.gz GNCXAANBDABGFB-DOMZBBRYSA-N 0 3 383.323 3.469 10 0 GGAEHN Cc1n[nH]c(C)c1[C@@H]1CCCN1C[C@H](O)COc1cccc(Br)c1 ZINC000180526920 566069971 /nfs/dbraw/zinc/06/99/71/566069971.db2.gz BYGYMAYPWJMXKV-RDJZCZTQSA-N 0 3 394.313 3.366 10 0 GGAEHN Brc1ccc(-c2noc(CN3CCN4CCCC[C@H]4C3)n2)s1 ZINC000248344040 566076087 /nfs/dbraw/zinc/07/60/87/566076087.db2.gz LBLNOTZZXWBNRN-NSHDSACASA-N 0 3 383.315 3.231 10 0 GGAEHN CCc1nc2n(n1)C[C@@H](N[C@H](C)c1ccc(I)cc1)CC2 ZINC000180625849 566078422 /nfs/dbraw/zinc/07/84/22/566078422.db2.gz WDQRFKNXFXRUII-RISCZKNCSA-N 0 3 396.276 3.111 10 0 GGAEHN O[C@@H]1CCC[C@@H](CN[C@H](c2ccc(Br)cc2)c2cncnc2)C1 ZINC000248565388 566081298 /nfs/dbraw/zinc/08/12/98/566081298.db2.gz ORLRUNNZKAGGMX-FSPWUOQZSA-N 0 3 376.298 3.469 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1C[C@@H](O)c1ccc(F)c(Br)c1 ZINC000248565385 566081560 /nfs/dbraw/zinc/08/15/60/566081560.db2.gz ORKLMHRUCKREHF-WMLDXEAASA-N 0 3 382.277 3.291 10 0 GGAEHN C[C@@H](CC(=O)Nc1ccc(Br)cc1)NCC(=O)NC1CCCCC1 ZINC000180732259 566083693 /nfs/dbraw/zinc/08/36/93/566083693.db2.gz MARUADFVVSRVEE-ZDUSSCGKSA-N 0 3 396.329 3.205 10 0 GGAEHN C[C@H](CC(=O)Nc1ccc(Br)cc1)NCC(=O)NC1CCCCC1 ZINC000180732277 566083770 /nfs/dbraw/zinc/08/37/70/566083770.db2.gz MARUADFVVSRVEE-CYBMUJFWSA-N 0 3 396.329 3.205 10 0 GGAEHN C[C@@H](CC(=O)Nc1cccc(Br)c1)NCC(=O)NC1CCCCC1 ZINC000180732308 566084770 /nfs/dbraw/zinc/08/47/70/566084770.db2.gz FYWUEWMVZMYXGT-ZDUSSCGKSA-N 0 3 396.329 3.205 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(Br)cc2C)[C@@H](C)C1 ZINC000248697157 566086048 /nfs/dbraw/zinc/08/60/48/566086048.db2.gz JXSKASXYGMKWJC-DZGCQCFKSA-N 0 3 389.359 3.108 10 0 GGAEHN Cc1csc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1I ZINC000248710177 566086544 /nfs/dbraw/zinc/08/65/44/566086544.db2.gz PTKARVCXFWIUBD-WDEREUQCSA-N 0 3 392.306 3.216 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)N[C@H](C)c2ccc(Br)cc2OC)C1 ZINC000248689752 566086973 /nfs/dbraw/zinc/08/69/73/566086973.db2.gz ITSPCJSLUGIALD-TZMCWYRMSA-N 0 3 384.318 3.302 10 0 GGAEHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1ncsc1Br ZINC000288714089 566087805 /nfs/dbraw/zinc/08/78/05/566087805.db2.gz SMEGIQQGPZHPLS-ZDUSSCGKSA-N 0 3 380.311 3.473 10 0 GGAEHN CN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)c1ncsc1Br ZINC000288736818 566089156 /nfs/dbraw/zinc/08/91/56/566089156.db2.gz BTTYADSBOCLQAB-CQSZACIVSA-N 0 3 394.338 3.500 10 0 GGAEHN CC(C(=O)N[C@H]1CCCC[C@H]1C)S(=O)(=O)Cc1csc(C(C)(C)C)n1 ZINC000248847118 566090055 /nfs/dbraw/zinc/09/00/55/566090055.db2.gz ALSRLUHUPHEWDQ-IPYPFGDCSA-N 0 3 386.583 3.439 10 0 GGAEHN CN1CC[C@@H](NC(=O)Nc2cncc(Br)c2)[C@H]1c1ccccc1 ZINC000249030035 566093898 /nfs/dbraw/zinc/09/38/98/566093898.db2.gz LMFGAUDEJWUNAR-HZPDHXFCSA-N 0 3 375.270 3.411 10 0 GGAEHN C[C@@H]1CN(C(=O)c2c(Cl)cc(F)cc2Cl)CC[C@H]1N1CCN(C)CC1 ZINC000365397274 566098850 /nfs/dbraw/zinc/09/88/50/566098850.db2.gz VGZXNDMAKUBEMD-MLGOLLRUSA-N 0 3 388.314 3.231 10 0 GGAEHN COc1cc(Br)ccc1CNC1CCN(c2cccnn2)CC1 ZINC000365469191 566102198 /nfs/dbraw/zinc/10/21/98/566102198.db2.gz KBHRDGDPKKIYDX-UHFFFAOYSA-N 0 3 377.286 3.006 10 0 GGAEHN OC[C@@H]1CN(C[C@@H](O)c2ccccc2Br)C[C@H]1c1ccsc1 ZINC000249552499 566104024 /nfs/dbraw/zinc/10/40/24/566104024.db2.gz INBKHQGONKSXNE-JLJPHGGASA-N 0 3 382.323 3.252 10 0 GGAEHN C[C@@H](NC(=O)CN(C)[C@@]1(CO)CC[C@@H](C)C1)c1ccc(Br)cc1 ZINC000249568670 566104602 /nfs/dbraw/zinc/10/46/02/566104602.db2.gz NRAHRCUIOARXMC-LBTNJELSSA-N 0 3 383.330 3.109 10 0 GGAEHN O=C(NCCCNCc1cccnc1)NCCSc1ccc(Cl)cc1 ZINC000416863717 566109612 /nfs/dbraw/zinc/10/96/12/566109612.db2.gz NREYWLFNKWUXRJ-UHFFFAOYSA-N 0 3 378.929 3.306 10 0 GGAEHN C[C@@H]1CCCN(CCNC(=O)N[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000252475208 566114378 /nfs/dbraw/zinc/11/43/78/566114378.db2.gz VXXVKZPHPGHKPV-CJNGLKHVSA-N 0 3 396.329 3.304 10 0 GGAEHN CC[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1cc(C)ccc1Br ZINC000252736263 566117448 /nfs/dbraw/zinc/11/74/48/566117448.db2.gz TVIFIIWCXLNIJZ-KBPBESRZSA-N 0 3 387.343 3.005 10 0 GGAEHN COc1nc(C)c(Br)cc1-c1noc(CC2CCN(C)CC2)n1 ZINC000289332054 566117687 /nfs/dbraw/zinc/11/76/87/566117687.db2.gz ZTXBIHMIQMGKDN-UHFFFAOYSA-N 0 3 381.274 3.095 10 0 GGAEHN C[C@H]1CN(C2CCOCC2)CCN1Cc1nc2cc(Br)ccc2[nH]1 ZINC000365817387 566121174 /nfs/dbraw/zinc/12/11/74/566121174.db2.gz ATCNRLNEZVSHCJ-ZDUSSCGKSA-N 0 3 393.329 3.011 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)c2coc(-c3ccc(Br)cc3F)n2)C1 ZINC000181200331 566123670 /nfs/dbraw/zinc/12/36/70/566123670.db2.gz PLCFCSGQWIKOHH-NSHDSACASA-N 0 3 382.233 3.019 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)NC[C@@H](N)c1ccccc1 ZINC000417097005 566125048 /nfs/dbraw/zinc/12/50/48/566125048.db2.gz DDZKLBABJQFQRI-SUMWQHHRSA-N 0 3 376.298 3.379 10 0 GGAEHN COc1ccc(CN2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)c(Br)c1[O-] ZINC000261621735 566126915 /nfs/dbraw/zinc/12/69/15/566126915.db2.gz BZVBRVLVFASDJQ-CVEARBPZSA-N 0 3 391.309 3.338 10 0 GGAEHN NC1(C(=O)NCC2(c3cccc(Br)c3)CCCCC2)CCOCC1 ZINC000261673414 566128747 /nfs/dbraw/zinc/12/87/47/566128747.db2.gz CDJAEEDYSZZENV-UHFFFAOYSA-N 0 3 395.341 3.275 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)[C@](C)(N)c1ccc(Br)cc1 ZINC000261702327 566131094 /nfs/dbraw/zinc/13/10/94/566131094.db2.gz IOFLMCLZTWJKTR-HBUWYVDXSA-N 0 3 382.346 3.002 10 0 GGAEHN CCNC(=O)N1CC[C@H](N[C@@H]2CCCOc3ccc(Br)cc32)C1 ZINC000181329382 566132926 /nfs/dbraw/zinc/13/29/26/566132926.db2.gz FBAGAHCBUSOUNR-DZGCQCFKSA-N 0 3 382.302 3.056 10 0 GGAEHN NC1(C(=O)Nc2ncc(Cc3cc(Cl)ccc3Cl)s2)CCOCC1 ZINC000261822743 566136533 /nfs/dbraw/zinc/13/65/33/566136533.db2.gz KJCLOAVRKBCWEL-UHFFFAOYSA-N 0 3 386.304 3.487 10 0 GGAEHN COCCOc1c(Cl)cc(NC(=O)N2CC[C@@H](N(C)C)C2)cc1Cl ZINC000181459437 566142219 /nfs/dbraw/zinc/14/22/19/566142219.db2.gz UCJAAPFLRCSSQA-GFCCVEGCSA-N 0 3 376.284 3.186 10 0 GGAEHN C[C@H](Cc1cccc(Br)c1)NC(=O)NC[C@@H](N)c1ccccc1 ZINC000417278220 566142757 /nfs/dbraw/zinc/14/27/57/566142757.db2.gz IPQVKPPCZAIFEJ-CXAGYDPISA-N 0 3 376.298 3.379 10 0 GGAEHN C[C@H](NC(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C)c1ccc(Br)cc1 ZINC000261970152 566143443 /nfs/dbraw/zinc/14/34/43/566143443.db2.gz YWPWHFDKUYMFFQ-NVJLRMAKSA-N 0 3 381.314 3.159 10 0 GGAEHN C[C@@H](NCC1(C(N)=O)CCOCC1)c1cc2cc(Br)ccc2o1 ZINC000181484902 566143567 /nfs/dbraw/zinc/14/35/67/566143567.db2.gz RAJFCBQGJPETHH-LLVKDONJSA-N 0 3 381.270 3.128 10 0 GGAEHN CN(Cc1csc(Br)c1)C(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C ZINC000262451193 566152763 /nfs/dbraw/zinc/15/27/63/566152763.db2.gz HVYUUHWCVOJLOQ-AXAPSJFSSA-N 0 3 387.343 3.002 10 0 GGAEHN CN(Cc1csc(Br)c1)C(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C ZINC000262451195 566152828 /nfs/dbraw/zinc/15/28/28/566152828.db2.gz HVYUUHWCVOJLOQ-NORZTCDRSA-N 0 3 387.343 3.002 10 0 GGAEHN C[C@@H](NC[C@@H]1CCCN(S(C)(=O)=O)C1)c1cc(F)c(Cl)cc1Cl ZINC000181645129 566154737 /nfs/dbraw/zinc/15/47/37/566154737.db2.gz IZHGWOONTTYLPM-MNOVXSKESA-N 0 3 383.316 3.455 10 0 GGAEHN C[C@@H](NC[C@H]1CCCN(S(C)(=O)=O)C1)c1cc(F)c(Cl)cc1Cl ZINC000181645172 566154994 /nfs/dbraw/zinc/15/49/94/566154994.db2.gz IZHGWOONTTYLPM-GHMZBOCLSA-N 0 3 383.316 3.455 10 0 GGAEHN C[C@H](NC[C@@H]1CCCN(S(C)(=O)=O)C1)c1cc(F)c(Cl)cc1Cl ZINC000181645109 566155420 /nfs/dbraw/zinc/15/54/20/566155420.db2.gz IZHGWOONTTYLPM-QWRGUYRKSA-N 0 3 383.316 3.455 10 0 GGAEHN C[C@H](CC(=O)NC1CCN([C@H]2CCOC2)CC1)c1ccc(Br)cc1 ZINC000366592726 566159548 /nfs/dbraw/zinc/15/95/48/566159548.db2.gz VXHYMQFBBKYVFS-KDOFPFPSSA-N 0 3 395.341 3.312 10 0 GGAEHN C[C@H](CC(=O)NC1CCN([C@@H]2CCOC2)CC1)c1ccc(Br)cc1 ZINC000366592728 566159947 /nfs/dbraw/zinc/15/99/47/566159947.db2.gz VXHYMQFBBKYVFS-RDTXWAMCSA-N 0 3 395.341 3.312 10 0 GGAEHN CNS(=O)(=O)c1ccc([C@H](C)NCCOCc2ccc(Cl)cc2)cc1 ZINC000181711456 566160470 /nfs/dbraw/zinc/16/04/70/566160470.db2.gz HOJOCJJUJICGLF-AWEZNQCLSA-N 0 3 382.913 3.116 10 0 GGAEHN COCCN1CCN(CCCc2ccc(Br)cc2OC)C[C@@H]1C ZINC000181817747 566166890 /nfs/dbraw/zinc/16/68/90/566166890.db2.gz JTHWHXMICGTCKC-HNNXBMFYSA-N 0 3 385.346 3.043 10 0 GGAEHN C[C@H](CNC(=O)NC[C@@H](N)c1ccccc1)Oc1cccc(Br)c1 ZINC000417793575 566175161 /nfs/dbraw/zinc/17/51/61/566175161.db2.gz LPQIWOIDXQVNDY-CXAGYDPISA-N 0 3 392.297 3.216 10 0 GGAEHN C[C@@H](CNC(=O)NC[C@@H](N)c1ccccc1)Oc1cccc(Br)c1 ZINC000417793578 566175999 /nfs/dbraw/zinc/17/59/99/566175999.db2.gz LPQIWOIDXQVNDY-SUMWQHHRSA-N 0 3 392.297 3.216 10 0 GGAEHN C[C@@H](CNC(=O)NC[C@H](N)c1ccccc1)Oc1cccc(Br)c1 ZINC000417793577 566176181 /nfs/dbraw/zinc/17/61/81/566176181.db2.gz LPQIWOIDXQVNDY-GUYCJALGSA-N 0 3 392.297 3.216 10 0 GGAEHN O=C(NCCCc1nccs1)NCC1CCN(Cc2cccs2)CC1 ZINC000290650961 566183457 /nfs/dbraw/zinc/18/34/57/566183457.db2.gz GPAJCGNYRGATCL-UHFFFAOYSA-N 0 3 378.567 3.349 10 0 GGAEHN C[C@H](CS(C)(=O)=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)N2C ZINC000367163562 566188858 /nfs/dbraw/zinc/18/88/58/566188858.db2.gz KOZGWQZBXDWCIQ-GYISXVGNSA-N 0 3 384.973 3.277 10 0 GGAEHN CCn1nncc1CN[C@H](C)CCc1ccc(I)cc1 ZINC000418032279 566190945 /nfs/dbraw/zinc/19/09/45/566190945.db2.gz PMILZQOXCRLKIB-GFCCVEGCSA-N 0 3 384.265 3.014 10 0 GGAEHN CC(C)NC(=O)CCN1CCC(C(=O)Nc2cccc(Br)c2)CC1 ZINC000263667891 566192880 /nfs/dbraw/zinc/19/28/80/566192880.db2.gz FTSQYLPWIMSDHT-UHFFFAOYSA-N 0 3 396.329 3.014 10 0 GGAEHN CC[C@@H](NC(=O)N[C@@H]1CNCCC1(F)F)c1cc(F)cc(Br)c1 ZINC000418145571 566200339 /nfs/dbraw/zinc/20/03/39/566200339.db2.gz OKMKEFKFORTFIW-CHWSQXEVSA-N 0 3 394.235 3.336 10 0 GGAEHN CC[C@@H](N[C@H]1CCN(C2CCOCC2)C1=O)c1cccc(Br)c1 ZINC000367412548 566200525 /nfs/dbraw/zinc/20/05/25/566200525.db2.gz KHAGRUXFYDPLRO-SJORKVTESA-N 0 3 381.314 3.270 10 0 GGAEHN COCC[C@H](NC(=O)N[C@@H]1CNCCC1(F)F)c1ccc(Cl)c(Cl)c1 ZINC000418172410 566202112 /nfs/dbraw/zinc/20/21/12/566202112.db2.gz RPHJVADHQTWUOQ-UONOGXRCSA-N 0 3 396.265 3.367 10 0 GGAEHN COCC[C@H](NC(=O)N[C@H]1CNCCC1(F)F)c1ccc(Cl)c(Cl)c1 ZINC000418172408 566202704 /nfs/dbraw/zinc/20/27/04/566202704.db2.gz RPHJVADHQTWUOQ-KBPBESRZSA-N 0 3 396.265 3.367 10 0 GGAEHN CN1CC[C@@H]2[C@H](CCCN2C(=O)NCc2cc(F)cc(Br)c2)C1 ZINC000182435081 566204725 /nfs/dbraw/zinc/20/47/25/566204725.db2.gz LBFNIXOOXPCOHW-CZUORRHYSA-N 0 3 384.293 3.214 10 0 GGAEHN Cc1ccc(Br)cc1NC(=O)CCN[C@H]1CCCc2n[nH]cc21 ZINC000367525052 566205649 /nfs/dbraw/zinc/20/56/49/566205649.db2.gz DLMDCAKEPKBCFT-AWEZNQCLSA-N 0 3 377.286 3.476 10 0 GGAEHN CN(Cc1ccccc1Br)C(=O)CCN[C@H]1CCCc2n[nH]cc21 ZINC000367534864 566205754 /nfs/dbraw/zinc/20/57/54/566205754.db2.gz YYNMJEQEHBJTJF-INIZCTEOSA-N 0 3 391.313 3.188 10 0 GGAEHN Brc1ccccc1-c1noc(C2CCN([C@@H]3CCOC3)CC2)n1 ZINC000367558943 566207234 /nfs/dbraw/zinc/20/72/34/566207234.db2.gz HMYURULKKGFICX-CYBMUJFWSA-N 0 3 378.270 3.467 10 0 GGAEHN N[C@@H](CNC(=O)N[C@@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000418425326 566213149 /nfs/dbraw/zinc/21/31/49/566213149.db2.gz HYWWEPZHGWUOEZ-IRXDYDNUSA-N 0 3 382.291 3.416 10 0 GGAEHN N[C@H](CNC(=O)N1CCc2c(Br)ccc(F)c2C1)c1ccccc1 ZINC000418434427 566213306 /nfs/dbraw/zinc/21/33/06/566213306.db2.gz VKEPECHLSCTVQD-QGZVFWFLSA-N 0 3 392.272 3.356 10 0 GGAEHN N[C@H](CNC(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000418426302 566213381 /nfs/dbraw/zinc/21/33/81/566213381.db2.gz JIVQFYHCJOYTGP-QGZVFWFLSA-N 0 3 382.291 3.197 10 0 GGAEHN N[C@@H](CNC(=O)N1CCc2cc(Br)cc(F)c2C1)c1ccccc1 ZINC000418430206 566213535 /nfs/dbraw/zinc/21/35/35/566213535.db2.gz OTMNTTLEFBFYQY-KRWDZBQOSA-N 0 3 392.272 3.356 10 0 GGAEHN O=C(NCc1ccc2c(c1)CNC2)N1CCc2cccc(Br)c2C1 ZINC000418548900 566216395 /nfs/dbraw/zinc/21/63/95/566216395.db2.gz CWTOULOJTWUEOL-UHFFFAOYSA-N 0 3 386.293 3.320 10 0 GGAEHN CCOc1cc(C[NH2+][C@H]2CCN(c3ccccn3)C2)cc(Br)c1[O-] ZINC000291382856 566218026 /nfs/dbraw/zinc/21/80/26/566218026.db2.gz BHKBUVUGKQZKSN-AWEZNQCLSA-N 0 3 392.297 3.317 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)N1CCC[C@@H]1c1ccc(Br)cc1 ZINC000418747187 566221893 /nfs/dbraw/zinc/22/18/93/566221893.db2.gz AFAWJKSUEYPNND-KGLIPLIRSA-N 0 3 388.256 3.293 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)N(Cc1csc(Br)c1)C1CC1 ZINC000418749371 566221965 /nfs/dbraw/zinc/22/19/65/566221965.db2.gz CAJAVBYPYAVGEV-LLVKDONJSA-N 0 3 394.285 3.182 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)N1CCC[C@@H]1c1ccc(Br)cc1 ZINC000418747189 566222036 /nfs/dbraw/zinc/22/20/36/566222036.db2.gz AFAWJKSUEYPNND-ZIAGYGMSSA-N 0 3 388.256 3.293 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)N(Cc1csc(Br)c1)C1CC1 ZINC000418749372 566222271 /nfs/dbraw/zinc/22/22/71/566222271.db2.gz CAJAVBYPYAVGEV-NSHDSACASA-N 0 3 394.285 3.182 10 0 GGAEHN OC[C@@H](CN[C@@H]1CCCOc2c(Br)cccc21)c1cccnc1 ZINC000367905525 566222260 /nfs/dbraw/zinc/22/22/60/566222260.db2.gz XJPHSWSSFHARKO-RHSMWYFYSA-N 0 3 377.282 3.424 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)N1CCC[C@H]1c1ccc(Br)cc1 ZINC000418747186 566222530 /nfs/dbraw/zinc/22/25/30/566222530.db2.gz AFAWJKSUEYPNND-KBPBESRZSA-N 0 3 388.256 3.293 10 0 GGAEHN C[C@@H](c1ccccc1Br)N(C)C(=O)N[C@@H]1CNCCC1(F)F ZINC000418775930 566223094 /nfs/dbraw/zinc/22/30/94/566223094.db2.gz WQVBSRZDBUIUNQ-GXFFZTMASA-N 0 3 376.245 3.149 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)N(Cc1ccc(F)cc1Cl)CC1CC1 ZINC000418777444 566223266 /nfs/dbraw/zinc/22/32/66/566223266.db2.gz YFOTWIIBQGLTIH-HNNXBMFYSA-N 0 3 375.822 3.398 10 0 GGAEHN CN(Cc1ccc(Br)cc1Cl)C(=O)N[C@H]1CNCCC1(F)F ZINC000418777339 566223427 /nfs/dbraw/zinc/22/34/27/566223427.db2.gz XXBPJARMQDQYFT-LBPRGKRZSA-N 0 3 396.663 3.241 10 0 GGAEHN CN(Cc1cc(Br)ccc1Cl)C(=O)N[C@@H]1CNCCC1(F)F ZINC000418768218 566223456 /nfs/dbraw/zinc/22/34/56/566223456.db2.gz QZQHQPGWFWTLIV-GFCCVEGCSA-N 0 3 396.663 3.241 10 0 GGAEHN C[C@@H](NCCOc1ccc(Cl)cc1Cl)c1ccc(S(N)(=O)=O)cc1 ZINC000182861918 566227261 /nfs/dbraw/zinc/22/72/61/566227261.db2.gz DGVCOSLDGCVPLI-LLVKDONJSA-N 0 3 389.304 3.370 10 0 GGAEHN CN1CC[C@H](NCC(=O)Nc2cccnc2Cl)[C@@H]1c1ccc(Cl)cc1 ZINC000368064170 566229017 /nfs/dbraw/zinc/22/90/17/566229017.db2.gz OWOIRDPZZXWSEN-YOEHRIQHSA-N 0 3 379.291 3.362 10 0 GGAEHN OCCN1CCCN(c2ccc3cc(Br)cc(Cl)c3n2)CC1 ZINC000182930470 566230060 /nfs/dbraw/zinc/23/00/60/566230060.db2.gz MNNYIDXUIHTTHK-UHFFFAOYSA-N 0 3 384.705 3.155 10 0 GGAEHN Cc1cn[nH]c1CN1CCC(C(=O)Nc2ccc(Br)cc2)CC1 ZINC000368216788 566232938 /nfs/dbraw/zinc/23/29/38/566232938.db2.gz UTXMSZBIQRKCGO-UHFFFAOYSA-N 0 3 377.286 3.331 10 0 GGAEHN C[C@H](NC(=O)N1CC[C@H](N2CC=CC2)C1)c1ccc(Br)cc1F ZINC000291751977 566233365 /nfs/dbraw/zinc/23/33/65/566233365.db2.gz SVLSKRKAZZXTGM-JSGCOSHPSA-N 0 3 382.277 3.305 10 0 GGAEHN O=C1C[C@@H]([C@H]2CCCCN2Cc2nc3cc(Br)ccc3o2)CN1 ZINC000368505073 566240360 /nfs/dbraw/zinc/24/03/60/566240360.db2.gz UHHRCSIOCVUENL-BXUZGUMPSA-N 0 3 378.270 3.081 10 0 GGAEHN O=C1C[C@H]([C@@H]2CCCCN2Cc2nc3cc(Br)ccc3o2)CN1 ZINC000368505074 566240722 /nfs/dbraw/zinc/24/07/22/566240722.db2.gz UHHRCSIOCVUENL-FZMZJTMJSA-N 0 3 378.270 3.081 10 0 GGAEHN OC[C@@H](CN[C@H]1CCCOc2ccc(Br)cc21)c1cccnc1 ZINC000368577420 566242304 /nfs/dbraw/zinc/24/23/04/566242304.db2.gz WIBNSYRTKHGZRR-PBHICJAKSA-N 0 3 377.282 3.424 10 0 GGAEHN C[C@@]1(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCCS1 ZINC000369084126 566249536 /nfs/dbraw/zinc/24/95/36/566249536.db2.gz LEVBZZVNIWSIOC-XUJLQICISA-N 0 3 379.492 3.377 10 0 GGAEHN O[C@@H]([C@H]1CCCN(CCCc2nc(-c3cccs3)no2)C1)C(F)(F)F ZINC000444733018 566250668 /nfs/dbraw/zinc/25/06/68/566250668.db2.gz QBRCZGIOBUNBTO-FZMZJTMJSA-N 0 3 375.416 3.366 10 0 GGAEHN O[C@H]([C@H]1CCCN(CCCc2nc(-c3cccs3)no2)C1)C(F)(F)F ZINC000444733025 566250808 /nfs/dbraw/zinc/25/08/08/566250808.db2.gz QBRCZGIOBUNBTO-SMDDNHRTSA-N 0 3 375.416 3.366 10 0 GGAEHN CCOC(=O)C[C@H](O)CN1CCC(OCc2ccc(Cl)c(Cl)c2)CC1 ZINC000599311534 566253086 /nfs/dbraw/zinc/25/30/86/566253086.db2.gz JOOIJCYUIXEBKD-AWEZNQCLSA-N 0 3 390.307 3.289 10 0 GGAEHN COCCOc1ccc(Br)cc1NC(=O)c1ccc2c(c1)CNC2 ZINC000575124962 566253771 /nfs/dbraw/zinc/25/37/71/566253771.db2.gz QDUKFKZXGFGTKI-UHFFFAOYSA-N 0 3 391.265 3.330 10 0 GGAEHN CC(C)N(CCN(C)C)c1ncnc2cccc(I)c21 ZINC000444828800 566254159 /nfs/dbraw/zinc/25/41/59/566254159.db2.gz WREDMCLOVIWHPG-UHFFFAOYSA-N 0 3 384.265 3.011 10 0 GGAEHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)c1[nH]nc2ccc(Br)cc21 ZINC000599352002 566254986 /nfs/dbraw/zinc/25/49/86/566254986.db2.gz HXAPGNYLYOWFOZ-NEPJUHHUSA-N 0 3 379.302 3.176 10 0 GGAEHN CN(C)S(=O)(=O)CCN(C)[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000509028325 566255296 /nfs/dbraw/zinc/25/52/96/566255296.db2.gz GCQNPUCKAFDPNP-CVEARBPZSA-N 0 3 378.460 3.165 10 0 GGAEHN OCC1(CO)CCN(Cc2ccc(-c3ccccc3Br)cc2)C1 ZINC000668665155 566256322 /nfs/dbraw/zinc/25/63/22/566256322.db2.gz GRGDFELOPGSKHY-UHFFFAOYSA-N 0 3 376.294 3.293 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1CC[C@@H]2COC[C@H]2C1 ZINC000668705040 566257445 /nfs/dbraw/zinc/25/74/45/566257445.db2.gz FPJTTWSISWHAKR-GDBMZVCRSA-N 0 3 376.298 3.412 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1CC[C@H]2COC[C@H]2C1 ZINC000668706573 566258437 /nfs/dbraw/zinc/25/84/37/566258437.db2.gz UZZQKBRALSNIPD-GOEBONIOSA-N 0 3 376.298 3.412 10 0 GGAEHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)c1cc2c(cncc2Br)s1 ZINC000648299222 566258580 /nfs/dbraw/zinc/25/85/80/566258580.db2.gz HWNPAQOZNQLULZ-ZWNOBZJWSA-N 0 3 382.327 3.471 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CC[C@H]2COC[C@@H]2C1 ZINC000668704055 566259186 /nfs/dbraw/zinc/25/91/86/566259186.db2.gz BORNWUMBMIPFPQ-HOCLYGCPSA-N 0 3 376.298 3.412 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1CCC2(COC2)C1 ZINC000668719971 566260365 /nfs/dbraw/zinc/26/03/65/566260365.db2.gz GZAPGZPEUPUKSM-UHFFFAOYSA-N 0 3 376.298 3.474 10 0 GGAEHN CC(C)NC(=O)[C@H]1CCCN(CC2=Cc3cc(Br)ccc3OC2)C1 ZINC000668732729 566260455 /nfs/dbraw/zinc/26/04/55/566260455.db2.gz FMIJYQQGTHHYGK-HNNXBMFYSA-N 0 3 393.325 3.462 10 0 GGAEHN CN(C)CC[C@](C)(O)CNC(=O)c1cc(Br)cc2ccccc21 ZINC000420028680 566261432 /nfs/dbraw/zinc/26/14/32/566261432.db2.gz COZFNIIFYNHHAS-SFHVURJKSA-N 0 3 379.298 3.035 10 0 GGAEHN CN1CCN(C)[C@H](CN[C@@H]2CCC(C)(C)c3ccc(Br)cc32)C1 ZINC000481923007 566265761 /nfs/dbraw/zinc/26/57/61/566265761.db2.gz JRHRRFBPVXEKNB-CRAIPNDOSA-N 0 3 380.374 3.397 10 0 GGAEHN COC(=O)[C@@H]1CCCC[C@@H]1N[C@H]1CCc2cc(Br)ccc2NC1=O ZINC000599433465 566266300 /nfs/dbraw/zinc/26/63/00/566266300.db2.gz SLASJHVEZYXZHP-KBMXLJTQSA-N 0 3 395.297 3.024 10 0 GGAEHN CN(C[C@H]1CCCN(C)C1)C(=O)c1c(F)c(F)c(Br)c(F)c1F ZINC000668800630 566268314 /nfs/dbraw/zinc/26/83/14/566268314.db2.gz WBNNIPFTDBROPC-QMMMGPOBSA-N 0 3 397.210 3.419 10 0 GGAEHN C[C@@H]1CN(CCCOc2cccc(I)c2)CCCO1 ZINC000556064725 566268307 /nfs/dbraw/zinc/26/83/07/566268307.db2.gz AVKLLEVCQOVMHR-CYBMUJFWSA-N 0 3 375.250 3.171 10 0 GGAEHN CN(C[C@@H]1CCCN(C)C1)C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000668800400 566269443 /nfs/dbraw/zinc/26/94/43/566269443.db2.gz NWFDGQGKHUFMAH-OAHLLOKOSA-N 0 3 394.357 3.463 10 0 GGAEHN Brc1cc(CN2CCCc3[nH]ncc3C2)cc2c1OCCCO2 ZINC000668844712 566270674 /nfs/dbraw/zinc/27/06/74/566270674.db2.gz ISLAZHVJEUUOJI-UHFFFAOYSA-N 0 3 378.270 3.282 10 0 GGAEHN CCN(CC)[C@H](CN[C@@H](C)Cn1cc(Br)ccc1=O)c1ccco1 ZINC000556233883 566276533 /nfs/dbraw/zinc/27/65/33/566276533.db2.gz LTNRTGSZOGBJLU-GOEBONIOSA-N 0 3 396.329 3.265 10 0 GGAEHN CN(C)CCn1nccc1NC(=O)c1cc2c(cncc2Br)s1 ZINC000648403109 566278186 /nfs/dbraw/zinc/27/81/86/566278186.db2.gz SCCLGQYGKJKRHW-UHFFFAOYSA-N 0 3 394.298 3.069 10 0 GGAEHN Fc1ccc([C@@H](NCCCCn2cc(Br)cn2)c2c[nH]nn2)cc1 ZINC000556243813 566278485 /nfs/dbraw/zinc/27/84/85/566278485.db2.gz NFRCAOCDYCNSNL-MRXNPFEDSA-N 0 3 393.264 3.062 10 0 GGAEHN CN1CC[C@]2(CCN(C(=O)c3cc4c(cncc4Br)s3)C2)C1 ZINC000648400363 566278426 /nfs/dbraw/zinc/27/84/26/566278426.db2.gz PBMDMQGQMBLYFS-INIZCTEOSA-N 0 3 380.311 3.227 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2csc(-c3ccccc3)n2)[C@H](C)C1 ZINC000462300250 566278662 /nfs/dbraw/zinc/27/86/62/566278662.db2.gz ILVVVAUGTKHZPE-GDBMZVCRSA-N 0 3 379.551 3.161 10 0 GGAEHN COc1cc2c(cc1F)CC[C@H]2N[C@H](C)Cn1cc(Br)ccc1=O ZINC000556260582 566279657 /nfs/dbraw/zinc/27/96/57/566279657.db2.gz MAAKLCNKBRJLQE-BDJLRTHQSA-N 0 3 395.272 3.424 10 0 GGAEHN COc1cc2c(cc1F)CC[C@H]2N[C@@H](C)Cn1cc(Br)ccc1=O ZINC000556260592 566280480 /nfs/dbraw/zinc/28/04/80/566280480.db2.gz MAAKLCNKBRJLQE-MEDUHNTESA-N 0 3 395.272 3.424 10 0 GGAEHN OCCn1ncc2c1CCC[C@H]2N[C@@H]1CCc2c1ccc(F)c2Br ZINC000648434166 566285585 /nfs/dbraw/zinc/28/55/85/566285585.db2.gz VARYXAYJBMMYEF-HZPDHXFCSA-N 0 3 394.288 3.432 10 0 GGAEHN COc1ccc(CCC(=O)N(C)[C@@H]2CCN(C)C[C@@H]2C)c(Br)c1 ZINC000669119721 566286240 /nfs/dbraw/zinc/28/62/40/566286240.db2.gz GDAZMIGFSJDDPO-SUMWQHHRSA-N 0 3 383.330 3.189 10 0 GGAEHN COc1ccc(CCC(=O)N(C)[C@H]2CCN(C)C[C@H]2C)c(Br)c1 ZINC000669119719 566287047 /nfs/dbraw/zinc/28/70/47/566287047.db2.gz GDAZMIGFSJDDPO-DYVFJYSZSA-N 0 3 383.330 3.189 10 0 GGAEHN COC(=O)C1C[C@H](C)N(CCC(=O)Nc2ccccc2Br)[C@@H](C)C1 ZINC000599695913 566287636 /nfs/dbraw/zinc/28/76/36/566287636.db2.gz LWCPHLZJINIBRV-STQMWFEESA-N 0 3 397.313 3.440 10 0 GGAEHN CC(C)N1CCCN(C(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)CC1 ZINC000625208630 566288110 /nfs/dbraw/zinc/28/81/10/566288110.db2.gz KZRCLJPNIIYAMM-CGTJXYLNSA-N 0 3 377.326 3.278 10 0 GGAEHN COC(=O)C1C[C@H](C)N(C[C@H](O)COc2c(Cl)cccc2Cl)[C@@H](C)C1 ZINC000599705789 566288647 /nfs/dbraw/zinc/28/86/47/566288647.db2.gz HQVLWPGJWAHYKY-OBJOEFQTSA-N 0 3 390.307 3.395 10 0 GGAEHN COC(=O)C1C[C@H](C)N(C[C@H](O)COc2cc(Cl)ccc2Cl)[C@@H](C)C1 ZINC000599711581 566289693 /nfs/dbraw/zinc/28/96/93/566289693.db2.gz UOJAAEGIKUJXCR-HUBLWGQQSA-N 0 3 390.307 3.395 10 0 GGAEHN COC(=O)C1C[C@H](C)N(C[C@H](O)COc2ccc(Cl)cc2Cl)[C@@H](C)C1 ZINC000599710360 566290028 /nfs/dbraw/zinc/29/00/28/566290028.db2.gz QTJWHXQYOWBYKM-HUBLWGQQSA-N 0 3 390.307 3.395 10 0 GGAEHN C[C@H]1C[C@H](NC(=O)c2cc(Br)cc(N3CCCC3)c2)CCN1C ZINC000669184438 566290274 /nfs/dbraw/zinc/29/02/74/566290274.db2.gz ZFLQPRGJEOLIRK-XJKSGUPXSA-N 0 3 380.330 3.262 10 0 GGAEHN C[C@H](Cc1ccc(F)c(Br)c1)C(=O)N(C)[C@H]1CN2CCC1CC2 ZINC000482181313 566290745 /nfs/dbraw/zinc/29/07/45/566290745.db2.gz QYEDNGNRIXOLEV-PXAZEXFGSA-N 0 3 383.305 3.319 10 0 GGAEHN CCCCN(C)CCNS(=O)(=O)c1cccc(Br)c1Cl ZINC000556363569 566290992 /nfs/dbraw/zinc/29/09/92/566290992.db2.gz YJZAATXGVJSQLK-UHFFFAOYSA-N 0 3 383.739 3.113 10 0 GGAEHN CN1Cc2ccccc2[C@@H](NC(=O)c2n[nH]c3ccc(Br)cc32)C1 ZINC000535279481 566292015 /nfs/dbraw/zinc/29/20/15/566292015.db2.gz CKRGLKIICYINSF-INIZCTEOSA-N 0 3 385.265 3.242 10 0 GGAEHN CN1CCC2(CCCN2C(=O)Nc2cnc3c(Br)cccn23)CC1 ZINC000575863513 566292346 /nfs/dbraw/zinc/29/23/46/566292346.db2.gz OLGJTSWPXUBNCQ-UHFFFAOYSA-N 0 3 392.301 3.189 10 0 GGAEHN CN(C)C1(CN(C)S(=O)(=O)c2cccc(Br)c2Cl)CCC1 ZINC000556373352 566292990 /nfs/dbraw/zinc/29/29/90/566292990.db2.gz KPZPYKSVPQUTGC-UHFFFAOYSA-N 0 3 395.750 3.207 10 0 GGAEHN O=C(NCc1cc(F)cc(Br)c1)N1CCN(C2CCCC2)CC1 ZINC000556382424 566294026 /nfs/dbraw/zinc/29/40/26/566294026.db2.gz VIGXYFNOFANRTF-UHFFFAOYSA-N 0 3 384.293 3.358 10 0 GGAEHN CS[C@@H]1CN(C(=O)[C@@H]2[C@@H]3Cc4cc(Cl)ccc4[C@@H]32)C[C@H]1N1CCCC1 ZINC000599763278 566294073 /nfs/dbraw/zinc/29/40/73/566294073.db2.gz SHOHCFDGMUGJNY-IEWDOMPSSA-N 0 3 376.953 3.264 10 0 GGAEHN O=C1Nc2ccc(Br)cc2CC[C@@H]1N1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000625261584 566299523 /nfs/dbraw/zinc/29/95/23/566299523.db2.gz HRHDRRXNBSDTLO-DAYGRLMNSA-N 0 3 393.325 3.451 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1c(C)cc(C)c(Br)c1C ZINC000625266998 566299946 /nfs/dbraw/zinc/29/99/46/566299946.db2.gz JLQRBCGZHJWNJG-OAHLLOKOSA-N 0 3 383.330 3.215 10 0 GGAEHN Cc1ccc(O[C@@H](C)C(=O)N(C)[C@@H]2CCN(C3CC3)C2)c(Br)c1 ZINC000599868008 566300935 /nfs/dbraw/zinc/30/09/35/566300935.db2.gz YLFOULHYXMTZKR-DZGCQCFKSA-N 0 3 381.314 3.220 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)[C@@H]1COc2ccc(Br)cc21 ZINC000535389157 566301274 /nfs/dbraw/zinc/30/12/74/566301274.db2.gz KUPJNDRVYOLBCM-XJKCOSOUSA-N 0 3 381.314 3.304 10 0 GGAEHN CN(C(=O)CCCOc1ccccc1Br)[C@@H]1CCN(C2CC2)C1 ZINC000599868993 566301691 /nfs/dbraw/zinc/30/16/91/566301691.db2.gz CWHAEGLOYQCHRI-OAHLLOKOSA-N 0 3 381.314 3.303 10 0 GGAEHN C[C@H](CNC(=O)Nc1cc(F)c(Cl)cc1I)N(C)C ZINC000599927775 566303166 /nfs/dbraw/zinc/30/31/66/566303166.db2.gz GWTMBDNPHVCFRS-SSDOTTSWSA-N 0 3 399.635 3.155 10 0 GGAEHN O=C([C@H]1CCc2cc(Br)ccc21)N1CCN(c2ccncc2)CC1 ZINC000648718518 566303595 /nfs/dbraw/zinc/30/35/95/566303595.db2.gz OFWGGNSGUVCRBT-SFHVURJKSA-N 0 3 386.293 3.223 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)c1cc2cc[nH]c(=O)c2s1)c1ccsc1 ZINC000648733303 566306129 /nfs/dbraw/zinc/30/61/29/566306129.db2.gz MLOFNJSKNQEWFI-CQSZACIVSA-N 0 3 375.519 3.464 10 0 GGAEHN Cc1ccc(C(=O)N2CCCC[C@H]2CN(C)C)cc1I ZINC000556503117 566308540 /nfs/dbraw/zinc/30/85/40/566308540.db2.gz FAOZIBISFNOCDL-AWEZNQCLSA-N 0 3 386.277 3.156 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)c1cc2c(cncc2Br)s1 ZINC000648769541 566310698 /nfs/dbraw/zinc/31/06/98/566310698.db2.gz YYYBEHLZOUSNMY-UHFFFAOYSA-N 0 3 382.327 3.473 10 0 GGAEHN CN(C)CCN1CCN(C(=O)CCCc2cc(Cl)sc2Cl)CC1 ZINC000445769238 566311089 /nfs/dbraw/zinc/31/10/89/566311089.db2.gz QVZPHOCOZCKPDC-UHFFFAOYSA-N 0 3 378.369 3.083 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)NCc1ccc([O-])c(Br)c1 ZINC000482478334 566311358 /nfs/dbraw/zinc/31/13/58/566311358.db2.gz OCMZIYNYMLGQGK-CHWSQXEVSA-N 0 3 384.318 3.217 10 0 GGAEHN CN(C[C@@H]1CCCN(C)C1)C(=O)c1cc2c(cncc2Br)s1 ZINC000648786277 566313976 /nfs/dbraw/zinc/31/39/76/566313976.db2.gz XUMRPJDGHYNVJD-LLVKDONJSA-N 0 3 382.327 3.473 10 0 GGAEHN O=C([C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)N1CC[C@H](N2CCCCC2)C1 ZINC000625366076 566315059 /nfs/dbraw/zinc/31/50/59/566315059.db2.gz WKUCJLUFLSSVGV-KRDRHDLTSA-N 0 3 389.337 3.422 10 0 GGAEHN O=C(CCn1cc(Br)cn1)NCCN1CCC2(CCCCC2)CC1 ZINC000669622383 566315652 /nfs/dbraw/zinc/31/56/52/566315652.db2.gz AIQXZEABEMNEAV-UHFFFAOYSA-N 0 3 397.361 3.198 10 0 GGAEHN CCOC(=O)c1cccc(CNCCc2cc(Br)ccc2F)n1 ZINC000600130557 566318323 /nfs/dbraw/zinc/31/83/23/566318323.db2.gz PDUVLUSXEAESCL-UHFFFAOYSA-N 0 3 381.245 3.492 10 0 GGAEHN C[C@H](N[C@H](CO)C[C@@H](O)C(C)(C)C)c1ccc(I)cc1 ZINC000556605556 566318446 /nfs/dbraw/zinc/31/84/46/566318446.db2.gz ARDUHERCAKOYEH-TUKIKUTGSA-N 0 3 391.293 3.100 10 0 GGAEHN O=C1Nc2ccc(Br)cc2CC[C@H]1N1CC[C@]2(C1)CCCOC2 ZINC000625402085 566318512 /nfs/dbraw/zinc/31/85/12/566318512.db2.gz DCYBAAIJLQVMLO-AEFFLSMTSA-N 0 3 379.298 3.205 10 0 GGAEHN CS(=O)(=O)NC[C@@H]1CCC[C@H]1NCc1c(Cl)ccc(Cl)c1Cl ZINC000669686512 566320463 /nfs/dbraw/zinc/32/04/63/566320463.db2.gz HXGNWJCKXJHANU-TVQRCGJNSA-N 0 3 385.744 3.454 10 0 GGAEHN C[C@H](CC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)n1cc(Br)cn1 ZINC000648842546 566320852 /nfs/dbraw/zinc/32/08/52/566320852.db2.gz BYSIOZVSLFRDBQ-QBIMZIAESA-N 0 3 391.313 3.158 10 0 GGAEHN C[C@H](NC(=O)c1cc2c(cncc2Br)s1)C1=CCN(C)CC1 ZINC000648856942 566322109 /nfs/dbraw/zinc/32/21/09/566322109.db2.gz GLXVVIHMWYVTCR-JTQLQIEISA-N 0 3 380.311 3.439 10 0 GGAEHN CC[C@@H](CN1CCCC1)NC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000669766276 566326355 /nfs/dbraw/zinc/32/63/55/566326355.db2.gz PUGNKXOPUFJZBR-BBRMVZONSA-N 0 3 396.329 3.446 10 0 GGAEHN CCN1CCCC[C@@H]1CNC(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000625469566 566328268 /nfs/dbraw/zinc/32/82/68/566328268.db2.gz UYHNDMPSVPITKM-ZYRRHWMLSA-N 0 3 377.326 3.325 10 0 GGAEHN COC[C@@H]1CCCN([C@@H]2CCc3cc(Br)ccc3NC2=O)CC1 ZINC000625466080 566328433 /nfs/dbraw/zinc/32/84/33/566328433.db2.gz WIYAEEFXCUKAME-CXAGYDPISA-N 0 3 381.314 3.451 10 0 GGAEHN Cn1nccc1C1=CCN(CCC(=O)Nc2cccc(Br)c2)CC1 ZINC000556831157 566336047 /nfs/dbraw/zinc/33/60/47/566336047.db2.gz GLMVKLXJZKEUOV-UHFFFAOYSA-N 0 3 389.297 3.301 10 0 GGAEHN CCCN(C(=O)Cc1c(F)ccc(Br)c1F)[C@@H]1CCN(C)C1 ZINC000648996200 566336910 /nfs/dbraw/zinc/33/69/10/566336910.db2.gz OEVSUVHHDWFMRD-LLVKDONJSA-N 0 3 375.257 3.213 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCC1)c1csc(I)c1 ZINC000600469632 566340499 /nfs/dbraw/zinc/34/04/99/566340499.db2.gz CVTJEEYKDALSIP-GFCCVEGCSA-N 0 3 390.290 3.099 10 0 GGAEHN Cc1oc(Br)cc1C(=O)NC[C@@H]1CN(C)C[C@H]1c1ccccc1 ZINC000649104607 566344207 /nfs/dbraw/zinc/34/42/07/566344207.db2.gz JIAYNWDHAMRPOB-ZBFHGGJFSA-N 0 3 377.282 3.426 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1F)N[C@@H](C)C1(S(C)(=O)=O)CC1 ZINC000556921447 566344697 /nfs/dbraw/zinc/34/46/97/566344697.db2.gz VZHNPHTWHFYLLU-QWRGUYRKSA-N 0 3 378.307 3.075 10 0 GGAEHN Cc1cc(Cl)c2c(c1)[C@H](NC[C@H]1CCCCN1S(C)(=O)=O)CCCO2 ZINC000556920587 566345081 /nfs/dbraw/zinc/34/50/81/566345081.db2.gz NHIJFHXCTPOAEB-RHSMWYFYSA-N 0 3 386.945 3.266 10 0 GGAEHN C[C@@H](Cc1ccc(Br)c(F)c1)N[C@@H](C)C1(S(C)(=O)=O)CC1 ZINC000556924591 566346715 /nfs/dbraw/zinc/34/67/15/566346715.db2.gz SHKOVDIYMVPCFL-QWRGUYRKSA-N 0 3 378.307 3.075 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)c1cc(Cl)cc(Br)c1)CCO2 ZINC000649131374 566346932 /nfs/dbraw/zinc/34/69/32/566346932.db2.gz IZEFXMUQTKJOAD-UHFFFAOYSA-N 0 3 387.705 3.039 10 0 GGAEHN Cc1sc(Br)c(C(=O)N2CCOC3(CCN(C)CC3)C2)c1C ZINC000649129968 566347415 /nfs/dbraw/zinc/34/74/15/566347415.db2.gz RMEYUKQLIWZBKF-UHFFFAOYSA-N 0 3 387.343 3.064 10 0 GGAEHN CN(C(=O)c1cc2c(cc(Br)cc2F)[nH]1)[C@H]1CCN(C2CC2)C1 ZINC000600572437 566347592 /nfs/dbraw/zinc/34/75/92/566347592.db2.gz RMRSCZCSCHWKSM-LBPRGKRZSA-N 0 3 380.261 3.378 10 0 GGAEHN CCCN1CCC[C@H]1C(=O)N[C@@H]1CCN(c2ccccc2Br)C1 ZINC000600577708 566347651 /nfs/dbraw/zinc/34/76/51/566347651.db2.gz KSOFXBZLXDENJS-PBHICJAKSA-N 0 3 380.330 3.018 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)c1cccc(Br)c1Cl)CCO2 ZINC000649130867 566348012 /nfs/dbraw/zinc/34/80/12/566348012.db2.gz ZJZINSHPOLXSJC-UHFFFAOYSA-N 0 3 387.705 3.039 10 0 GGAEHN CN(C[C@H]1CCCN(C)C1)C(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000625644786 566348034 /nfs/dbraw/zinc/34/80/34/566348034.db2.gz ILQUGHPREHCSRT-PWUKJLEFSA-N 0 3 377.326 3.135 10 0 GGAEHN Cc1cc(C(=O)N2CCOC3(CCN(C)CC3)C2)c(C)cc1Br ZINC000649131642 566348237 /nfs/dbraw/zinc/34/82/37/566348237.db2.gz VPNUJXVESDRABZ-UHFFFAOYSA-N 0 3 381.314 3.003 10 0 GGAEHN COC(=O)[C@@H](NC[C@@H]1CCN1C1CCCC1)c1cccc(Br)c1 ZINC000600612977 566350527 /nfs/dbraw/zinc/35/05/27/566350527.db2.gz DGMMBWSINCVYBZ-IRXDYDNUSA-N 0 3 381.314 3.270 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)NCc1ccsc1Br ZINC000556974497 566350718 /nfs/dbraw/zinc/35/07/18/566350718.db2.gz GLNWWGPXKVZCGM-HNNXBMFYSA-N 0 3 396.354 3.483 10 0 GGAEHN COC(=O)CCCN1CCC(N[C@@H]2COc3c2ccc(Cl)c3Cl)CC1 ZINC000462774455 566351449 /nfs/dbraw/zinc/35/14/49/566351449.db2.gz CMJFLSUDHCNEGG-OAHLLOKOSA-N 0 3 387.307 3.434 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)NCc1ccsc1Br ZINC000556974502 566351756 /nfs/dbraw/zinc/35/17/56/566351756.db2.gz GLNWWGPXKVZCGM-OAHLLOKOSA-N 0 3 396.354 3.483 10 0 GGAEHN CN(C)C1(CN(C)C(=O)N[C@@H]2CCOc3ccc(Br)cc32)CCC1 ZINC000446496199 566352722 /nfs/dbraw/zinc/35/27/22/566352722.db2.gz GZDXGYDJOPADEJ-OAHLLOKOSA-N 0 3 396.329 3.398 10 0 GGAEHN O=C(COc1ccccc1)N1CC[C@@H](NCc2ccc(Br)cc2)C1 ZINC000509962624 566352822 /nfs/dbraw/zinc/35/28/22/566352822.db2.gz GGDHZVFMKMFXOW-QGZVFWFLSA-N 0 3 389.293 3.219 10 0 GGAEHN O[C@H](CN1CC[C@H](Sc2ccc(Br)cc2)C1)CC1(O)CCC1 ZINC000625701161 566352891 /nfs/dbraw/zinc/35/28/91/566352891.db2.gz NQPSEFFWMAFAFH-HOCLYGCPSA-N 0 3 386.355 3.282 10 0 GGAEHN CCCN1CCC[C@@H]1C(=O)NCc1nc2cc(Br)ccc2n1CC ZINC000483046441 566353831 /nfs/dbraw/zinc/35/38/31/566353831.db2.gz JUBWAICNUUEEII-MRXNPFEDSA-N 0 3 393.329 3.309 10 0 GGAEHN CN(C)C[C@@H]1CN(C(=O)Cc2sccc2Br)c2ccccc2O1 ZINC000649199073 566354050 /nfs/dbraw/zinc/35/40/50/566354050.db2.gz FQMWNBOAAZDRHB-GFCCVEGCSA-N 0 3 395.322 3.409 10 0 GGAEHN Cc1nc(C(=O)NC[C@@H]2CN(C)C[C@H]2c2ccccc2)c(Br)s1 ZINC000649235363 566355659 /nfs/dbraw/zinc/35/56/59/566355659.db2.gz NRJRWKKUUSKZER-KGLIPLIRSA-N 0 3 394.338 3.289 10 0 GGAEHN COCCOCCN(CCO)Cc1cccc2c(Br)cccc12 ZINC000625754467 566355823 /nfs/dbraw/zinc/35/58/23/566355823.db2.gz DIHVUXJBFUICFK-UHFFFAOYSA-N 0 3 382.298 3.060 10 0 GGAEHN O=C(COc1ccccc1)N1CC[C@H](NCc2csc(Br)c2)C1 ZINC000510010240 566356846 /nfs/dbraw/zinc/35/68/46/566356846.db2.gz OXSCIZLNKSPTHC-AWEZNQCLSA-N 0 3 395.322 3.280 10 0 GGAEHN COc1cc(Br)ccc1[C@H]1CCCN1C[C@H](O)CN(C)C1CC1 ZINC000625794390 566359137 /nfs/dbraw/zinc/35/91/37/566359137.db2.gz JJCMKUZSPSNYMJ-NVXWUHKLSA-N 0 3 383.330 3.050 10 0 GGAEHN CN(C)C[C@]1(O)CCCN(C(=O)C2(c3ccc(Cl)c(Cl)c3)CCC2)C1 ZINC000670378038 566359940 /nfs/dbraw/zinc/35/99/40/566359940.db2.gz MMJPXSKOIPFCNG-GOSISDBHSA-N 0 3 385.335 3.330 10 0 GGAEHN O=C(CCCN1CCC(OCCCO)CC1)c1ccc(Br)cc1 ZINC000649349212 566361943 /nfs/dbraw/zinc/36/19/43/566361943.db2.gz QKEKNDUWZWWODR-UHFFFAOYSA-N 0 3 384.314 3.275 10 0 GGAEHN C[C@@H](Oc1cccc(Br)c1)C(=O)N1CCc2ccccc2[C@@H]1CN ZINC000576637989 566366179 /nfs/dbraw/zinc/36/61/79/566366179.db2.gz NDNNDERWMYSEME-ACJLOTCBSA-N 0 3 389.293 3.301 10 0 GGAEHN O=C(Cc1ccc(Br)s1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000510138646 566367249 /nfs/dbraw/zinc/36/72/49/566367249.db2.gz FYESLAWACDCPTN-CQSZACIVSA-N 0 3 379.323 3.444 10 0 GGAEHN Cc1cc(Br)ccc1[C@H]1CCCN1C(=O)N[C@@H](CN)C(F)(F)F ZINC000625899363 566368285 /nfs/dbraw/zinc/36/82/85/566368285.db2.gz RUPNZTJCARHVEY-OLZOCXBDSA-N 0 3 394.235 3.494 10 0 GGAEHN NC[C@H](NC(=O)NCC/C=C/c1ccc(Br)cc1)C(F)(F)F ZINC000625899546 566368632 /nfs/dbraw/zinc/36/86/32/566368632.db2.gz WKWWZJIXOCOIDL-JWPFQLSCSA-N 0 3 380.208 3.041 10 0 GGAEHN OC1(CNCc2ccc(F)cc2I)Cc2ccccc2C1 ZINC000576687467 566369570 /nfs/dbraw/zinc/36/95/70/566369570.db2.gz CSWVAILVGSPKGM-UHFFFAOYSA-N 0 3 397.231 3.050 10 0 GGAEHN CN(C)C[C@@H](NC[C@H](O)COCc1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000625983122 566371918 /nfs/dbraw/zinc/37/19/18/566371918.db2.gz GLUPYNYFLRBEQU-KBXCAEBGSA-N 0 3 387.307 3.356 10 0 GGAEHN CC(C)S(=O)(=O)CCCN[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000625983191 566372162 /nfs/dbraw/zinc/37/21/62/566372162.db2.gz IOXNQFQJNKGTMS-MRXNPFEDSA-N 0 3 381.369 3.399 10 0 GGAEHN CN(C)C[C@H](NCC1(CS(C)(=O)=O)CC1)c1ccc(Cl)c(Cl)c1 ZINC000625983016 566372353 /nfs/dbraw/zinc/37/23/53/566372353.db2.gz BNWGDIFXQZKBRL-HNNXBMFYSA-N 0 3 379.353 3.011 10 0 GGAEHN CN(C)C[C@H](NC[C@@H](O)COCc1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000625983123 566373241 /nfs/dbraw/zinc/37/32/41/566373241.db2.gz GLUPYNYFLRBEQU-KDOFPFPSSA-N 0 3 387.307 3.356 10 0 GGAEHN COCC[C@@H](N[C@@H](C)Cn1cc(Br)ccc1=O)c1ccc(C)o1 ZINC000576731494 566373243 /nfs/dbraw/zinc/37/32/43/566373243.db2.gz DQKYPRRHBSOFJP-SWLSCSKDSA-N 0 3 383.286 3.268 10 0 GGAEHN CC(C)N(CCc1nccs1)Cc1ccc(S(=O)(=O)NC2CC2)cc1 ZINC000649567486 566375283 /nfs/dbraw/zinc/37/52/83/566375283.db2.gz SSPNKBHYJXQGLT-UHFFFAOYSA-N 0 3 379.551 3.037 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)cc2C)[C@@H](C)C1 ZINC000510338842 566375849 /nfs/dbraw/zinc/37/58/49/566375849.db2.gz GBHUXGWZILALPU-DZGCQCFKSA-N 0 3 378.460 3.365 10 0 GGAEHN CN1CCC[C@@H]1CN[C@H](CO)c1ccc(Br)cc1C(F)(F)F ZINC000649595854 566377285 /nfs/dbraw/zinc/37/72/85/566377285.db2.gz BBNLZQAMALQBNA-BXUZGUMPSA-N 0 3 381.236 3.185 10 0 GGAEHN O=C(NCCCN1CCc2ccccc2C1)c1nscc1Br ZINC000649601645 566377432 /nfs/dbraw/zinc/37/74/32/566377432.db2.gz YKDGDHJLZKEGRL-UHFFFAOYSA-N 0 3 380.311 3.084 10 0 GGAEHN C[C@@H]1C[C@@H](c2ccc(Br)cc2)CN1CC[C@H]1CCS(=O)(=O)C1 ZINC000626041001 566378561 /nfs/dbraw/zinc/37/85/61/566378561.db2.gz PHNFSOCKEDICML-IJEWVQPXSA-N 0 3 386.355 3.452 10 0 GGAEHN Ic1cccc(OCCCN2CC[C@@H](n3cccn3)C2)c1 ZINC000463034261 566378607 /nfs/dbraw/zinc/37/86/07/566378607.db2.gz MRSVSBBSRALROT-OAHLLOKOSA-N 0 3 397.260 3.204 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cc(C)sc2Br)C[C@@H]1N1CCCC1 ZINC000483391005 566378920 /nfs/dbraw/zinc/37/89/20/566378920.db2.gz FHJZWVVXNMSOSY-STQMWFEESA-N 0 3 389.384 3.471 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2F)C[C@@H]1N1CCCC1 ZINC000483392375 566379303 /nfs/dbraw/zinc/37/93/03/566379303.db2.gz GBOGCLXNZOGRFW-LSDHHAIUSA-N 0 3 376.419 3.496 10 0 GGAEHN CNC(=O)C[C@H](NCCOc1cc(F)cc(Br)c1)c1ccccc1 ZINC000483404198 566380505 /nfs/dbraw/zinc/38/05/05/566380505.db2.gz IXEWOEGIGKZGDL-KRWDZBQOSA-N 0 3 395.272 3.434 10 0 GGAEHN CNC(=O)C[C@H](NCCOc1ccccc1Br)c1ccccc1 ZINC000483412698 566380899 /nfs/dbraw/zinc/38/08/99/566380899.db2.gz VQANUNRQPGGXKM-INIZCTEOSA-N 0 3 377.282 3.295 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cc(C)cc(Br)c2)C[C@H]1N1CCCC1 ZINC000483400706 566381063 /nfs/dbraw/zinc/38/10/63/566381063.db2.gz DISBMKIGIZZQJQ-HZPDHXFCSA-N 0 3 383.355 3.409 10 0 GGAEHN CCCCN1CCCC[C@@H]1CNS(=O)(=O)c1cccnc1C(F)(F)F ZINC000576847006 566382367 /nfs/dbraw/zinc/38/23/67/566382367.db2.gz PMPPQQGBRQHZBT-CYBMUJFWSA-N 0 3 379.448 3.033 10 0 GGAEHN C[C@]1(Cc2cccc(Cl)c2)CCCN1C[C@H]1CCCN(S(C)(=O)=O)C1 ZINC000649684190 566385411 /nfs/dbraw/zinc/38/54/11/566385411.db2.gz IKKAZYQGAAUEOJ-IEBWSBKVSA-N 0 3 384.973 3.409 10 0 GGAEHN C[C@@H]1C[C@@H](N2CCCC2)CN1S(=O)(=O)Cc1ccc(Cl)cc1Cl ZINC000510483477 566386393 /nfs/dbraw/zinc/38/63/93/566386393.db2.gz AIPVQWNJBYJHMJ-IUODEOHRSA-N 0 3 377.337 3.382 10 0 GGAEHN C[C@@H]1C[C@H](N2CCCC2)CN1S(=O)(=O)Cc1ccc(Cl)cc1Cl ZINC000510483475 566386705 /nfs/dbraw/zinc/38/67/05/566386705.db2.gz AIPVQWNJBYJHMJ-DOMZBBRYSA-N 0 3 377.337 3.382 10 0 GGAEHN CO[C@H]1CCCN(CCCOc2cccc(I)c2)C1 ZINC000536598522 566386790 /nfs/dbraw/zinc/38/67/90/566386790.db2.gz CZWBLTZIMCLMLC-HNNXBMFYSA-N 0 3 375.250 3.171 10 0 GGAEHN C[C@@H](NC(=O)N[C@@H]1CCc2cc(Br)ccc21)C1=CCN(C)CC1 ZINC000510498552 566388076 /nfs/dbraw/zinc/38/80/76/566388076.db2.gz CBESGUVJGJFLCP-SJKOYZFVSA-N 0 3 378.314 3.386 10 0 GGAEHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)c1cc[nH]c(=O)c1Br)N(C)C ZINC000510514542 566389615 /nfs/dbraw/zinc/38/96/15/566389615.db2.gz UYLRDWGCQUEZFR-BLLLJJGKSA-N 0 3 392.297 3.279 10 0 GGAEHN COc1cc(Br)ccc1CCCN[C@@H]1CCO[C@@H]1c1nc(C)no1 ZINC000626143876 566389636 /nfs/dbraw/zinc/38/96/36/566389636.db2.gz ITGSSVMUYVFESG-ZBFHGGJFSA-N 0 3 396.285 3.202 10 0 GGAEHN Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(C[C@@H]1CCCO1)C(F)(F)F ZINC000649730489 566389667 /nfs/dbraw/zinc/38/96/67/566389667.db2.gz SCZAQLACSWXMPG-WCQYABFASA-N 0 3 379.400 3.085 10 0 GGAEHN CNS(=O)(=O)C[C@@H]1CCCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1 ZINC000626165945 566390109 /nfs/dbraw/zinc/39/01/09/566390109.db2.gz JXHGHYZTKNTKPI-UKRRQHHQSA-N 0 3 378.460 3.114 10 0 GGAEHN CN1CC[C@@H]2[C@H](CCCN2C(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)C1 ZINC000626197103 566393250 /nfs/dbraw/zinc/39/32/50/566393250.db2.gz GCHYONNWBSCLBE-JESAGEAFSA-N 0 3 389.337 3.278 10 0 GGAEHN CN1CCC(n2cc(NCc3cccc(I)c3)cn2)CC1 ZINC000601148981 566394075 /nfs/dbraw/zinc/39/40/75/566394075.db2.gz ICSAIIKSZUVTPC-UHFFFAOYSA-N 0 3 396.276 3.367 10 0 GGAEHN Cc1cc(CN(C)C)cc(NC(=O)c2cnn3cc(Br)cnc23)c1 ZINC000536713883 566396350 /nfs/dbraw/zinc/39/63/50/566396350.db2.gz HSRHXAKTZWFRDL-UHFFFAOYSA-N 0 3 388.269 3.114 10 0 GGAEHN COc1ncc(Br)cc1CNC(=O)Nc1cccc(CN(C)C)c1 ZINC000626263638 566397362 /nfs/dbraw/zinc/39/73/62/566397362.db2.gz FNLZIFFACFWXTB-UHFFFAOYSA-N 0 3 393.285 3.236 10 0 GGAEHN O=C(CNC1(c2c(Cl)cccc2Cl)CC1)NC1CCN(C2CC2)CC1 ZINC000557570949 566397244 /nfs/dbraw/zinc/39/72/44/566397244.db2.gz FLCIFBJBBAHGRQ-UHFFFAOYSA-N 0 3 382.335 3.315 10 0 GGAEHN CNC(=O)CCOC1CCN([C@H]2CCCc3ccc(Br)cc32)CC1 ZINC000536731337 566397720 /nfs/dbraw/zinc/39/77/20/566397720.db2.gz JQEPFJFLYAUOPB-SFHVURJKSA-N 0 3 395.341 3.444 10 0 GGAEHN C[C@@H](Cc1cccc(Br)c1)NC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000601281128 566398740 /nfs/dbraw/zinc/39/87/40/566398740.db2.gz ZKAGXCWFQQVFOH-SUMWQHHRSA-N 0 3 380.330 3.258 10 0 GGAEHN C[C@H](Cc1cccc(Br)c1)NC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000601281125 566398822 /nfs/dbraw/zinc/39/88/22/566398822.db2.gz ZKAGXCWFQQVFOH-CXAGYDPISA-N 0 3 380.330 3.258 10 0 GGAEHN CN(C(=O)NCCCc1cccc(Br)c1)[C@@H]1CCN(C2CC2)C1 ZINC000601324233 566400521 /nfs/dbraw/zinc/40/05/21/566400521.db2.gz VCLRQSWKDMSECE-QGZVFWFLSA-N 0 3 380.330 3.260 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)NCCOc1cccc(Cl)c1Cl ZINC000577058627 566401024 /nfs/dbraw/zinc/40/10/24/566401024.db2.gz SCYJBYJCMLPAII-POHZPAGDSA-N 0 3 387.307 3.021 10 0 GGAEHN CN(C(=O)c1ccn(-c2ccc(Cl)cc2Cl)n1)[C@@H]1CCN(C2CC2)C1 ZINC000536782646 566401748 /nfs/dbraw/zinc/40/17/48/566401748.db2.gz FBZXHDJKWFNYGB-CQSZACIVSA-N 0 3 379.291 3.488 10 0 GGAEHN CN(C[C@H]1CCCN1C)C(=O)c1c(Br)cccc1Br ZINC000421713140 566402449 /nfs/dbraw/zinc/40/24/49/566402449.db2.gz RWDLEZPXHWOQPX-SNVBAGLBSA-N 0 3 390.119 3.378 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2C[C@H](N3CCCC3)C[C@@H]2C)c1 ZINC000557640574 566403867 /nfs/dbraw/zinc/40/38/67/566403867.db2.gz KNVVRRWQILFNBI-UONOGXRCSA-N 0 3 398.288 3.298 10 0 GGAEHN COC(=O)CN(C)C(=O)CCN1CCC(c2cccc(Cl)c2Cl)CC1 ZINC000463375783 566405445 /nfs/dbraw/zinc/40/54/45/566405445.db2.gz MUXBYNROOBSQBG-UHFFFAOYSA-N 0 3 387.307 3.194 10 0 GGAEHN C[C@H](CCc1ccc(Cl)s1)NCCS(=O)(=O)NCc1ccccc1 ZINC000536858948 566406505 /nfs/dbraw/zinc/40/65/05/566406505.db2.gz SWJWQQCJPOCPOG-CQSZACIVSA-N 0 3 386.970 3.432 10 0 GGAEHN O=C(NC1CCN(CCOc2ccc(Br)cc2)CC1)[C@@H]1CC12CC2 ZINC000421773670 566408716 /nfs/dbraw/zinc/40/87/16/566408716.db2.gz RAYSGASICXAVDC-KRWDZBQOSA-N 0 3 393.325 3.209 10 0 GGAEHN CC(C(=O)NCC(F)(F)F)S(=O)(=O)Cc1ccc(Cl)c2ccccc12 ZINC000421816454 566410029 /nfs/dbraw/zinc/41/00/29/566410029.db2.gz XRAOQZUNXYNATR-SNVBAGLBSA-N 0 3 393.814 3.475 10 0 GGAEHN CN(Cc1ccc(Br)c(F)c1)C(=O)CCN(C)c1ccncc1 ZINC000577168632 566411179 /nfs/dbraw/zinc/41/11/79/566411179.db2.gz FGCTUGRDHLQQKT-UHFFFAOYSA-N 0 3 380.261 3.468 10 0 GGAEHN C[C@@H](CNC(=O)N(C)[C@@H]1CCN(C2CC2)C1)Oc1ccccc1Br ZINC000484009240 566411554 /nfs/dbraw/zinc/41/15/54/566411554.db2.gz PCBJGSTVJHXEHU-DZGCQCFKSA-N 0 3 396.329 3.095 10 0 GGAEHN C[C@H](NC[C@H]1CC[C@H](C(N)=O)CC1)c1ccccc1I ZINC000421851276 566412003 /nfs/dbraw/zinc/41/20/03/566412003.db2.gz FPZCKZGQQZLPHO-AVGNSLFASA-N 0 3 386.277 3.234 10 0 GGAEHN CCN(CC)CCN(C(=O)c1ccnn1CC)c1ccc(Br)cn1 ZINC000649988963 566412511 /nfs/dbraw/zinc/41/25/11/566412511.db2.gz VJPCDSBBBMYZGD-UHFFFAOYSA-N 0 3 394.317 3.049 10 0 GGAEHN CSC1(CNC(=O)Cc2csc(CCC(F)(F)F)n2)CCN(C)CC1 ZINC000601587497 566413036 /nfs/dbraw/zinc/41/30/36/566413036.db2.gz FYEQQIIFNNSCAI-UHFFFAOYSA-N 0 3 395.516 3.124 10 0 GGAEHN CCO[C@@H]1C[C@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)[C@@]12CCCO2 ZINC000577172763 566413290 /nfs/dbraw/zinc/41/32/90/566413290.db2.gz CQFBEXQZSMUBGQ-UOUZQGKXSA-N 0 3 390.307 3.049 10 0 GGAEHN C[C@H](NC(=O)CN1CC[C@@]2(C1)CCCOC2)c1ccc(Br)cc1 ZINC000671254504 566413455 /nfs/dbraw/zinc/41/34/55/566413455.db2.gz APMLRMNRNIBVFM-KBXCAEBGSA-N 0 3 381.314 3.129 10 0 GGAEHN CN(CCCN(C)c1cc(Br)cc(F)c1C(N)=O)Cc1ccco1 ZINC000557752208 566414149 /nfs/dbraw/zinc/41/41/49/566414149.db2.gz FMHYVWOECJSARI-UHFFFAOYSA-N 0 3 398.276 3.238 10 0 GGAEHN COC[C@@H](NCc1cnn(-c2ccc(Br)cc2)c1)C1CCOCC1 ZINC000447560636 566416579 /nfs/dbraw/zinc/41/65/79/566416579.db2.gz XAEFFPKJSMHRJP-GOSISDBHSA-N 0 3 394.313 3.166 10 0 GGAEHN CC(C)N1CC[C@@H](N(C)C(=O)[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000650085757 566421604 /nfs/dbraw/zinc/42/16/04/566421604.db2.gz XRIJEQZLJFLNGL-CABCVRRESA-N 0 3 381.314 3.256 10 0 GGAEHN CC[C@H](N[C@H](CO)CC1CCCC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000510945239 566422679 /nfs/dbraw/zinc/42/26/79/566422679.db2.gz LZZGSEVWLUTPAN-RDJZCZTQSA-N 0 3 388.961 3.230 10 0 GGAEHN C[C@H](CCC(F)(F)F)[NH2+]CC[N-]S(=O)(=O)c1ccc(F)cc1Cl ZINC000510959454 566423152 /nfs/dbraw/zinc/42/31/52/566423152.db2.gz PCZGOKNBYBCPEB-SECBINFHSA-N 0 3 376.803 3.078 10 0 GGAEHN O=C(c1nscc1Br)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1 ZINC000650110539 566424317 /nfs/dbraw/zinc/42/43/17/566424317.db2.gz XLTCPIJXJKKFJE-DZGCQCFKSA-N 0 3 392.322 3.252 10 0 GGAEHN COC(=O)CCN(Cc1cccc(Br)c1)C[C@@H](O)CC(F)(F)F ZINC000484305489 566425388 /nfs/dbraw/zinc/42/53/88/566425388.db2.gz VIRPVAAEQSOOGO-ZDUSSCGKSA-N 0 3 398.219 3.128 10 0 GGAEHN CCCN1CCC(CNS(=O)(=O)c2ccc(SC)c(Cl)c2)CC1 ZINC000463695491 566427603 /nfs/dbraw/zinc/42/76/03/566427603.db2.gz COTKNLKRMXNASU-UHFFFAOYSA-N 0 3 376.975 3.462 10 0 GGAEHN CCC[C@H](C)CN1CCN(CC(=O)Nc2ccc(Br)cc2)CC1 ZINC000537204645 566430159 /nfs/dbraw/zinc/43/01/59/566430159.db2.gz YEPGVFXDZXQVHF-HNNXBMFYSA-N 0 3 382.346 3.441 10 0 GGAEHN CC(C)C[N@@H+]1CCC[C@@H](CNC(=O)Cc2ccc(Br)cc2[O-])C1 ZINC000484494802 566432821 /nfs/dbraw/zinc/43/28/21/566432821.db2.gz ZGJISKZKIMNFOK-AWEZNQCLSA-N 0 3 383.330 3.181 10 0 GGAEHN CC(C)C[N@H+]1CCC[C@@H](CNC(=O)Cc2ccc(Br)cc2[O-])C1 ZINC000484494802 566432825 /nfs/dbraw/zinc/43/28/25/566432825.db2.gz ZGJISKZKIMNFOK-AWEZNQCLSA-N 0 3 383.330 3.181 10 0 GGAEHN COc1cc(F)c(Br)cc1NC(=O)CCN(C)c1ccncc1 ZINC000577483789 566439113 /nfs/dbraw/zinc/43/91/13/566439113.db2.gz KFDALCNVFTUUMH-UHFFFAOYSA-N 0 3 382.233 3.457 10 0 GGAEHN C[C@@H]1CN(CCCNC(=O)N2CCc3c2cccc3Br)CCCO1 ZINC000422197436 566439921 /nfs/dbraw/zinc/43/99/21/566439921.db2.gz FVUUBSVFFSHOAL-CQSZACIVSA-N 0 3 396.329 3.022 10 0 GGAEHN CS[C@@H]1CN([C@@H](C)C(=O)Nc2ccc(F)cc2Cl)C[C@H]1N1CCCC1 ZINC000484609905 566440624 /nfs/dbraw/zinc/44/06/24/566440624.db2.gz BAMMWMAETIDDHZ-JCURWCKSSA-N 0 3 385.936 3.318 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)c(F)c2)[C@@H](C)C1 ZINC000447874377 566441488 /nfs/dbraw/zinc/44/14/88/566441488.db2.gz LFQYQQVLNWQANN-NHYWBVRUSA-N 0 3 382.423 3.195 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)c(F)c2)[C@H](C)C1 ZINC000447874376 566441588 /nfs/dbraw/zinc/44/15/88/566441588.db2.gz LFQYQQVLNWQANN-IAQYHMDHSA-N 0 3 382.423 3.195 10 0 GGAEHN CN(C)CCN(Cc1ccccn1)C(=O)Cc1ccc(Br)s1 ZINC000511161681 566441728 /nfs/dbraw/zinc/44/17/28/566441728.db2.gz NUZFGGCPONAJNM-UHFFFAOYSA-N 0 3 382.327 3.039 10 0 GGAEHN COC1CCN(C(C)(C)CNC(=O)Cc2ccc(Br)s2)CC1 ZINC000511164061 566441751 /nfs/dbraw/zinc/44/17/51/566441751.db2.gz BUSCKDRCDXWZSB-UHFFFAOYSA-N 0 3 389.359 3.059 10 0 GGAEHN CS[C@@H]1CN([C@@H](C)C(=O)Nc2cc(Cl)ccc2F)C[C@H]1N1CCCC1 ZINC000484631200 566442319 /nfs/dbraw/zinc/44/23/19/566442319.db2.gz HZEWAECZTPFLMO-JCURWCKSSA-N 0 3 385.936 3.318 10 0 GGAEHN CN(C)CCNC(=O)Nc1cc(OC(F)(F)F)c(F)cc1Br ZINC000626710521 566443864 /nfs/dbraw/zinc/44/38/64/566443864.db2.gz ILZPFHATKPEKOG-UHFFFAOYSA-N 0 3 388.159 3.170 10 0 GGAEHN O=C(NCCNCc1ccnn1-c1ccccc1)c1cccc(Br)c1 ZINC000447939346 566449336 /nfs/dbraw/zinc/44/93/36/566449336.db2.gz FHQFOVONNCORCR-UHFFFAOYSA-N 0 3 399.292 3.154 10 0 GGAEHN O=C(NC[C@H](O)CN1CCCCC1)c1cccc2cccc(Br)c21 ZINC000671779088 566450548 /nfs/dbraw/zinc/45/05/48/566450548.db2.gz WESHKKMZQISYDJ-HNNXBMFYSA-N 0 3 391.309 3.179 10 0 GGAEHN OC[C@H](CNCc1ccc(OC(F)F)c(Br)c1)c1cccnc1 ZINC000558117618 566450876 /nfs/dbraw/zinc/45/08/76/566450876.db2.gz CBTDXCRMWVYZHM-ZDUSSCGKSA-N 0 3 387.224 3.311 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@H]1CCC(C)(C)O1)c1ccc(Br)cn1 ZINC000577637685 566451213 /nfs/dbraw/zinc/45/12/13/566451213.db2.gz AKRNHDVGKVJRKP-OAHLLOKOSA-N 0 3 398.345 3.477 10 0 GGAEHN CC[C@@H]1CN(C)CCCN1C(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000626803157 566451888 /nfs/dbraw/zinc/45/18/88/566451888.db2.gz FQPKLUTUHJACKV-ZYRRHWMLSA-N 0 3 377.326 3.278 10 0 GGAEHN CC[C@@H]1CN(C)CCCN1C(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000626803156 566451946 /nfs/dbraw/zinc/45/19/46/566451946.db2.gz FQPKLUTUHJACKV-UOAMXJAYSA-N 0 3 377.326 3.278 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@@H]1CCC(C)(C)O1)c1ccc(Br)cn1 ZINC000577637684 566452254 /nfs/dbraw/zinc/45/22/54/566452254.db2.gz AKRNHDVGKVJRKP-HNNXBMFYSA-N 0 3 398.345 3.477 10 0 GGAEHN C[C@@H](NC(=O)C(=O)c1ccc(Br)cc1)[C@H]1CCCN(C2CCC2)C1 ZINC000511381441 566460073 /nfs/dbraw/zinc/46/00/73/566460073.db2.gz RKLSMXHCXZBITR-HIFRSBDPSA-N 0 3 393.325 3.401 10 0 GGAEHN C[C@@H](NC(=O)C(=O)c1ccc(Br)cc1)[C@@H]1CCCN(C2CCC2)C1 ZINC000511381442 566460154 /nfs/dbraw/zinc/46/01/54/566460154.db2.gz RKLSMXHCXZBITR-UKRRQHHQSA-N 0 3 393.325 3.401 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N1CCC[C@H](Nc2cccc(Br)c2)C1 ZINC000448173010 566462747 /nfs/dbraw/zinc/46/27/47/566462747.db2.gz HMTANKDIEJHQNV-IRXDYDNUSA-N 0 3 395.345 3.129 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N1CCC[C@@H](Nc2cccc(Br)c2)C1 ZINC000448173011 566463112 /nfs/dbraw/zinc/46/31/12/566463112.db2.gz HMTANKDIEJHQNV-SJORKVTESA-N 0 3 395.345 3.129 10 0 GGAEHN FC(F)[C@@H]1CNCCN1Cc1ccc(Br)c(Br)c1 ZINC000577751962 566463088 /nfs/dbraw/zinc/46/30/88/566463088.db2.gz XNLVLBOXLBFQAN-NSHDSACASA-N 0 3 384.062 3.251 10 0 GGAEHN FC(F)[C@H]1CNCCN1Cc1ccc(Br)c(Br)c1 ZINC000577751961 566463302 /nfs/dbraw/zinc/46/33/02/566463302.db2.gz XNLVLBOXLBFQAN-LLVKDONJSA-N 0 3 384.062 3.251 10 0 GGAEHN COc1cc(CN[C@H](C)c2ccc(CN)nc2C)cc(Br)c1OC ZINC000422935346 566466950 /nfs/dbraw/zinc/46/69/50/566466950.db2.gz ADLSOMVRHQLGRK-LLVKDONJSA-N 0 3 394.313 3.479 10 0 GGAEHN C[C@@H](NC[C@H]1CCN(c2ccc(Br)cc2)C1)c1cnccc1N ZINC000422941506 566467339 /nfs/dbraw/zinc/46/73/39/566467339.db2.gz JIVYPNYJTBXJBG-ZIAGYGMSSA-N 0 3 375.314 3.434 10 0 GGAEHN Cc1cc(Br)cn2cc(CN[C@@H](C)c3ccc(CN)nc3C)nc12 ZINC000423031779 566469580 /nfs/dbraw/zinc/46/95/80/566469580.db2.gz DOFKYEBHXNCGTF-LBPRGKRZSA-N 0 3 388.313 3.418 10 0 GGAEHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000627161517 566469989 /nfs/dbraw/zinc/46/99/89/566469989.db2.gz SXUYMQDNQWAZRM-VRPWAGJOSA-N 0 3 389.337 3.420 10 0 GGAEHN C[C@@H]1CC[C@@H](C)N1[C@H]1CCCN(C(=O)C(=O)c2ccc(Br)cc2)C1 ZINC000511543623 566470086 /nfs/dbraw/zinc/47/00/86/566470086.db2.gz YBWZDLAFCKRRTI-CPUCHLNUSA-N 0 3 393.325 3.496 10 0 GGAEHN C[C@@H]1CCCN(C(C)(C)CNC(=O)C(=O)c2ccc(Br)cc2)C1 ZINC000511551255 566471228 /nfs/dbraw/zinc/47/12/28/566471228.db2.gz KTVRBLPZNPHRAM-CYBMUJFWSA-N 0 3 381.314 3.259 10 0 GGAEHN C[C@H]1CCCN(C(C)(C)CNC(=O)C(=O)c2ccc(Br)cc2)C1 ZINC000511551256 566471329 /nfs/dbraw/zinc/47/13/29/566471329.db2.gz KTVRBLPZNPHRAM-ZDUSSCGKSA-N 0 3 381.314 3.259 10 0 GGAEHN Cc1nccc(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c1Br ZINC000558425358 566471507 /nfs/dbraw/zinc/47/15/07/566471507.db2.gz BECRYCJCHKPGDP-GUYCJALGSA-N 0 3 391.313 3.387 10 0 GGAEHN CN(C)CCn1cc(Nc2ccc(Br)c(C(F)(F)F)n2)cn1 ZINC000672198497 566472911 /nfs/dbraw/zinc/47/29/11/566472911.db2.gz TZGOJRHJCWFZEB-UHFFFAOYSA-N 0 3 378.196 3.365 10 0 GGAEHN CCN1CCN(CCCOc2cccc(I)c2)[C@@H](C)C1 ZINC000511608038 566475000 /nfs/dbraw/zinc/47/50/00/566475000.db2.gz AWQBLGQJTSUDFA-AWEZNQCLSA-N 0 3 388.293 3.086 10 0 GGAEHN C[C@@H](NC(=O)[C@H]1CCCCN1C1CCCC1)c1ncc(Br)cn1 ZINC000558457835 566475078 /nfs/dbraw/zinc/47/50/78/566475078.db2.gz CFNOBIOTUAPSAU-IUODEOHRSA-N 0 3 381.318 3.213 10 0 GGAEHN C[C@@H]1[C@@H](C)N(CCCOc2cccc(I)c2)CCN1C ZINC000537851715 566475393 /nfs/dbraw/zinc/47/53/93/566475393.db2.gz QGIUFQKOXNXZCO-ZIAGYGMSSA-N 0 3 388.293 3.085 10 0 GGAEHN C[C@](CO)(NC[C@H](O)CCc1ccccc1)c1ccc(Br)cc1 ZINC000511589136 566475616 /nfs/dbraw/zinc/47/56/16/566475616.db2.gz VSFQDOXCVSBPSH-RTBURBONSA-N 0 3 378.310 3.240 10 0 GGAEHN C[C@H](N[C@@H](C)c1cnccc1N)c1ccc(Br)cc1OCCCO ZINC000423122774 566476285 /nfs/dbraw/zinc/47/62/85/566476285.db2.gz CWYIGXHOOXHQJV-STQMWFEESA-N 0 3 394.313 3.430 10 0 GGAEHN C[C@](CO)(NCC[S@@](=O)c1ccccc1)c1ccc(Br)cc1 ZINC000511612792 566476857 /nfs/dbraw/zinc/47/68/57/566476857.db2.gz VQQOVTWDFXJBGB-VGOFRKELSA-N 0 3 382.323 3.054 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N1CCC(OCCN(C)C)CC1 ZINC000485119364 566476799 /nfs/dbraw/zinc/47/67/99/566476799.db2.gz NDDHTKZSENGCLK-ZDUSSCGKSA-N 0 3 389.323 3.330 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)c(C)c2)[C@@H](C)C1 ZINC000558470928 566477122 /nfs/dbraw/zinc/47/71/22/566477122.db2.gz KOSNBRQTXMYYPR-BBRMVZONSA-N 0 3 378.460 3.365 10 0 GGAEHN CC1(C)CCCN[C@@H]1C(=O)N1CCO[C@H](c2cccc(Br)c2)C1 ZINC000423112972 566477176 /nfs/dbraw/zinc/47/71/76/566477176.db2.gz XUSSHGRUOPFVEU-JKSUJKDBSA-N 0 3 381.314 3.127 10 0 GGAEHN C[C@@H](N[C@H](C)c1cnccc1N)c1ccc(Br)cc1OCCCO ZINC000423122771 566477303 /nfs/dbraw/zinc/47/73/03/566477303.db2.gz CWYIGXHOOXHQJV-CHWSQXEVSA-N 0 3 394.313 3.430 10 0 GGAEHN Cc1c(Br)cccc1C[C@H](CO)CN[C@@H](C)c1cnccc1N ZINC000423149040 566478363 /nfs/dbraw/zinc/47/83/63/566478363.db2.gz AESRZJSPQTZSNG-KBPBESRZSA-N 0 3 378.314 3.067 10 0 GGAEHN CN(C)CCOC1CCN(C(=O)c2cc3c(cccc3Br)[nH]2)CC1 ZINC000485138399 566479669 /nfs/dbraw/zinc/47/96/69/566479669.db2.gz JRRPFJULGCJKRG-UHFFFAOYSA-N 0 3 394.313 3.113 10 0 GGAEHN CCS(=O)(=O)c1cc(Cl)cc(CN[C@H](C)c2ccc(CN)nc2C)c1 ZINC000423165841 566481082 /nfs/dbraw/zinc/48/10/82/566481082.db2.gz BJSVVUDLACDDKG-GFCCVEGCSA-N 0 3 381.929 3.147 10 0 GGAEHN O=S1(=O)CCC(CCN[C@H]2CCc3c2c(Br)ccc3F)CC1 ZINC000537959555 566481785 /nfs/dbraw/zinc/48/17/85/566481785.db2.gz MBYYRSGGWZFBMU-HNNXBMFYSA-N 0 3 390.318 3.380 10 0 GGAEHN CN(C)[C@H](CNC(=O)Cc1sccc1Br)Cc1ccccc1 ZINC000448602285 566481883 /nfs/dbraw/zinc/48/18/83/566481883.db2.gz AHUMFUHTNHUEKH-AWEZNQCLSA-N 0 3 381.339 3.342 10 0 GGAEHN O=C(N[C@H]1CCN(C2CC2)C1)NC1(c2ccccc2Br)CCC1 ZINC000650876778 566482256 /nfs/dbraw/zinc/48/22/56/566482256.db2.gz GDQTTWIVWQKUBU-ZDUSSCGKSA-N 0 3 378.314 3.364 10 0 GGAEHN CN1CCN(CCCNC(=O)c2ccc3scc(Br)c3c2)CC1 ZINC000448596198 566482735 /nfs/dbraw/zinc/48/27/35/566482735.db2.gz KPBAGQQXGAXMTP-UHFFFAOYSA-N 0 3 396.354 3.031 10 0 GGAEHN CCSc1ccc(CC(=O)N2CC[C@H]3CN(C)C[C@@H]32)c(Br)c1 ZINC000627488475 566483129 /nfs/dbraw/zinc/48/31/29/566483129.db2.gz ZSCFSZNCIAFIHS-BBRMVZONSA-N 0 3 383.355 3.266 10 0 GGAEHN CCSc1ccc(CC(=O)N2CC[C@H]3CN(C)C[C@H]32)c(Br)c1 ZINC000627488478 566483405 /nfs/dbraw/zinc/48/34/05/566483405.db2.gz ZSCFSZNCIAFIHS-XJKSGUPXSA-N 0 3 383.355 3.266 10 0 GGAEHN Cc1cc(N2CCC[C@@H](N[C@@H](C)c3cncc(Br)c3)C2)n(C)n1 ZINC000578027423 566484420 /nfs/dbraw/zinc/48/44/20/566484420.db2.gz ZQOMLVJDJSTPSX-XJKSGUPXSA-N 0 3 378.318 3.206 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1cc(C(F)(F)F)ccc1Cl ZINC000627518634 566485472 /nfs/dbraw/zinc/48/54/72/566485472.db2.gz PCGREDFNVVEMSD-LSDHHAIUSA-N 0 3 376.806 3.294 10 0 GGAEHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000558570386 566486482 /nfs/dbraw/zinc/48/64/82/566486482.db2.gz XYSFZHPSKBQCHJ-HFBAOOFYSA-N 0 3 394.313 3.055 10 0 GGAEHN CN1CCC[C@]2(CCN(C(=O)[C@@H]3[C@@H]4Cc5c(cccc5Br)[C@@H]43)C2)C1 ZINC000627534327 566486523 /nfs/dbraw/zinc/48/65/23/566486523.db2.gz VUHMYTZKJRJSRQ-QEEHTWDDSA-N 0 3 389.337 3.279 10 0 GGAEHN CN(C)Cc1cnc(CNC2CC(N3CCC(C(F)(F)F)CC3)C2)s1 ZINC000511765514 566486769 /nfs/dbraw/zinc/48/67/69/566486769.db2.gz SCNHVFFYXJGVCR-UHFFFAOYSA-N 0 3 376.492 3.100 10 0 GGAEHN C[C@@H](N[C@H]1CNCCC1(F)F)c1ccc(F)c(I)c1 ZINC000423472773 566490507 /nfs/dbraw/zinc/49/05/07/566490507.db2.gz GDIWZVCVJLUROU-PELKAZGASA-N 0 3 384.183 3.078 10 0 GGAEHN C[C@@H]1CN(C(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)CCN(C2CC2)C1 ZINC000627557567 566488695 /nfs/dbraw/zinc/48/86/95/566488695.db2.gz FUQURXFRERDTJG-PHRNICBLSA-N 0 3 389.337 3.278 10 0 GGAEHN C[C@@H]1CN(C(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)CCN(C2CC2)C1 ZINC000627557568 566488753 /nfs/dbraw/zinc/48/87/53/566488753.db2.gz FUQURXFRERDTJG-SZUHRMQMSA-N 0 3 389.337 3.278 10 0 GGAEHN COC(=O)c1cc(NCCN2CCCC2)c2cc(Br)ccc2n1 ZINC000538086639 566492661 /nfs/dbraw/zinc/49/26/61/566492661.db2.gz PKHXVRXJGAXDCQ-UHFFFAOYSA-N 0 3 378.270 3.292 10 0 GGAEHN CC(C)(C)NS(=O)(=O)CCN[C@@H](c1ccc(Br)cc1)C1CC1 ZINC000538116456 566493230 /nfs/dbraw/zinc/49/32/30/566493230.db2.gz KZXUISUMCZLBMD-OAHLLOKOSA-N 0 3 389.359 3.208 10 0 GGAEHN Cc1cc([C@H](NC[C@@H](O)CS(=O)(=O)c2cccs2)C2CC2)ccc1F ZINC000538116639 566494098 /nfs/dbraw/zinc/49/40/98/566494098.db2.gz LQVWHWIFMWVCCC-CRAIPNDOSA-N 0 3 383.510 3.071 10 0 GGAEHN O=C(CCN[C@H]1CCOc2c(Br)cccc21)Nc1cccnc1 ZINC000558616411 566494120 /nfs/dbraw/zinc/49/41/20/566494120.db2.gz URQVVHNHXSTUEP-HNNXBMFYSA-N 0 3 376.254 3.286 10 0 GGAEHN CCN1CC[C@H]2OCCN(Cc3c(F)ccc(Br)c3F)[C@H]2C1 ZINC000578146844 566494950 /nfs/dbraw/zinc/49/49/50/566494950.db2.gz DLZKAEIUTDJGFT-LSDHHAIUSA-N 0 3 375.257 3.022 10 0 GGAEHN CC1CCN(CCNC(=O)[C@@H]2CCOc3ccc(Br)cc32)CC1 ZINC000651105695 566496248 /nfs/dbraw/zinc/49/62/48/566496248.db2.gz FDEGVFOVNRTEPH-OAHLLOKOSA-N 0 3 381.314 3.163 10 0 GGAEHN CCc1ccccc1[C@H](N)CNC(=O)COc1ccccc1Br ZINC000423936942 566496311 /nfs/dbraw/zinc/49/63/11/566496311.db2.gz FHZLNMHMFZZYAB-MRXNPFEDSA-N 0 3 377.282 3.207 10 0 GGAEHN OCCN(CCc1ccccc1)C[C@H](O)COc1c(Cl)cccc1Cl ZINC000602879294 566498209 /nfs/dbraw/zinc/49/82/09/566498209.db2.gz XZNARTRAKMEIBM-INIZCTEOSA-N 0 3 384.303 3.270 10 0 GGAEHN OCCN(CCc1ccccc1)C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000602879295 566499298 /nfs/dbraw/zinc/49/92/98/566499298.db2.gz XZNARTRAKMEIBM-MRXNPFEDSA-N 0 3 384.303 3.270 10 0 GGAEHN OC[C@H](CN[C@@H](c1ccc(Br)cc1)[C@H]1CCCO1)c1cccnc1 ZINC000672618412 566499431 /nfs/dbraw/zinc/49/94/31/566499431.db2.gz CIOXBKBCHZNYFQ-UHOSZYNNSA-N 0 3 391.309 3.430 10 0 GGAEHN CCc1ccccc1[C@@H](N)CNC(=O)c1ccc(Br)cc1OC ZINC000423982074 566500653 /nfs/dbraw/zinc/50/06/53/566500653.db2.gz RFTHZQCMQGNLLH-INIZCTEOSA-N 0 3 377.282 3.450 10 0 GGAEHN O=C([C@@H]1CCOc2ccc(Br)cc21)N1CCC[C@H]1CN1CCCC1 ZINC000651204418 566502326 /nfs/dbraw/zinc/50/23/26/566502326.db2.gz PHNWQKCMSAYEEI-JKSUJKDBSA-N 0 3 393.325 3.402 10 0 GGAEHN Cc1ccc(C(=O)N2CCC(N3CCCOCC3)CC2)c(Br)c1 ZINC000627740639 566502357 /nfs/dbraw/zinc/50/23/57/566502357.db2.gz ZDMMBEADHGWKFT-UHFFFAOYSA-N 0 3 381.314 3.084 10 0 GGAEHN Cc1ccc(F)c(C(=O)N2CCC(N3CCCOCC3)CC2)c1Br ZINC000627741348 566502398 /nfs/dbraw/zinc/50/23/98/566502398.db2.gz CUPLEOGPMGTPKK-UHFFFAOYSA-N 0 3 399.304 3.224 10 0 GGAEHN Cc1sc(C(=O)N2CCC(N3CCCOCC3)CC2)cc1Br ZINC000627742379 566502504 /nfs/dbraw/zinc/50/25/04/566502504.db2.gz TVNFNVAFKMZSHU-UHFFFAOYSA-N 0 3 387.343 3.146 10 0 GGAEHN Cc1ccc(C(=O)N2CCC(N3CCCOCC3)CC2)cc1Br ZINC000627740207 566502529 /nfs/dbraw/zinc/50/25/29/566502529.db2.gz GATCRXXDBVFZTB-UHFFFAOYSA-N 0 3 381.314 3.084 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2ccc(OC)cc2Br)n1 ZINC000511991295 566502507 /nfs/dbraw/zinc/50/25/07/566502507.db2.gz RAOKSZWXWFYHIF-UHFFFAOYSA-N 0 3 399.310 3.423 10 0 GGAEHN O=C([C@H]1CCOc2ccc(Br)cc21)N1CCC[C@H]1CN1CCCC1 ZINC000651204416 566502691 /nfs/dbraw/zinc/50/26/91/566502691.db2.gz PHNWQKCMSAYEEI-HOTGVXAUSA-N 0 3 393.325 3.402 10 0 GGAEHN C[C@@H](C(=O)N1CCC(N2CCCOCC2)CC1)c1ccc(Br)cc1 ZINC000627740897 566502814 /nfs/dbraw/zinc/50/28/14/566502814.db2.gz JXSMLDVOZQHPGO-OAHLLOKOSA-N 0 3 395.341 3.266 10 0 GGAEHN Cc1cc(C(=O)N2CCC(N3CCCOCC3)CC2)ccc1Br ZINC000627740884 566503014 /nfs/dbraw/zinc/50/30/14/566503014.db2.gz JNJPIJIBCPIPRT-UHFFFAOYSA-N 0 3 381.314 3.084 10 0 GGAEHN Cc1cc(Br)ccc1C(=O)N1CCC(N2CCCOCC2)CC1 ZINC000627738788 566503078 /nfs/dbraw/zinc/50/30/78/566503078.db2.gz CFHUSUCGLZRKPO-UHFFFAOYSA-N 0 3 381.314 3.084 10 0 GGAEHN COc1ccc(F)cc1[C@@H](C)N[C@H](C)Cn1cc(Br)ccc1=O ZINC000578227495 566503564 /nfs/dbraw/zinc/50/35/64/566503564.db2.gz MSHXVQWFBCMQHD-VXGBXAGGSA-N 0 3 383.261 3.498 10 0 GGAEHN Cc1cc(C(=O)N2CCC(N3CCCOCC3)CC2)c(C)cc1Br ZINC000627740714 566503695 /nfs/dbraw/zinc/50/36/95/566503695.db2.gz BZAGGBUQKCKOFO-UHFFFAOYSA-N 0 3 395.341 3.393 10 0 GGAEHN Cc1cc(Br)cc(C(=O)N2CCC(N3CCCOCC3)CC2)c1C ZINC000627742971 566503793 /nfs/dbraw/zinc/50/37/93/566503793.db2.gz WJAOCAHYEVPAEW-UHFFFAOYSA-N 0 3 395.341 3.393 10 0 GGAEHN O=C([C@H]1CCOc2ccc(Br)cc21)N1CC[C@H](N2CCCC2)C1 ZINC000651235963 566504161 /nfs/dbraw/zinc/50/41/61/566504161.db2.gz QDFYSKLJFRDYSD-GJZGRUSLSA-N 0 3 379.298 3.012 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651260406 566506022 /nfs/dbraw/zinc/50/60/22/566506022.db2.gz XTLUVOGTXHPCSV-OAHLLOKOSA-N 0 3 381.314 3.115 10 0 GGAEHN O=C([C@H]1CCOc2ccc(Br)cc21)N1CC[C@@H](N2CCCCC2)C1 ZINC000651290012 566506981 /nfs/dbraw/zinc/50/69/81/566506981.db2.gz GVCREGAPPJSOEG-CVEARBPZSA-N 0 3 393.325 3.402 10 0 GGAEHN CC(C)N1CC[C@H](NC[C@@H](C)CS(C)(=O)=O)[C@H]1c1ccc(Cl)c(F)c1 ZINC000558829549 566510074 /nfs/dbraw/zinc/51/00/74/566510074.db2.gz SCMHRHJXHILJAT-JEBQAFNWSA-N 0 3 390.952 3.273 10 0 GGAEHN COCC[C@H](Cc1cccc(Br)c1)C(=O)N1CCC[C@@H]1CN(C)C ZINC000464930701 566510215 /nfs/dbraw/zinc/51/02/15/566510215.db2.gz FBAFZTHLUMOHSR-SJLPKXTDSA-N 0 3 397.357 3.197 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)COc1ccc(Br)cc1Cl ZINC000464921544 566510521 /nfs/dbraw/zinc/51/05/21/566510521.db2.gz GQOYNAPDEMFBCB-LBPRGKRZSA-N 0 3 375.694 3.034 10 0 GGAEHN COCC[C@H](Cc1cccc(Br)c1)C(=O)N1CCC[C@H]1CN(C)C ZINC000464930699 566510409 /nfs/dbraw/zinc/51/04/09/566510409.db2.gz FBAFZTHLUMOHSR-AEFFLSMTSA-N 0 3 397.357 3.197 10 0 GGAEHN CC(C)Oc1cc(C(=O)N(C)[C@@H]2CN3CCC2CC3)ccc1Br ZINC000651307417 566510599 /nfs/dbraw/zinc/51/05/99/566510599.db2.gz AIDOHJVHDSRWOF-MRXNPFEDSA-N 0 3 381.314 3.403 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1cc(Cl)c(Br)cc1F ZINC000448906120 566510934 /nfs/dbraw/zinc/51/09/34/566510934.db2.gz CIEUXHKCUQBHKD-JTQLQIEISA-N 0 3 393.684 3.082 10 0 GGAEHN CC(=O)Nc1cccc(CNC[C@H](O)COc2c(Cl)cccc2Cl)c1 ZINC000578316178 566511119 /nfs/dbraw/zinc/51/11/19/566511119.db2.gz QABAQBPXDSVFJB-HNNXBMFYSA-N 0 3 383.275 3.481 10 0 GGAEHN Cc1[nH]c2ccc(Br)cc2c1CC(=O)N1CCC[C@@H]1CN(C)C ZINC000464939283 566512079 /nfs/dbraw/zinc/51/20/79/566512079.db2.gz WPIDMXZXFCJMOZ-CQSZACIVSA-N 0 3 378.314 3.334 10 0 GGAEHN COC1CCN(CCNc2ncc(Br)c3ccc(F)cc32)CC1 ZINC000651325414 566512429 /nfs/dbraw/zinc/51/24/29/566512429.db2.gz HLVBGQKNYLZIDX-UHFFFAOYSA-N 0 3 382.277 3.081 10 0 GGAEHN Cc1c(Br)cccc1C[C@H](CO)CNCc1cncn1C(C)C ZINC000424166070 566516452 /nfs/dbraw/zinc/51/64/52/566516452.db2.gz CDDGSKUWZTYCCO-HNNXBMFYSA-N 0 3 380.330 3.476 10 0 GGAEHN CC(C)C[C@H](N[C@@H](C)c1ccc(Br)s1)C(=O)NCCN(C)C ZINC000538548525 566520597 /nfs/dbraw/zinc/52/05/97/566520597.db2.gz OTEINSJENXVFHX-STQMWFEESA-N 0 3 390.391 3.254 10 0 GGAEHN O=C(NC[C@@H]1CCCCN1CCO)N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000578417624 566520779 /nfs/dbraw/zinc/52/07/79/566520779.db2.gz LFQMEFXSXGTGRZ-GOEBONIOSA-N 0 3 383.945 3.023 10 0 GGAEHN CN(Cc1ccccc1)[C@H]1CCN(C(=O)c2nscc2Br)C1 ZINC000651398724 566521465 /nfs/dbraw/zinc/52/14/65/566521465.db2.gz ZVIJRHQSBVPMTR-ZDUSSCGKSA-N 0 3 380.311 3.252 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)[C@@H]2CCOc3ccc(Br)cc32)CN1C1CC1 ZINC000651467186 566524974 /nfs/dbraw/zinc/52/49/74/566524974.db2.gz YAARTJYJTMIHDX-OSAQELSMSA-N 0 3 379.298 3.057 10 0 GGAEHN CO[C@H]1C[C@H]2C[C@H](N[C@H]3CCN(c4cccc(Br)c4)C3=O)C[C@H]2C1 ZINC000424280788 566525283 /nfs/dbraw/zinc/52/52/83/566525283.db2.gz MGEREYMPGXVKRI-MMGJPBGESA-N 0 3 393.325 3.348 10 0 GGAEHN CCN(C(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12)[C@H]1CCN(CC)C1 ZINC000628066656 566527547 /nfs/dbraw/zinc/52/75/47/566527547.db2.gz IKYCAZRXBMMQHU-PWUKJLEFSA-N 0 3 377.326 3.278 10 0 GGAEHN CC(C)(C)N1CC[C@H](NC(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)C1 ZINC000628045707 566527874 /nfs/dbraw/zinc/52/78/74/566527874.db2.gz LINZVVLIYMQHFN-HYEYJGRESA-N 0 3 377.326 3.324 10 0 GGAEHN O=S(=O)(Cc1cc(Cl)sc1Cl)NC1CCN(CC2CC2)CC1 ZINC000651524975 566529648 /nfs/dbraw/zinc/52/96/48/566529648.db2.gz OYZKWVZKHHUYEI-UHFFFAOYSA-N 0 3 383.366 3.349 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCN=c1[nH]cc(Cn2cc(Br)cn2)s1 ZINC000485873562 566536049 /nfs/dbraw/zinc/53/60/49/566536049.db2.gz NRQDKQHDOCIXBW-STQMWFEESA-N 0 3 398.374 3.247 10 0 GGAEHN C[C@H]1C[C@@H](NC(=O)C(=O)Nc2cc(Cl)c(Cl)c(Cl)c2)CCN1C ZINC000651588169 566539557 /nfs/dbraw/zinc/53/95/57/566539557.db2.gz JUEUJZQBJQKVOS-IUCAKERBSA-N 0 3 378.687 3.184 10 0 GGAEHN CCO[C@@H](CC)C(=O)N(CCN(CC)CC)c1ccc(Br)cn1 ZINC000578632300 566539989 /nfs/dbraw/zinc/53/99/89/566539989.db2.gz RIQLWVXBCBTISP-HNNXBMFYSA-N 0 3 386.334 3.334 10 0 GGAEHN Cc1cc(Br)c(CN[C@@H](CC(N)=O)C2CCOCC2)cc1Cl ZINC000449241157 566540827 /nfs/dbraw/zinc/54/08/27/566540827.db2.gz RONLQUKTUYXXOO-HNNXBMFYSA-N 0 3 389.721 3.171 10 0 GGAEHN CN1CCC[C@@H]2CN(S(=O)(=O)Cc3cc(Cl)sc3Cl)CC[C@H]21 ZINC000651604235 566541044 /nfs/dbraw/zinc/54/10/44/566541044.db2.gz UVACKHIAFXLSCK-ZYHUDNBSSA-N 0 3 383.366 3.301 10 0 GGAEHN C[C@@H](CNC(=O)Cc1noc2ccc(Br)cc21)N1CCC[C@H](C)C1 ZINC000424585820 566543711 /nfs/dbraw/zinc/54/37/11/566543711.db2.gz QUYJWSSNWBHLCB-STQMWFEESA-N 0 3 394.313 3.369 10 0 GGAEHN CCOC1CC(CNCc2cc(Cl)sc2Cl)(N2CCOCC2)C1 ZINC000449282996 566544374 /nfs/dbraw/zinc/54/43/74/566544374.db2.gz JQEIIFRRIKUGCL-UHFFFAOYSA-N 0 3 379.353 3.414 10 0 GGAEHN Cc1cc(N2CCC[C@@H](NCc3cccc(Br)c3F)C2)n(C)n1 ZINC000449282880 566544885 /nfs/dbraw/zinc/54/48/85/566544885.db2.gz JNQSMRBSESTVPL-CQSZACIVSA-N 0 3 381.293 3.389 10 0 GGAEHN COc1ccc(Br)cc1C[C@@H](CO)CNCc1oc(C)nc1C ZINC000628302310 566544886 /nfs/dbraw/zinc/54/48/86/566544886.db2.gz YPELPSVFTAUOFV-CYBMUJFWSA-N 0 3 383.286 3.003 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000465758074 566545045 /nfs/dbraw/zinc/54/50/45/566545045.db2.gz OXUDMYXDPQOIBZ-HIFRSBDPSA-N 0 3 382.302 3.056 10 0 GGAEHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)Cc1noc2ccc(Br)cc21 ZINC000424604056 566545177 /nfs/dbraw/zinc/54/51/77/566545177.db2.gz GVEINKNFYFYXTP-OLZOCXBDSA-N 0 3 394.313 3.369 10 0 GGAEHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)Cc1noc2ccc(Br)cc21 ZINC000424604054 566545434 /nfs/dbraw/zinc/54/54/34/566545434.db2.gz GVEINKNFYFYXTP-CHWSQXEVSA-N 0 3 394.313 3.369 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000465758076 566545451 /nfs/dbraw/zinc/54/54/51/566545451.db2.gz OXUDMYXDPQOIBZ-ZFWWWQNUSA-N 0 3 382.302 3.056 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000465758075 566545801 /nfs/dbraw/zinc/54/58/01/566545801.db2.gz OXUDMYXDPQOIBZ-UKRRQHHQSA-N 0 3 382.302 3.056 10 0 GGAEHN COc1nccnc1CN[C@@H](C)CCc1ccc(I)cc1 ZINC000449300551 566547061 /nfs/dbraw/zinc/54/70/61/566547061.db2.gz PGRPIPHIGCEMEJ-LBPRGKRZSA-N 0 3 397.260 3.201 10 0 GGAEHN CC(C)(C)[C@@H](O)C[C@@H](CO)NCc1ccnc2c(Br)cccc12 ZINC000449309698 566548320 /nfs/dbraw/zinc/54/83/20/566548320.db2.gz FDQCXWYBNUPVDG-BBRMVZONSA-N 0 3 381.314 3.245 10 0 GGAEHN C[C@@H](NCc1ccnc2c(Br)cccc12)C1(S(C)(=O)=O)CC1 ZINC000449319325 566548750 /nfs/dbraw/zinc/54/87/50/566548750.db2.gz GHAADQMDTQQBHV-LLVKDONJSA-N 0 3 383.311 3.053 10 0 GGAEHN CN(C)CCn1ccc(C(=O)NCC/C=C/c2ccc(Br)cc2)n1 ZINC000628336864 566548863 /nfs/dbraw/zinc/54/88/63/566548863.db2.gz QYPNXROHOXERKX-HWKANZROSA-N 0 3 391.313 3.041 10 0 GGAEHN C[C@@H](NC1CC(c2ccc(Br)cc2F)C1)C1(S(C)(=O)=O)CC1 ZINC000449318963 566549063 /nfs/dbraw/zinc/54/90/63/566549063.db2.gz FHIMXERKDRASAB-XSRFYTQQSA-N 0 3 390.318 3.390 10 0 GGAEHN CN(C)CCn1ccc(C(=O)NCC/C=C\c2ccc(Br)cc2)n1 ZINC000628336865 566549194 /nfs/dbraw/zinc/54/91/94/566549194.db2.gz QYPNXROHOXERKX-HYXAFXHYSA-N 0 3 391.313 3.041 10 0 GGAEHN COc1ncc(C(=O)N(CCN(C)C)C2CCCCC2)cc1Br ZINC000424655898 566553790 /nfs/dbraw/zinc/55/37/90/566553790.db2.gz AJPWNWRERATMFJ-UHFFFAOYSA-N 0 3 384.318 3.189 10 0 GGAEHN C[C@H]1C[C@@H](N2CCCC2)CN1S(=O)(=O)Cc1cc(Cl)sc1Cl ZINC000651701974 566553741 /nfs/dbraw/zinc/55/37/41/566553741.db2.gz GZPIIBFUMIAYJM-CMPLNLGQSA-N 0 3 383.366 3.443 10 0 GGAEHN OC[C@@]1(NCc2cnc(C3CC3)o2)CCc2cc(Br)ccc2C1 ZINC000628423804 566554283 /nfs/dbraw/zinc/55/42/83/566554283.db2.gz LFDXJCLGDGJWSG-GOSISDBHSA-N 0 3 377.282 3.324 10 0 GGAEHN CN(Cc1cc(Br)cc(C(F)(F)F)c1)[C@@H]1CCN2CCO[C@H]1C2 ZINC000449365973 566554673 /nfs/dbraw/zinc/55/46/73/566554673.db2.gz VEBLDMYNWXFHNL-CABCVRRESA-N 0 3 393.247 3.373 10 0 GGAEHN CCN1CCC(N(C)C(=O)c2cc(C)ccc2I)CC1 ZINC000512765864 566555467 /nfs/dbraw/zinc/55/54/67/566555467.db2.gz CONLLEHSDKBKJY-UHFFFAOYSA-N 0 3 386.277 3.156 10 0 GGAEHN CSC1(CNC(=O)N[C@@H](C)c2ccc3ncsc3c2)CCN(C)CC1 ZINC000578810299 566555516 /nfs/dbraw/zinc/55/55/16/566555516.db2.gz AABFHDDZMBJRAF-ZDUSSCGKSA-N 0 3 378.567 3.484 10 0 GGAEHN COCCCN(C)CCNC(=O)N1CCC[C@H]1c1ccc(Br)cc1 ZINC000466078458 566556238 /nfs/dbraw/zinc/55/62/38/566556238.db2.gz UHFSBSPMIAEGTR-KRWDZBQOSA-N 0 3 398.345 3.264 10 0 GGAEHN COC[C@@](C)(O)CCNCc1ccc(OC(F)(F)F)c(Br)c1 ZINC000449388317 566556237 /nfs/dbraw/zinc/55/62/37/566556237.db2.gz ZJKIOTUSXCTYLB-ZDUSSCGKSA-N 0 3 386.208 3.225 10 0 GGAEHN OC[C@@H](NC1CCC(O)(C(F)(F)F)CC1)c1ccc(Br)cc1 ZINC000539044387 566556355 /nfs/dbraw/zinc/55/63/55/566556355.db2.gz YIMUXAHLOXHXIO-ROKHWSDSSA-N 0 3 382.220 3.308 10 0 GGAEHN Nc1c(Br)cc(Br)cc1CN[C@H]1CO[C@@H](C2CC2)C1 ZINC000628463064 566557420 /nfs/dbraw/zinc/55/74/20/566557420.db2.gz RHTXZSDSAJMXKV-DGCLKSJQSA-N 0 3 390.119 3.451 10 0 GGAEHN CCN1CCC[C@H](NC(=O)c2ccc(Cl)c(I)c2)C1 ZINC000604202309 566557577 /nfs/dbraw/zinc/55/75/77/566557577.db2.gz OWVKINJLGGLBLX-NSHDSACASA-N 0 3 392.668 3.159 10 0 GGAEHN CCC1([NH+]2CCOCC2)CCN(Cc2cccc([O-])c2Br)CC1 ZINC000628476086 566557546 /nfs/dbraw/zinc/55/75/46/566557546.db2.gz BYYIYGJTXZDVGI-UHFFFAOYSA-N 0 3 383.330 3.232 10 0 GGAEHN C[C@@H](NCCC1CCS(=O)(=O)CC1)c1ccc(F)cc1Br ZINC000539065847 566557680 /nfs/dbraw/zinc/55/76/80/566557680.db2.gz LBPBFBPJATXQKV-LLVKDONJSA-N 0 3 378.307 3.454 10 0 GGAEHN CC(C)N1CCC[C@H](NC(=O)[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000651751657 566557766 /nfs/dbraw/zinc/55/77/66/566557766.db2.gz CEHNZJNYKUDDLO-LSDHHAIUSA-N 0 3 381.314 3.304 10 0 GGAEHN C[C@H](NCCC1CCS(=O)(=O)CC1)c1ccc(F)cc1Br ZINC000539065850 566558732 /nfs/dbraw/zinc/55/87/32/566558732.db2.gz LBPBFBPJATXQKV-NSHDSACASA-N 0 3 378.307 3.454 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)Cc2noc3ccc(Br)cc32)CCN1C ZINC000424688241 566558822 /nfs/dbraw/zinc/55/88/22/566558822.db2.gz NUVTYYFRXTYQTO-DGCLKSJQSA-N 0 3 380.286 3.074 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)Cc2noc3ccc(Br)cc32)CCN1C ZINC000424688448 566559095 /nfs/dbraw/zinc/55/90/95/566559095.db2.gz NUVTYYFRXTYQTO-YPMHNXCESA-N 0 3 380.286 3.074 10 0 GGAEHN CN(C)C[C@H](CNS(=O)(=O)C[C@H]1CCCC1(F)F)c1ccc(Cl)cc1 ZINC000651764839 566559436 /nfs/dbraw/zinc/55/94/36/566559436.db2.gz QIHAOZCAWNOYEM-LSDHHAIUSA-N 0 3 394.915 3.340 10 0 GGAEHN CC[C@@H](NCc1cn(-c2ccc(Br)cc2)nc1C)[C@@H](O)C(F)F ZINC000449421866 566560077 /nfs/dbraw/zinc/56/00/77/566560077.db2.gz JPEFBTUWPDWJAV-HUUCEWRRSA-N 0 3 388.256 3.437 10 0 GGAEHN CC(C)[C@H]1C[C@H](CNCc2ncc(I)s2)CCO1 ZINC000449491446 566569343 /nfs/dbraw/zinc/56/93/43/566569343.db2.gz GWXUFLXJRSSQCA-GHMZBOCLSA-N 0 3 380.295 3.289 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@@H]1CN(C2CC2)C[C@H]1C ZINC000466221625 566560251 /nfs/dbraw/zinc/56/02/51/566560251.db2.gz VMVWDLCNSSNJAI-PBFPGSCMSA-N 0 3 380.330 3.162 10 0 GGAEHN CCOc1cc(CN[C@H](CC)[C@@H](O)C(F)F)cc(Br)c1OC ZINC000449426529 566560488 /nfs/dbraw/zinc/56/04/88/566560488.db2.gz VEDKVQJWQCGOPX-DGCLKSJQSA-N 0 3 382.245 3.351 10 0 GGAEHN COCCOc1ccc(Br)cc1NC(=O)C1CCN(C2CC2)CC1 ZINC000486126792 566560878 /nfs/dbraw/zinc/56/08/78/566560878.db2.gz JZVNZCYSNAJDNE-UHFFFAOYSA-N 0 3 397.313 3.287 10 0 GGAEHN CNS(=O)(=O)C[C@H]1CCCN(Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000628495921 566561682 /nfs/dbraw/zinc/56/16/82/566561682.db2.gz CVXCBSLXOMJGEH-AWEZNQCLSA-N 0 3 382.526 3.315 10 0 GGAEHN CN(C)CCn1cc(NC(=O)NC2(c3cccc(Br)c3)CC2)cn1 ZINC000673864927 566561584 /nfs/dbraw/zinc/56/15/84/566561584.db2.gz GWPAEWXAPSUKQB-UHFFFAOYSA-N 0 3 392.301 3.018 10 0 GGAEHN CNS(=O)(=O)C[C@@H]1CCCN(Cc2ccc(-c3ccc(C)cc3)s2)C1 ZINC000628496514 566562155 /nfs/dbraw/zinc/56/21/55/566562155.db2.gz SGGVBEOKCJCINU-MRXNPFEDSA-N 0 3 378.563 3.485 10 0 GGAEHN CN(C)CCn1cc(NC(=O)NCc2nc3cc(Cl)ccc3s2)cn1 ZINC000673866437 566562229 /nfs/dbraw/zinc/56/22/29/566562229.db2.gz CINHJTBCNGFBNS-UHFFFAOYSA-N 0 3 378.889 3.030 10 0 GGAEHN CNS(=O)(=O)C[C@H]1CCCN(Cc2ccc(-c3ccccc3F)s2)C1 ZINC000628496575 566562269 /nfs/dbraw/zinc/56/22/69/566562269.db2.gz UNSIUHSKKVQEBP-AWEZNQCLSA-N 0 3 382.526 3.315 10 0 GGAEHN CNS(=O)(=O)C[C@H]1CCCN(Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000628496573 566562281 /nfs/dbraw/zinc/56/22/81/566562281.db2.gz UMVVEOOUTSOTGC-AWEZNQCLSA-N 0 3 382.526 3.315 10 0 GGAEHN CNS(=O)(=O)C[C@@H]1CCCN(Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000628495922 566562307 /nfs/dbraw/zinc/56/23/07/566562307.db2.gz CVXCBSLXOMJGEH-CQSZACIVSA-N 0 3 382.526 3.315 10 0 GGAEHN Cc1cc(Br)cc(C)c1CNC(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C ZINC000466293878 566563004 /nfs/dbraw/zinc/56/30/04/566563004.db2.gz RUVZVRWQUPOHJK-SUMWQHHRSA-N 0 3 380.330 3.348 10 0 GGAEHN O[C@@H]1C[C@H]([C@@H]2CCCOC2)N(Cc2ccnc3c(Br)cccc23)C1 ZINC000449433577 566563024 /nfs/dbraw/zinc/56/30/24/566563024.db2.gz MXJSXROGGVIUKO-IIDMSEBBSA-N 0 3 391.309 3.359 10 0 GGAEHN Cc1oc(Br)cc1C(=O)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000424727088 566563202 /nfs/dbraw/zinc/56/32/02/566563202.db2.gz YGHCUUQXIYNYLJ-AWEZNQCLSA-N 0 3 385.302 3.068 10 0 GGAEHN O[C@@H]1C[C@H]([C@H]2CCCOC2)N(Cc2ccc(Br)c3cccnc23)C1 ZINC000449431188 566563055 /nfs/dbraw/zinc/56/30/55/566563055.db2.gz CYQPZTSXDSIKCJ-HDMKZQKVSA-N 0 3 391.309 3.359 10 0 GGAEHN Cc1cc(Br)cc(C)c1CNC(=O)N[C@@H]1CN(C2CC2)C[C@H]1C ZINC000466293875 566563334 /nfs/dbraw/zinc/56/33/34/566563334.db2.gz RUVZVRWQUPOHJK-CXAGYDPISA-N 0 3 380.330 3.348 10 0 GGAEHN C[C@H](c1ccccc1Br)N(C)C(=O)Nc1cnn(CCN(C)C)c1 ZINC000673870833 566564155 /nfs/dbraw/zinc/56/41/55/566564155.db2.gz RWSYWYMAKUUBPC-CYBMUJFWSA-N 0 3 394.317 3.432 10 0 GGAEHN O=C(N1CCCC1)N1CCC[C@@H](NCc2ccc(Br)c(F)c2)C1 ZINC000512855485 566564511 /nfs/dbraw/zinc/56/45/11/566564511.db2.gz IICNUQGGCRPICO-CQSZACIVSA-N 0 3 384.293 3.358 10 0 GGAEHN CCOc1cc(C[NH2+]C2CCN(C(=O)C3CC3)CC2)cc(Br)c1[O-] ZINC000578930998 566565209 /nfs/dbraw/zinc/56/52/09/566565209.db2.gz PZYVARNOYGWMBG-UHFFFAOYSA-N 0 3 397.313 3.044 10 0 GGAEHN C[C@H](CC(=O)NC[C@H]1CCN1C1CCCCC1)n1cc(Br)cn1 ZINC000628543915 566565349 /nfs/dbraw/zinc/56/53/49/566565349.db2.gz VYZLQCPZOTUAQV-CZUORRHYSA-N 0 3 383.334 3.120 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cc(Br)c(C)s2)C[C@@H]1N1CCCC1 ZINC000424773898 566569580 /nfs/dbraw/zinc/56/95/80/566569580.db2.gz GSMOZNKLKDLCNA-JSGCOSHPSA-N 0 3 389.384 3.471 10 0 GGAEHN COc1cc(Br)c(CNCC2(CF)CCOCC2)c(OC)c1 ZINC000449488285 566569859 /nfs/dbraw/zinc/56/98/59/566569859.db2.gz FOBUTYGJHFBTQF-UHFFFAOYSA-N 0 3 376.266 3.322 10 0 GGAEHN C[C@H](CNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1)Oc1ccc(Br)cc1 ZINC000466369700 566570420 /nfs/dbraw/zinc/57/04/20/566570420.db2.gz ZQCMGONMCADHEO-FMKPAKJESA-N 0 3 398.345 3.341 10 0 GGAEHN CCOCCOc1ccc(Br)cc1CNCCc1cc(C)no1 ZINC000512977691 566570404 /nfs/dbraw/zinc/57/04/04/566570404.db2.gz QEQBGLKYRWOADC-UHFFFAOYSA-N 0 3 383.286 3.493 10 0 GGAEHN CC(C)N1CC[C@H](NC(=O)[C@@H](N)CC(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000578985822 566570794 /nfs/dbraw/zinc/57/07/94/566570794.db2.gz VSWICSRNCHJGCF-OFQRWUPVSA-N 0 3 377.838 3.102 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)NC1CCN(C3CC3)CC1)CC2 ZINC000539249820 566571038 /nfs/dbraw/zinc/57/10/38/566571038.db2.gz UFXDUHDAZUBVGM-UHFFFAOYSA-N 0 3 392.341 3.452 10 0 GGAEHN COC(=O)[C@@H]1CCCC[C@@H]1NCc1cc(OC)c(OC)cc1Br ZINC000449509415 566571750 /nfs/dbraw/zinc/57/17/50/566571750.db2.gz IYVIXJMQCSPDHL-OCCSQVGLSA-N 0 3 386.286 3.288 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@H]1CNCc1cnc(-c2ccc(Cl)cc2)s1 ZINC000512995318 566571942 /nfs/dbraw/zinc/57/19/42/566571942.db2.gz ABNUDRCKHOWMGL-HNNXBMFYSA-N 0 3 399.969 3.367 10 0 GGAEHN Cc1c(Br)cccc1CNC(=O)NCCCNCc1cccnc1 ZINC000579004742 566572446 /nfs/dbraw/zinc/57/24/46/566572446.db2.gz OLRJAAKVWGEWBJ-UHFFFAOYSA-N 0 3 391.313 3.132 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@@H]1CNCc1ccc(Cl)c(Br)c1 ZINC000512997437 566572609 /nfs/dbraw/zinc/57/26/09/566572609.db2.gz PCJFTUASSOOMLW-GFCCVEGCSA-N 0 3 395.750 3.006 10 0 GGAEHN O=C(NC[C@@H]1CCCCN1C1CC1)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651897177 566572741 /nfs/dbraw/zinc/57/27/41/566572741.db2.gz QPFXXFUMUACWSY-JKSUJKDBSA-N 0 3 393.325 3.448 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@@H]1CNCc1ccc(-c2ccc(F)cc2)s1 ZINC000513033653 566574366 /nfs/dbraw/zinc/57/43/66/566574366.db2.gz XNCXVJGLSAKBNV-MRXNPFEDSA-N 0 3 382.526 3.458 10 0 GGAEHN C[C@H]1CN(Cc2c(Br)cnn2C)CCN(Cc2ccccc2)C1 ZINC000449552612 566574667 /nfs/dbraw/zinc/57/46/67/566574667.db2.gz JWXKWONAQUOVHO-OAHLLOKOSA-N 0 3 377.330 3.137 10 0 GGAEHN Cc1ccc(-c2ncc(CNC[C@@H]3CCCCN3S(C)(=O)=O)s2)cc1 ZINC000513007137 566574888 /nfs/dbraw/zinc/57/48/88/566574888.db2.gz JSTURQHPTGOJMA-INIZCTEOSA-N 0 3 379.551 3.022 10 0 GGAEHN COC[C@@](C)(CO)NCc1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1 ZINC000674067496 566575054 /nfs/dbraw/zinc/57/50/54/566575054.db2.gz KETZQIGENWJJLP-CHWSQXEVSA-N 0 3 375.309 3.046 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@@H](C)COc1cccc(F)c1 ZINC000559892853 566575067 /nfs/dbraw/zinc/57/50/67/566575067.db2.gz ARLQFMXNHDQKDX-OLZOCXBDSA-N 0 3 383.261 3.196 10 0 GGAEHN COc1cc(Cl)ccc1CN[C@@H](C)Cn1cc(Br)ccc1=O ZINC000559894757 566575138 /nfs/dbraw/zinc/57/51/38/566575138.db2.gz QCIHWPCZKLTHSB-NSHDSACASA-N 0 3 385.689 3.451 10 0 GGAEHN COC[C@](C)(CO)NCc1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1 ZINC000674067497 566575748 /nfs/dbraw/zinc/57/57/48/566575748.db2.gz KETZQIGENWJJLP-OLZOCXBDSA-N 0 3 375.309 3.046 10 0 GGAEHN COc1c(Br)ccc(C)c1C(=O)N1C[C@H](N2CCCC2)C[C@@H]1C ZINC000424833268 566576506 /nfs/dbraw/zinc/57/65/06/566576506.db2.gz JQKHVETUNFRBMY-UONOGXRCSA-N 0 3 381.314 3.465 10 0 GGAEHN COc1c(Br)ccc(C)c1C(=O)N1C[C@@H](N2CCCC2)C[C@H]1C ZINC000424833267 566576743 /nfs/dbraw/zinc/57/67/43/566576743.db2.gz JQKHVETUNFRBMY-KGLIPLIRSA-N 0 3 381.314 3.465 10 0 GGAEHN O[C@@]1(CCNCc2cnc(-c3ccc(Br)cc3)s2)CCOC1 ZINC000651943318 566579690 /nfs/dbraw/zinc/57/96/90/566579690.db2.gz NVNPRFMHTXCWPZ-INIZCTEOSA-N 0 3 383.311 3.204 10 0 GGAEHN CCCn1cc(CNC[C@H](CO)Cc2cc(Br)ccc2F)cn1 ZINC000449600751 566580030 /nfs/dbraw/zinc/58/00/30/566580030.db2.gz PKDRBNOKGWEOGG-CYBMUJFWSA-N 0 3 384.293 3.136 10 0 GGAEHN Cc1ccc(C[C@@H](CO)CNCc2cnn3ccccc23)cc1Br ZINC000449601204 566580821 /nfs/dbraw/zinc/58/08/21/566580821.db2.gz QXWVEMNUIDJWMD-MRXNPFEDSA-N 0 3 388.309 3.346 10 0 GGAEHN COc1cc(C)nc(CNC[C@H](CO)Cc2ccc(C)c(Br)c2)c1 ZINC000449601393 566582297 /nfs/dbraw/zinc/58/22/97/566582297.db2.gz RKGFOAGIOALPOE-MRXNPFEDSA-N 0 3 393.325 3.410 10 0 GGAEHN COC(=O)C[C@](C)(NCCn1nc(C)cc1C)c1ccc(Br)cc1 ZINC000513144765 566583946 /nfs/dbraw/zinc/58/39/46/566583946.db2.gz NINMUUNILKTBJH-SFHVURJKSA-N 0 3 394.313 3.331 10 0 GGAEHN COC1CCN(CCNC(=O)N[C@@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000674327281 566584592 /nfs/dbraw/zinc/58/45/92/566584592.db2.gz IPSFTTKCSHYDNY-MRXNPFEDSA-N 0 3 386.323 3.391 10 0 GGAEHN COC(=O)C[C@@](C)(NCCOCC(F)F)c1ccc(Br)cc1 ZINC000513150318 566585216 /nfs/dbraw/zinc/58/52/16/566585216.db2.gz PIUDGWQEDIKFMG-OAHLLOKOSA-N 0 3 380.229 3.099 10 0 GGAEHN COc1sc(CN[C@@H]2CCCc3c2ccc(=O)n3C)cc1Br ZINC000652048809 566585380 /nfs/dbraw/zinc/58/53/80/566585380.db2.gz VOOGHLIGBMKZBF-CYBMUJFWSA-N 0 3 383.311 3.385 10 0 GGAEHN CC(=O)N1CCN(CCN[C@@H](C)c2cc3cc(Br)ccc3o2)CC1 ZINC000539500209 566585797 /nfs/dbraw/zinc/58/57/97/566585797.db2.gz UGWZTIUUPDHZLY-ZDUSSCGKSA-N 0 3 394.313 3.010 10 0 GGAEHN COc1ccc(CN[C@H]2CCCc3c2ccc(=O)n3C)cc1Br ZINC000652044509 566586054 /nfs/dbraw/zinc/58/60/54/566586054.db2.gz OOUDVJLMKOWLQT-HNNXBMFYSA-N 0 3 377.282 3.324 10 0 GGAEHN COCCN1CCN(CC2=Cc3cc(Br)ccc3OC2)C(C)(C)C1 ZINC000652035897 566586181 /nfs/dbraw/zinc/58/61/81/566586181.db2.gz LNNWNNLUEGIUKT-UHFFFAOYSA-N 0 3 395.341 3.268 10 0 GGAEHN Cc1cc(CCC(=O)Nc2cnn(CCN(C)C)c2)ccc1Br ZINC000674345672 566586189 /nfs/dbraw/zinc/58/61/89/566586189.db2.gz JPZXWOIQVGEWSW-UHFFFAOYSA-N 0 3 379.302 3.087 10 0 GGAEHN C[C@@H]1OCC[C@H]1N(CCO)Cc1ccc(OC(F)F)c(Br)c1 ZINC000449677316 566589383 /nfs/dbraw/zinc/58/93/83/566589383.db2.gz MHTKWIKAWBWECF-GXFFZTMASA-N 0 3 380.229 3.022 10 0 GGAEHN C[C@H]1OCC[C@H]1N(CCO)Cc1ccc(OC(F)F)c(Br)c1 ZINC000449677318 566589601 /nfs/dbraw/zinc/58/96/01/566589601.db2.gz MHTKWIKAWBWECF-ZWNOBZJWSA-N 0 3 380.229 3.022 10 0 GGAEHN OC[C@H](CNCc1cnn2ccccc12)Cc1ccc(F)c(Br)c1 ZINC000449681132 566590629 /nfs/dbraw/zinc/59/06/29/566590629.db2.gz LGYBBIHWPLDPGV-AWEZNQCLSA-N 0 3 392.272 3.177 10 0 GGAEHN C[C@H]([N-]S(=O)(=O)c1cccc(Br)c1Cl)C(C)(C)C[NH+](C)C ZINC000560042469 566590764 /nfs/dbraw/zinc/59/07/64/566590764.db2.gz RKXOKANMJKATLF-JTQLQIEISA-N 0 3 397.766 3.357 10 0 GGAEHN O=C(NCCNc1ccncc1)c1ccc(Br)cc1C(F)(F)F ZINC000539579853 566590812 /nfs/dbraw/zinc/59/08/12/566590812.db2.gz BRIYYIRBZPGPSZ-UHFFFAOYSA-N 0 3 388.187 3.127 10 0 GGAEHN CNC(=O)CC[C@@H]1CCCCN1C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000513216245 566590974 /nfs/dbraw/zinc/59/09/74/566590974.db2.gz ZBLOTWHGSGJUPD-UONOGXRCSA-N 0 3 389.323 3.114 10 0 GGAEHN CNC(=O)CC[C@H]1CCCCN1C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000513216246 566591037 /nfs/dbraw/zinc/59/10/37/566591037.db2.gz ZBLOTWHGSGJUPD-ZIAGYGMSSA-N 0 3 389.323 3.114 10 0 GGAEHN C[C@H]1OCC[C@@H]1N(CCO)Cc1ccc(OC(F)(F)F)c(Br)c1 ZINC000449683219 566591130 /nfs/dbraw/zinc/59/11/30/566591130.db2.gz YHPXOXCHHZTRMI-MFKMUULPSA-N 0 3 398.219 3.319 10 0 GGAEHN C[C@H]1OCC[C@H]1N(CCO)Cc1ccc(OC(F)(F)F)c(Br)c1 ZINC000449683221 566591440 /nfs/dbraw/zinc/59/14/40/566591440.db2.gz YHPXOXCHHZTRMI-ZWNOBZJWSA-N 0 3 398.219 3.319 10 0 GGAEHN CC[C@@H](NC(=O)N(C)[C@@H]1CCN(C2CC2)C1)c1nc(C(F)(F)F)cs1 ZINC000466696608 566591603 /nfs/dbraw/zinc/59/16/03/566591603.db2.gz OHBKFJCBAOINIS-VXGBXAGGSA-N 0 3 376.448 3.491 10 0 GGAEHN CC[C@@H](NC(=O)N(C)[C@H]1CCN(C2CC2)C1)c1nc(C(F)(F)F)cs1 ZINC000466696606 566591643 /nfs/dbraw/zinc/59/16/43/566591643.db2.gz OHBKFJCBAOINIS-NWDGAFQWSA-N 0 3 376.448 3.491 10 0 GGAEHN Cc1c(Br)cccc1C[C@@H](CO)CNCc1cnn2ccccc12 ZINC000449684620 566593046 /nfs/dbraw/zinc/59/30/46/566593046.db2.gz PXBWHLLFKFZRAX-OAHLLOKOSA-N 0 3 388.309 3.346 10 0 GGAEHN Cc1c(Br)cccc1C[C@H](CO)CNCc1cnn2ccccc12 ZINC000449684619 566593167 /nfs/dbraw/zinc/59/31/67/566593167.db2.gz PXBWHLLFKFZRAX-HNNXBMFYSA-N 0 3 388.309 3.346 10 0 GGAEHN O=C1CC[C@@H](N2CCN(CCCc3c(Cl)cccc3Cl)CC2)CCN1 ZINC000449702572 566594291 /nfs/dbraw/zinc/59/42/91/566594291.db2.gz SKYYFYBEOBEJBR-OAHLLOKOSA-N 0 3 384.351 3.212 10 0 GGAEHN CN(CCC(=O)NCc1cc(F)c(Br)cc1F)c1ccncc1 ZINC000628893185 566594307 /nfs/dbraw/zinc/59/43/07/566594307.db2.gz REVQBZJZPLSUDJ-UHFFFAOYSA-N 0 3 384.224 3.265 10 0 GGAEHN CC[C@@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1cccc(Br)c1 ZINC000579264207 566594518 /nfs/dbraw/zinc/59/45/18/566594518.db2.gz BFMZKJXAAFYSSG-HZPDHXFCSA-N 0 3 389.359 3.304 10 0 GGAEHN CC[C@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1cccc(Br)c1 ZINC000579264206 566595051 /nfs/dbraw/zinc/59/50/51/566595051.db2.gz BFMZKJXAAFYSSG-HOTGVXAUSA-N 0 3 389.359 3.304 10 0 GGAEHN CN(CCC(F)(F)F)[C@@H](CNCc1cnnn1C)c1ccc(Cl)cc1 ZINC000560077048 566595205 /nfs/dbraw/zinc/59/52/05/566595205.db2.gz OJAXZHVVHCTTOC-HNNXBMFYSA-N 0 3 375.826 3.184 10 0 GGAEHN COc1cc(C)nc(CNCCCNC(=O)c2ccc(Br)cc2)c1 ZINC000539712459 566597742 /nfs/dbraw/zinc/59/77/42/566597742.db2.gz MLSDFZFMKYYJAV-UHFFFAOYSA-N 0 3 392.297 3.071 10 0 GGAEHN CC1(C)CCC[C@@H](CNCc2ccc(S(=O)(=O)N3CCOCC3)s2)C1 ZINC000539713673 566598151 /nfs/dbraw/zinc/59/81/51/566598151.db2.gz FXAAUEQQUSZSJL-OAHLLOKOSA-N 0 3 386.583 3.075 10 0 GGAEHN CC(C)(C)n1cc(Br)c(C(=O)NC[C@@H]2CCN2C2CCCC2)n1 ZINC000628965994 566599081 /nfs/dbraw/zinc/59/90/81/566599081.db2.gz GNFRDPOLOUCCMX-ZDUSSCGKSA-N 0 3 383.334 3.147 10 0 GGAEHN COc1cc(Br)ccc1CN[C@@H]1CCO[C@@H](c2nccn2C)C1 ZINC000449773327 566600433 /nfs/dbraw/zinc/60/04/33/566600433.db2.gz MSZYQUYIEXASJP-GDBMZVCRSA-N 0 3 380.286 3.201 10 0 GGAEHN CN(C[C@@H](O)COc1ccc(Cl)cc1Br)C[C@@H]1CCCCO1 ZINC000513414429 566600452 /nfs/dbraw/zinc/60/04/52/566600452.db2.gz DKKDGDGQMATNEB-KGLIPLIRSA-N 0 3 392.721 3.343 10 0 GGAEHN CN(C)C[C@H](NC(=O)CN(C)[C@@H]1CCSC1)c1ccc(Cl)c(Cl)c1 ZINC000628969842 566602640 /nfs/dbraw/zinc/60/26/40/566602640.db2.gz ZNEPRKYFVZPFQN-CJNGLKHVSA-N 0 3 390.380 3.150 10 0 GGAEHN C[C@H]1COCC[C@H]1C(=O)Nc1cc(Br)ccc1N(C)CCN(C)C ZINC000425097548 566603299 /nfs/dbraw/zinc/60/32/99/566603299.db2.gz IHHNCXWKPBZNBV-DZGCQCFKSA-N 0 3 398.345 3.058 10 0 GGAEHN Cc1cc(Br)sc1S(=O)(=O)[N-]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000652366369 566605546 /nfs/dbraw/zinc/60/55/46/566605546.db2.gz SCYJJNIDXQPQES-SNVBAGLBSA-N 0 3 389.340 3.317 10 0 GGAEHN Cc1cc(Br)sc1S(=O)(=O)[N-]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000652366368 566605820 /nfs/dbraw/zinc/60/58/20/566605820.db2.gz SCYJJNIDXQPQES-JTQLQIEISA-N 0 3 389.340 3.317 10 0 GGAEHN CN(Cc1cnn(-c2ccc(Br)cc2)c1)[C@@H]1CCN(C2CC2)C1 ZINC000513502902 566606505 /nfs/dbraw/zinc/60/65/05/566606505.db2.gz IFSCBQOCWMMPTP-GOSISDBHSA-N 0 3 375.314 3.303 10 0 GGAEHN CN(Cc1cnn(-c2ccc(Br)cc2)c1)[C@H]1CCN(C2CC2)C1 ZINC000513502903 566607155 /nfs/dbraw/zinc/60/71/55/566607155.db2.gz IFSCBQOCWMMPTP-SFHVURJKSA-N 0 3 375.314 3.303 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1c(Cl)cc(F)cc1Br ZINC000449839718 566607223 /nfs/dbraw/zinc/60/72/23/566607223.db2.gz DCOGOHAYCVVEPO-LLVKDONJSA-N 0 3 393.684 3.082 10 0 GGAEHN O=C1C[C@H]([C@H]2CCCCN2Cc2nc3ccc(Br)cc3o2)CN1 ZINC000579421483 566607397 /nfs/dbraw/zinc/60/73/97/566607397.db2.gz JTBWSXMVEREXSF-SMDDNHRTSA-N 0 3 378.270 3.081 10 0 GGAEHN COC(=O)c1ccc(CN2CCC[C@H]([C@@H]3CCOC3)C2)c(Br)c1 ZINC000560261165 566611242 /nfs/dbraw/zinc/61/12/42/566611242.db2.gz PXLHRQDRYZBOJE-GOEBONIOSA-N 0 3 382.298 3.484 10 0 GGAEHN COC(=O)c1ccc(CNCCc2cnc(C3CC3)nc2)c(Br)c1 ZINC000560258367 566612001 /nfs/dbraw/zinc/61/20/01/566612001.db2.gz WLMFYULCXIYFHG-UHFFFAOYSA-N 0 3 390.281 3.235 10 0 GGAEHN CCC[C@H](C)[C@@H](CO)NCC(=O)Nc1c(Cl)cc(Cl)cc1C(=O)OC ZINC000579480397 566612821 /nfs/dbraw/zinc/61/28/21/566612821.db2.gz RZYFXERPNWXCPF-IINYFYTJSA-N 0 3 391.295 3.105 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CCC[C@H]2CN2CCCC2)c1 ZINC000513605316 566613248 /nfs/dbraw/zinc/61/32/48/566613248.db2.gz RDOAVVBUFCFOPH-AWEZNQCLSA-N 0 3 398.288 3.300 10 0 GGAEHN CCCN(C(=O)[C@H]1CCOc2ccc(Br)cc21)[C@H]1CCN(C)C1 ZINC000652489963 566614066 /nfs/dbraw/zinc/61/40/66/566614066.db2.gz QADYXKNYXFOBER-GJZGRUSLSA-N 0 3 381.314 3.258 10 0 GGAEHN O[C@H](COC[C@H]1CCCO1)CN1CCC[C@@H]1c1ccccc1Br ZINC000674875777 566614469 /nfs/dbraw/zinc/61/44/69/566614469.db2.gz SLLQXEGZVAELDV-HDMKZQKVSA-N 0 3 384.314 3.143 10 0 GGAEHN CC(=O)N1C[C@@H]2CCC[C@H](NCc3nc4cc(Br)ccc4[nH]3)[C@@H]2C1 ZINC000579577385 566620752 /nfs/dbraw/zinc/62/07/52/566620752.db2.gz VMRIVKKKINXJIR-CFVMTHIKSA-N 0 3 391.313 3.062 10 0 GGAEHN Cc1ccc(F)c(C(=O)NCCCNCc2cccnc2)c1Br ZINC000579593325 566622479 /nfs/dbraw/zinc/62/24/79/566622479.db2.gz CJJLWVWGKVYOJV-UHFFFAOYSA-N 0 3 380.261 3.201 10 0 GGAEHN CN(C(=O)Cc1c[nH]c2cccc(Br)c12)[C@@H]1CCN(C2CC2)C1 ZINC000513774795 566622787 /nfs/dbraw/zinc/62/27/87/566622787.db2.gz FOSQCPJNFRZOCH-CQSZACIVSA-N 0 3 376.298 3.168 10 0 GGAEHN CC[C@@H](CNC(=O)N[C@H]1CCCN(C)C1)Cc1cccc(Br)c1 ZINC000605961576 566623041 /nfs/dbraw/zinc/62/30/41/566623041.db2.gz RYEGUHNOLUMTDD-PBHICJAKSA-N 0 3 382.346 3.411 10 0 GGAEHN C[S@](=O)c1ccc(CN[C@H]2CCO[C@@H]2c2cncc(Br)c2)cc1 ZINC000486822898 566625267 /nfs/dbraw/zinc/62/52/67/566625267.db2.gz CBHJPQIJGZWNAQ-MFEFFIJZSA-N 0 3 395.322 3.201 10 0 GGAEHN CC[C@H](CN1CCCC1)NC(=O)N1CCc2cccc(Br)c2C1 ZINC000675194935 566627042 /nfs/dbraw/zinc/62/70/42/566627042.db2.gz SEOVIAFZFXFEFY-OAHLLOKOSA-N 0 3 380.330 3.391 10 0 GGAEHN CC[C@@H](CN1CCCC1)NC(=O)N1CCN(Cc2ccc(Cl)s2)CC1 ZINC000675193586 566627176 /nfs/dbraw/zinc/62/71/76/566627176.db2.gz IVJNGWKIPLLQHU-HNNXBMFYSA-N 0 3 384.977 3.103 10 0 GGAEHN CS(=O)(=O)N1CC[C@H](CN(Cc2ccc(Cl)c(Cl)c2)C2CC2)C1 ZINC000513879763 566630750 /nfs/dbraw/zinc/63/07/50/566630750.db2.gz KAQZBYVBFYPGIU-CYBMUJFWSA-N 0 3 377.337 3.239 10 0 GGAEHN C[C@@H](N[C@@H](CO)c1ccc(Br)cc1)c1ccc(-n2cncn2)cc1 ZINC000540140925 566631485 /nfs/dbraw/zinc/63/14/85/566631485.db2.gz AXSIUDGISSZXRM-ACJLOTCBSA-N 0 3 387.281 3.414 10 0 GGAEHN C[C@@H](CC(=O)N1CCCCCC1)N[C@H](CO)c1ccc(Br)cc1 ZINC000540160418 566632230 /nfs/dbraw/zinc/63/22/30/566632230.db2.gz FNFVMIYFTQZEBK-WMLDXEAASA-N 0 3 383.330 3.253 10 0 GGAEHN C[C@H](CC(=O)N1CCCCCC1)N[C@H](CO)c1ccc(Br)cc1 ZINC000540160417 566632945 /nfs/dbraw/zinc/63/29/45/566632945.db2.gz FNFVMIYFTQZEBK-RHSMWYFYSA-N 0 3 383.330 3.253 10 0 GGAEHN C[C@H](CC(=O)N1CCCCCC1)N[C@@H](CO)c1ccc(Br)cc1 ZINC000540160416 566632973 /nfs/dbraw/zinc/63/29/73/566632973.db2.gz FNFVMIYFTQZEBK-PBHICJAKSA-N 0 3 383.330 3.253 10 0 GGAEHN OC[C@@H](NC1CCC(O)(C(F)(F)F)CC1)c1cccc(Br)c1 ZINC000540164533 566633138 /nfs/dbraw/zinc/63/31/38/566633138.db2.gz SKUUQRKFUNPTBT-ROKHWSDSSA-N 0 3 382.220 3.308 10 0 GGAEHN CS[C@H]1CC[C@H]1NCC(C)(C)S(=O)(=O)c1ccc(Br)cc1 ZINC000425339584 566633232 /nfs/dbraw/zinc/63/32/32/566633232.db2.gz CSCBVMUKBOQVIR-KGLIPLIRSA-N 0 3 392.384 3.485 10 0 GGAEHN CCCOc1c(Br)cc(CN2CC[C@H](c3nc[nH]n3)C2)cc1OC ZINC000425347153 566633500 /nfs/dbraw/zinc/63/35/00/566633500.db2.gz AHADECDBGOUXFL-ZDUSSCGKSA-N 0 3 395.301 3.354 10 0 GGAEHN Cc1ccc(CC(=O)NCCCCN2C[C@@H](C)O[C@H](C)C2)c(Br)c1 ZINC000450121094 566635168 /nfs/dbraw/zinc/63/51/68/566635168.db2.gz HVWFKRCWAHQYBA-HZPDHXFCSA-N 0 3 397.357 3.306 10 0 GGAEHN CC[C@H](CNCc1c(Br)cnn1C)N1CCc2ccccc2C1 ZINC000486925397 566636391 /nfs/dbraw/zinc/63/63/91/566636391.db2.gz FYADEMFHOQSACY-MRXNPFEDSA-N 0 3 377.330 3.109 10 0 GGAEHN Cc1nn(-c2ccccc2)cc1CCCNCc1c(Br)cnn1C ZINC000486944890 566637934 /nfs/dbraw/zinc/63/79/34/566637934.db2.gz WVQUPZPPZLOAPO-UHFFFAOYSA-N 0 3 388.313 3.399 10 0 GGAEHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1c(Cl)cc(F)cc1Br ZINC000450151178 566639689 /nfs/dbraw/zinc/63/96/89/566639689.db2.gz GGRNDDWEAUAFDP-AMIZOPFISA-N 0 3 375.669 3.454 10 0 GGAEHN CCCN(Cc1ccc(S(=O)(=O)N(C)C)s1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000425418370 566641391 /nfs/dbraw/zinc/64/13/91/566641391.db2.gz LOULXYDAYVOHLZ-USXIJHARSA-N 0 3 386.583 3.024 10 0 GGAEHN CCN(CC)[C@H](CNCc1c(Br)cnn1C)Cc1ccccc1 ZINC000486990090 566641490 /nfs/dbraw/zinc/64/14/90/566641490.db2.gz OJSORVAFQHQFAP-INIZCTEOSA-N 0 3 379.346 3.225 10 0 GGAEHN CCN(CC)[C@H](CNCc1c(Br)cnn1C)c1cccc(OC)c1 ZINC000486986696 566641969 /nfs/dbraw/zinc/64/19/69/566641969.db2.gz YMXIFSYCOGXNTJ-QGZVFWFLSA-N 0 3 395.345 3.364 10 0 GGAEHN CC[C@@H]1C[C@H](CN2CCCN(c3nnc(C(F)(F)F)s3)CC2)CCO1 ZINC000467365364 566642566 /nfs/dbraw/zinc/64/25/66/566642566.db2.gz PLEUVTBIYIKBMD-CHWSQXEVSA-N 0 3 378.464 3.274 10 0 GGAEHN CC[C@H](NC(=O)NCCNc1ccncc1)c1cc(F)cc(Br)c1 ZINC000487053491 566644409 /nfs/dbraw/zinc/64/44/09/566644409.db2.gz LAIMUSWQNZGFED-INIZCTEOSA-N 0 3 395.276 3.268 10 0 GGAEHN O=C1c2ccccc2C(=O)N1CCNC1(c2cccc(Br)c2)CC1 ZINC000514148134 566645452 /nfs/dbraw/zinc/64/54/52/566645452.db2.gz CHXCWGCCOMJIJR-UHFFFAOYSA-N 0 3 385.261 3.324 10 0 GGAEHN C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ccc(Br)cn2)CC1 ZINC000450246640 566649862 /nfs/dbraw/zinc/64/98/62/566649862.db2.gz VJQRZBOCOCEYCZ-CRAIPNDOSA-N 0 3 390.325 3.131 10 0 GGAEHN O[C@H](CNc1ncc(Br)cc1C(F)(F)F)CN1CCCCC1 ZINC000450259546 566650788 /nfs/dbraw/zinc/65/07/88/566650788.db2.gz XCUNNQGQRACXCQ-LLVKDONJSA-N 0 3 382.224 3.122 10 0 GGAEHN Cc1cc(Br)c(F)cc1OCC(=O)NC1CCN(C2CC2)CC1 ZINC000629384528 566652764 /nfs/dbraw/zinc/65/27/64/566652764.db2.gz VUJOQSGVFZFHRE-UHFFFAOYSA-N 0 3 385.277 3.018 10 0 GGAEHN CCN1CC[C@@H](NCC2(CS(C)(=O)=O)CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000579932113 566652999 /nfs/dbraw/zinc/65/29/99/566652999.db2.gz PCPNRDMRISZABS-IAGOWNOFSA-N 0 3 388.936 3.029 10 0 GGAEHN Cc1ccc(C(=O)N[C@@H](CC(C)C)C(=O)NCCN(C)C)c(Cl)c1Cl ZINC000450273428 566652933 /nfs/dbraw/zinc/65/29/33/566652933.db2.gz GSSYOAXVUAJSSM-AWEZNQCLSA-N 0 3 388.339 3.124 10 0 GGAEHN CCN1CCN(CCC(=O)N[C@H](c2ccc(Cl)cc2)C(F)(F)F)CC1 ZINC000467551599 566653880 /nfs/dbraw/zinc/65/38/80/566653880.db2.gz SXDLSQFZIUYVEE-MRXNPFEDSA-N 0 3 377.838 3.087 10 0 GGAEHN CN(C)[C@]1(CNC(=O)N[C@@H]2CCCOc3c(Cl)cccc32)CCSC1 ZINC000540486257 566654806 /nfs/dbraw/zinc/65/48/06/566654806.db2.gz XMRHGVMKAWNCRK-QAPCUYQASA-N 0 3 383.945 3.290 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)N[C@H]2CCCOc3c(Cl)cccc32)CCSC1 ZINC000540486256 566654882 /nfs/dbraw/zinc/65/48/82/566654882.db2.gz XMRHGVMKAWNCRK-MAUKXSAKSA-N 0 3 383.945 3.290 10 0 GGAEHN Brc1cc(CNc2ccc3c(c2)OCCNC3)cc2c1OCO2 ZINC000629402321 566654909 /nfs/dbraw/zinc/65/49/09/566654909.db2.gz ZJMKGMYIBITGTB-UHFFFAOYSA-N 0 3 377.238 3.272 10 0 GGAEHN NC(=O)c1ccccc1N1CC[C@H](NCc2ccc(Br)c(F)c2)C1 ZINC000675640874 566656497 /nfs/dbraw/zinc/65/64/97/566656497.db2.gz HRBRYMQWNLXNHS-ZDUSSCGKSA-N 0 3 392.272 3.056 10 0 GGAEHN NC(=O)c1ccccc1N1CC[C@@H](NCc2ccc(Br)c(F)c2)C1 ZINC000675640870 566656516 /nfs/dbraw/zinc/65/65/16/566656516.db2.gz HRBRYMQWNLXNHS-CYBMUJFWSA-N 0 3 392.272 3.056 10 0 GGAEHN Cc1cc(Br)cc(C(=O)N2CC[C@@H](OCCN3CCCCC3)C2)c1 ZINC000467647663 566657842 /nfs/dbraw/zinc/65/78/42/566657842.db2.gz RRZXIUJBIUUHGG-GOSISDBHSA-N 0 3 395.341 3.475 10 0 GGAEHN CCN1CC[C@H](N(C)C(=O)c2n[nH]c3ccc(Br)cc32)C[C@@H]1C ZINC000607128298 566658716 /nfs/dbraw/zinc/65/87/16/566658716.db2.gz YXPXXAKBSZRNEF-AAEUAGOBSA-N 0 3 379.302 3.270 10 0 GGAEHN O=C1c2ccccc2C(=O)N1CCN[C@H]1CCc2cc(Br)ccc21 ZINC000675778390 566663484 /nfs/dbraw/zinc/66/34/84/566663484.db2.gz WQTBZPMIOLBJRQ-KRWDZBQOSA-N 0 3 385.261 3.322 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)Nc2cnc3c(Br)cccn23)CCN1C ZINC000425669867 566664241 /nfs/dbraw/zinc/66/42/41/566664241.db2.gz DGEHWDYBXQYGHB-NEPJUHHUSA-N 0 3 380.290 3.043 10 0 GGAEHN CN1CCN(CCCOc2cccc(I)c2)CC1(C)C ZINC000580089564 566665339 /nfs/dbraw/zinc/66/53/39/566665339.db2.gz MDCGAWCIYHBTQE-UHFFFAOYSA-N 0 3 388.293 3.086 10 0 GGAEHN COc1cc(Br)ccc1[C@H]1CCCN1C[C@@H]1CCC2(CNC2)O1 ZINC000629558178 566665733 /nfs/dbraw/zinc/66/57/33/566665733.db2.gz CJVOWLHEWQRJNM-GOEBONIOSA-N 0 3 381.314 3.116 10 0 GGAEHN COc1cc(Br)ccc1[C@H]1CCCN1C[C@H]1CCC2(CNC2)O1 ZINC000629558176 566666263 /nfs/dbraw/zinc/66/62/63/566666263.db2.gz CJVOWLHEWQRJNM-GDBMZVCRSA-N 0 3 381.314 3.116 10 0 GGAEHN CS[C@H]1CN(c2ncc(Br)cc2C(F)(F)F)C[C@@H]1N(C)C ZINC000450399506 566666666 /nfs/dbraw/zinc/66/66/66/566666666.db2.gz DHTXEYLJGBLVLO-QWRGUYRKSA-N 0 3 384.265 3.345 10 0 GGAEHN CS[C@@H]1CN(c2ncc(Br)cc2C(F)(F)F)C[C@H]1N(C)C ZINC000450399503 566667033 /nfs/dbraw/zinc/66/70/33/566667033.db2.gz DHTXEYLJGBLVLO-GHMZBOCLSA-N 0 3 384.265 3.345 10 0 GGAEHN C[C@@H]1C[C@@H](c2ccc(Br)cc2)CN1Cc1nc(C(C)(C)N)no1 ZINC000629581682 566667552 /nfs/dbraw/zinc/66/75/52/566667552.db2.gz FVHQVFWJBQBYPM-DGCLKSJQSA-N 0 3 379.302 3.404 10 0 GGAEHN C[C@H]1C[C@@H](c2ccc(Br)cc2)CN1Cc1nc(C(C)(C)N)no1 ZINC000629581683 566667788 /nfs/dbraw/zinc/66/77/88/566667788.db2.gz FVHQVFWJBQBYPM-WCQYABFASA-N 0 3 379.302 3.404 10 0 GGAEHN CCN1CCC[C@H](NC(=O)[C@H](CCOC)Cc2cccc(Br)c2)C1 ZINC000607339217 566668085 /nfs/dbraw/zinc/66/80/85/566668085.db2.gz APGCMNKATMOJMM-AEFFLSMTSA-N 0 3 397.357 3.245 10 0 GGAEHN O=C1CC[C@@H](CN2CCC[C@H]2c2ccccc2I)CCN1 ZINC000450403846 566668796 /nfs/dbraw/zinc/66/87/96/566668796.db2.gz MYUAOUZQNUGERD-CJNGLKHVSA-N 0 3 398.288 3.344 10 0 GGAEHN O[C@H](CNC[C@@H]1Cc2ccccc2CO1)COc1ccc(Cl)cc1Cl ZINC000629587589 566668823 /nfs/dbraw/zinc/66/88/23/566668823.db2.gz NWFITYPEYMSTSJ-SJORKVTESA-N 0 3 382.287 3.464 10 0 GGAEHN O[C@@H](CNC[C@@H](n1cccn1)C(F)(F)F)COc1c(Cl)cccc1Cl ZINC000629600802 566670493 /nfs/dbraw/zinc/67/04/93/566670493.db2.gz QZMIUXUDZPFQAG-GXFFZTMASA-N 0 3 398.212 3.323 10 0 GGAEHN O=S1(=O)C[C@@H](CNC2CC(c3ccc(Cl)cc3)C2)Oc2ccccc21 ZINC000580193679 566672565 /nfs/dbraw/zinc/67/25/65/566672565.db2.gz OUOBWGPJUDJTAZ-BDVYOWHSSA-N 0 3 377.893 3.411 10 0 GGAEHN O[C@H](CNC[C@@H](n1cccn1)C(F)(F)F)COc1cc(Cl)ccc1Cl ZINC000629601759 566672899 /nfs/dbraw/zinc/67/28/99/566672899.db2.gz VAEMTLCERWCTMT-BXUZGUMPSA-N 0 3 398.212 3.323 10 0 GGAEHN O=C1CC[C@H](CN2CCC[C@@H]2c2ccc(I)cc2)CCN1 ZINC000450457338 566673928 /nfs/dbraw/zinc/67/39/28/566673928.db2.gz RPXFAMILTBZUCF-XJKSGUPXSA-N 0 3 398.288 3.344 10 0 GGAEHN CN1C[C@@H]2CCCN(C(=O)N[C@H]3CCOc4c(Br)cccc43)[C@@H]2C1 ZINC000425757064 566674498 /nfs/dbraw/zinc/67/44/98/566674498.db2.gz OKMXIOMCWLEHAZ-VBNZEHGJSA-N 0 3 394.313 3.008 10 0 GGAEHN CO[C@H](CCNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1)C(F)(F)F ZINC000514856610 566674935 /nfs/dbraw/zinc/67/49/35/566674935.db2.gz PRZHOOFHJPEYKK-OAHLLOKOSA-N 0 3 381.460 3.315 10 0 GGAEHN CCN(CC)CCN(C(=O)CC[C@H](C)OC)c1ccc(Br)cn1 ZINC000580272997 566679035 /nfs/dbraw/zinc/67/90/35/566679035.db2.gz RTHLILXFWPLTLP-AWEZNQCLSA-N 0 3 386.334 3.334 10 0 GGAEHN COCCN1CCCN(c2ccc(Br)c(C(F)(F)F)n2)CC1 ZINC000561137229 566679561 /nfs/dbraw/zinc/67/95/61/566679561.db2.gz PVJPDNDJYFQZJB-UHFFFAOYSA-N 0 3 382.224 3.021 10 0 GGAEHN COc1ccc(C[C@H](C)CNCc2c(Br)cnn2C)cc1OC ZINC000487552770 566680118 /nfs/dbraw/zinc/68/01/18/566680118.db2.gz BEYASLTUMUCGBY-LBPRGKRZSA-N 0 3 382.302 3.168 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)CCN(C)c1ccncc1 ZINC000540929235 566681540 /nfs/dbraw/zinc/68/15/40/566681540.db2.gz VESGCULJVLVWOJ-AWEZNQCLSA-N 0 3 376.298 3.418 10 0 GGAEHN COCCN1CCC[C@H](NC(=O)C[C@@H](C)c2ccc(Br)cc2)C1 ZINC000676275890 566683420 /nfs/dbraw/zinc/68/34/20/566683420.db2.gz USOHLEAIYUAWIB-PBHICJAKSA-N 0 3 383.330 3.170 10 0 GGAEHN C[C@H]1CC[C@H](C)N1CC(=O)NC1(c2ccc(Br)cc2)CCOCC1 ZINC000468110633 566683504 /nfs/dbraw/zinc/68/35/04/566683504.db2.gz WADUJGSVBCXHAF-GJZGRUSLSA-N 0 3 395.341 3.444 10 0 GGAEHN COCCN1CCC[C@H](NC(=O)C[C@H](C)c2ccc(Br)cc2)C1 ZINC000676275895 566683652 /nfs/dbraw/zinc/68/36/52/566683652.db2.gz USOHLEAIYUAWIB-YOEHRIQHSA-N 0 3 383.330 3.170 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1CC[C@H](CO)[C@H]1C ZINC000425975926 566684799 /nfs/dbraw/zinc/68/47/99/566684799.db2.gz DHXAVRHTSMTKDT-UKRRQHHQSA-N 0 3 378.314 3.454 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1 ZINC000607907313 566686799 /nfs/dbraw/zinc/68/67/99/566686799.db2.gz FIPIVLAWUIPQER-NSHDSACASA-N 0 3 381.263 3.400 10 0 GGAEHN O=C(CCOc1cccc(Cl)c1Cl)NC1CCN([C@@H]2CCOC2)CC1 ZINC000676393861 566689316 /nfs/dbraw/zinc/68/93/16/566689316.db2.gz VJSDONIDVWAFRA-CQSZACIVSA-N 0 3 387.307 3.132 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@@H]1O[C@@H](C)C[C@H]1C)c1ccc(Br)cn1 ZINC000580436478 566693363 /nfs/dbraw/zinc/69/33/63/566693363.db2.gz YKNDXCDWAJHNOR-JKIFEVAISA-N 0 3 398.345 3.332 10 0 GGAEHN C[C@@H](Nc1ncc(I)cn1)[C@H](c1ccccc1)N(C)C ZINC000561324864 566695304 /nfs/dbraw/zinc/69/53/04/566695304.db2.gz LMIVWTCIWUFYKO-BXUZGUMPSA-N 0 3 382.249 3.185 10 0 GGAEHN C[C@H](Nc1ncc(I)cn1)[C@@H](c1ccccc1)N(C)C ZINC000561324865 566695935 /nfs/dbraw/zinc/69/59/35/566695935.db2.gz LMIVWTCIWUFYKO-FZMZJTMJSA-N 0 3 382.249 3.185 10 0 GGAEHN C[C@H](CS(=O)(=O)c1ccccc1)NCCc1ccccc1Br ZINC000580498969 566697802 /nfs/dbraw/zinc/69/78/02/566697802.db2.gz INWLFUZFIZLNMS-CQSZACIVSA-N 0 3 382.323 3.444 10 0 GGAEHN CC[C@H](NCCS(=O)(=O)c1cccc(Br)c1)[C@H]1CCCCO1 ZINC000653877338 566700738 /nfs/dbraw/zinc/70/07/38/566700738.db2.gz NJQJNARPFABINE-JKSUJKDBSA-N 0 3 390.343 3.160 10 0 GGAEHN C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Br)c(C(F)(F)F)c1 ZINC000450725101 566701791 /nfs/dbraw/zinc/70/17/91/566701791.db2.gz BRSHNARLEKQCPT-DTWKUNHWSA-N 0 3 383.208 3.013 10 0 GGAEHN Cc1cc(Br)cc(C)c1N1CCC[C@H](N[C@H](C)[C@@H](C)CO)C1=O ZINC000450737399 566701888 /nfs/dbraw/zinc/70/18/88/566701888.db2.gz JAEKHPIGBMOFQC-LZWOXQAQSA-N 0 3 383.330 3.168 10 0 GGAEHN CCn1nc2c(cc1=O)CN(CC/C=C\c1ccc(Br)cc1)CC2 ZINC000608096272 566702471 /nfs/dbraw/zinc/70/24/71/566702471.db2.gz OCGATKQCVCITFX-HYXAFXHYSA-N 0 3 388.309 3.487 10 0 GGAEHN Cc1nc2ccc(Br)cc2c(N(C)C[C@H]2CCS(=O)(=O)C2)c1C ZINC000608086721 566702691 /nfs/dbraw/zinc/70/26/91/566702691.db2.gz BBZFPCSCCHCJFO-CYBMUJFWSA-N 0 3 397.338 3.485 10 0 GGAEHN CN1CCC[C@@H](NC(=O)CCc2nc3cc(Br)ccc3s2)C1 ZINC000608127047 566704806 /nfs/dbraw/zinc/70/48/06/566704806.db2.gz BRMQATGQBSCDCP-GFCCVEGCSA-N 0 3 382.327 3.202 10 0 GGAEHN CN(CCNc1ccc2nnc(-c3cc(Cl)cc(Cl)c3)n2n1)C1CC1 ZINC000488063377 566705742 /nfs/dbraw/zinc/70/57/42/566705742.db2.gz CFKFQAAWGSDOER-UHFFFAOYSA-N 0 3 377.279 3.026 10 0 GGAEHN Cc1cc(Cl)cc2c1OCCC[C@H]2NC[C@@H]1CCCCN1S(C)(=O)=O ZINC000580588195 566705880 /nfs/dbraw/zinc/70/58/80/566705880.db2.gz CDVPYLKQJRMVNG-DOTOQJQBSA-N 0 3 386.945 3.266 10 0 GGAEHN C[C@@H]1[C@H]([NH2+]CC[N-]S(=O)(=O)c2ccc(Cl)s2)C[C@H]1c1ccccc1 ZINC000541239295 566706613 /nfs/dbraw/zinc/70/66/13/566706613.db2.gz CTAOJSLZHZTMPG-NWANDNLSSA-N 0 3 384.954 3.462 10 0 GGAEHN Cc1cc(S(=O)(=O)NCCN[C@@H]2C[C@H](c3ccccc3)[C@@H]2C)c(C)s1 ZINC000541239707 566706681 /nfs/dbraw/zinc/70/66/81/566706681.db2.gz NWFNDTMLFLVFAI-JCGIZDLHSA-N 0 3 378.563 3.425 10 0 GGAEHN Brc1ccc2[nH]c(CN[C@H]3CCCC[C@@H]3N3CCOCC3)nc2c1 ZINC000580615910 566709175 /nfs/dbraw/zinc/70/91/75/566709175.db2.gz TXCQLWNRKJGPQK-RDJZCZTQSA-N 0 3 393.329 3.058 10 0 GGAEHN Brc1ccc2nc(CN[C@H]3CCCC[C@@H]3N3CCOCC3)[nH]c2c1 ZINC000580615910 566709180 /nfs/dbraw/zinc/70/91/80/566709180.db2.gz TXCQLWNRKJGPQK-RDJZCZTQSA-N 0 3 393.329 3.058 10 0 GGAEHN OCC1(NCC2=Cc3cc(Br)ccc3OC2)Cc2ccccc2C1 ZINC000561490149 566709258 /nfs/dbraw/zinc/70/92/58/566709258.db2.gz MWZBIIRVGQAAOK-UHFFFAOYSA-N 0 3 386.289 3.344 10 0 GGAEHN O=C(CCNC[C@H](O)COc1c(Cl)cccc1Cl)N1CCCCCC1 ZINC000515415962 566711470 /nfs/dbraw/zinc/71/14/70/566711470.db2.gz ZUDRPWHGSCDBMK-AWEZNQCLSA-N 0 3 389.323 3.115 10 0 GGAEHN COCCSCCCN1CCN(Cc2ccc(Br)cc2)CC1 ZINC000488192060 566712883 /nfs/dbraw/zinc/71/28/83/566712883.db2.gz GRGXTEYQCQWIMB-UHFFFAOYSA-N 0 3 387.387 3.336 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)NCC1(N(C)C)CCC1 ZINC000468599087 566713139 /nfs/dbraw/zinc/71/31/39/566713139.db2.gz OCTSEJPSBXIGTP-LBPRGKRZSA-N 0 3 384.318 3.302 10 0 GGAEHN CN(C)CCN1CCC(NC(=O)N[C@@H]2CCCc3sc(Cl)cc32)CC1 ZINC000488213324 566714159 /nfs/dbraw/zinc/71/41/59/566714159.db2.gz CZPDZNQTAMLAAN-OAHLLOKOSA-N 0 3 384.977 3.104 10 0 GGAEHN O=C(Nc1cnc2c(Br)cccn12)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000654084442 566715026 /nfs/dbraw/zinc/71/50/26/566715026.db2.gz SNYCUTABIPPAGO-KGLIPLIRSA-N 0 3 392.301 3.235 10 0 GGAEHN CO[C@H](CCNCc1c(Cl)cccc1N1CCN(C)CC1)C(F)(F)F ZINC000468616307 566716172 /nfs/dbraw/zinc/71/61/72/566716172.db2.gz XTYUPWMAWPHZTO-MRXNPFEDSA-N 0 3 379.854 3.149 10 0 GGAEHN COc1cc(Br)ccc1CN1CCN(C2CCOCC2)C[C@@H]1C ZINC000426561394 566717383 /nfs/dbraw/zinc/71/73/83/566717383.db2.gz VRCDMSHVXFNMFG-AWEZNQCLSA-N 0 3 383.330 3.143 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@H]1CN(C2CC2)C[C@@H]1C ZINC000468694350 566720895 /nfs/dbraw/zinc/72/08/95/566720895.db2.gz OXTHEMHNOSVLCV-MKBNYLNASA-N 0 3 396.329 3.301 10 0 GGAEHN CC(C)[C@H]1C[C@@H](NCc2ccccc2CS(=O)(=O)N2CCCC2)CS1 ZINC000488432138 566727110 /nfs/dbraw/zinc/72/71/10/566727110.db2.gz GPVDLIGEPGQYIO-RTBURBONSA-N 0 3 382.595 3.232 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000654312053 566727782 /nfs/dbraw/zinc/72/77/82/566727782.db2.gz MQCQLDIKBSEEDU-CVEARBPZSA-N 0 3 381.314 3.133 10 0 GGAEHN Cc1c(Br)ccc(C(=O)N(CCN(C)C)C[C@@H]2CCCO2)c1F ZINC000468778367 566728786 /nfs/dbraw/zinc/72/87/86/566728786.db2.gz BGAPGIPFJPWBSU-ZDUSSCGKSA-N 0 3 387.293 3.079 10 0 GGAEHN C[C@H](c1ccccc1)[C@H](O)CN[C@@](C)(CO)c1ccc(Br)cc1 ZINC000450977982 566729576 /nfs/dbraw/zinc/72/95/76/566729576.db2.gz CJZOVAOXRVBOEJ-ZMYBRWDISA-N 0 3 378.310 3.411 10 0 GGAEHN C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NCc1ccc(S(C)(=O)=O)s1 ZINC000468786199 566730129 /nfs/dbraw/zinc/73/01/29/566730129.db2.gz BGDAXTMLVKLNQP-QAPCUYQASA-N 0 3 378.563 3.152 10 0 GGAEHN Cc1c(Cl)cccc1S(=O)(=O)NCc1cccc(OCCN(C)C)c1 ZINC000515754338 566731048 /nfs/dbraw/zinc/73/10/48/566731048.db2.gz VEQJNXRZCZZAQE-UHFFFAOYSA-N 0 3 382.913 3.067 10 0 GGAEHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc[nH]c(=O)c2Br)C1 ZINC000468801266 566731435 /nfs/dbraw/zinc/73/14/35/566731435.db2.gz CMESOLJTJVAQEP-OCCSQVGLSA-N 0 3 390.281 3.115 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)NCCc1ccc(F)c(Br)c1 ZINC000515827798 566734282 /nfs/dbraw/zinc/73/42/82/566734282.db2.gz AOLAAGHRNZPBQE-ZDUSSCGKSA-N 0 3 386.309 3.304 10 0 GGAEHN O=C(N[C@H]1CSc2ccc(Br)cc21)N1CC[C@H](N2CC=CC2)C1 ZINC000426842652 566734903 /nfs/dbraw/zinc/73/49/03/566734903.db2.gz ICDUCYWOWJYSBU-ZFWWWQNUSA-N 0 3 394.338 3.252 10 0 GGAEHN CC(C)(C)[C@@H]1CCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C[C@H]1O ZINC000541618368 566738433 /nfs/dbraw/zinc/73/84/33/566738433.db2.gz MQOAQACFCBAGBI-XJKCOSOUSA-N 0 3 376.324 3.462 10 0 GGAEHN C[C@@H](NCCCOc1cccc(I)c1)c1cnn(C)c1 ZINC000541644520 566740029 /nfs/dbraw/zinc/74/00/29/566740029.db2.gz RADBEJZNSFLSHK-GFCCVEGCSA-N 0 3 385.249 3.144 10 0 GGAEHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)nc(C)n1 ZINC000541623777 566740265 /nfs/dbraw/zinc/74/02/65/566740265.db2.gz JUNUBMKTMQLAKF-UHFFFAOYSA-N 0 3 391.313 3.060 10 0 GGAEHN O=C(CCc1cc(Cl)ccc1Br)N[C@H]1CNCCC1(F)F ZINC000581010910 566742481 /nfs/dbraw/zinc/74/24/81/566742481.db2.gz BRPZRFCZELZFBG-LBPRGKRZSA-N 0 3 381.648 3.149 10 0 GGAEHN O=C(CCc1cc(Cl)ccc1Br)N[C@@H]1CNCCC1(F)F ZINC000581010909 566743207 /nfs/dbraw/zinc/74/32/07/566743207.db2.gz BRPZRFCZELZFBG-GFCCVEGCSA-N 0 3 381.648 3.149 10 0 GGAEHN C[C@H](NC[C@@H](O)COc1c(Cl)cccc1Cl)C(=O)N1CCCC[C@@H]1C ZINC000516050061 566743815 /nfs/dbraw/zinc/74/38/15/566743815.db2.gz KOUNNFYNTGGZRS-MELADBBJSA-N 0 3 389.323 3.112 10 0 GGAEHN C[C@H](NC[C@H](O)COc1c(Cl)cccc1Cl)C(=O)N1CCCC[C@H]1C ZINC000516050062 566743945 /nfs/dbraw/zinc/74/39/45/566743945.db2.gz KOUNNFYNTGGZRS-RDBSUJKOSA-N 0 3 389.323 3.112 10 0 GGAEHN Cc1c(Br)ccc(C(=O)N2CCC(OCCN(C)C)CC2)c1F ZINC000468941020 566745434 /nfs/dbraw/zinc/74/54/34/566745434.db2.gz ICOXRFRWRKQCJV-UHFFFAOYSA-N 0 3 387.293 3.079 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@H]1CCN(C2CC2)C1 ZINC000468967471 566748353 /nfs/dbraw/zinc/74/83/53/566748353.db2.gz KALAZKLSUZHUOZ-AAEUAGOBSA-N 0 3 382.302 3.055 10 0 GGAEHN Cc1ccc(C(=O)N[C@H](C)CN2CCCCC2)cc1I ZINC000609070535 566748995 /nfs/dbraw/zinc/74/89/95/566748995.db2.gz HWMYAFKUBWEOEA-CYBMUJFWSA-N 0 3 386.277 3.204 10 0 GGAEHN CCN1CCC(n2nccc2NC(=O)c2ncsc2Br)CC1 ZINC000654699121 566749961 /nfs/dbraw/zinc/74/99/61/566749961.db2.gz ZPFUEQDSJROJLH-UHFFFAOYSA-N 0 3 384.303 3.011 10 0 GGAEHN Cc1ccc(C(=O)N2CC[C@@H](OCCN3CCCCC3)C2)cc1Br ZINC000427148125 566750095 /nfs/dbraw/zinc/75/00/95/566750095.db2.gz SYNDIQHDFVNBLD-QGZVFWFLSA-N 0 3 395.341 3.475 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1ccc(Br)cc1SC ZINC000654724739 566751477 /nfs/dbraw/zinc/75/14/77/566751477.db2.gz KDWBFTUXKIBPOL-CYBMUJFWSA-N 0 3 387.343 3.012 10 0 GGAEHN CS[C@@H]1CN(C(=O)COc2cc(Cl)ccc2Cl)C[C@H]1N1CCCC1 ZINC000541843632 566754067 /nfs/dbraw/zinc/75/40/67/566754067.db2.gz GUBWZYGHOWQMQU-GDBMZVCRSA-N 0 3 389.348 3.410 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N1CCC(Oc2cccc(Br)c2)CC1 ZINC000541842368 566754750 /nfs/dbraw/zinc/75/47/50/566754750.db2.gz KOLRSBBMKNEGNS-HNNXBMFYSA-N 0 3 396.329 3.096 10 0 GGAEHN O[C@@H](CCNCc1cccc(Br)c1OC(F)F)C(F)(F)F ZINC000561980686 566754851 /nfs/dbraw/zinc/75/48/51/566754851.db2.gz VNGYUSDCNYENPJ-VIFPVBQESA-N 0 3 378.135 3.453 10 0 GGAEHN Cc1ccc([C@@H](CNC(=O)c2c(F)cncc2Br)N(C)C)cc1 ZINC000630838975 566756252 /nfs/dbraw/zinc/75/62/52/566756252.db2.gz LXPSHFROXBJSRU-OAHLLOKOSA-N 0 3 380.261 3.324 10 0 GGAEHN CCNC(=O)C[C@H]1CCCCN1C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000581265808 566761996 /nfs/dbraw/zinc/76/19/96/566761996.db2.gz LAOUFKKXPWNUOD-ZIAGYGMSSA-N 0 3 389.323 3.114 10 0 GGAEHN Cc1[nH]c(=O)c(Br)cc1C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000581266685 566762427 /nfs/dbraw/zinc/76/24/27/566762427.db2.gz GKMWNJGVEUKHRA-HOTGVXAUSA-N 0 3 390.281 3.033 10 0 GGAEHN O=C([C@@H]1[C@@H]2Cc3cc(Br)ccc3[C@@H]21)N1CC[C@@H](N2CCCC2)C1 ZINC000630900068 566762652 /nfs/dbraw/zinc/76/26/52/566762652.db2.gz SKRPXBYAIXFNHD-NRSFXHEJSA-N 0 3 375.310 3.032 10 0 GGAEHN NC(C(=O)NCCCCSc1ccccc1Br)C(F)(F)F ZINC000581308403 566766935 /nfs/dbraw/zinc/76/69/35/566766935.db2.gz MNXVAZKYKXAGOA-NSHDSACASA-N 0 3 385.249 3.327 10 0 GGAEHN CN1CCC[C@H](NC(=O)NCc2ccc(Br)cc2C(F)(F)F)C1 ZINC000677859186 566767937 /nfs/dbraw/zinc/76/79/37/566767937.db2.gz SARISNVLVDMNOS-LBPRGKRZSA-N 0 3 394.235 3.361 10 0 GGAEHN CN(C(=O)CSCc1ccc(Br)cc1)[C@H]1CCN(C2CC2)C1 ZINC000609508998 566768646 /nfs/dbraw/zinc/76/86/46/566768646.db2.gz DGCZBCJXCIKBJE-INIZCTEOSA-N 0 3 383.355 3.377 10 0 GGAEHN CN(C)CCn1ccc(C(=O)N2CCC[C@@H]2c2ccc(Br)s2)n1 ZINC000654996806 566770342 /nfs/dbraw/zinc/77/03/42/566770342.db2.gz AMIAHTFXNXPMLJ-CYBMUJFWSA-N 0 3 397.342 3.246 10 0 GGAEHN COc1cc(CNC2CCN(C(=O)C(C)C)CC2)c(F)cc1Br ZINC000631038796 566772205 /nfs/dbraw/zinc/77/22/05/566772205.db2.gz MEYKAGZTSPGTCU-UHFFFAOYSA-N 0 3 387.293 3.333 10 0 GGAEHN Cc1cc(CN2CC[C@H](Cc3cccc(I)c3)C2)ncn1 ZINC000451187660 566773666 /nfs/dbraw/zinc/77/36/66/566773666.db2.gz GMROEIAZBAVFMU-OAHLLOKOSA-N 0 3 393.272 3.454 10 0 GGAEHN CN1CCN(CCCCNc2ncc(Br)cc2C(F)(F)F)CC1 ZINC000631058388 566774327 /nfs/dbraw/zinc/77/43/27/566774327.db2.gz DUTPFARABKYDBZ-UHFFFAOYSA-N 0 3 395.267 3.302 10 0 GGAEHN Cc1cc(C(=O)N[C@@H]2CNCCC2(F)F)nn1-c1ccc(Cl)c(Cl)c1 ZINC000516650364 566775489 /nfs/dbraw/zinc/77/54/89/566775489.db2.gz TXGIBSOYRDZMIR-CQSZACIVSA-N 0 3 389.233 3.215 10 0 GGAEHN O=C(c1ccccc1)N1CCC(CNCc2ccncc2Br)CC1 ZINC000631075922 566776245 /nfs/dbraw/zinc/77/62/45/566776245.db2.gz IGXGXOSGVNNHGL-UHFFFAOYSA-N 0 3 388.309 3.486 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)N[C@@H](C)c1ccc(Br)cc1OC ZINC000469265196 566776242 /nfs/dbraw/zinc/77/62/42/566776242.db2.gz CPFMDFRUDALWQV-GXTWGEPZSA-N 0 3 384.318 3.302 10 0 GGAEHN C[C@@H](C(=O)N(CCO)Cc1cc(Br)cs1)N1[C@H](C)CC[C@@H]1C ZINC000427555810 566778846 /nfs/dbraw/zinc/77/88/46/566778846.db2.gz LZNYFRRZDHZVNL-XQQFMLRXSA-N 0 3 389.359 3.093 10 0 GGAEHN CN(C)Cc1ccc(C(=O)N(CCO)Cc2cc(Br)cs2)cc1 ZINC000427556320 566779032 /nfs/dbraw/zinc/77/90/32/566779032.db2.gz OBUPPPMJWCXJGP-UHFFFAOYSA-N 0 3 397.338 3.207 10 0 GGAEHN COC(=O)[C@@H]1CCCCC[C@@H]1NCC(=O)Nc1ccc(C)cc1Br ZINC000451226488 566780613 /nfs/dbraw/zinc/78/06/13/566780613.db2.gz AUHHMMHWMTZPLS-HIFRSBDPSA-N 0 3 397.313 3.408 10 0 GGAEHN Cc1cc(NC(=O)c2ncsc2Br)ccc1OCCN(C)C ZINC000655143598 566782932 /nfs/dbraw/zinc/78/29/32/566782932.db2.gz FYRLPNQIPMICRQ-UHFFFAOYSA-N 0 3 384.299 3.407 10 0 GGAEHN CS[C@H]1CN(C(=O)Nc2cc(F)cc(Br)c2F)C[C@H]1N(C)C ZINC000562359066 566783610 /nfs/dbraw/zinc/78/36/10/566783610.db2.gz WEZYWCFBIYAJAV-NEPJUHHUSA-N 0 3 394.285 3.237 10 0 GGAEHN O=S(=O)(NCCCNCc1ccc(C(F)F)nc1)c1ccccc1Cl ZINC000631128026 566784285 /nfs/dbraw/zinc/78/42/85/566784285.db2.gz WRCBFNHLSUENGP-UHFFFAOYSA-N 0 3 389.855 3.131 10 0 GGAEHN Cn1ccnc1[C@@H]1C[C@@H](NCc2ncc(Br)cc2Cl)CCO1 ZINC000631154138 566785677 /nfs/dbraw/zinc/78/56/77/566785677.db2.gz FHZVCQDEUAYZHL-FZMZJTMJSA-N 0 3 385.693 3.241 10 0 GGAEHN CC[C@H](Cc1ccc(Br)cc1)NCc1cn(C[C@H]2CCOC2)nn1 ZINC000631176848 566786755 /nfs/dbraw/zinc/78/67/55/566786755.db2.gz HWXBCHPPDSUQKN-NVXWUHKLSA-N 0 3 393.329 3.188 10 0 GGAEHN NS(=O)(=O)c1cc(CN[C@@H]2[C@@H]3Cc4cc(Cl)ccc4[C@@H]32)ccc1Cl ZINC000631180895 566789638 /nfs/dbraw/zinc/78/96/38/566789638.db2.gz JNZSWXIXCCHWJJ-XOKHGSTOSA-N 0 3 383.300 3.069 10 0 GGAEHN Cc1scc(CNCc2ccc(S(N)(=O)=O)c(Br)c2)c1C ZINC000631208023 566790539 /nfs/dbraw/zinc/79/05/39/566790539.db2.gz YQCGYUMQKLQUQR-UHFFFAOYSA-N 0 3 389.340 3.065 10 0 GGAEHN O[C@@H]1C[C@@H]([C@H]2CCCOC2)N(Cc2cc(Br)cc3cccnc32)C1 ZINC000451295090 566791902 /nfs/dbraw/zinc/79/19/02/566791902.db2.gz CWBURJFIOGMQKN-QGTPRVQTSA-N 0 3 391.309 3.359 10 0 GGAEHN COc1cc(C[NH2+]C[C@H](O)CCc2ccccc2)cc(Br)c1[O-] ZINC000542314385 566793195 /nfs/dbraw/zinc/79/31/95/566793195.db2.gz FWSXJMKQAUBOJY-OAHLLOKOSA-N 0 3 380.282 3.247 10 0 GGAEHN Brc1cccc2c1C[C@H]([NH2+]Cc1nnc(C3CCOCC3)[n-]1)CC2 ZINC000631214776 566793143 /nfs/dbraw/zinc/79/31/43/566793143.db2.gz YKQIQSBAKNHLAW-CQSZACIVSA-N 0 3 391.313 3.108 10 0 GGAEHN Brc1cccc2c1C[C@H](NCc1nnc(C3CCOCC3)[nH]1)CC2 ZINC000631214776 566793152 /nfs/dbraw/zinc/79/31/52/566793152.db2.gz YKQIQSBAKNHLAW-CQSZACIVSA-N 0 3 391.313 3.108 10 0 GGAEHN Cc1nnc(SCCC(=O)Nc2ccc(CN(C)C)c(Br)c2)[nH]1 ZINC000469484139 566793198 /nfs/dbraw/zinc/79/31/98/566793198.db2.gz PANZHBOBGCYWHA-UHFFFAOYSA-N 0 3 398.330 3.058 10 0 GGAEHN CN1CCC(n2cc(NCc3cc(Br)cc4c3OCC4)cn2)CC1 ZINC000631225585 566793822 /nfs/dbraw/zinc/79/38/22/566793822.db2.gz MQEBZPORHWKHPC-UHFFFAOYSA-N 0 3 391.313 3.459 10 0 GGAEHN C[C@@H](CNC(=O)c1c(F)cncc1Br)N(C)Cc1ccccc1 ZINC000631221911 566793838 /nfs/dbraw/zinc/79/38/38/566793838.db2.gz MMKQNVSJRLFGHN-LBPRGKRZSA-N 0 3 380.261 3.234 10 0 GGAEHN COc1ccccc1[C@H]1[C@@H](N)CCCN1C(=O)c1ccncc1Br ZINC000516954808 566795200 /nfs/dbraw/zinc/79/52/00/566795200.db2.gz YFNATXLLDRCXHQ-RDJZCZTQSA-N 0 3 390.281 3.157 10 0 GGAEHN O=C(c1cc[nH]c(=O)c1Br)N(CCN1CCCC1)c1ccccc1 ZINC000562483405 566795236 /nfs/dbraw/zinc/79/52/36/566795236.db2.gz RWWCWUXSELVMTL-UHFFFAOYSA-N 0 3 390.281 3.292 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)N1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000581657173 566796745 /nfs/dbraw/zinc/79/67/45/566796745.db2.gz JEPPARNQRDCUMU-UONOGXRCSA-N 0 3 394.249 3.074 10 0 GGAEHN O[C@H](COC[C@@H]1CCCO1)CN1CCC(c2cccc(Br)c2)CC1 ZINC000562498938 566796879 /nfs/dbraw/zinc/79/68/79/566796879.db2.gz GYCOYSDBZYNHRD-OALUTQOASA-N 0 3 398.341 3.185 10 0 GGAEHN CO[C@@H](C(=O)N1CCc2ccccc2[C@H]1CN)c1ccccc1Br ZINC000655483761 566802920 /nfs/dbraw/zinc/80/29/20/566802920.db2.gz LLKOFJDKIWYVJD-QZTJIDSGSA-N 0 3 389.293 3.221 10 0 GGAEHN Cc1nc2ccc(S(=O)(=O)NC[C@H]3CCCN(CC(C)C)C3)cc2s1 ZINC000489721332 566804864 /nfs/dbraw/zinc/80/48/64/566804864.db2.gz PZRJRMWNGDJROQ-OAHLLOKOSA-N 0 3 381.567 3.251 10 0 GGAEHN Cc1nc2ccc(S(=O)(=O)NC[C@@H]3CCCN(CC(C)C)C3)cc2s1 ZINC000489721330 566804920 /nfs/dbraw/zinc/80/49/20/566804920.db2.gz PZRJRMWNGDJROQ-HNNXBMFYSA-N 0 3 381.567 3.251 10 0 GGAEHN O=C1[C@H](N[C@@H]2CCCc3ccc(Br)cc32)CCN1C1CCOCC1 ZINC000678595663 566805504 /nfs/dbraw/zinc/80/55/04/566805504.db2.gz WYYQRGUABHNGSA-QZTJIDSGSA-N 0 3 393.325 3.196 10 0 GGAEHN NC[C@@H](NC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1)C(F)(F)F ZINC000655513796 566806075 /nfs/dbraw/zinc/80/60/75/566806075.db2.gz DZXZNOKUNDSMKD-SNVBAGLBSA-N 0 3 383.317 3.448 10 0 GGAEHN Cc1nc(CSc2ccccc2C(=O)N[C@H](CN)C(F)(F)F)cs1 ZINC000655515334 566806327 /nfs/dbraw/zinc/80/63/27/566806327.db2.gz YGOGVKBNTRDHKP-CYBMUJFWSA-N 0 3 375.441 3.363 10 0 GGAEHN Cc1nc(CSc2ccc(C(=O)N[C@H](CN)C(F)(F)F)cc2)cs1 ZINC000655513720 566806611 /nfs/dbraw/zinc/80/66/11/566806611.db2.gz CNRNCGIMMQHIAV-CYBMUJFWSA-N 0 3 375.441 3.363 10 0 GGAEHN NC[C@H](NC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1)C(F)(F)F ZINC000655513795 566807032 /nfs/dbraw/zinc/80/70/32/566807032.db2.gz DZXZNOKUNDSMKD-JTQLQIEISA-N 0 3 383.317 3.448 10 0 GGAEHN Cc1nc(CSc2ccc(C(=O)N[C@@H](CN)C(F)(F)F)cc2)cs1 ZINC000655513721 566807191 /nfs/dbraw/zinc/80/71/91/566807191.db2.gz CNRNCGIMMQHIAV-ZDUSSCGKSA-N 0 3 375.441 3.363 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)NCc1sccc1Br ZINC000581822773 566807432 /nfs/dbraw/zinc/80/74/32/566807432.db2.gz ORSXYPIKXBOSLY-CQSZACIVSA-N 0 3 380.311 3.278 10 0 GGAEHN OC[C@@H](N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1 ZINC000678609929 566807477 /nfs/dbraw/zinc/80/74/77/566807477.db2.gz ATCKYNBGGNGUAE-RTBURBONSA-N 0 3 375.310 3.347 10 0 GGAEHN OC[C@H](N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1 ZINC000678609926 566807798 /nfs/dbraw/zinc/80/77/98/566807798.db2.gz ATCKYNBGGNGUAE-MOPGFXCFSA-N 0 3 375.310 3.347 10 0 GGAEHN Cc1cc(Br)ccc1NC(=O)CN1CCc2ccccc2[C@@H]1CN ZINC000517146724 566808391 /nfs/dbraw/zinc/80/83/91/566808391.db2.gz LMEGHLLRYCUMMK-SFHVURJKSA-N 0 3 388.309 3.254 10 0 GGAEHN N[C@H](CC(F)F)C(=O)N1CCN(c2cc(Cl)c(Cl)c(Cl)c2)CC1 ZINC000655525302 566808497 /nfs/dbraw/zinc/80/84/97/566808497.db2.gz MVIFWAGLPLCURJ-LLVKDONJSA-N 0 3 386.657 3.278 10 0 GGAEHN CN(C)CCn1ccc(NC(=O)Nc2cc(Cl)ccc2C(F)(F)F)n1 ZINC000489762298 566808731 /nfs/dbraw/zinc/80/87/31/566808731.db2.gz CVJUOGTVYXDAHL-UHFFFAOYSA-N 0 3 375.782 3.183 10 0 GGAEHN CN(Cc1ccccc1)[C@@H]1CCN(C(=O)c2c(F)cncc2Br)C1 ZINC000631543958 566809544 /nfs/dbraw/zinc/80/95/44/566809544.db2.gz NTSUBAYDVCDDPR-CQSZACIVSA-N 0 3 392.272 3.330 10 0 GGAEHN Brc1cnn(CCCNCc2cnc(-c3ccccn3)s2)c1 ZINC000517198509 566811316 /nfs/dbraw/zinc/81/13/16/566811316.db2.gz GVSKDWXSNVTBJC-UHFFFAOYSA-N 0 3 378.299 3.344 10 0 GGAEHN CN(C)C(=O)C1(NC[C@@H](O)COc2c(Cl)cccc2Cl)CCCCC1 ZINC000451405519 566812254 /nfs/dbraw/zinc/81/22/54/566812254.db2.gz PEZWCXIVXSMELR-CYBMUJFWSA-N 0 3 389.323 3.114 10 0 GGAEHN CS(=O)(=O)[C@@H]1CCCC[C@@H]1N[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000631659938 566812846 /nfs/dbraw/zinc/81/28/46/566812846.db2.gz GHZDUJUBXLATQX-LMLQULGWSA-N 0 3 384.339 3.033 10 0 GGAEHN Cc1ccsc1[C@@H](CO)NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000489917549 566817920 /nfs/dbraw/zinc/81/79/20/566817920.db2.gz XNVAOLOYJISPNM-CABCVRRESA-N 0 3 379.551 3.288 10 0 GGAEHN C[C@@H](Cc1ccc(Br)c(F)c1)NCc1nnc(C2CCOCC2)[nH]1 ZINC000631695719 566817973 /nfs/dbraw/zinc/81/79/73/566817973.db2.gz IMKQLNXYZMKDMP-NSHDSACASA-N 0 3 397.292 3.321 10 0 GGAEHN C[C@@H](Cc1ccc(Br)c(F)c1)[NH2+]Cc1nnc(C2CCOCC2)[n-]1 ZINC000631695719 566817977 /nfs/dbraw/zinc/81/79/77/566817977.db2.gz IMKQLNXYZMKDMP-NSHDSACASA-N 0 3 397.292 3.321 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1F)NCc1n[nH]c(C2CCOCC2)n1 ZINC000631695973 566819000 /nfs/dbraw/zinc/81/90/00/566819000.db2.gz LBDVBCCPGKSWOZ-NSHDSACASA-N 0 3 397.292 3.321 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1F)[NH2+]Cc1nnc(C2CCOCC2)[n-]1 ZINC000631695973 566819007 /nfs/dbraw/zinc/81/90/07/566819007.db2.gz LBDVBCCPGKSWOZ-NSHDSACASA-N 0 3 397.292 3.321 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)NCc1n[nH]c(C2CCOCC2)n1 ZINC000631695972 566819176 /nfs/dbraw/zinc/81/91/76/566819176.db2.gz LBDVBCCPGKSWOZ-LLVKDONJSA-N 0 3 397.292 3.321 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)[NH2+]Cc1nnc(C2CCOCC2)[n-]1 ZINC000631695972 566819183 /nfs/dbraw/zinc/81/91/83/566819183.db2.gz LBDVBCCPGKSWOZ-LLVKDONJSA-N 0 3 397.292 3.321 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@@H](C)c1ccc2[nH]c(=O)oc2c1 ZINC000631736960 566822206 /nfs/dbraw/zinc/82/22/06/566822206.db2.gz CNKPVDCKPQJGMR-MNOVXSKESA-N 0 3 392.253 3.197 10 0 GGAEHN C[C@@H]1CC[C@H](C)N1[C@H]1CCCN(S(=O)(=O)c2onc(C3CC3)c2Cl)C1 ZINC000631785164 566824964 /nfs/dbraw/zinc/82/49/64/566824964.db2.gz MFAPHMIUXZLUJK-SCRDCRAPSA-N 0 3 387.933 3.231 10 0 GGAEHN CC(C)N(Cc1cc(Br)cc(Br)c1N)C[C@H](C)O ZINC000469897709 566826315 /nfs/dbraw/zinc/82/63/15/566826315.db2.gz FYXHXCOBCVLXMM-VIFPVBQESA-N 0 3 380.124 3.385 10 0 GGAEHN O=C(NC1CCN([C@H]2CCOC2)CC1)c1oc2ccccc2c1Br ZINC000631801956 566827591 /nfs/dbraw/zinc/82/75/91/566827591.db2.gz XVCXWFNDVNYBGP-ZDUSSCGKSA-N 0 3 393.281 3.178 10 0 GGAEHN Cc1cc(Br)ccc1C(=O)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000469931706 566827542 /nfs/dbraw/zinc/82/75/42/566827542.db2.gz XDQWBLYWAZLZSA-KRWDZBQOSA-N 0 3 395.341 3.475 10 0 GGAEHN O=C(Cc1ccc(Br)cc1)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000469922487 566827922 /nfs/dbraw/zinc/82/79/22/566827922.db2.gz AYPGTOUCEBGVCR-SFHVURJKSA-N 0 3 395.341 3.095 10 0 GGAEHN O=C(c1csc(Br)c1)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000469920673 566827977 /nfs/dbraw/zinc/82/79/77/566827977.db2.gz VOPWBXHOMBSWIS-CQSZACIVSA-N 0 3 387.343 3.228 10 0 GGAEHN C[C@H](CC(=O)Nc1ccc(Br)cc1)N[C@H]1CCCn2nccc21 ZINC000631809308 566828235 /nfs/dbraw/zinc/82/82/35/566828235.db2.gz NLPSLWARSBEUJP-DOMZBBRYSA-N 0 3 377.286 3.487 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)[C@H]1CCCN1C1CCCC1 ZINC000428268585 566828725 /nfs/dbraw/zinc/82/87/25/566828725.db2.gz FFRFHJFDQNLQQK-MRXNPFEDSA-N 0 3 381.314 3.481 10 0 GGAEHN Cc1c(Br)cccc1C(=O)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000469933168 566828854 /nfs/dbraw/zinc/82/88/54/566828854.db2.gz BEHQISNNGZCYPW-MRXNPFEDSA-N 0 3 395.341 3.475 10 0 GGAEHN O=C(c1sccc1Br)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000469932507 566829352 /nfs/dbraw/zinc/82/93/52/566829352.db2.gz JVMTXTAUDGRSDE-CYBMUJFWSA-N 0 3 387.343 3.228 10 0 GGAEHN CN(CC(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1)[C@H]1CCSC1 ZINC000490182791 566834714 /nfs/dbraw/zinc/83/47/14/566834714.db2.gz RKKSQORXZSHEKP-BBRMVZONSA-N 0 3 378.929 3.317 10 0 GGAEHN C[C@@H](N[C@@H](C)Cc1ccc(F)cc1Br)C1(S(C)(=O)=O)CC1 ZINC000582144555 566834969 /nfs/dbraw/zinc/83/49/69/566834969.db2.gz QDNHDQBTNMOFGF-WDEREUQCSA-N 0 3 378.307 3.075 10 0 GGAEHN Brc1ccc2c(c1)[C@H](NC1CCN([C@@H]3CCOC3)CC1)CCO2 ZINC000655701571 566836734 /nfs/dbraw/zinc/83/67/34/566836734.db2.gz TVUAKVLIXLNQMX-NVXWUHKLSA-N 0 3 381.314 3.116 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1C[C@@H](O)C2(CC2)C1 ZINC000428389646 566837415 /nfs/dbraw/zinc/83/74/15/566837415.db2.gz MEUOLRDJSJCUAV-QGZVFWFLSA-N 0 3 376.298 3.208 10 0 GGAEHN CN(CC(=O)N1CCN(c2ncc(Cl)cc2Cl)CC1)C1(C)CCCC1 ZINC000490205449 566837536 /nfs/dbraw/zinc/83/75/36/566837536.db2.gz UEJFFDDDSDBQNI-UHFFFAOYSA-N 0 3 385.339 3.302 10 0 GGAEHN CN1CC[C@H]2[C@H](CCCN2C(=O)Cc2csc(CCC(F)(F)F)n2)C1 ZINC000631951221 566838061 /nfs/dbraw/zinc/83/80/61/566838061.db2.gz ZOFVLYPPPKJCCL-OCCSQVGLSA-N 0 3 375.460 3.123 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CNC1CCC(C(N)=O)CC1 ZINC000655736429 566840344 /nfs/dbraw/zinc/84/03/44/566840344.db2.gz GVYIQPWATOSNBG-UHFFFAOYSA-N 0 3 391.313 3.077 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000517696722 566841268 /nfs/dbraw/zinc/84/12/68/566841268.db2.gz AJJYMVZDTFPMJU-HNNXBMFYSA-N 0 3 390.325 3.407 10 0 GGAEHN CN(C(=O)CCCOc1ccccc1Br)[C@H]1CN2CCC1CC2 ZINC000517699670 566841662 /nfs/dbraw/zinc/84/16/62/566841662.db2.gz SPPPTIIJNLNUOV-INIZCTEOSA-N 0 3 381.314 3.161 10 0 GGAEHN C[C@H]1CN(CCCNC(=O)c2cc3c(cccc3Br)[nH]2)CCCO1 ZINC000470066182 566843110 /nfs/dbraw/zinc/84/31/10/566843110.db2.gz MSLVPHZCEXYVJN-ZDUSSCGKSA-N 0 3 394.313 3.161 10 0 GGAEHN Brc1cccc([C@@H]2CCN(CCc3nnnn3-c3ccccc3)C2)c1 ZINC000451576363 566843135 /nfs/dbraw/zinc/84/31/35/566843135.db2.gz ZQGVRIONIIRDRP-MRXNPFEDSA-N 0 3 398.308 3.457 10 0 GGAEHN CSC1(CNC(=O)[C@@H]2CCc3cc(Br)ccc32)CCN(C)CC1 ZINC000582242746 566844222 /nfs/dbraw/zinc/84/42/22/566844222.db2.gz PJLJTGANTXIBPW-MRXNPFEDSA-N 0 3 397.382 3.423 10 0 GGAEHN O=S1(=O)CCC(CCNCc2oc3ccccc3c2Br)CC1 ZINC000655757244 566844526 /nfs/dbraw/zinc/84/45/26/566844526.db2.gz RFIOUADDSMLNIA-UHFFFAOYSA-N 0 3 386.311 3.500 10 0 GGAEHN COC(=O)[C@@H]1CCCC[C@@H]1NCC(=O)Nc1ccc(C)cc1Br ZINC000451587064 566845341 /nfs/dbraw/zinc/84/53/41/566845341.db2.gz JUKNQZBWQLPQFX-OCCSQVGLSA-N 0 3 383.286 3.017 10 0 GGAEHN Brc1cccc2c1OCC[C@H]2NC1CCN([C@H]2CCOC2)CC1 ZINC000655763544 566845339 /nfs/dbraw/zinc/84/53/39/566845339.db2.gz PRSILKIXACWSJJ-WMLDXEAASA-N 0 3 381.314 3.116 10 0 GGAEHN CC[C@@H](NCc1cn(-c2ccccc2Br)nc1C)[C@@H](O)C(F)F ZINC000655778407 566847834 /nfs/dbraw/zinc/84/78/34/566847834.db2.gz KHRXQCRZJVDFGV-UKRRQHHQSA-N 0 3 388.256 3.437 10 0 GGAEHN C[C@H]1CN(CCCNC(=O)C(C)(C)c2cccc(Br)c2)CCCO1 ZINC000470111741 566847900 /nfs/dbraw/zinc/84/79/00/566847900.db2.gz NDFYKSCDNUUTEX-HNNXBMFYSA-N 0 3 397.357 3.344 10 0 GGAEHN CC[C@H](NCc1cn(-c2ccccc2Br)nc1C)[C@@H](O)C(F)F ZINC000655778405 566848021 /nfs/dbraw/zinc/84/80/21/566848021.db2.gz KHRXQCRZJVDFGV-DZGCQCFKSA-N 0 3 388.256 3.437 10 0 GGAEHN C[C@@H]1CN(CCCNC(=O)C(C)(C)c2cccc(Br)c2)CCCO1 ZINC000470111743 566848127 /nfs/dbraw/zinc/84/81/27/566848127.db2.gz NDFYKSCDNUUTEX-OAHLLOKOSA-N 0 3 397.357 3.344 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@@H]1CCO[C@@H](C)C1)c1ccc(Br)cn1 ZINC000517804255 566849299 /nfs/dbraw/zinc/84/92/99/566849299.db2.gz LDNCUWSUYLNIHN-LSDHHAIUSA-N 0 3 398.345 3.334 10 0 GGAEHN C[C@H](NC(=O)N1CCN(CCC(C)(C)C)CC1)c1ncc(Br)cn1 ZINC000563056895 566849622 /nfs/dbraw/zinc/84/96/22/566849622.db2.gz GHNDCJWDYJDZQA-ZDUSSCGKSA-N 0 3 398.349 3.064 10 0 GGAEHN COCCN1CCC[C@@H]1CN[C@H](c1ccc(Br)cc1)[C@@H]1CCCO1 ZINC000679336583 566849688 /nfs/dbraw/zinc/84/96/88/566849688.db2.gz AJVGPDLZGZBUMA-CEXWTWQISA-N 0 3 397.357 3.370 10 0 GGAEHN Brc1ccccc1-n1cc(CNCCCC2CCOCC2)nn1 ZINC000470160910 566851645 /nfs/dbraw/zinc/85/16/45/566851645.db2.gz JFRPXMNZXRZBMZ-UHFFFAOYSA-N 0 3 379.302 3.326 10 0 GGAEHN COc1sc(CNC[C@@H](C)N2C[C@@H](C)O[C@@H](C)C2)cc1Br ZINC000655823790 566852303 /nfs/dbraw/zinc/85/23/03/566852303.db2.gz MPONXIULCZPXCJ-UTUOFQBUSA-N 0 3 377.348 3.107 10 0 GGAEHN CCS(=O)(=O)C[C@@H](C)NCC1(c2cccc(OC(F)(F)F)c2)CCC1 ZINC000655821382 566852584 /nfs/dbraw/zinc/85/25/84/566852584.db2.gz XRCHNFLBWNUNGH-CYBMUJFWSA-N 0 3 379.444 3.420 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)Nc1ccc(I)cc1Cl ZINC000517898090 566853172 /nfs/dbraw/zinc/85/31/72/566853172.db2.gz NLDMSDDGPIPGQZ-JTQLQIEISA-N 0 3 393.656 3.160 10 0 GGAEHN O=C(NC[C@@H]1CCCCN1C1CC1)c1[nH]nc2ccc(Br)cc21 ZINC000470165801 566853546 /nfs/dbraw/zinc/85/35/46/566853546.db2.gz OQFQLCZJXGZAES-ZDUSSCGKSA-N 0 3 377.286 3.072 10 0 GGAEHN CN1CCC[C@H](NC(=O)Nc2cc(I)ccc2Cl)C1 ZINC000610713574 566856188 /nfs/dbraw/zinc/85/61/88/566856188.db2.gz PZGMQMCLLURZBU-JTQLQIEISA-N 0 3 393.656 3.160 10 0 GGAEHN COc1ccc(OC)c(CNC[C@@H](CO)Cc2ccc(Br)cc2)c1 ZINC000428544187 566856184 /nfs/dbraw/zinc/85/61/84/566856184.db2.gz UAIADZLLIOHJCM-HNNXBMFYSA-N 0 3 394.309 3.407 10 0 GGAEHN COc1ccc(OC)c(CNC[C@@H](CO)Cc2cccc(Br)c2)c1 ZINC000428545019 566856318 /nfs/dbraw/zinc/85/63/18/566856318.db2.gz UYFABYBMQQDLKV-HNNXBMFYSA-N 0 3 394.309 3.407 10 0 GGAEHN COc1ccc(OC)c(CNC[C@H](CO)Cc2cccc(Br)c2)c1 ZINC000428545021 566856606 /nfs/dbraw/zinc/85/66/06/566856606.db2.gz UYFABYBMQQDLKV-OAHLLOKOSA-N 0 3 394.309 3.407 10 0 GGAEHN COc1cc(C)nc(CNC[C@H](CO)Cc2ccccc2Br)c1 ZINC000428546675 566856910 /nfs/dbraw/zinc/85/69/10/566856910.db2.gz MJYWKGGCPRYOES-CQSZACIVSA-N 0 3 379.298 3.102 10 0 GGAEHN NC[C@@H](NC(=O)N[C@@H](c1ccc(Br)cc1)C1CCC1)C(F)(F)F ZINC000655910747 566858434 /nfs/dbraw/zinc/85/84/34/566858434.db2.gz BMGVKQOEBYKOOD-CHWSQXEVSA-N 0 3 394.235 3.479 10 0 GGAEHN NC[C@@H](NC(=O)N1CCC[C@@H](COc2ccccc2Cl)C1)C(F)(F)F ZINC000655919442 566858681 /nfs/dbraw/zinc/85/86/81/566858681.db2.gz CORXNFLSAUHPJO-BXUZGUMPSA-N 0 3 379.810 3.030 10 0 GGAEHN O=C(Nc1ccc2c(c1)CNC2)N1CCOc2cccc(Br)c2C1 ZINC000655910123 566858917 /nfs/dbraw/zinc/85/89/17/566858917.db2.gz UOLQRXUKRWODKW-UHFFFAOYSA-N 0 3 388.265 3.479 10 0 GGAEHN CN(CC1(c2ccc(Br)cc2)CC1)C(=O)N[C@@H](CN)C(F)(F)F ZINC000655922083 566859201 /nfs/dbraw/zinc/85/92/01/566859201.db2.gz ZUHNGYQPPJXYOP-LBPRGKRZSA-N 0 3 394.235 3.012 10 0 GGAEHN NC[C@@H](NC(=O)N[C@@H](c1cc(F)cc(Br)c1)C1CC1)C(F)(F)F ZINC000655924251 566859265 /nfs/dbraw/zinc/85/92/65/566859265.db2.gz IYPYAWKUKZKMKO-VXGBXAGGSA-N 0 3 398.198 3.228 10 0 GGAEHN NC[C@H](NC(=O)NC1(c2ccc(Br)cc2)CCC1)C(F)(F)F ZINC000655912722 566859363 /nfs/dbraw/zinc/85/93/63/566859363.db2.gz BRJDGCIPKSKQBC-NSHDSACASA-N 0 3 380.208 3.017 10 0 GGAEHN NC[C@H](NC(=O)NCC1(c2ccc(Br)cc2)CCC1)C(F)(F)F ZINC000655910834 566859463 /nfs/dbraw/zinc/85/94/63/566859463.db2.gz CTQCLONMNZITQV-LBPRGKRZSA-N 0 3 394.235 3.060 10 0 GGAEHN NC[C@H](NC(=O)N1CCC[C@@H]1c1ccccc1Br)C(F)(F)F ZINC000655921705 566859857 /nfs/dbraw/zinc/85/98/57/566859857.db2.gz PBMFJTRQHCWOEC-NEPJUHHUSA-N 0 3 380.208 3.185 10 0 GGAEHN CC[C@H](Cc1ccccc1Br)N(C)C(=O)N[C@H](CN)C(F)(F)F ZINC000655924611 566860736 /nfs/dbraw/zinc/86/07/36/566860736.db2.gz MUMKVARQBFKARW-DGCLKSJQSA-N 0 3 396.251 3.301 10 0 GGAEHN CN(Cc1cc(Br)ccc1Cl)C(=O)N[C@H](CN)C(F)(F)F ZINC000655927837 566861234 /nfs/dbraw/zinc/86/12/34/566861234.db2.gz JGLHCAGWGORJLY-SNVBAGLBSA-N 0 3 388.615 3.134 10 0 GGAEHN NC[C@@H](NC(=O)N1CCC[C@H]1c1ccc(Br)s1)C(F)(F)F ZINC000655925282 566861287 /nfs/dbraw/zinc/86/12/87/566861287.db2.gz ZPDXCRGPGVIJKT-IONNQARKSA-N 0 3 386.237 3.247 10 0 GGAEHN NC[C@H](NC(=O)N1CCC(c2cccc(Br)c2)CC1)C(F)(F)F ZINC000655925902 566861591 /nfs/dbraw/zinc/86/15/91/566861591.db2.gz ACZVQEARXMYUSN-ZDUSSCGKSA-N 0 3 394.235 3.228 10 0 GGAEHN C[C@H](CN(C)C(=O)N[C@H](CN)C(F)(F)F)Oc1ccc(Cl)c(Cl)c1 ZINC000655927955 566861681 /nfs/dbraw/zinc/86/16/81/566861681.db2.gz JVWFXHNITTWUTE-PRHODGIISA-N 0 3 388.217 3.292 10 0 GGAEHN CC[C@@H]1Cc2c(Br)cccc2CN1C(=O)N[C@@H](CN)C(F)(F)F ZINC000655926015 566861731 /nfs/dbraw/zinc/86/17/31/566861731.db2.gz CGXQZJGWAPQGCM-MFKMUULPSA-N 0 3 394.235 3.185 10 0 GGAEHN NC[C@@H](NC(=O)N1CCC[C@@H]1c1ccc(Br)s1)C(F)(F)F ZINC000655925283 566861945 /nfs/dbraw/zinc/86/19/45/566861945.db2.gz ZPDXCRGPGVIJKT-VXNVDRBHSA-N 0 3 386.237 3.247 10 0 GGAEHN CCN(CC)CCN(C(=O)CSC1CC1)c1ccc(Br)cn1 ZINC000563217926 566864484 /nfs/dbraw/zinc/86/44/84/566864484.db2.gz OTPYCOYUOZNBJH-UHFFFAOYSA-N 0 3 386.359 3.415 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)c1ccc(I)cc1 ZINC000518085037 566864873 /nfs/dbraw/zinc/86/48/73/566864873.db2.gz JTETVWRLLQKJQH-BETUJISGSA-N 0 3 386.277 3.284 10 0 GGAEHN O=C(CCN1CCC[C@@H](OC(F)F)C1)Nc1ccccc1Br ZINC000679677515 566866469 /nfs/dbraw/zinc/86/64/69/566866469.db2.gz AZRULIKSSWIZEI-LLVKDONJSA-N 0 3 377.229 3.481 10 0 GGAEHN C[C@H]1CN(CCOc2c(Cl)cccc2Cl)CC[C@H]1N1CCN(C)CC1 ZINC000490652074 566873723 /nfs/dbraw/zinc/87/37/23/566873723.db2.gz QICQTFNTNUJCPO-MAUKXSAKSA-N 0 3 386.367 3.330 10 0 GGAEHN CCCN1CCC[C@H]1C(=O)N[C@H]1CCN(c2cccc(Br)c2)C1 ZINC000470443523 566874288 /nfs/dbraw/zinc/87/42/88/566874288.db2.gz IHPAYFHLVVYOEQ-RDJZCZTQSA-N 0 3 380.330 3.018 10 0 GGAEHN C[C@@H]1CN(CCOc2c(Cl)cccc2Cl)CC[C@@H]1N1CCN(C)CC1 ZINC000490652075 566874417 /nfs/dbraw/zinc/87/44/17/566874417.db2.gz QICQTFNTNUJCPO-QAPCUYQASA-N 0 3 386.367 3.330 10 0 GGAEHN CCCCN(CCCC(=O)Nc1c(C)cc(Br)cc1C)CC(N)=O ZINC000679817309 566875093 /nfs/dbraw/zinc/87/50/93/566875093.db2.gz OESCEVYPMLEGKI-UHFFFAOYSA-N 0 3 398.345 3.372 10 0 GGAEHN COc1ccc([C@@H](CN(C)C)NC(=O)Cc2sccc2Br)cc1 ZINC000451767347 566877111 /nfs/dbraw/zinc/87/71/11/566877111.db2.gz DOECUNMQCCNHKI-OAHLLOKOSA-N 0 3 397.338 3.481 10 0 GGAEHN CC[C@@H]1CCC[C@H](CNCc2ccc(S(=O)(=O)N3CCOCC3)s2)C1 ZINC000543413259 566879041 /nfs/dbraw/zinc/87/90/41/566879041.db2.gz CHSIILDNWQSQSP-CVEARBPZSA-N 0 3 386.583 3.075 10 0 GGAEHN Cc1ccnc([C@@H]2CCN(C[C@@H](O)COc3ccc(Br)cc3)C2)c1 ZINC000563365919 566879197 /nfs/dbraw/zinc/87/91/97/566879197.db2.gz FMPFARQUZHDUPX-NVXWUHKLSA-N 0 3 391.309 3.382 10 0 GGAEHN O=C(NCCN1CCc2ccccc2C1)c1n[nH]c2ccc(Br)cc21 ZINC000518389596 566881019 /nfs/dbraw/zinc/88/10/19/566881019.db2.gz WLMRIIBMJHYWNC-UHFFFAOYSA-N 0 3 399.292 3.114 10 0 GGAEHN Cc1c(Br)cccc1CS(=O)(=O)Nc1ccnc(N(C)C)c1 ZINC000656182497 566881502 /nfs/dbraw/zinc/88/15/02/566881502.db2.gz NYXQXPVWQZBGFN-UHFFFAOYSA-N 0 3 384.299 3.160 10 0 GGAEHN Cc1c(Br)cccc1CS(=O)(=O)[N-]c1cc[nH+]c(N(C)C)c1 ZINC000656182497 566881505 /nfs/dbraw/zinc/88/15/05/566881505.db2.gz NYXQXPVWQZBGFN-UHFFFAOYSA-N 0 3 384.299 3.160 10 0 GGAEHN CS(=O)(=O)N[C@@H]1CCCC[C@H]1CNCc1ncc(-c2ccccc2)s1 ZINC000518411704 566882015 /nfs/dbraw/zinc/88/20/15/566882015.db2.gz WGKVBUHYNALRIZ-JKSUJKDBSA-N 0 3 379.551 3.008 10 0 GGAEHN Cc1ccc(OCCC(=O)N(C)[C@H]2CN3CCC2CC3)c(Br)c1 ZINC000518432641 566882775 /nfs/dbraw/zinc/88/27/75/566882775.db2.gz WZGKKBHERRGTFN-INIZCTEOSA-N 0 3 381.314 3.079 10 0 GGAEHN O=C1[C@H](N[C@H]2CCCc3c(Br)cccc32)CCN1C1CCOCC1 ZINC000679991597 566885083 /nfs/dbraw/zinc/88/50/83/566885083.db2.gz AXSKJUUZMGPNAE-ZWKOTPCHSA-N 0 3 393.325 3.196 10 0 GGAEHN N[C@@H]1CN(S(=O)(=O)c2cc(F)ccc2Cl)CC[C@H]1c1ccc(F)cc1 ZINC000563446620 566885374 /nfs/dbraw/zinc/88/53/74/566885374.db2.gz VKBKDTVYFDZPST-GOEBONIOSA-N 0 3 386.851 3.124 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)NCc1ccc(Br)cc1 ZINC000518520062 566888030 /nfs/dbraw/zinc/88/80/30/566888030.db2.gz RWKFEEZOMYCIHH-GOSISDBHSA-N 0 3 390.325 3.421 10 0 GGAEHN CCN1CCN(CCCOc2cccc(I)c2)C[C@@H]1C ZINC000611092027 566888180 /nfs/dbraw/zinc/88/81/80/566888180.db2.gz GZGBVUZWQYIQCN-AWEZNQCLSA-N 0 3 388.293 3.086 10 0 GGAEHN C[C@H](NCC(=O)Nc1ccc(Br)cn1)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000543547497 566888868 /nfs/dbraw/zinc/88/88/68/566888868.db2.gz QJKSMBRZWDFPMG-OAVHHTNSSA-N 0 3 390.281 3.325 10 0 GGAEHN CCN1CCN(CCCOc2cccc(I)c2)C[C@H]1C ZINC000611092028 566889061 /nfs/dbraw/zinc/88/90/61/566889061.db2.gz GZGBVUZWQYIQCN-CQSZACIVSA-N 0 3 388.293 3.086 10 0 GGAEHN C[C@H](NCC(=O)Nc1ccc(Br)cn1)[C@@H]1Oc2ccccc2[C@H]1C ZINC000543547495 566889315 /nfs/dbraw/zinc/88/93/15/566889315.db2.gz QJKSMBRZWDFPMG-FTLABTOESA-N 0 3 390.281 3.325 10 0 GGAEHN Cc1ccc(Cl)c(S(=O)(=O)N2CC[C@H](c3ccc(F)cc3)[C@@H](N)C2)c1 ZINC000582736659 566889683 /nfs/dbraw/zinc/88/96/83/566889683.db2.gz DQAXJWVGZRJFOG-WBVHZDCISA-N 0 3 382.888 3.293 10 0 GGAEHN CCn1nc2c(cc1=O)CN(CCCc1ccccc1Br)CC2 ZINC000680057328 566890279 /nfs/dbraw/zinc/89/02/79/566890279.db2.gz JGZVDRUFUFCWRI-UHFFFAOYSA-N 0 3 376.298 3.017 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1CCCC[C@@H]1CC(N)=O ZINC000656251077 566890664 /nfs/dbraw/zinc/89/06/64/566890664.db2.gz GEGQRSDBNYSQHF-MRXNPFEDSA-N 0 3 391.313 3.173 10 0 GGAEHN C[C@H](NCc1cc(Cl)cc(S(N)(=O)=O)c1)[C@H]1Oc2ccccc2[C@@H]1C ZINC000563539781 566892363 /nfs/dbraw/zinc/89/23/63/566892363.db2.gz WSUPNFREJCPKMW-PZROIBLQSA-N 0 3 380.897 3.030 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1CC[C@H]2CN(C)C[C@@H]21 ZINC000656259811 566892774 /nfs/dbraw/zinc/89/27/74/566892774.db2.gz CSJIKCJTNXRLMD-KSSFIOAISA-N 0 3 375.314 3.079 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1CC[C@@H]2CN(C)C[C@H]21 ZINC000656259813 566893297 /nfs/dbraw/zinc/89/32/97/566893297.db2.gz CSJIKCJTNXRLMD-RDTXWAMCSA-N 0 3 375.314 3.079 10 0 GGAEHN COc1cc(S(=O)(=O)N[C@@H](C)[C@@H]2CCCN(C3CCC3)C2)ccc1Cl ZINC000563539931 566893670 /nfs/dbraw/zinc/89/36/70/566893670.db2.gz DWNLYWMQUKIKBI-UONOGXRCSA-N 0 3 386.945 3.280 10 0 GGAEHN Cc1cc(Br)cc(C)c1CNC(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000428969417 566893873 /nfs/dbraw/zinc/89/38/73/566893873.db2.gz RKJHAOCOOWXASG-HIFRSBDPSA-N 0 3 380.330 3.490 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)c1ccccc1I ZINC000518597501 566894008 /nfs/dbraw/zinc/89/40/08/566894008.db2.gz HKHLAURBGFZWFQ-STQMWFEESA-N 0 3 386.277 3.284 10 0 GGAEHN CCN1CC[C@H]2OCCN(Cc3oc4ccccc4c3Br)[C@H]2C1 ZINC000656260608 566894260 /nfs/dbraw/zinc/89/42/60/566894260.db2.gz SVDHSAGECBIBBW-GOEBONIOSA-N 0 3 379.298 3.490 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CNCC[C@@H](O)C(F)(F)F ZINC000656262171 566894704 /nfs/dbraw/zinc/89/47/04/566894704.db2.gz PMJKBFPFNWOALI-CQSZACIVSA-N 0 3 392.219 3.346 10 0 GGAEHN O[C@@H]1C[C@H]2CN(Cc3ccc(-c4ccccc4Br)cc3)CCN2C1 ZINC000656273726 566897474 /nfs/dbraw/zinc/89/74/74/566897474.db2.gz PEMFHIUTXUPKFX-ZWKOTPCHSA-N 0 3 387.321 3.367 10 0 GGAEHN C[C@@H]1CN(CCC(=O)Nc2ccc(Cl)cc2)CCN(CC(F)(F)F)C1 ZINC000451877363 566899257 /nfs/dbraw/zinc/89/92/57/566899257.db2.gz CPGOSIWUQXTJBI-CYBMUJFWSA-N 0 3 377.838 3.485 10 0 GGAEHN Cc1c2cc(Br)cc(C)c2oc1C(=O)NCCNc1ccncc1 ZINC000429021171 566900155 /nfs/dbraw/zinc/90/01/55/566900155.db2.gz NZDSRHGRGGEDOC-UHFFFAOYSA-N 0 3 388.265 3.471 10 0 GGAEHN CS[C@H]1CN(C(=O)CCc2ccc(Br)cc2)C[C@H]1N1CCCC1 ZINC000543700309 566903191 /nfs/dbraw/zinc/90/31/91/566903191.db2.gz APALASPXKYORIP-SJORKVTESA-N 0 3 397.382 3.420 10 0 GGAEHN CCOC(=O)C[C@H](O)CN1CCC(COc2cc(Cl)cc(Cl)c2)CC1 ZINC000611237991 566903605 /nfs/dbraw/zinc/90/36/05/566903605.db2.gz WHVHKZLURVXQHN-INIZCTEOSA-N 0 3 390.307 3.398 10 0 GGAEHN CN1CCC(CC(=O)Nc2cnn(-c3ccccc3Br)c2)CC1 ZINC000680360030 566903579 /nfs/dbraw/zinc/90/35/79/566903579.db2.gz CPYRUWQARYNYRN-UHFFFAOYSA-N 0 3 377.286 3.305 10 0 GGAEHN CCN(CCOc1ccc(Br)cc1)C(=O)CC1CCN(C)CC1 ZINC000680371053 566906298 /nfs/dbraw/zinc/90/62/98/566906298.db2.gz SGEVXLUHIVZWSL-UHFFFAOYSA-N 0 3 383.330 3.408 10 0 GGAEHN C[C@H](OC[C@H](O)CN1CC[C@H]([C@@H](O)C(F)(F)F)C1)c1ccc(Cl)cc1 ZINC000451911332 566906803 /nfs/dbraw/zinc/90/68/03/566906803.db2.gz POTRBKCFPOBCKO-DDUYRFODSA-N 0 3 381.822 3.024 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1[nH]nc(-c2ccccc2)c1Br ZINC000518894810 566907419 /nfs/dbraw/zinc/90/74/19/566907419.db2.gz DFYRBFJOZJMNSH-CYBMUJFWSA-N 0 3 391.313 3.443 10 0 GGAEHN O[C@H]([C@H]1CCN(CCc2nc(-c3ccc(Cl)cc3)no2)C1)C(F)(F)F ZINC000451919240 566907638 /nfs/dbraw/zinc/90/76/38/566907638.db2.gz ZGDVSCQGFSINIC-SMDDNHRTSA-N 0 3 375.778 3.178 10 0 GGAEHN O[C@@H]([C@H]1CCN(CCc2nc(-c3ccc(Cl)cc3)no2)C1)C(F)(F)F ZINC000451919238 566907978 /nfs/dbraw/zinc/90/79/78/566907978.db2.gz ZGDVSCQGFSINIC-FZMZJTMJSA-N 0 3 375.778 3.178 10 0 GGAEHN CC(C(=O)N[C@@H]1CCOc2ccccc21)S(=O)(=O)Cc1ccsc1Cl ZINC000656533160 566912110 /nfs/dbraw/zinc/91/21/10/566912110.db2.gz PLWITMQZDBUPSU-BXUZGUMPSA-N 0 3 399.921 3.345 10 0 GGAEHN Cc1ccccc1CCNC(=O)C(C)S(=O)(=O)Cc1ccsc1Cl ZINC000656533183 566912218 /nfs/dbraw/zinc/91/22/18/566912218.db2.gz QDNKEEZWFCYJND-ZDUSSCGKSA-N 0 3 385.938 3.372 10 0 GGAEHN CC(C(=O)N[C@@H]1CCOc2ccccc21)S(=O)(=O)Cc1ccsc1Cl ZINC000656533163 566912259 /nfs/dbraw/zinc/91/22/59/566912259.db2.gz PLWITMQZDBUPSU-SMDDNHRTSA-N 0 3 399.921 3.345 10 0 GGAEHN O=C(Cc1csc(CCC(F)(F)F)n1)NC[C@@H]1CCCCN1C1CC1 ZINC000632767146 566912508 /nfs/dbraw/zinc/91/25/08/566912508.db2.gz KMEZXTWCJLXYOO-AWEZNQCLSA-N 0 3 375.460 3.314 10 0 GGAEHN CN1CCCC(C)(C)[C@H]1CNC(=O)Cc1csc(CCC(F)(F)F)n1 ZINC000632797904 566913816 /nfs/dbraw/zinc/91/38/16/566913816.db2.gz OXPPBAXZLLLRSC-CYBMUJFWSA-N 0 3 377.476 3.417 10 0 GGAEHN CC(C(=O)N1CCc2ccccc2C1)S(=O)(=O)Cc1ccsc1Cl ZINC000656534404 566914146 /nfs/dbraw/zinc/91/41/46/566914146.db2.gz PKODQMSMJGBRPO-GFCCVEGCSA-N 0 3 383.922 3.290 10 0 GGAEHN Cc1ccsc1[C@H](CO)NC[C@@H](O)COc1cc(Cl)ccc1Cl ZINC000563764808 566914366 /nfs/dbraw/zinc/91/43/66/566914366.db2.gz MTNSITMUWXCMKU-OCCSQVGLSA-N 0 3 376.305 3.426 10 0 GGAEHN CC[C@H](CN1CCCC1)NC(=O)Nc1ccc(Br)c(C(=O)OC)c1 ZINC000611391356 566915131 /nfs/dbraw/zinc/91/51/31/566915131.db2.gz HCZPACNDZBPEAB-GFCCVEGCSA-N 0 3 398.301 3.232 10 0 GGAEHN Cc1ccc(OC[C@@H](O)CN[C@@H](CO)c2cccc(Br)c2)c(C)c1 ZINC000543835955 566915302 /nfs/dbraw/zinc/91/53/02/566915302.db2.gz DGVJCSQXUFIQCS-ROUUACIJSA-N 0 3 394.309 3.129 10 0 GGAEHN COc1cc(Br)ccc1CCC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000543858690 566917738 /nfs/dbraw/zinc/91/77/38/566917738.db2.gz ROMPBGVMNSRVJZ-BBRMVZONSA-N 0 3 383.330 3.331 10 0 GGAEHN O=S(=O)(CCN[C@H]1C[C@H]1c1ccccc1)c1cccc(Br)c1 ZINC000583061467 566917818 /nfs/dbraw/zinc/91/78/18/566917818.db2.gz KNBJBLHIJCEYKS-IRXDYDNUSA-N 0 3 380.307 3.369 10 0 GGAEHN O=S(=O)(CCN[C@H]1C[C@@H]1c1ccccc1)c1cccc(Br)c1 ZINC000583061468 566918040 /nfs/dbraw/zinc/91/80/40/566918040.db2.gz KNBJBLHIJCEYKS-SJORKVTESA-N 0 3 380.307 3.369 10 0 GGAEHN C[C@@H](N[C@@H]1Cc2cccc(O)c2C1)C(=O)Nc1ccccc1Br ZINC000429304561 566921630 /nfs/dbraw/zinc/92/16/30/566921630.db2.gz GZMXPEIVILTWRA-DGCLKSJQSA-N 0 3 375.266 3.239 10 0 GGAEHN CC[C@@H](Cc1ccccc1Br)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000471077428 566925742 /nfs/dbraw/zinc/92/57/42/566925742.db2.gz DRJZGVDQSSJFKX-IRXDYDNUSA-N 0 3 392.341 3.426 10 0 GGAEHN CC[C@H](Cc1ccccc1Br)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000471077427 566925996 /nfs/dbraw/zinc/92/59/96/566925996.db2.gz DRJZGVDQSSJFKX-IAGOWNOFSA-N 0 3 392.341 3.426 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NCc1cn2ccc(Br)cc2n1 ZINC000519235835 566927058 /nfs/dbraw/zinc/92/70/58/566927058.db2.gz DSFIUDQNZGKCFN-QGZVFWFLSA-N 0 3 387.325 3.359 10 0 GGAEHN CC(C)(CN1CCCC1)NCC(=O)Nc1ccc(OC(F)F)c(Cl)c1 ZINC000452079675 566931968 /nfs/dbraw/zinc/93/19/68/566931968.db2.gz AQTXZPFKHNWNMN-UHFFFAOYSA-N 0 3 375.847 3.344 10 0 GGAEHN CC1(C)CCCN[C@H]1C(=O)NC[C@H]1CCN(c2ccc(Br)cc2)C1 ZINC000563959243 566932000 /nfs/dbraw/zinc/93/20/00/566932000.db2.gz FCEWUKQSUCKSMR-PBHICJAKSA-N 0 3 394.357 3.170 10 0 GGAEHN COC[C@@H](N[C@H](C)C(=O)Nc1cc(Cl)ccc1Cl)C1CCOCC1 ZINC000656679442 566932115 /nfs/dbraw/zinc/93/21/15/566932115.db2.gz IKYKVHAJPBSYFV-BDJLRTHQSA-N 0 3 375.296 3.352 10 0 GGAEHN COC[C@@H](N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)C1CCOCC1 ZINC000656680034 566933262 /nfs/dbraw/zinc/93/32/62/566933262.db2.gz SZVNKAJLUOIHSZ-IAGOWNOFSA-N 0 3 387.307 3.130 10 0 GGAEHN COC[C@H](N[C@@H](C)C(=O)Nc1ccc(Cl)cc1Cl)C1CCOCC1 ZINC000656680904 566933669 /nfs/dbraw/zinc/93/36/69/566933669.db2.gz XEKMGUXXIDXLJE-ZBEGNZNMSA-N 0 3 375.296 3.352 10 0 GGAEHN NC(=O)[C@@H](Cc1ccccc1)NCC1(Cc2ccc(Br)cc2)CC1 ZINC000656684146 566934223 /nfs/dbraw/zinc/93/42/23/566934223.db2.gz BBQQPUYVAQRLRX-GOSISDBHSA-N 0 3 387.321 3.458 10 0 GGAEHN COC[C@@H](N[C@H](C)C(=O)Nc1ccc(Cl)c(Cl)c1)C1CCOCC1 ZINC000656679846 566934485 /nfs/dbraw/zinc/93/44/85/566934485.db2.gz RMKDZSVRQMHPIO-BDJLRTHQSA-N 0 3 375.296 3.352 10 0 GGAEHN COC[C@H](N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)C1CCOCC1 ZINC000656680038 566934493 /nfs/dbraw/zinc/93/44/93/566934493.db2.gz SZVNKAJLUOIHSZ-SJORKVTESA-N 0 3 387.307 3.130 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)NCCNc1ncc(Cl)cc1Cl ZINC000519372840 566935435 /nfs/dbraw/zinc/93/54/35/566935435.db2.gz HIQQLNSXWMLRPT-STQMWFEESA-N 0 3 388.343 3.362 10 0 GGAEHN O=S(=O)(c1ccc(C(F)(F)F)cc1)N1CCCC[C@H](N2CCCC2)C1 ZINC000519376350 566935486 /nfs/dbraw/zinc/93/54/86/566935486.db2.gz MNDPKKVMFQDZBO-HNNXBMFYSA-N 0 3 376.444 3.344 10 0 GGAEHN O=S(=O)([N-]CC[NH2+][C@@H]1CC[C@H]1C1CCC1)c1cccc(Cl)c1Cl ZINC000583278765 566935992 /nfs/dbraw/zinc/93/59/92/566935992.db2.gz BXDVXTOJMSMJKD-GXTWGEPZSA-N 0 3 377.337 3.440 10 0 GGAEHN O=S(=O)([N-]CC[NH2+][C@@H]1CC[C@@H]1C1CCC1)c1cccc(Cl)c1Cl ZINC000583278768 566936068 /nfs/dbraw/zinc/93/60/68/566936068.db2.gz BXDVXTOJMSMJKD-TZMCWYRMSA-N 0 3 377.337 3.440 10 0 GGAEHN COCCCN(C(=O)c1scc(Br)c1C)C1CCN(C)CC1 ZINC000633142517 566936551 /nfs/dbraw/zinc/93/65/51/566936551.db2.gz DQEFXMLFDZNGKE-UHFFFAOYSA-N 0 3 389.359 3.392 10 0 GGAEHN COC[C@@H]1CCCN([C@@H]2CCN(c3cccc(Br)c3)C2=O)CC1 ZINC000452103091 566936685 /nfs/dbraw/zinc/93/66/85/566936685.db2.gz LROWTHWCZAGFQM-RHSMWYFYSA-N 0 3 381.314 3.303 10 0 GGAEHN NC[C@H](C(=O)N1CCc2cc(Br)ccc2C1)c1ccc(F)cc1 ZINC000519396984 566937229 /nfs/dbraw/zinc/93/72/29/566937229.db2.gz KWHBMLDHWWUGMS-KRWDZBQOSA-N 0 3 377.257 3.215 10 0 GGAEHN N[C@H]1CCCc2cn(CCCOc3cccc(I)c3)nc21 ZINC000519385148 566937411 /nfs/dbraw/zinc/93/74/11/566937411.db2.gz WSPNMULKKKEYJY-HNNXBMFYSA-N 0 3 397.260 3.293 10 0 GGAEHN COC[C@H]1CCCN([C@@H]2CCN(c3cccc(Br)c3)C2=O)CC1 ZINC000452103093 566937718 /nfs/dbraw/zinc/93/77/18/566937718.db2.gz LROWTHWCZAGFQM-WMLDXEAASA-N 0 3 381.314 3.303 10 0 GGAEHN Cc1cc(Br)cc(C)c1CN[C@@H](Cc1ccc(F)cc1)C(N)=O ZINC000544093975 566938210 /nfs/dbraw/zinc/93/82/10/566938210.db2.gz POXAUYUBMRBSCM-KRWDZBQOSA-N 0 3 379.273 3.391 10 0 GGAEHN CO[C@@H]1CCC[C@@H](N[C@H]2CCN(c3ccc(Br)c(C)c3)C2=O)C1 ZINC000680882087 566938391 /nfs/dbraw/zinc/93/83/91/566938391.db2.gz MYWJIEXZRFFWOE-UNEWFSDZSA-N 0 3 381.314 3.410 10 0 GGAEHN CO[C@@H]1CCC[C@H](N[C@H]2CCN(c3ccc(Br)c(C)c3)C2=O)C1 ZINC000680882085 566938396 /nfs/dbraw/zinc/93/83/96/566938396.db2.gz MYWJIEXZRFFWOE-LXZKKBNFSA-N 0 3 381.314 3.410 10 0 GGAEHN C[C@H](NC(=O)N[C@@H]1[C@H]2Cc3c(cccc3Br)[C@@H]12)C1=CCN(C)CC1 ZINC000633158796 566938788 /nfs/dbraw/zinc/93/87/88/566938788.db2.gz YJRZVTBZMSIOHR-DRCJMICCSA-N 0 3 390.325 3.037 10 0 GGAEHN CN1CC[C@]2(CCN(C(=O)[C@H]3C[C@@]3(C)c3cccc(Br)c3)C2)C1 ZINC000633186433 566940044 /nfs/dbraw/zinc/94/00/44/566940044.db2.gz SGWULSCKJREXDH-NEWSRXKRSA-N 0 3 377.326 3.281 10 0 GGAEHN CC[C@@H](C)N[C@H](CNC(=O)c1cc[nH]c(=O)c1Br)c1ccco1 ZINC000519458902 566940708 /nfs/dbraw/zinc/94/07/08/566940708.db2.gz XTQOZXUWNAYOIF-ZYHUDNBSSA-N 0 3 382.258 3.002 10 0 GGAEHN Cc1cc(N2CCC[C@H](N[C@@H](C)c3ccc(Br)cn3)C2)n(C)n1 ZINC000519505868 566942559 /nfs/dbraw/zinc/94/25/59/566942559.db2.gz SGOPLOMZEUOGSZ-ZFWWWQNUSA-N 0 3 378.318 3.206 10 0 GGAEHN CN(CCNS(=O)(=O)c1ccc(OC(F)F)c(Cl)c1)C1CCCCC1 ZINC000519483367 566943272 /nfs/dbraw/zinc/94/32/72/566943272.db2.gz CKOJRNZJCYBLPB-UHFFFAOYSA-N 0 3 396.887 3.484 10 0 GGAEHN C[C@@H]1CN(C(=O)c2c[nH]c3cccc(Br)c23)CCN(C2CC2)C1 ZINC000452167647 566946991 /nfs/dbraw/zinc/94/69/91/566946991.db2.gz BVDLHPIEUJYFHK-LBPRGKRZSA-N 0 3 376.298 3.487 10 0 GGAEHN C[C@@H]1CN(C(=O)C2(c3ccccc3Br)CC2)CCN(C2CC2)C1 ZINC000452171041 566947161 /nfs/dbraw/zinc/94/71/61/566947161.db2.gz JRNBPWDCGCPPOM-AWEZNQCLSA-N 0 3 377.326 3.423 10 0 GGAEHN C[C@@H]1CN(C(=O)[C@H]2[C@@H]3c4ccc(Br)cc4C[C@H]23)CCN(C2CC2)C1 ZINC000633254561 566947339 /nfs/dbraw/zinc/94/73/39/566947339.db2.gz BWRQNFBVAZLIEG-MDVLYUJXSA-N 0 3 389.337 3.278 10 0 GGAEHN CN(C)c1cc(NCc2c(C(F)(F)F)cnn2C)ncc1Br ZINC000656776375 566948810 /nfs/dbraw/zinc/94/88/10/566948810.db2.gz JHVQCHVVPGLYRW-UHFFFAOYSA-N 0 3 378.196 3.275 10 0 GGAEHN CN(CCCc1nc(-c2cccs2)no1)CCn1cc(Br)cn1 ZINC000564158093 566952173 /nfs/dbraw/zinc/95/21/73/566952173.db2.gz YTDXYZREACCPCU-UHFFFAOYSA-N 0 3 396.314 3.322 10 0 GGAEHN COc1ccc(CCC(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)c(Br)c1 ZINC000612102608 566952484 /nfs/dbraw/zinc/95/24/84/566952484.db2.gz CCZLKBQEGHRNIR-TZMCWYRMSA-N 0 3 381.314 3.132 10 0 GGAEHN CN1C(=O)N(C[C@@H]2CCN2C(C)(C)C)C(=O)[C@H]1c1cccc(Br)c1 ZINC000656821437 566954068 /nfs/dbraw/zinc/95/40/68/566954068.db2.gz IOUNYTMJWBLYIA-LSDHHAIUSA-N 0 3 394.313 3.257 10 0 GGAEHN Cn1nc2c(c1CNC[C@H](O)COc1c(Cl)cccc1Cl)CCCC2 ZINC000519636269 566955351 /nfs/dbraw/zinc/95/53/51/566955351.db2.gz HLSWFPKRXFOPGF-LBPRGKRZSA-N 0 3 384.307 3.135 10 0 GGAEHN O=S(=O)(c1cscn1)N(CCCN1CCCC1)c1ccc(Cl)cc1 ZINC000583499789 566955879 /nfs/dbraw/zinc/95/58/79/566955879.db2.gz ABMLJZOTFFRPCX-UHFFFAOYSA-N 0 3 385.942 3.478 10 0 GGAEHN NC(=O)c1ncc(Br)cc1NC1CCN(Cc2ccccc2)CC1 ZINC000544353993 566955881 /nfs/dbraw/zinc/95/58/81/566955881.db2.gz RMUCMOJZOGWBDX-UHFFFAOYSA-N 0 3 389.297 3.020 10 0 GGAEHN Cc1cc(Br)c(F)cc1NC(=O)Nc1cnn(CCN(C)C)c1 ZINC000681181511 566958790 /nfs/dbraw/zinc/95/87/90/566958790.db2.gz SPHXRCHGVUTDBV-UHFFFAOYSA-N 0 3 384.253 3.299 10 0 GGAEHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000612305595 566962925 /nfs/dbraw/zinc/96/29/25/566962925.db2.gz ZQAFFNZHVKMULQ-SCLBCKFNSA-N 0 3 392.341 3.262 10 0 GGAEHN Cc1ccccc1C[C@H](CO)NC[C@@H](O)COc1c(Cl)cccc1Cl ZINC000583565093 566963414 /nfs/dbraw/zinc/96/34/14/566963414.db2.gz QBXRXOAYKBLULV-HZPDHXFCSA-N 0 3 384.303 3.235 10 0 GGAEHN Cc1nc(CS(=O)(=O)NCc2ccccc2CN2CCCCC2)cs1 ZINC000681311531 566967021 /nfs/dbraw/zinc/96/70/21/566967021.db2.gz ULKMVMCAJYCLDP-UHFFFAOYSA-N 0 3 379.551 3.057 10 0 GGAEHN CN1CCC[C@H](NC(=O)N[C@H](c2cc(F)cc(Br)c2)C2CC2)C1 ZINC000681317124 566968367 /nfs/dbraw/zinc/96/83/67/566968367.db2.gz JGSPMVQTLDNERN-HOTGVXAUSA-N 0 3 384.293 3.433 10 0 GGAEHN CCN(Cc1ccc(CN(C)C)cc1)S(=O)(=O)C[C@@H](C)CC(F)(F)F ZINC000656894523 566969450 /nfs/dbraw/zinc/96/94/50/566969450.db2.gz UXJADOGWADBJHX-AWEZNQCLSA-N 0 3 380.476 3.488 10 0 GGAEHN COc1ccc(CNC[C@@H](O)COc2ccc(C)cc2)cc1Br ZINC000583626469 566969650 /nfs/dbraw/zinc/96/96/50/566969650.db2.gz SWXSHJLAEHDMLK-OAHLLOKOSA-N 0 3 380.282 3.296 10 0 GGAEHN O=C(CCCOc1cccc(Cl)c1Cl)NC[C@H]1CCCCN1CCO ZINC000452387950 566973233 /nfs/dbraw/zinc/97/32/33/566973233.db2.gz INHLNTWFWJBGFL-CQSZACIVSA-N 0 3 389.323 3.115 10 0 GGAEHN Brc1ccc2[nH]c(CN3CCCN(C[C@H]4CCCO4)CC3)nc2c1 ZINC000681398467 566973466 /nfs/dbraw/zinc/97/34/66/566973466.db2.gz FWZKADJOFDTRTO-OAHLLOKOSA-N 0 3 393.329 3.012 10 0 GGAEHN OCC[C@]1(CNCc2cc(C(F)(F)F)ccc2Br)CCOC1 ZINC000564411216 566974076 /nfs/dbraw/zinc/97/40/76/566974076.db2.gz MQXDQFWUENVDBA-CQSZACIVSA-N 0 3 382.220 3.347 10 0 GGAEHN C[C@@H](CN1CCC(C)CC1)NC(=O)Cc1csc(CCC(F)(F)F)n1 ZINC000633635118 566975559 /nfs/dbraw/zinc/97/55/59/566975559.db2.gz FJHTWLZBZPGLHO-ZDUSSCGKSA-N 0 3 377.476 3.417 10 0 GGAEHN OCCN(CCCOCC(F)(F)F)Cc1cc(Br)cs1 ZINC000494254845 566978271 /nfs/dbraw/zinc/97/82/71/566978271.db2.gz VSGSWSCNJNLFIF-UHFFFAOYSA-N 0 3 376.238 3.274 10 0 GGAEHN COc1cc(Cl)c(Br)cc1C(=O)N1CCC[C@H]1CN(C)C ZINC000430042679 566978261 /nfs/dbraw/zinc/97/82/61/566978261.db2.gz BWWIHWBPPNPDRK-JTQLQIEISA-N 0 3 375.694 3.277 10 0 GGAEHN CN1C(=O)C[C@H](NCC[S@@](=O)c2ccccc2)[C@@H]1c1ccc(Cl)cc1 ZINC000494271616 566981307 /nfs/dbraw/zinc/98/13/07/566981307.db2.gz RODVAFVKYJFDCO-FXJWSJNKSA-N 0 3 376.909 3.009 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1cc(Br)cc(OC(C)C)c1 ZINC000471858591 566982206 /nfs/dbraw/zinc/98/22/06/566982206.db2.gz HIQCANJEEVJAQQ-INIZCTEOSA-N 0 3 399.329 3.077 10 0 GGAEHN COc1cc(C)nc(CNCCc2cn3cc(Br)cc(C)c3n2)c1 ZINC000544706200 566983031 /nfs/dbraw/zinc/98/30/31/566983031.db2.gz KONSFPVJTQWANV-UHFFFAOYSA-N 0 3 389.297 3.450 10 0 GGAEHN CC(C)[C@](C)(CO)NCc1cc(Br)cc(Br)c1N ZINC000583784652 566983169 /nfs/dbraw/zinc/98/31/69/566983169.db2.gz ONCLXDTYKFQDTF-ZDUSSCGKSA-N 0 3 380.124 3.290 10 0 GGAEHN CNS(=O)(=O)c1ccc([C@H](C)NCc2ccc3nc(C)sc3c2)cc1 ZINC000494368113 566993410 /nfs/dbraw/zinc/99/34/10/566993410.db2.gz LULXMGGKJIORAG-LBPRGKRZSA-N 0 3 375.519 3.364 10 0 GGAEHN O=C(Cn1ccnc1)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1 ZINC000564637701 566994368 /nfs/dbraw/zinc/99/43/68/566994368.db2.gz IHBXQWTUEPSBFH-UHFFFAOYSA-N 0 3 381.307 3.315 10 0 GGAEHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1[nH]nc2ccc(Br)cc21 ZINC000520310039 566994930 /nfs/dbraw/zinc/99/49/30/566994930.db2.gz BGFVWDGPILRULO-HNNXBMFYSA-N 0 3 399.292 3.330 10 0 GGAEHN CN(C(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1)[C@H]1CCN(C2CC2)C1 ZINC000520317809 566998110 /nfs/dbraw/zinc/99/81/10/566998110.db2.gz OOARGJBINPJYNH-AWEZNQCLSA-N 0 3 379.291 3.488 10 0 GGAEHN C[NH+](C)C1CCC([N-]S(=O)(=O)c2cc(Cl)cc(Br)c2)CC1 ZINC000657017202 566999017 /nfs/dbraw/zinc/99/90/17/566999017.db2.gz LTTLNRMRMHSOPF-UHFFFAOYSA-N 0 3 395.750 3.254 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)c1ccc(-n2cc(Br)cn2)cc1 ZINC000520364341 566999336 /nfs/dbraw/zinc/99/93/36/566999336.db2.gz NOPNAGFCDOOAKP-INIZCTEOSA-N 0 3 393.329 3.341 10 0 GGAEHN O=C(CSc1nncs1)N[C@@H]1CCCCCN(Cc2ccccc2)C1 ZINC000633889323 567000619 /nfs/dbraw/zinc/00/06/19/567000619.db2.gz QRVXEMHKRSFETB-MRXNPFEDSA-N 0 3 376.551 3.191 10 0 GGAEHN O=C(CSc1nncs1)N[C@H]1CCCCCN(Cc2ccccc2)C1 ZINC000633889320 567000697 /nfs/dbraw/zinc/00/06/97/567000697.db2.gz QRVXEMHKRSFETB-INIZCTEOSA-N 0 3 376.551 3.191 10 0 GGAEHN C[C@H]1CN(C2CCOCC2)CCN1c1ncnc2ccc(Br)cc21 ZINC000583987555 567001644 /nfs/dbraw/zinc/00/16/44/567001644.db2.gz ZUDWSOXBTLIWLT-ZDUSSCGKSA-N 0 3 391.313 3.082 10 0 GGAEHN Cc1ccsc1[C@H](CO)NC[C@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000681695697 567002091 /nfs/dbraw/zinc/00/20/91/567002091.db2.gz KMKAOUKXIARVGP-NHYWBVRUSA-N 0 3 376.305 3.426 10 0 GGAEHN COc1cc(Br)ccc1CN[C@@H](C)c1cccc(-n2cnnn2)c1 ZINC000681742514 567002668 /nfs/dbraw/zinc/00/26/68/567002668.db2.gz GROAOUXJOGQGBS-LBPRGKRZSA-N 0 3 388.269 3.284 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N(C)[C@H](C)C1CCN(C)CC1 ZINC000430277397 567003750 /nfs/dbraw/zinc/00/37/50/567003750.db2.gz YVLPQXGIQVRFQK-CYBMUJFWSA-N 0 3 398.345 3.329 10 0 GGAEHN CN1CCC[C@H](NC(=O)Nc2ccnn2Cc2c(Cl)cccc2Cl)C1 ZINC000681779922 567005166 /nfs/dbraw/zinc/00/51/66/567005166.db2.gz SKUZRABAHJXHGH-LBPRGKRZSA-N 0 3 382.295 3.454 10 0 GGAEHN CC[C@H](CN1CCCC1)NC(=O)NCc1ccc(Br)cc1OC ZINC000681797596 567006112 /nfs/dbraw/zinc/00/61/12/567006112.db2.gz RXIMLJGJJCNJOP-OAHLLOKOSA-N 0 3 384.318 3.131 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1ccc(I)c(F)c1 ZINC000520513629 567010816 /nfs/dbraw/zinc/01/08/16/567010816.db2.gz JHCDORFESRHGKG-LLVKDONJSA-N 0 3 390.240 3.035 10 0 GGAEHN Cc1cc(Br)cc2c1[C@H](N[C@@H]1CCN(C3CCOCC3)C1=O)CC2 ZINC000494613948 567011446 /nfs/dbraw/zinc/01/14/46/567011446.db2.gz LELCYEFUPJRKRX-IAGOWNOFSA-N 0 3 393.325 3.114 10 0 GGAEHN Cc1cc(Br)cc2c1[C@@H](N[C@H]1CCN(C3CCOCC3)C1=O)CC2 ZINC000494613950 567012043 /nfs/dbraw/zinc/01/20/43/567012043.db2.gz LELCYEFUPJRKRX-IRXDYDNUSA-N 0 3 393.325 3.114 10 0 GGAEHN Cn1cc(Br)c(CNC(=O)c2ccc(CN3CCCCC3)cc2)n1 ZINC000452750418 567012250 /nfs/dbraw/zinc/01/22/50/567012250.db2.gz ADDLVCDJCAUSRD-UHFFFAOYSA-N 0 3 391.313 3.099 10 0 GGAEHN C[C@@](O)(CN[C@@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1)C(F)(F)F ZINC000564850106 567013142 /nfs/dbraw/zinc/01/31/42/567013142.db2.gz QDNJSECIMRXMDR-BXKDBHETSA-N 0 3 391.743 3.235 10 0 GGAEHN CN1CCC(n2cc(NC(=O)Cc3sccc3Br)cn2)CC1 ZINC000634096454 567016363 /nfs/dbraw/zinc/01/63/63/567016363.db2.gz URBRFUZVMZAJAC-UHFFFAOYSA-N 0 3 383.315 3.155 10 0 GGAEHN Cc1ccsc1[C@@H](CO)NC[C@@H](O)COc1c(Cl)cccc1Cl ZINC000494675097 567016733 /nfs/dbraw/zinc/01/67/33/567016733.db2.gz YSQIVOZRPIDNBT-BXUZGUMPSA-N 0 3 376.305 3.426 10 0 GGAEHN Cc1ccsc1[C@H](CO)NC[C@H](O)COc1ccccc1C(F)(F)F ZINC000494672997 567017088 /nfs/dbraw/zinc/01/70/88/567017088.db2.gz OMLSKAASMDKYAG-JSGCOSHPSA-N 0 3 375.412 3.138 10 0 GGAEHN CN1CCC(n2cc(NC(=O)Cc3ccc(Br)c(F)c3)cn2)CC1 ZINC000634093525 567017151 /nfs/dbraw/zinc/01/71/51/567017151.db2.gz OHYNVXBVKXESAW-UHFFFAOYSA-N 0 3 395.276 3.233 10 0 GGAEHN O=C(Nc1cnc2c(Br)cccn12)N1CC[C@H](N2CCCCC2)C1 ZINC000564883413 567017676 /nfs/dbraw/zinc/01/76/76/567017676.db2.gz ZLKWJMHDJRQLDS-ZDUSSCGKSA-N 0 3 392.301 3.189 10 0 GGAEHN CCc1nn(C)c(CC)c1CNC[C@H](O)COc1c(Cl)cccc1Cl ZINC000584167800 567018891 /nfs/dbraw/zinc/01/88/91/567018891.db2.gz HOQGJFGJACZYBH-LBPRGKRZSA-N 0 3 386.323 3.381 10 0 GGAEHN O=C(CCCCOc1ccc(Br)cc1)N[C@@H]1CNCCC1(F)F ZINC000584172059 567019107 /nfs/dbraw/zinc/01/91/07/567019107.db2.gz VMIJLDUDAGKOKI-CQSZACIVSA-N 0 3 391.256 3.112 10 0 GGAEHN C[C@H]1CN(C2CC2)C[C@H]1Nc1ncnc2cccc(I)c21 ZINC000545164834 567024412 /nfs/dbraw/zinc/02/44/12/567024412.db2.gz YSIGKAIFLOHPOP-IINYFYTJSA-N 0 3 394.260 3.129 10 0 GGAEHN COc1ccc(Br)c(CC(=O)NCCN2[C@@H](C)CCC[C@@H]2C)c1 ZINC000494817893 567025685 /nfs/dbraw/zinc/02/56/85/567025685.db2.gz HSGPPGNABHTSHO-KBPBESRZSA-N 0 3 383.330 3.379 10 0 GGAEHN COc1ccc(CN2CCc3ccccc3[C@H]2C[NH3+])c(Br)c1[O-] ZINC000564973857 567025817 /nfs/dbraw/zinc/02/58/17/567025817.db2.gz YTFSAIFUUSKAEQ-OAHLLOKOSA-N 0 3 377.282 3.221 10 0 GGAEHN COc1ccc(Br)c(CC(=O)NCCN2[C@H](C)CCC[C@H]2C)c1 ZINC000494817895 567025747 /nfs/dbraw/zinc/02/57/47/567025747.db2.gz HSGPPGNABHTSHO-ZIAGYGMSSA-N 0 3 383.330 3.379 10 0 GGAEHN CSc1ccccc1C[C@@H](C)NC[C@H]1CS(=O)(=O)c2ccccc2O1 ZINC000564964525 567026327 /nfs/dbraw/zinc/02/63/27/567026327.db2.gz OFTSTVADWPTCJH-ZBFHGGJFSA-N 0 3 377.531 3.164 10 0 GGAEHN Cc1ccc(CCN[C@@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)cc1 ZINC000430711964 567031280 /nfs/dbraw/zinc/03/12/80/567031280.db2.gz GKDWHUOUBSRTCF-ZDUSSCGKSA-N 0 3 397.338 3.298 10 0 GGAEHN C[C@@H]1CN(CCCNC(=O)[C@@H]2CCc3cc(Br)ccc32)CCCO1 ZINC000565022554 567031919 /nfs/dbraw/zinc/03/19/19/567031919.db2.gz GHFRYJIINJEKAE-RDTXWAMCSA-N 0 3 395.341 3.096 10 0 GGAEHN CCN1CC[C@H](NCCn2c(C)csc2=O)[C@H]1c1ccc(Cl)c(F)c1 ZINC000584339039 567034518 /nfs/dbraw/zinc/03/45/18/567034518.db2.gz DLAVBRGNLCEXKZ-DLBZAZTESA-N 0 3 383.920 3.436 10 0 GGAEHN CCNC(=O)c1cc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)c(C)s1 ZINC000634419739 567034875 /nfs/dbraw/zinc/03/48/75/567034875.db2.gz MEMGFHRMMYXWPX-GHMZBOCLSA-N 0 3 378.416 3.492 10 0 GGAEHN CN(Cc1cc(Br)cc(Br)c1N)C1CCOCC1 ZINC000545300774 567036400 /nfs/dbraw/zinc/03/64/00/567036400.db2.gz SEENYMYTUXDLIE-UHFFFAOYSA-N 0 3 378.108 3.405 10 0 GGAEHN CN(CCNS(=O)(=O)c1ccc(F)cc1Br)C1CCCCC1 ZINC000521046987 567037890 /nfs/dbraw/zinc/03/78/90/567037890.db2.gz DIAGMXNDTWHXPG-UHFFFAOYSA-N 0 3 393.322 3.131 10 0 GGAEHN Cc1ccc(CN2CC[C@@H](CN(C)C(=O)c3nc(C)ncc3Cl)C2)s1 ZINC000565091670 567038688 /nfs/dbraw/zinc/03/86/88/567038688.db2.gz BUYJHTMTBHYWDP-AWEZNQCLSA-N 0 3 378.929 3.402 10 0 GGAEHN C[C@H](Oc1ccc(F)cc1Br)C(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000521081971 567040664 /nfs/dbraw/zinc/04/06/64/567040664.db2.gz FTSLAZZPQGIEHS-FZMZJTMJSA-N 0 3 385.277 3.051 10 0 GGAEHN Cc1ccc([O-])c(C[NH2+]CCc2cn3cc(Br)cc(C)c3n2)n1 ZINC000545353080 567041610 /nfs/dbraw/zinc/04/16/10/567041610.db2.gz XHTPLEVGZZJDBI-UHFFFAOYSA-N 0 3 375.270 3.147 10 0 GGAEHN COC(=O)c1cccc(NC(=O)NCCN2CCCC[C@@H]2C)c1Br ZINC000495040298 567042610 /nfs/dbraw/zinc/04/26/10/567042610.db2.gz CJSOZTDEBYXMRA-LBPRGKRZSA-N 0 3 398.301 3.232 10 0 GGAEHN CN(C)CCn1cc(NC(=O)Nc2cc(Br)c(F)cc2F)cn1 ZINC000682421545 567042927 /nfs/dbraw/zinc/04/29/27/567042927.db2.gz AGTZCIRVKWXIKZ-UHFFFAOYSA-N 0 3 388.216 3.129 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000613543281 567044799 /nfs/dbraw/zinc/04/47/99/567044799.db2.gz AUTXFPZYBYURQF-UGSOOPFHSA-N 0 3 388.309 3.403 10 0 GGAEHN O=C1NCCC[C@@H]1CNCc1cnc(-c2ccc(Br)cc2)s1 ZINC000657283736 567045097 /nfs/dbraw/zinc/04/50/97/567045097.db2.gz HRYHZEVAKLESFZ-GFCCVEGCSA-N 0 3 380.311 3.188 10 0 GGAEHN Brc1cccc(N2CC[C@H](CNCc3cc4n(n3)CCC4)C2)c1 ZINC000657328987 567045814 /nfs/dbraw/zinc/04/58/14/567045814.db2.gz GSTOLHHZXQUHIL-CQSZACIVSA-N 0 3 375.314 3.208 10 0 GGAEHN CN1CCN(Cc2cccc(NCc3c(F)cncc3Br)c2)CC1 ZINC000657328272 567046908 /nfs/dbraw/zinc/04/69/08/567046908.db2.gz UXXLREVVFNNBON-UHFFFAOYSA-N 0 3 393.304 3.343 10 0 GGAEHN Brc1ccc(N2CC[C@@H](NCc3ccnn3-c3ccncc3)C2)cc1 ZINC000657351326 567049014 /nfs/dbraw/zinc/04/90/14/567049014.db2.gz CJVCWBOCMJYFOX-MRXNPFEDSA-N 0 3 398.308 3.398 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)[C@@H](N)Cc1ccccc1 ZINC000584524587 567050821 /nfs/dbraw/zinc/05/08/21/567050821.db2.gz RQBAEWDMXZBVPO-WBMJQRKESA-N 0 3 377.282 3.205 10 0 GGAEHN Cc1c(Br)cncc1CNCCCN1C(=O)COc2ccccc21 ZINC000657379586 567052633 /nfs/dbraw/zinc/05/26/33/567052633.db2.gz APVBFMVPPYJPJI-UHFFFAOYSA-N 0 3 390.281 3.058 10 0 GGAEHN C[C@](O)(C[C@H](O)CNCc1cc(Br)ccc1OC(F)F)C1CC1 ZINC000634703065 567054726 /nfs/dbraw/zinc/05/47/26/567054726.db2.gz PBNOECUSVAJMGD-BBRMVZONSA-N 0 3 394.256 3.052 10 0 GGAEHN Brc1ccc(CN2CCC(NCc3cnn4c3CCC4)CC2)cc1 ZINC000657401173 567054917 /nfs/dbraw/zinc/05/49/17/567054917.db2.gz RIBHWSJCEGIMTI-UHFFFAOYSA-N 0 3 389.341 3.346 10 0 GGAEHN Cc1noc(CCN[C@@H](C)c2ccc(F)c(I)c2)n1 ZINC000453133995 567055656 /nfs/dbraw/zinc/05/56/56/567055656.db2.gz JKCUBJZHHJEBQO-QMMMGPOBSA-N 0 3 375.185 3.015 10 0 GGAEHN Cn1ncc(C2CCC2)c1CNC[C@H](CO)Cc1cccc(Br)c1 ZINC000657447502 567056765 /nfs/dbraw/zinc/05/67/65/567056765.db2.gz CRFZISPFBKYDAG-OAHLLOKOSA-N 0 3 392.341 3.391 10 0 GGAEHN O[C@H](CN[C@@H]1CCCCc2cc(Br)ccc21)CC1(O)CCOCC1 ZINC000634722366 567056733 /nfs/dbraw/zinc/05/67/33/567056733.db2.gz NXVUUOXHNXTAJK-FUHWJXTLSA-N 0 3 398.341 3.099 10 0 GGAEHN Cc1c(Br)cncc1CN[C@H]1CC(=O)N(Cc2ccccc2)[C@H]1C ZINC000657458708 567058648 /nfs/dbraw/zinc/05/86/48/567058648.db2.gz OBSLOQZXWVOVRE-KSSFIOAISA-N 0 3 388.309 3.432 10 0 GGAEHN Brc1cccc(N2CC[C@@H](NCc3ccnn3-c3ccncc3)C2)c1 ZINC000657451207 567058853 /nfs/dbraw/zinc/05/88/53/567058853.db2.gz KBXHUQCFAIJKFL-MRXNPFEDSA-N 0 3 398.308 3.398 10 0 GGAEHN CN(C)CCOc1ccc(NC(=O)c2cccc([S@@](C)=O)c2)cc1Cl ZINC000613775652 567060763 /nfs/dbraw/zinc/06/07/63/567060763.db2.gz CHWHTWRQPOHIME-RUZDIDTESA-N 0 3 380.897 3.270 10 0 GGAEHN Cn1ncc(C2CCC2)c1CNCCCS(=O)(=O)c1ccc(Cl)cc1 ZINC000657476406 567061089 /nfs/dbraw/zinc/06/10/89/567061089.db2.gz NWELORYUJGOBIJ-UHFFFAOYSA-N 0 3 381.929 3.295 10 0 GGAEHN COC1([C@H](C)NCc2cn3cc(Br)cc(C)c3n2)CCOCC1 ZINC000453188754 567061152 /nfs/dbraw/zinc/06/11/52/567061152.db2.gz AELUQGWJFJMWFA-ZDUSSCGKSA-N 0 3 382.302 3.079 10 0 GGAEHN CS[C@@H]1CN(C(=O)CSc2cccc(C(F)(F)F)c2)C[C@H]1N(C)C ZINC000495566653 567062879 /nfs/dbraw/zinc/06/28/79/567062879.db2.gz XUVDJYIGRHIVRS-ZIAGYGMSSA-N 0 3 378.485 3.302 10 0 GGAEHN CCOC(=O)c1nn(C)cc1CNCC(C)(C)c1ccc(Br)cc1 ZINC000473118906 567063228 /nfs/dbraw/zinc/06/32/28/567063228.db2.gz ASWGGPQYOSVMKD-UHFFFAOYSA-N 0 3 394.313 3.427 10 0 GGAEHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)N[C@@H]1C[C@H]1C1CC1 ZINC000431185690 567063595 /nfs/dbraw/zinc/06/35/95/567063595.db2.gz ACTVXFOKQZXBPO-DLBZAZTESA-N 0 3 380.330 3.321 10 0 GGAEHN COc1ccc(CN2CCC(C[NH+]3CCCC3)CC2)c(Br)c1[O-] ZINC000545560586 567063716 /nfs/dbraw/zinc/06/37/16/567063716.db2.gz BCFZLSIFOTXEPM-UHFFFAOYSA-N 0 3 383.330 3.471 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cc3c(cccc3Br)[nH]2)C[C@H]1N(C)C ZINC000495608375 567064520 /nfs/dbraw/zinc/06/45/20/567064520.db2.gz RLZQJXUPKJJWSC-CABCVRRESA-N 0 3 382.327 3.048 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cc3c(cccc3Br)[nH]2)C[C@@H]1N(C)C ZINC000495608376 567064712 /nfs/dbraw/zinc/06/47/12/567064712.db2.gz RLZQJXUPKJJWSC-GJZGRUSLSA-N 0 3 382.327 3.048 10 0 GGAEHN CS[C@@H]1CN(C(=O)CSCc2cc(-c3cccs3)on2)C[C@@H]1N(C)C ZINC000495635112 567064946 /nfs/dbraw/zinc/06/49/46/567064946.db2.gz JEBRCJSWNURNJA-XJKSGUPXSA-N 0 3 397.591 3.140 10 0 GGAEHN CO[C@@H](CNCc1cn(-c2ccc(Br)cc2)nc1C)[C@@H]1CCOC1 ZINC000657545562 567066731 /nfs/dbraw/zinc/06/67/31/567066731.db2.gz SDKUSQSOHPZMPS-KDOFPFPSSA-N 0 3 394.313 3.084 10 0 GGAEHN CO[C@@H](CNCc1cn(-c2cccc(Br)c2)nc1C)[C@H]1CCOC1 ZINC000657541634 567066997 /nfs/dbraw/zinc/06/69/97/567066997.db2.gz QPLDJVKGWAZSOL-KSSFIOAISA-N 0 3 394.313 3.084 10 0 GGAEHN CO[C@@H](CNCc1cc(Br)cc(Br)c1)[C@@H]1CCOC1 ZINC000657542207 567067150 /nfs/dbraw/zinc/06/71/50/567067150.db2.gz OVJGUBWLUZXKRX-RISCZKNCSA-N 0 3 393.119 3.353 10 0 GGAEHN CO[C@@H](CNCc1cccc(Br)c1OC(F)F)[C@@H]1CCOC1 ZINC000657541468 567067710 /nfs/dbraw/zinc/06/77/10/567067710.db2.gz KTIHCXTVLFAKAM-YPMHNXCESA-N 0 3 380.229 3.192 10 0 GGAEHN COC[C@@H](CCNCc1cn(-c2cccc(Br)c2)nc1C)OC ZINC000657553547 567068795 /nfs/dbraw/zinc/06/87/95/567068795.db2.gz LAYDKRXCGJKTEW-QGZVFWFLSA-N 0 3 382.302 3.084 10 0 GGAEHN CS(=O)(=O)CC1(CCNCc2oc3ccccc3c2Br)CC1 ZINC000657546750 567069298 /nfs/dbraw/zinc/06/92/98/567069298.db2.gz BEWUJEJVUKSIQC-UHFFFAOYSA-N 0 3 386.311 3.500 10 0 GGAEHN COc1cc(CN[C@@H](CO)C2CCC2)cc(Br)c1OC(F)F ZINC000657557745 567069760 /nfs/dbraw/zinc/06/97/60/567069760.db2.gz AKHXLAVEMHBEPR-LBPRGKRZSA-N 0 3 380.229 3.310 10 0 GGAEHN COc1c(Br)cc(Br)cc1CN[C@H](CO)C1CCC1 ZINC000657557222 567069788 /nfs/dbraw/zinc/06/97/88/567069788.db2.gz KEIRJBHSEDVYHP-CYBMUJFWSA-N 0 3 393.119 3.471 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1cc(Br)cc2ccccc21 ZINC000521646894 567070339 /nfs/dbraw/zinc/07/03/39/567070339.db2.gz BUJAYOLVGQKINS-INIZCTEOSA-N 0 3 391.309 3.443 10 0 GGAEHN CC[C@H](N[C@@H](C)c1ccc(S(=O)(=O)C2CCCC2)cc1)[C@H](O)C(F)F ZINC000453273106 567071515 /nfs/dbraw/zinc/07/15/15/567071515.db2.gz UAXNPALDGBBKNM-ZLIFDBKOSA-N 0 3 375.481 3.458 10 0 GGAEHN CC[C@H](N[C@H](C)c1ccc(S(=O)(=O)C2CCCC2)cc1)[C@@H](O)C(F)F ZINC000453273105 567071568 /nfs/dbraw/zinc/07/15/68/567071568.db2.gz UAXNPALDGBBKNM-OAUYIBNBSA-N 0 3 375.481 3.458 10 0 GGAEHN O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)c1ncsc1Br ZINC000565485455 567072561 /nfs/dbraw/zinc/07/25/61/567072561.db2.gz DKGVUVJRPSILKW-ZDUSSCGKSA-N 0 3 380.311 3.158 10 0 GGAEHN CO[C@@H]1CCC[C@H]([C@@H](CO)NCc2cnc3c(C)cc(Br)cn23)C1 ZINC000657577075 567073293 /nfs/dbraw/zinc/07/32/93/567073293.db2.gz OKXCFHTUWLRGGA-IAOVAPTHSA-N 0 3 396.329 3.061 10 0 GGAEHN O[C@@H]1CCN(Cc2ccc(CNCc3ccc(F)cc3Br)cc2)C1 ZINC000657596987 567074648 /nfs/dbraw/zinc/07/46/48/567074648.db2.gz PZAAUVJUKRJRQK-GOSISDBHSA-N 0 3 393.300 3.445 10 0 GGAEHN Cc1cc(C(=O)N[C@H]2CCN(C)[C@@H](C)C2)nn1-c1ccc(Br)cc1 ZINC000431324245 567074763 /nfs/dbraw/zinc/07/47/63/567074763.db2.gz VHHDPVMYIOXUCO-WFASDCNBSA-N 0 3 391.313 3.156 10 0 GGAEHN O[C@@H]1CCN(Cc2ccc(CNCc3cccc(Br)c3F)cc2)C1 ZINC000657596457 567074790 /nfs/dbraw/zinc/07/47/90/567074790.db2.gz NHQURHJYFDLQAD-QGZVFWFLSA-N 0 3 393.300 3.445 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CNCCO[C@@H]1CC1(F)F ZINC000657618512 567076667 /nfs/dbraw/zinc/07/66/67/567076667.db2.gz GJPKVNBAQBWNGJ-OAHLLOKOSA-N 0 3 386.240 3.457 10 0 GGAEHN FC1(F)C[C@H]1OCCNCc1cc(Br)c2c(c1)OCCCO2 ZINC000657617827 567077051 /nfs/dbraw/zinc/07/70/51/567077051.db2.gz FMIXKZFOFYUXRH-CYBMUJFWSA-N 0 3 378.213 3.124 10 0 GGAEHN Fc1cncc(Br)c1CNCC1CCN(Cc2ccncc2)CC1 ZINC000657613979 567077347 /nfs/dbraw/zinc/07/73/47/567077347.db2.gz ZTEHODLGOWWUGF-UHFFFAOYSA-N 0 3 393.304 3.380 10 0 GGAEHN CCC(C)(C)[NH2+][C@H](C)C(=O)Nc1cc(I)ccc1[O-] ZINC000614008322 567077663 /nfs/dbraw/zinc/07/76/63/567077663.db2.gz BUTMYMFRWOOCET-SECBINFHSA-N 0 3 376.238 3.102 10 0 GGAEHN Brc1ccc(CN[C@@H]2COC3(CCC3)C2)c(N2CCOCC2)c1 ZINC000657630974 567078842 /nfs/dbraw/zinc/07/88/42/567078842.db2.gz SSHBNMVRWAPKDV-INIZCTEOSA-N 0 3 381.314 3.087 10 0 GGAEHN Cc1ccc(C(=O)N(CCN(C)C)C[C@@H]2CCCO2)c(C)c1Br ZINC000682893024 567079299 /nfs/dbraw/zinc/07/92/99/567079299.db2.gz XSSVBTQZBVYHMU-HNNXBMFYSA-N 0 3 383.330 3.249 10 0 GGAEHN C[C@@H]1CC[C@H](NCc2ccc(Br)c3cccnc23)CS1(=O)=O ZINC000657636147 567079278 /nfs/dbraw/zinc/07/92/78/567079278.db2.gz DPWJADAQOKFLIW-YPMHNXCESA-N 0 3 383.311 3.053 10 0 GGAEHN COCCCN1CCC(NC(=O)c2ccc(C)c(Br)c2C)CC1 ZINC000682889385 567079328 /nfs/dbraw/zinc/07/93/28/567079328.db2.gz RGJSVPRWMLCXIK-UHFFFAOYSA-N 0 3 383.330 3.297 10 0 GGAEHN CN(C)C[C@@]1(O)CCCN(C(=O)c2cc3ccc(Br)cc3s2)C1 ZINC000614070404 567080455 /nfs/dbraw/zinc/08/04/55/567080455.db2.gz KNBMWIJDQCYXHT-KRWDZBQOSA-N 0 3 397.338 3.193 10 0 GGAEHN CN(C)C[C@]1(O)CCCN(C(=O)c2ccc3scc(Br)c3c2)C1 ZINC000614063772 567080637 /nfs/dbraw/zinc/08/06/37/567080637.db2.gz HLDOYCLXDOPMGF-QGZVFWFLSA-N 0 3 397.338 3.193 10 0 GGAEHN CN(C)C[C@@]1(O)CCCN(C(=O)c2cccc3cccc(Br)c32)C1 ZINC000614063924 567080987 /nfs/dbraw/zinc/08/09/87/567080987.db2.gz JLEIWOQSPMKUEP-IBGZPJMESA-N 0 3 391.309 3.131 10 0 GGAEHN CNC(=O)[C@H](C)Oc1ccc(Br)cc1CNC[C@@H]1CCC[C@H](C)O1 ZINC000657670297 567081775 /nfs/dbraw/zinc/08/17/75/567081775.db2.gz SQCUNHUPZSEYBB-XEZPLFJOSA-N 0 3 399.329 3.010 10 0 GGAEHN CNC(=O)[C@H](C)Oc1ccc(Br)cc1CNC[C@]1(C)CC1(F)F ZINC000657665467 567081918 /nfs/dbraw/zinc/08/19/18/567081918.db2.gz MKRVLIRUSBDALR-BONVTDFDSA-N 0 3 391.256 3.097 10 0 GGAEHN CNC(=O)[C@@H](C)Oc1ccc(Br)cc1CNC[C@]1(C)CC1(F)F ZINC000657665465 567082664 /nfs/dbraw/zinc/08/26/64/567082664.db2.gz MKRVLIRUSBDALR-BMIGLBTASA-N 0 3 391.256 3.097 10 0 GGAEHN C[C@@]1(CNCc2ccc(Br)cc2N2CCOCC2)CC1(F)F ZINC000657667083 567082704 /nfs/dbraw/zinc/08/27/04/567082704.db2.gz SOGFXFCOSPHVFG-HNNXBMFYSA-N 0 3 375.257 3.421 10 0 GGAEHN CNC(=O)[C@@H](C)Oc1ccc(Br)cc1CNC[C@@]1(C)CC1(F)F ZINC000657665468 567082752 /nfs/dbraw/zinc/08/27/52/567082752.db2.gz MKRVLIRUSBDALR-MEBBXXQBSA-N 0 3 391.256 3.097 10 0 GGAEHN Ic1cccc2ncnc(NC3CCN(C4CC4)CC3)c12 ZINC000545867756 567083692 /nfs/dbraw/zinc/08/36/92/567083692.db2.gz AMDCXTDHVQVCDU-UHFFFAOYSA-N 0 3 394.260 3.273 10 0 GGAEHN CSc1c(C(=O)N(C)C[C@H]2CCN(Cc3ccc(C)s3)C2)cnn1C ZINC000521885644 567084416 /nfs/dbraw/zinc/08/44/16/567084416.db2.gz VWRWGLRDVLXADL-CQSZACIVSA-N 0 3 378.567 3.106 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)CSCc1ccc(Br)cc1F ZINC000497127139 567085027 /nfs/dbraw/zinc/08/50/27/567085027.db2.gz WXLRVHGXOIOPEI-AWEZNQCLSA-N 0 3 389.334 3.422 10 0 GGAEHN COc1cc(C[NH2+][C@@H]2CCC[C@@H]2Cc2cnn(C)c2)cc(Br)c1[O-] ZINC000657689875 567085431 /nfs/dbraw/zinc/08/54/31/567085431.db2.gz ZLCFQFVBGYBUJH-GDBMZVCRSA-N 0 3 394.313 3.398 10 0 GGAEHN OC(CNCc1nc(-c2cccc(Br)c2)c[nH]1)(C1CC1)C1CC1 ZINC000657698930 567085652 /nfs/dbraw/zinc/08/56/52/567085652.db2.gz XUSXXCDOFDWRTA-UHFFFAOYSA-N 0 3 376.298 3.480 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)NCc1cc(F)ccc1Br ZINC000565655228 567086069 /nfs/dbraw/zinc/08/60/69/567086069.db2.gz VXYVJQSFUNKUSJ-KRWDZBQOSA-N 0 3 392.272 3.356 10 0 GGAEHN Cn1cc(C[C@H]2CCC[C@H]2NCc2cc3c(cc2Br)OCO3)cn1 ZINC000657689905 567086175 /nfs/dbraw/zinc/08/61/75/567086175.db2.gz ZMURWBGBEZWDNX-CZUORRHYSA-N 0 3 392.297 3.412 10 0 GGAEHN Cc1nc(CC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c(C)s1 ZINC000473516363 567086580 /nfs/dbraw/zinc/08/65/80/567086580.db2.gz BCSKPJPKUGIGRH-UHFFFAOYSA-N 0 3 375.460 3.224 10 0 GGAEHN CCOc1c(Br)cc(CNCCc2cncc(C)n2)cc1OC ZINC000657710538 567087443 /nfs/dbraw/zinc/08/74/43/567087443.db2.gz SVBNRTPMNDHUTN-UHFFFAOYSA-N 0 3 380.286 3.287 10 0 GGAEHN CN(C)CCOC1CCN(C(=O)C2(c3ccccc3Br)CC2)CC1 ZINC000473536878 567087486 /nfs/dbraw/zinc/08/74/86/567087486.db2.gz XWOUYUBGLIPNKO-UHFFFAOYSA-N 0 3 395.341 3.050 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN[C@H]1C[C@@H](O)C12CCC2 ZINC000657708093 567087718 /nfs/dbraw/zinc/08/77/18/567087718.db2.gz KPQPNJZESSICMK-DLBZAZTESA-N 0 3 376.298 3.336 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN[C@@H]1C[C@H](O)C12CCC2 ZINC000657708096 567087958 /nfs/dbraw/zinc/08/79/58/567087958.db2.gz KPQPNJZESSICMK-SJORKVTESA-N 0 3 376.298 3.336 10 0 GGAEHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CNC[C@@H]1CCC(=O)N1 ZINC000657711465 567088109 /nfs/dbraw/zinc/08/81/09/567088109.db2.gz KCIAZKNLFMPDCN-HNNXBMFYSA-N 0 3 391.313 3.126 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN[C@H]1C[C@H](O)C12CCC2 ZINC000657708095 567088256 /nfs/dbraw/zinc/08/82/56/567088256.db2.gz KPQPNJZESSICMK-IRXDYDNUSA-N 0 3 376.298 3.336 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CNCCc1cncc(C)n1 ZINC000657713033 567088337 /nfs/dbraw/zinc/08/83/37/567088337.db2.gz JZCDGFJXDHLGOI-UHFFFAOYSA-N 0 3 386.297 3.374 10 0 GGAEHN CN(C(=O)CSCc1cc(-c2cccs2)on1)[C@@H]1CCN(C2CC2)C1 ZINC000521931240 567088660 /nfs/dbraw/zinc/08/86/60/567088660.db2.gz XMQWDCACFYQXNJ-OAHLLOKOSA-N 0 3 377.535 3.331 10 0 GGAEHN COc1cc(CN[C@H]2C[C@H](O)C23CCC3)cc(Br)c1OC(F)F ZINC000657703564 567088577 /nfs/dbraw/zinc/08/85/77/567088577.db2.gz NOFIKVRYTZLRNH-STQMWFEESA-N 0 3 392.240 3.452 10 0 GGAEHN COC(=O)c1ccc(CNCC[C@@H](OC)C(F)(F)F)c(Br)c1 ZINC000585767554 567089253 /nfs/dbraw/zinc/08/92/53/567089253.db2.gz LDMDUENVHIYTEZ-GFCCVEGCSA-N 0 3 384.192 3.293 10 0 GGAEHN Fc1cccc(CN[C@@H]2C[C@@H](N3CCOCC3)C23CCC3)c1Br ZINC000657748119 567093093 /nfs/dbraw/zinc/09/30/93/567093093.db2.gz DWTLLCUGDJDNJB-HZPDHXFCSA-N 0 3 383.305 3.321 10 0 GGAEHN CCS(=O)(=O)C1(CN[C@@H](C)Cc2ccc(F)cc2Br)CC1 ZINC000657758825 567093227 /nfs/dbraw/zinc/09/32/27/567093227.db2.gz MXIXKJNXPKLEQZ-NSHDSACASA-N 0 3 378.307 3.076 10 0 GGAEHN O=C(NCC12CCCN1CCC2)c1cc2c(cncc2Br)s1 ZINC000614230331 567094297 /nfs/dbraw/zinc/09/42/97/567094297.db2.gz PMGIEMKDBQHACC-UHFFFAOYSA-N 0 3 380.311 3.417 10 0 GGAEHN C[C@@]1(CNCc2cnc(-c3ccc(Br)cc3)s2)CCC(=O)N1 ZINC000453585828 567094111 /nfs/dbraw/zinc/09/41/11/567094111.db2.gz HGTLFMLOFQTPED-INIZCTEOSA-N 0 3 380.311 3.331 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)Cn1c(C)c(Br)c2ccccc21 ZINC000614230948 567095006 /nfs/dbraw/zinc/09/50/06/567095006.db2.gz BAWOAIWKUPXQCU-AWEZNQCLSA-N 0 3 378.314 3.313 10 0 GGAEHN O=C(NCC12CCCN1CCC2)c1c(F)c(F)c(Br)c(F)c1F ZINC000614228848 567095071 /nfs/dbraw/zinc/09/50/71/567095071.db2.gz SXIGEAKNAAMMPW-UHFFFAOYSA-N 0 3 395.194 3.364 10 0 GGAEHN C[C@]1(CNCc2cnc(-c3ccc(Br)cc3)s2)CCC(=O)N1 ZINC000453585829 567095148 /nfs/dbraw/zinc/09/51/48/567095148.db2.gz HGTLFMLOFQTPED-MRXNPFEDSA-N 0 3 380.311 3.331 10 0 GGAEHN Cc1cc(Br)cn2c(CNCC3(O)CCC(F)(F)CC3)cnc12 ZINC000657776368 567095163 /nfs/dbraw/zinc/09/51/63/567095163.db2.gz CRFFVSOGQIBSLO-UHFFFAOYSA-N 0 3 388.256 3.435 10 0 GGAEHN C[C@H](CO)CN1CCC(c2nc(-c3ccccc3Br)no2)CC1 ZINC000683103788 567096658 /nfs/dbraw/zinc/09/66/58/567096658.db2.gz NHCIMCGYUFMLAM-LBPRGKRZSA-N 0 3 380.286 3.307 10 0 GGAEHN CN(CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[C@@H]1CCN(C2CC2)C1 ZINC000522068442 567098344 /nfs/dbraw/zinc/09/83/44/567098344.db2.gz RBOKQTRSMXJWLB-CYBMUJFWSA-N 0 3 375.822 3.466 10 0 GGAEHN CN(Cc1nnc(-c2ccccc2Br)o1)[C@H]1CCN(C2CC2)C1 ZINC000522069464 567098443 /nfs/dbraw/zinc/09/84/43/567098443.db2.gz RTGQJHFIMUEMRP-ZDUSSCGKSA-N 0 3 377.286 3.168 10 0 GGAEHN CC[C@@H]1CN(C)CCCN1C(=O)CCc1ccc(OC)cc1Br ZINC000614329936 567102969 /nfs/dbraw/zinc/10/29/69/567102969.db2.gz JUFBNPVZWRRJMD-OAHLLOKOSA-N 0 3 383.330 3.333 10 0 GGAEHN CC[C@H]1CN(C)CCCN1C(=O)CCc1ccc(OC)cc1Br ZINC000614329929 567103601 /nfs/dbraw/zinc/10/36/01/567103601.db2.gz JUFBNPVZWRRJMD-HNNXBMFYSA-N 0 3 383.330 3.333 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1S(=O)(=O)c1c(Cl)cc(F)cc1Cl ZINC000565833257 567104071 /nfs/dbraw/zinc/10/40/71/567104071.db2.gz VQAUOCLXJDKPTM-OAHLLOKOSA-N 0 3 389.279 3.379 10 0 GGAEHN COC[C@@H](CC1CCOCC1)N[C@@H](CCO)c1ccccc1Br ZINC000657969585 567109984 /nfs/dbraw/zinc/10/99/84/567109984.db2.gz REFLDHVJSPXBHN-QAPCUYQASA-N 0 3 386.330 3.294 10 0 GGAEHN CN(CCN1CCCC1)C(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000497583899 567111503 /nfs/dbraw/zinc/11/15/03/567111503.db2.gz DNFCTHYXQLFJJW-OAHLLOKOSA-N 0 3 382.302 3.010 10 0 GGAEHN CCS(=O)(=O)c1cc(Cl)cc(CN[C@H](COC)CC2CCOCC2)c1 ZINC000658034287 567116800 /nfs/dbraw/zinc/11/68/00/567116800.db2.gz KLAARRPAFCMHSG-KRWDZBQOSA-N 0 3 389.945 3.055 10 0 GGAEHN C[C@H](CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccccn1 ZINC000658061306 567118404 /nfs/dbraw/zinc/11/84/04/567118404.db2.gz APCAVXZAIOJOPW-MLGOLLRUSA-N 0 3 395.322 3.456 10 0 GGAEHN Cc1cc(Br)ccc1CN(C)C(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000683384683 567118428 /nfs/dbraw/zinc/11/84/28/567118428.db2.gz MWLHXDBPDUEUTF-KRWDZBQOSA-N 0 3 380.330 3.383 10 0 GGAEHN C[C@@H](CN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)c1ccccn1 ZINC000658065766 567118459 /nfs/dbraw/zinc/11/84/59/567118459.db2.gz FRJZQTXTXAVURY-QWRGUYRKSA-N 0 3 388.320 3.490 10 0 GGAEHN CC[C@@H](NC[C@@H]1CCN1C(C)(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000658061471 567118501 /nfs/dbraw/zinc/11/85/01/567118501.db2.gz OKKBJUBVTZDMEM-GOEBONIOSA-N 0 3 387.977 3.162 10 0 GGAEHN CC[C@H](NC[C@@H]1CCN1C(C)(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000658061474 567119561 /nfs/dbraw/zinc/11/95/61/567119561.db2.gz OKKBJUBVTZDMEM-HOCLYGCPSA-N 0 3 387.977 3.162 10 0 GGAEHN CCN(CC)CCN(C(=O)c1nc(C)oc1C)c1ccc(Br)cn1 ZINC000566012818 567119954 /nfs/dbraw/zinc/11/99/54/567119954.db2.gz UFECWZMXRBRSKU-UHFFFAOYSA-N 0 3 395.301 3.438 10 0 GGAEHN COc1cc(OC)c([C@H](C)NCCC2(CS(C)(=O)=O)CC2)cc1Cl ZINC000658075975 567120225 /nfs/dbraw/zinc/12/02/25/567120225.db2.gz DIQGBTSBEABSHD-LBPRGKRZSA-N 0 3 375.918 3.223 10 0 GGAEHN CO[C@H](CN[C@H](c1ccc(Br)cc1)[C@H]1CCCO1)[C@@H]1CCOC1 ZINC000658079730 567120236 /nfs/dbraw/zinc/12/02/36/567120236.db2.gz XDGBDIDVKYZPBN-VDHUWJSZSA-N 0 3 384.314 3.310 10 0 GGAEHN COc1ccc([C@@H](C)NCCC2(CS(C)(=O)=O)CC2)c(Br)c1 ZINC000658080693 567120385 /nfs/dbraw/zinc/12/03/85/567120385.db2.gz LRZCHSUAMUBRDS-GFCCVEGCSA-N 0 3 390.343 3.323 10 0 GGAEHN CC(C)c1ccccc1OC[C@@H](O)CN(C)CCn1cc(Br)cn1 ZINC000566033168 567121019 /nfs/dbraw/zinc/12/10/19/567121019.db2.gz JUXQQRCAMUYZBN-INIZCTEOSA-N 0 3 396.329 3.141 10 0 GGAEHN CC(C)c1ccccc1OC[C@H](O)CN(C)CCn1cc(Br)cn1 ZINC000566033169 567121308 /nfs/dbraw/zinc/12/13/08/567121308.db2.gz JUXQQRCAMUYZBN-MRXNPFEDSA-N 0 3 396.329 3.141 10 0 GGAEHN OCCO[C@]1(CN[C@H](Cc2ccccc2Cl)c2ccsc2)CCOC1 ZINC000658143750 567123707 /nfs/dbraw/zinc/12/37/07/567123707.db2.gz IOVWIYOXJVYFKL-MOPGFXCFSA-N 0 3 381.925 3.443 10 0 GGAEHN CC[C@H](NC[C@@]1(OCCO)CCOC1)c1ccc(Br)cc1Cl ZINC000658143244 567123822 /nfs/dbraw/zinc/12/38/22/567123822.db2.gz GMPJOIFFSJAEER-HOTGVXAUSA-N 0 3 392.721 3.311 10 0 GGAEHN C[C@@H](NCc1ccc(CN2CC[C@H](O)C2)cc1)c1ncc(Br)s1 ZINC000658136792 567124111 /nfs/dbraw/zinc/12/41/11/567124111.db2.gz IIUNHDLYOPEBOF-DOMZBBRYSA-N 0 3 396.354 3.323 10 0 GGAEHN O=S1(=O)C[C@H](CNC2CC(c3cccc(Cl)c3)C2)Oc2ccccc21 ZINC000566067912 567124487 /nfs/dbraw/zinc/12/44/87/567124487.db2.gz IGXQCUVRHSJVHA-PREGVCBESA-N 0 3 377.893 3.411 10 0 GGAEHN O=C(Cc1cscc1Br)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000432030865 567126342 /nfs/dbraw/zinc/12/63/42/567126342.db2.gz HAUFMCGWCFMNPV-OAHLLOKOSA-N 0 3 379.323 3.444 10 0 GGAEHN C[C@@H](NC[C@@]1(OCCO)CCOC1)c1ccc(SCC(F)(F)F)cc1 ZINC000658149170 567126863 /nfs/dbraw/zinc/12/68/63/567126863.db2.gz RATKUYQDJCZECH-CJNGLKHVSA-N 0 3 379.444 3.160 10 0 GGAEHN C[C@@H](NC[C@@H]1CC(=O)N(C)C1)c1ccc(Br)cc1Br ZINC000658244061 567131582 /nfs/dbraw/zinc/13/15/82/567131582.db2.gz JVEYOAKTUNQYJD-ZJUUUORDSA-N 0 3 390.119 3.341 10 0 GGAEHN CCS(=O)(=O)C1(CN[C@@H](C)Cc2ccc(Br)c(F)c2)CC1 ZINC000658298248 567134103 /nfs/dbraw/zinc/13/41/03/567134103.db2.gz FEBSDGIJEQSPFI-NSHDSACASA-N 0 3 378.307 3.076 10 0 GGAEHN CC(C)CC1(N[C@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)CC1 ZINC000658320906 567135519 /nfs/dbraw/zinc/13/55/19/567135519.db2.gz ISRGETXRBXARJT-LLVKDONJSA-N 0 3 375.332 3.326 10 0 GGAEHN CC1(C)OCC[C@@H]1CN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000658329612 567135833 /nfs/dbraw/zinc/13/58/33/567135833.db2.gz GMEWGYBFDMQBOM-BXUZGUMPSA-N 0 3 388.327 3.072 10 0 GGAEHN CC(C)CC1(N[C@@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)CC1 ZINC000658320907 567136284 /nfs/dbraw/zinc/13/62/84/567136284.db2.gz ISRGETXRBXARJT-NSHDSACASA-N 0 3 375.332 3.326 10 0 GGAEHN O=C1N(CCN[C@@H]2CCc3c2ccc(F)c3Br)C[C@@H]2CCCCN12 ZINC000658305693 567136465 /nfs/dbraw/zinc/13/64/65/567136465.db2.gz LRQMOZFRZIHULH-BLLLJJGKSA-N 0 3 396.304 3.455 10 0 GGAEHN C[C@H](NC[C@@H]1CSc2ccccc2O1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000566220664 567138770 /nfs/dbraw/zinc/13/87/70/567138770.db2.gz LAJSBBDECOITLU-GXTWGEPZSA-N 0 3 381.494 3.433 10 0 GGAEHN O[C@H](COC[C@@H]1CCCO1)CN1CC=C(c2cccc(Br)c2)CC1 ZINC000546586394 567141277 /nfs/dbraw/zinc/14/12/77/567141277.db2.gz HWFDQCLXNNBSBM-OALUTQOASA-N 0 3 396.325 3.095 10 0 GGAEHN O=C(NCCCNCc1cccnc1)[C@H]1CCc2cc(Br)ccc21 ZINC000566240061 567142074 /nfs/dbraw/zinc/14/20/74/567142074.db2.gz HDNIJSYKINPNHF-SFHVURJKSA-N 0 3 388.309 3.170 10 0 GGAEHN N[C@@H]1CN(S(=O)(=O)c2ccc(Cl)c(F)c2)CC[C@H]1c1ccc(F)cc1 ZINC000658403813 567142724 /nfs/dbraw/zinc/14/27/24/567142724.db2.gz QAQFAAQVIANAKI-WMLDXEAASA-N 0 3 386.851 3.124 10 0 GGAEHN C[C@H](CNC(=O)c1cc(Oc2cccc(Br)c2)ccn1)N(C)C ZINC000474167512 567143678 /nfs/dbraw/zinc/14/36/78/567143678.db2.gz GUIFUCDBJVVBHC-GFCCVEGCSA-N 0 3 378.270 3.316 10 0 GGAEHN O=C1c2ccccc2C(=O)N1CCNCCOc1cccc(Cl)c1Cl ZINC000683705166 567146558 /nfs/dbraw/zinc/14/65/58/567146558.db2.gz KVSHPMRGWRTNEM-UHFFFAOYSA-N 0 3 379.243 3.258 10 0 GGAEHN CCN(CC)CCN(C(=O)Cc1cncs1)c1ccc(Br)cn1 ZINC000566303027 567147606 /nfs/dbraw/zinc/14/76/06/567147606.db2.gz DMDGUEONEJFRNY-UHFFFAOYSA-N 0 3 397.342 3.218 10 0 GGAEHN CN(Cc1c(F)ccc(I)c1F)[C@H]1CCN(C2CC2)C1 ZINC000474264487 567151898 /nfs/dbraw/zinc/15/18/98/567151898.db2.gz HVZPKECDIPACJB-NSHDSACASA-N 0 3 392.231 3.238 10 0 GGAEHN CN1CCC[C@H](CNc2ncnc3c2NC(=O)CS3)[C@H]1c1cccs1 ZINC000683752233 567152259 /nfs/dbraw/zinc/15/22/59/567152259.db2.gz KPHXVTRNBJCFIZ-ABAIWWIYSA-N 0 3 375.523 3.077 10 0 GGAEHN O=C(Nc1cc(F)cc(Br)c1F)N1CCN(c2ccncc2)CC1 ZINC000683810964 567155399 /nfs/dbraw/zinc/15/53/99/567155399.db2.gz NZHYHGYOQVIFDE-UHFFFAOYSA-N 0 3 397.223 3.476 10 0 GGAEHN C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)N1CCC[C@@](O)(CN(C)C)C1 ZINC000683912955 567160360 /nfs/dbraw/zinc/16/03/60/567160360.db2.gz OWTHTURQCXPKRQ-SJKOYZFVSA-N 0 3 391.364 3.389 10 0 GGAEHN Cc1c2cc(Br)ccc2oc1C(=O)N1CCC[C@](O)(CN(C)C)C1 ZINC000683909339 567160677 /nfs/dbraw/zinc/16/06/77/567160677.db2.gz AIVROMZMCYBGNH-SFHVURJKSA-N 0 3 395.297 3.032 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)[C@H](C)Oc1ccc(F)cc1Br ZINC000498331598 567167595 /nfs/dbraw/zinc/16/75/95/567167595.db2.gz FSTTURAFAOCFOY-JSGCOSHPSA-N 0 3 389.309 3.448 10 0 GGAEHN CN1CC[C@@]2(CCN(C(=O)c3cc(Br)cc(N4CCCC4)c3)C2)C1 ZINC000615204862 567168862 /nfs/dbraw/zinc/16/88/62/567168862.db2.gz WGYDCSHQAOSATG-LJQANCHMSA-N 0 3 392.341 3.217 10 0 GGAEHN CN1CC[C@]2(CCN(C(=O)c3cc(Br)cc(N4CCCC4)c3)C2)C1 ZINC000615204858 567169123 /nfs/dbraw/zinc/16/91/23/567169123.db2.gz WGYDCSHQAOSATG-IBGZPJMESA-N 0 3 392.341 3.217 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)CCCc1cccc(Br)c1 ZINC000615266000 567172521 /nfs/dbraw/zinc/17/25/21/567172521.db2.gz QXJDRSIZMYFSRG-ZWKOTPCHSA-N 0 3 395.341 3.093 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)CCOc1ccc(Cl)cc1Cl ZINC000615262999 567172713 /nfs/dbraw/zinc/17/27/13/567172713.db2.gz HELSVGXJMPCJKC-HZPDHXFCSA-N 0 3 387.307 3.084 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)CCOc1cccc(Cl)c1Cl ZINC000615263790 567172921 /nfs/dbraw/zinc/17/29/21/567172921.db2.gz JKLMXKMDPHSONQ-CABCVRRESA-N 0 3 387.307 3.084 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1ccc(Cl)cc1Br ZINC000615261590 567173650 /nfs/dbraw/zinc/17/36/50/567173650.db2.gz DMEJMJPHAPLISJ-CABCVRRESA-N 0 3 387.705 3.038 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)CCOc1ccc(Cl)cc1Cl ZINC000615262995 567173763 /nfs/dbraw/zinc/17/37/63/567173763.db2.gz HELSVGXJMPCJKC-CVEARBPZSA-N 0 3 387.307 3.084 10 0 GGAEHN CNS(=O)(=O)CCCN(Cc1ccccc1C(F)(F)F)C1CCCC1 ZINC000523858349 567174406 /nfs/dbraw/zinc/17/44/06/567174406.db2.gz XFQQJOCRINRSAK-UHFFFAOYSA-N 0 3 378.460 3.389 10 0 GGAEHN COc1ncc(C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)cc1Cl ZINC000566641029 567175037 /nfs/dbraw/zinc/17/50/37/567175037.db2.gz JLSBEIHVHABOTO-MRXNPFEDSA-N 0 3 379.913 3.498 10 0 GGAEHN C[C@H](CC(=O)N1CCOC[C@H]1[C@@H]1CCCN1C)c1ccc(Br)cc1 ZINC000615270000 567174995 /nfs/dbraw/zinc/17/49/95/567174995.db2.gz NSUMHNAZXDGPQO-JLSDUUJJSA-N 0 3 395.341 3.264 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000615277542 567175344 /nfs/dbraw/zinc/17/53/44/567175344.db2.gz WLSULDHXXSAZRS-DACLVMHWSA-N 0 3 383.319 3.419 10 0 GGAEHN CSc1cc(Br)ccc1C(=O)N1CCOC[C@@H]1[C@H]1CCCN1C ZINC000615274785 567175512 /nfs/dbraw/zinc/17/55/12/567175512.db2.gz KEHXJHFNWOCKJG-HUUCEWRRSA-N 0 3 399.354 3.106 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)c1ccc(Br)c(Cl)c1 ZINC000615271801 567175656 /nfs/dbraw/zinc/17/56/56/567175656.db2.gz YPBXMCPNDRUHHI-GJZGRUSLSA-N 0 3 387.705 3.038 10 0 GGAEHN N[C@@H]1CN(C(=O)Nc2cc(Br)ccc2Br)CC[C@H]1F ZINC000658981635 567175730 /nfs/dbraw/zinc/17/57/30/567175730.db2.gz XWPUDWYTPRREHP-NXEZZACHSA-N 0 3 395.070 3.115 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1ccc(Cl)c(Br)c1 ZINC000615269182 567175690 /nfs/dbraw/zinc/17/56/90/567175690.db2.gz KHDRMNGQBWPSGK-LSDHHAIUSA-N 0 3 387.705 3.038 10 0 GGAEHN COc1c(Br)cc(Cl)cc1NC(=O)N1CC[C@@H](F)[C@H](N)C1 ZINC000658993442 567175836 /nfs/dbraw/zinc/17/58/36/567175836.db2.gz YNKPKGFKAIYNBQ-NXEZZACHSA-N 0 3 380.645 3.014 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1cc(Cl)cc(Br)c1 ZINC000615268229 567175855 /nfs/dbraw/zinc/17/58/55/567175855.db2.gz FVEXHQMMARHFMI-LSDHHAIUSA-N 0 3 387.705 3.038 10 0 GGAEHN Cc1cc(Br)cc(C(=O)N2CCOC[C@@H]2[C@@H]2CCCN2C)c1C ZINC000615274489 567175877 /nfs/dbraw/zinc/17/58/77/567175877.db2.gz JICPGWHTPPAYFF-DLBZAZTESA-N 0 3 381.314 3.001 10 0 GGAEHN N[C@@H]1CN(C(=O)Nc2ccc(C(F)(F)F)cc2Br)CC[C@H]1F ZINC000659006113 567177232 /nfs/dbraw/zinc/17/72/32/567177232.db2.gz AFUFUAFYYPWULQ-NXEZZACHSA-N 0 3 384.171 3.371 10 0 GGAEHN O=C(NCc1csc(Br)c1)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659032362 567179031 /nfs/dbraw/zinc/17/90/31/567179031.db2.gz QNRBUBPJXFIDNJ-AWEZNQCLSA-N 0 3 396.310 3.493 10 0 GGAEHN C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)N1CCC[C@H]1CN(C)C ZINC000524103630 567180924 /nfs/dbraw/zinc/18/09/24/567180924.db2.gz OGDQVIDHFGNQQG-YPMHNXCESA-N 0 3 389.721 3.422 10 0 GGAEHN CCCOc1c(Br)cc(C(=O)N2CCC[C@H]2CN(C)C)cc1OC ZINC000524103737 567181349 /nfs/dbraw/zinc/18/13/49/567181349.db2.gz XZACJLNJWBMHTG-AWEZNQCLSA-N 0 3 399.329 3.413 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Br)C(=O)N1CCC[C@H]1CN(C)C ZINC000524103627 567181627 /nfs/dbraw/zinc/18/16/27/567181627.db2.gz OGDQVIDHFGNQQG-AAEUAGOBSA-N 0 3 389.721 3.422 10 0 GGAEHN CN1C[C@H]2CCN(Cc3ccc(I)cc3Cl)[C@@H]2C1 ZINC000590010384 567204582 /nfs/dbraw/zinc/20/45/82/567204582.db2.gz GUASUONZLZUKTK-BXUZGUMPSA-N 0 3 376.669 3.081 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N1CCC(c2nc(C(F)(F)F)cs2)CC1 ZINC000454625512 567187747 /nfs/dbraw/zinc/18/77/47/567187747.db2.gz FGNOMLWBPRIFIJ-LBPRGKRZSA-N 0 3 376.448 3.145 10 0 GGAEHN C[C@H](NC(=O)C1(N)CC2(CCC2)C1)c1cc2c(cc1Br)OCCO2 ZINC000659254438 567193675 /nfs/dbraw/zinc/19/36/75/567193675.db2.gz REVYRJHHZDPREL-NSHDSACASA-N 0 3 395.297 3.059 10 0 GGAEHN CN1CC[C@@H](Cn2nnnc2Sc2nc3cc(Cl)cc(Cl)c3o2)C1 ZINC000432827804 567194152 /nfs/dbraw/zinc/19/41/52/567194152.db2.gz DZPJJPCOSUHHPN-MRVPVSSYSA-N 0 3 385.280 3.224 10 0 GGAEHN COc1ccc(Br)cc1CNC(=O)C[C@@H]1NCc2ccccc21 ZINC000659268767 567195778 /nfs/dbraw/zinc/19/57/78/567195778.db2.gz HAJOHCCOTBIAOL-INIZCTEOSA-N 0 3 375.266 3.309 10 0 GGAEHN C[C@@H]1CN(c2cc(C3CC3)nc3c(Br)cccc23)CCN1CCO ZINC000432847714 567196220 /nfs/dbraw/zinc/19/62/20/567196220.db2.gz VYLNWLNUKMLGGT-CYBMUJFWSA-N 0 3 390.325 3.378 10 0 GGAEHN COc1ccc(Br)cc1CNC(=O)C[C@H]1NCc2ccccc21 ZINC000659268770 567196895 /nfs/dbraw/zinc/19/68/95/567196895.db2.gz HAJOHCCOTBIAOL-MRXNPFEDSA-N 0 3 375.266 3.309 10 0 GGAEHN O=C(NCc1ccc(Cl)cc1Cl)[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000524395152 567198141 /nfs/dbraw/zinc/19/81/41/567198141.db2.gz FBDAMCMTVKUZMP-IBGZPJMESA-N 0 3 379.287 3.247 10 0 GGAEHN CCNC(=O)N1CC[C@@H](NCc2ccc(Br)cc2C(F)(F)F)C1 ZINC000474795239 567200283 /nfs/dbraw/zinc/20/02/83/567200283.db2.gz NIDRPAMVNDWODK-GFCCVEGCSA-N 0 3 394.235 3.361 10 0 GGAEHN O=C(Nc1cccc2c1CCNC2)c1sc2c(c1Br)CNC2 ZINC000659296337 567201746 /nfs/dbraw/zinc/20/17/46/567201746.db2.gz LNCKHCNLIJLNBU-UHFFFAOYSA-N 0 3 378.295 3.012 10 0 GGAEHN NC1(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)CC2(CCC2)C1 ZINC000659317284 567203543 /nfs/dbraw/zinc/20/35/43/567203543.db2.gz XBSSUEHWDIPKLQ-UHFFFAOYSA-N 0 3 393.325 3.481 10 0 GGAEHN O=C(C[C@@H]1NCc2ccccc21)N[C@@H]1COc2cc(F)c(Br)cc21 ZINC000659314961 567203682 /nfs/dbraw/zinc/20/36/82/567203682.db2.gz MNUWUICBQPWOEU-JKSUJKDBSA-N 0 3 391.240 3.373 10 0 GGAEHN O=C(Nc1ccc2c(c1F)CCNC2)c1sc2c(c1Br)CNC2 ZINC000659309242 567204122 /nfs/dbraw/zinc/20/41/22/567204122.db2.gz IHWIRXSUKVEERP-UHFFFAOYSA-N 0 3 396.285 3.151 10 0 GGAEHN NC1(C(=O)Nc2cnn(-c3ccccc3Br)c2)CC2(CCC2)C1 ZINC000659313356 567204678 /nfs/dbraw/zinc/20/46/78/567204678.db2.gz AENDDQCDVXPMKY-UHFFFAOYSA-N 0 3 375.270 3.235 10 0 GGAEHN CN1C[C@@H]2CCN(Cc3ccc(I)cc3Cl)[C@@H]2C1 ZINC000590010390 567204656 /nfs/dbraw/zinc/20/46/56/567204656.db2.gz GUASUONZLZUKTK-SMDDNHRTSA-N 0 3 376.669 3.081 10 0 GGAEHN NC1(C(=O)NCC2(Cc3ccc(Br)cc3)CC2)Cc2ccccc2C1 ZINC000659358096 567207493 /nfs/dbraw/zinc/20/74/93/567207493.db2.gz DLLRAKPSVYYFHN-UHFFFAOYSA-N 0 3 399.332 3.384 10 0 GGAEHN O=C(NCC1(Cc2ccc(Br)cc2)CC1)[C@H]1CNCCC1(F)F ZINC000659358219 567208056 /nfs/dbraw/zinc/20/80/56/567208056.db2.gz GKMGAPSJSKRTGU-CQSZACIVSA-N 0 3 387.268 3.133 10 0 GGAEHN Cc1nc2ccc(Br)cn2c1C(=O)NCCN1CCCC[C@@H]1C ZINC000474904130 567208575 /nfs/dbraw/zinc/20/85/75/567208575.db2.gz DMHXGLXBTIPMNK-LBPRGKRZSA-N 0 3 379.302 3.009 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)COc1cc(Cl)c(Cl)cc1Cl ZINC000590119472 567209586 /nfs/dbraw/zinc/20/95/86/567209586.db2.gz YUVPUSZXFHKSNR-NSHDSACASA-N 0 3 395.714 3.253 10 0 GGAEHN O=C(Cc1ccccc1Br)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659373023 567209937 /nfs/dbraw/zinc/20/99/37/567209937.db2.gz PBNOKJOCLAJWKC-QGZVFWFLSA-N 0 3 375.266 3.291 10 0 GGAEHN C[C@@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1cc(Br)cs1 ZINC000567009581 567210026 /nfs/dbraw/zinc/21/00/26/567210026.db2.gz UBBTUFAXENHBPG-DGCLKSJQSA-N 0 3 397.342 3.086 10 0 GGAEHN O=C(Cc1cccc(Br)c1)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659373970 567210221 /nfs/dbraw/zinc/21/02/21/567210221.db2.gz VPTNFAPYQBVEHQ-KRWDZBQOSA-N 0 3 375.266 3.291 10 0 GGAEHN N[C@H](CC(=O)N1CCOC[C@H]1c1cccc(Br)c1)c1ccccc1 ZINC000659370434 567210287 /nfs/dbraw/zinc/21/02/87/567210287.db2.gz XXLPWHOUFKPFRW-MSOLQXFVSA-N 0 3 389.293 3.439 10 0 GGAEHN O=C(COc1ccccc1Br)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659367053 567210317 /nfs/dbraw/zinc/21/03/17/567210317.db2.gz LKTFLUOZESPZRQ-KRWDZBQOSA-N 0 3 391.265 3.128 10 0 GGAEHN CC1(OCC(=O)N2CCc3sccc3[C@@H]2c2ccc(Cl)cc2)CNC1 ZINC000659371388 567210494 /nfs/dbraw/zinc/21/04/94/567210494.db2.gz FMDSBKRDUNQVQH-SFHVURJKSA-N 0 3 376.909 3.254 10 0 GGAEHN O=C(COc1ccc(Br)cc1)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659371726 567210562 /nfs/dbraw/zinc/21/05/62/567210562.db2.gz VZOLYIPCFUSCIN-KRWDZBQOSA-N 0 3 391.265 3.128 10 0 GGAEHN C[C@@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1cc(Br)cs1 ZINC000567009583 567210755 /nfs/dbraw/zinc/21/07/55/567210755.db2.gz UBBTUFAXENHBPG-YPMHNXCESA-N 0 3 397.342 3.086 10 0 GGAEHN C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)N[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]12 ZINC000637651165 567211205 /nfs/dbraw/zinc/21/12/05/567211205.db2.gz UHYLHEDPINDIAV-PXALQNAGSA-N 0 3 392.341 3.069 10 0 GGAEHN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1CC[C@@H](F)[C@H](N)C1 ZINC000659389620 567211163 /nfs/dbraw/zinc/21/11/63/567211163.db2.gz OAUOUMFPSKXUTR-ZIAGYGMSSA-N 0 3 383.876 3.195 10 0 GGAEHN Cc1ccc2c(c1Br)CN(C(=O)[C@@H](CN)c1ccc(F)cc1)C2 ZINC000659387770 567212082 /nfs/dbraw/zinc/21/20/82/567212082.db2.gz OGVLXXKWVBWGSB-HNNXBMFYSA-N 0 3 377.257 3.481 10 0 GGAEHN CC(C)[C@H](Cc1ccc(F)cc1)NCc1ccc(S(=O)(=O)N(C)C)s1 ZINC000567053887 567214282 /nfs/dbraw/zinc/21/42/82/567214282.db2.gz REPVRSJVLQHNCB-KRWDZBQOSA-N 0 3 384.542 3.494 10 0 GGAEHN C[C@@H](CNC(=O)N1CC[C@@H](F)[C@H](N)C1)Sc1ccc(Br)cc1 ZINC000659452207 567215087 /nfs/dbraw/zinc/21/50/87/567215087.db2.gz NRGOZFJIZCQWKN-ZLKJLUDKSA-N 0 3 390.322 3.010 10 0 GGAEHN Cc1sc(CNC(=O)N2CC[C@@H](F)[C@H](N)C2)nc1-c1ccc(Cl)cc1 ZINC000659443268 567215195 /nfs/dbraw/zinc/21/51/95/567215195.db2.gz YPCCJRBDJRPUHH-ZIAGYGMSSA-N 0 3 382.892 3.353 10 0 GGAEHN O=C(NC[C@H]1CCCCN1CCO)Nc1ccc(Cl)c(Br)c1 ZINC000454941506 567215885 /nfs/dbraw/zinc/21/58/85/567215885.db2.gz KQNHJABCWKAOHS-GFCCVEGCSA-N 0 3 390.709 3.071 10 0 GGAEHN O=S1(=O)CC(CCN[C@H](c2ccc(Br)cc2F)C2CC2)C1 ZINC000684559670 567216565 /nfs/dbraw/zinc/21/65/65/567216565.db2.gz OMIVQINVCKDKPP-HNNXBMFYSA-N 0 3 376.291 3.064 10 0 GGAEHN C[C@@H](CN[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl)c1ccncc1 ZINC000684554115 567216689 /nfs/dbraw/zinc/21/66/89/567216689.db2.gz PKWOLSPKUAUWMC-WDEREUQCSA-N 0 3 388.320 3.490 10 0 GGAEHN CC[C@@H](NC(=O)N1CC[C@@H](F)[C@H](N)C1)c1cc(F)cc(Br)c1 ZINC000659483839 567216888 /nfs/dbraw/zinc/21/68/88/567216888.db2.gz KAPJTFXKZRQBBL-MGPQQGTHSA-N 0 3 376.245 3.120 10 0 GGAEHN Cc1nnccc1NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000547543426 567217176 /nfs/dbraw/zinc/21/71/76/567217176.db2.gz GJZMWDBUEVRXJH-UHFFFAOYSA-N 0 3 392.301 3.143 10 0 GGAEHN N[C@@H]1CN(C(=O)NCc2cc(Cl)cc(Cl)c2OC(F)F)CC[C@H]1F ZINC000659467154 567217224 /nfs/dbraw/zinc/21/72/24/567217224.db2.gz MOUDACBECIFMAP-GHMZBOCLSA-N 0 3 386.201 3.176 10 0 GGAEHN OCCCN1CCN(c2cc(C3CC3)nc3c(Br)cccc23)CC1 ZINC000433042440 567218734 /nfs/dbraw/zinc/21/87/34/567218734.db2.gz XZYOVIDGXRNJNF-UHFFFAOYSA-N 0 3 390.325 3.379 10 0 GGAEHN Cc1cc(C)c(NC(=O)NC[C@H]2CCCCN2CCO)c(Br)c1 ZINC000454990403 567220304 /nfs/dbraw/zinc/22/03/04/567220304.db2.gz KSQJHYOFTANIOF-CQSZACIVSA-N 0 3 384.318 3.034 10 0 GGAEHN Brc1cccc(OCCN2CCC(c3nnc4n3CCC4)CC2)c1 ZINC000616012669 567220376 /nfs/dbraw/zinc/22/03/76/567220376.db2.gz GULTWYMZFFYJMT-UHFFFAOYSA-N 0 3 391.313 3.245 10 0 GGAEHN Brc1ccc(OCCN2CCC(c3nnc4n3CCC4)CC2)cc1 ZINC000616012969 567222191 /nfs/dbraw/zinc/22/21/91/567222191.db2.gz KZUQHDAWKWYVQB-UHFFFAOYSA-N 0 3 391.313 3.245 10 0 GGAEHN COc1ccc(Br)c(CNC(=O)NCCN2CCCC[C@@H]2C)c1 ZINC000616080730 567227037 /nfs/dbraw/zinc/22/70/37/567227037.db2.gz ZPQYZPOLJXLWIZ-ZDUSSCGKSA-N 0 3 384.318 3.131 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N[C@@H]1CCN(C)[C@@H](C)C1 ZINC000525102011 567227855 /nfs/dbraw/zinc/22/78/55/567227855.db2.gz GDHNQGDQMOKZOA-GXTWGEPZSA-N 0 3 378.314 3.311 10 0 GGAEHN C[C@@H]1CCN(CC(=O)N2CCC(Nc3cccc(Br)c3)CC2)C1 ZINC000567247382 567229901 /nfs/dbraw/zinc/22/99/01/567229901.db2.gz FSVFISOXGUDLPG-CQSZACIVSA-N 0 3 380.330 3.194 10 0 GGAEHN Cc1ncc(Cl)c(C(=O)Nc2ccc(CCN3CCSCC3)cc2)n1 ZINC000525155174 567230752 /nfs/dbraw/zinc/23/07/52/567230752.db2.gz MKVXNDJWEUODGR-UHFFFAOYSA-N 0 3 376.913 3.282 10 0 GGAEHN Clc1cc(Br)cnc1CN1CCC(CN2CCOCC2)CC1 ZINC000659843905 567231124 /nfs/dbraw/zinc/23/11/24/567231124.db2.gz CZWDMDRDOYBDCD-UHFFFAOYSA-N 0 3 388.737 3.042 10 0 GGAEHN O=C(NCCc1ccc(Br)cc1Cl)N1CCN2CCC1CC2 ZINC000455082195 567232698 /nfs/dbraw/zinc/23/26/98/567232698.db2.gz NJSRGHKKKGGJIS-UHFFFAOYSA-N 0 3 386.721 3.135 10 0 GGAEHN CN1CCN(c2ccncc2NC(=O)Nc2cccc(Br)c2)CC1 ZINC000547618783 567232805 /nfs/dbraw/zinc/23/28/05/567232805.db2.gz UTIQAXILQVRMTP-UHFFFAOYSA-N 0 3 390.285 3.240 10 0 GGAEHN OC[C@H](CNCc1ccc(-c2cc[nH]n2)o1)Cc1ccc(Br)cc1 ZINC000433328637 567241523 /nfs/dbraw/zinc/24/15/23/567241523.db2.gz ATJLIYZDXSQWTO-AWEZNQCLSA-N 0 3 390.281 3.373 10 0 GGAEHN OC[C@@H](CNCc1ccc(-c2cc[nH]n2)o1)Cc1cccc(Br)c1 ZINC000433333735 567242324 /nfs/dbraw/zinc/24/23/24/567242324.db2.gz FJQMBLRNNWKUQQ-CQSZACIVSA-N 0 3 390.281 3.373 10 0 GGAEHN COC(=O)[C@@H]1CCCCC[C@@H]1NCc1cn2cc(Br)ccc2n1 ZINC000590747965 567243463 /nfs/dbraw/zinc/24/34/63/567243463.db2.gz AZDRDKCBMSNTAZ-CABCVRRESA-N 0 3 380.286 3.308 10 0 GGAEHN CN1C[C@@H]2CCCN(C(=O)c3cc(Br)cc(N4CCCC4)c3)[C@@H]2C1 ZINC000616420739 567244086 /nfs/dbraw/zinc/24/40/86/567244086.db2.gz SAIGYBBYAQJACK-KBXCAEBGSA-N 0 3 392.341 3.216 10 0 GGAEHN COCc1cc(Cl)ccc1NC(=O)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000616425484 567244241 /nfs/dbraw/zinc/24/42/41/567244241.db2.gz VCXZQZVWVHBAMW-CHWSQXEVSA-N 0 3 381.778 3.409 10 0 GGAEHN COCc1cc(Cl)ccc1NC(=O)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000616425486 567244480 /nfs/dbraw/zinc/24/44/80/567244480.db2.gz VCXZQZVWVHBAMW-OLZOCXBDSA-N 0 3 381.778 3.409 10 0 GGAEHN CCOc1c(Cl)cc(NC(=O)NC[C@H]2CCCCN2CCO)cc1Cl ZINC000455190849 567244464 /nfs/dbraw/zinc/24/44/64/567244464.db2.gz OQXUWKJRZVAITA-CYBMUJFWSA-N 0 3 390.311 3.360 10 0 GGAEHN CCCCN(C)CCNC(=O)Nc1ccc(Br)c(C(=O)OC)c1 ZINC000547753740 567244565 /nfs/dbraw/zinc/24/45/65/567244565.db2.gz OSNKZDVRBLFEPU-UHFFFAOYSA-N 0 3 386.290 3.089 10 0 GGAEHN Cc1cc(C)c(NC(=O)NC[C@@H]2CCCCN2CCO)cc1Br ZINC000455196125 567245157 /nfs/dbraw/zinc/24/51/57/567245157.db2.gz QCCRNMFRUXUZCZ-AWEZNQCLSA-N 0 3 384.318 3.034 10 0 GGAEHN O=C(NC[C@@H]1CCCCN1CCO)Nc1cccc(Cl)c1Br ZINC000455261557 567253762 /nfs/dbraw/zinc/25/37/62/567253762.db2.gz WESQZYMRDGGXSG-NSHDSACASA-N 0 3 390.709 3.071 10 0 GGAEHN C[C@H]1CN(C)CC[C@H]1N(C)C(=O)CSCc1cc(-c2cccs2)on1 ZINC000525538328 567254071 /nfs/dbraw/zinc/25/40/71/567254071.db2.gz YWSOKRPIQPMVBB-DZGCQCFKSA-N 0 3 379.551 3.435 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)CSCc2ccc(Br)cc2F)CCN1C ZINC000525617492 567254452 /nfs/dbraw/zinc/25/44/52/567254452.db2.gz ODFNUBVHOFIQMN-BXUZGUMPSA-N 0 3 389.334 3.420 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NC[C@@H](C)N1CCCC[C@@H]1C ZINC000525657166 567256561 /nfs/dbraw/zinc/25/65/61/567256561.db2.gz KYWJHDHOXKWIDP-UONOGXRCSA-N 0 3 383.330 3.379 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NC[C@H](C)N1CCCC[C@H]1C ZINC000525657165 567257116 /nfs/dbraw/zinc/25/71/16/567257116.db2.gz KYWJHDHOXKWIDP-KGLIPLIRSA-N 0 3 383.330 3.379 10 0 GGAEHN CC(C)N1CC[C@H](N[C@H]2CCN(C)[C@@H](c3ccc(Br)cc3)C2)C1=O ZINC000638639589 567262841 /nfs/dbraw/zinc/26/28/41/567262841.db2.gz TVZUCEXFCYQFDX-OKZBNKHCSA-N 0 3 394.357 3.183 10 0 GGAEHN CC[NH+](CC)[C@H](C)C[N-]S(=O)(=O)c1cc(Br)sc1Cl ZINC000433623819 567263230 /nfs/dbraw/zinc/26/32/30/567263230.db2.gz IQYJJBAOVVTYSA-MRVPVSSYSA-N 0 3 389.768 3.173 10 0 GGAEHN Cn1ncc(Br)c1CNCCc1cccc(OCC(F)(F)F)c1 ZINC000475635783 567263418 /nfs/dbraw/zinc/26/34/18/567263418.db2.gz RRXGNPBPRDBSMF-UHFFFAOYSA-N 0 3 392.219 3.456 10 0 GGAEHN COc1cnccc1N1CCN(Cc2ccc(Br)cc2F)CC1 ZINC000475628537 567263925 /nfs/dbraw/zinc/26/39/25/567263925.db2.gz WHBBXZVYWDBUEF-UHFFFAOYSA-N 0 3 380.261 3.314 10 0 GGAEHN CN(C)[C@]1(CNC(=O)N[C@@H](c2cc(F)ccc2F)C(F)F)CCSC1 ZINC000433652168 567264594 /nfs/dbraw/zinc/26/45/94/567264594.db2.gz XBJWIQXFHNTCRQ-BBRMVZONSA-N 0 3 379.423 3.008 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)N[C@@H](c2cc(F)ccc2F)C(F)F)CCSC1 ZINC000433652171 567264916 /nfs/dbraw/zinc/26/49/16/567264916.db2.gz XBJWIQXFHNTCRQ-XJKSGUPXSA-N 0 3 379.423 3.008 10 0 GGAEHN C[C@@H]1CN(CCCCNc2nc(C3CC3)ncc2Br)C[C@@H](C)O1 ZINC000685272349 567265577 /nfs/dbraw/zinc/26/55/77/567265577.db2.gz HZRDJZCOPBTLKU-CHWSQXEVSA-N 0 3 383.334 3.418 10 0 GGAEHN Brc1ccc(CN2CCC[C@@H]3COCC[C@H]32)c(N2CCOCC2)c1 ZINC000475708788 567269649 /nfs/dbraw/zinc/26/96/49/567269649.db2.gz ZRFGYDUNGMVAHN-SJLPKXTDSA-N 0 3 395.341 3.287 10 0 GGAEHN O=C(NC[C@@H]1CCCCN1CCO)Nc1cc(Cl)ccc1C(F)(F)F ZINC000455403410 567270683 /nfs/dbraw/zinc/27/06/83/567270683.db2.gz CBURVWFQNGJDID-LBPRGKRZSA-N 0 3 379.810 3.327 10 0 GGAEHN CN(Cc1ccccc1Br)C(=O)CN1CCC[C@]2(CCCOC2)C1 ZINC000475731212 567270842 /nfs/dbraw/zinc/27/08/42/567270842.db2.gz NGLPZYZKYNVXRE-IBGZPJMESA-N 0 3 395.341 3.300 10 0 GGAEHN Cc1nccc(NC(=O)[C@@H]2CCCN(Cc3ccccc3)C2)c1Br ZINC000525849258 567270891 /nfs/dbraw/zinc/27/08/91/567270891.db2.gz FPFKNHVXDGYOOJ-MRXNPFEDSA-N 0 3 388.309 3.425 10 0 GGAEHN Cc1nccc(NC(=O)[C@H]2CCCN(Cc3ccccc3)C2)c1Br ZINC000525849257 567271325 /nfs/dbraw/zinc/27/13/25/567271325.db2.gz FPFKNHVXDGYOOJ-INIZCTEOSA-N 0 3 388.309 3.425 10 0 GGAEHN O=C(NC[C@@H]1CCCCN1CCO)Nc1cccc(Br)c1Cl ZINC000455404720 567271293 /nfs/dbraw/zinc/27/12/93/567271293.db2.gz ZCEQSWRTOUVVAD-NSHDSACASA-N 0 3 390.709 3.071 10 0 GGAEHN Cc1cc(CN[C@@H]2CCN(C)[C@@H](c3ccc(Br)cc3)C2)ncn1 ZINC000638812064 567271527 /nfs/dbraw/zinc/27/15/27/567271527.db2.gz REWMEDRWTPZMTK-SJLPKXTDSA-N 0 3 375.314 3.473 10 0 GGAEHN O=C(Nc1cc(Cl)ccc1C(F)(F)F)N[C@H]1CCCN(CCCO)C1 ZINC000455412837 567272873 /nfs/dbraw/zinc/27/28/73/567272873.db2.gz RKKYGYOVULDKJR-LBPRGKRZSA-N 0 3 379.810 3.327 10 0 GGAEHN C[C@@H](Oc1ccc(F)cc1Br)C(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000617016671 567275019 /nfs/dbraw/zinc/27/50/19/567275019.db2.gz JZJDLMMMBCWVGT-YPMHNXCESA-N 0 3 387.293 3.345 10 0 GGAEHN Cc1ncc(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)s1 ZINC000525914458 567275132 /nfs/dbraw/zinc/27/51/32/567275132.db2.gz OYNQYPAIALGWTK-UHFFFAOYSA-N 0 3 376.448 3.056 10 0 GGAEHN CN1CC[C@H](N[C@@H](CO)CC(F)(F)F)C[C@@H]1c1ccc(Br)cc1 ZINC000638833306 567275323 /nfs/dbraw/zinc/27/53/23/567275323.db2.gz VDAYVQITXKYWEU-RRFJBIMHSA-N 0 3 395.263 3.487 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000617013128 567275424 /nfs/dbraw/zinc/27/54/24/567275424.db2.gz NOAJZZOJSZRHQP-LBPRGKRZSA-N 0 3 392.297 3.306 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O ZINC000617019722 567276033 /nfs/dbraw/zinc/27/60/33/567276033.db2.gz QQELNAYMIKENJQ-SWLSCSKDSA-N 0 3 381.929 3.132 10 0 GGAEHN COc1cc(Br)c(C(=O)NC[C@@H]2CCN2C(C)(C)C)cc1OC ZINC000617007286 567276408 /nfs/dbraw/zinc/27/64/08/567276408.db2.gz PTVIUOZWRRXGFY-NSHDSACASA-N 0 3 385.302 3.069 10 0 GGAEHN C[C@H](Oc1ccc(F)cc1Br)C(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000617016668 567276504 /nfs/dbraw/zinc/27/65/04/567276504.db2.gz JZJDLMMMBCWVGT-AAEUAGOBSA-N 0 3 387.293 3.345 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000617013127 567276618 /nfs/dbraw/zinc/27/66/18/567276618.db2.gz NOAJZZOJSZRHQP-GFCCVEGCSA-N 0 3 392.297 3.306 10 0 GGAEHN C[C@@H]1CN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C[C@H](C)S1 ZINC000525928743 567277039 /nfs/dbraw/zinc/27/70/39/567277039.db2.gz DYLHEFGWIVRXHB-AVJIGQEQSA-N 0 3 379.492 3.327 10 0 GGAEHN Brc1cnc2c(CN[C@@H](c3ccccc3)[C@@H]3CCOC3)cnn2c1 ZINC000638856033 567277092 /nfs/dbraw/zinc/27/70/92/567277092.db2.gz SLNXRJMUPSTRTL-PBHICJAKSA-N 0 3 387.281 3.359 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000548074128 567278783 /nfs/dbraw/zinc/27/87/83/567278783.db2.gz TZJJFARGIRIWMY-INIZCTEOSA-N 0 3 381.314 3.174 10 0 GGAEHN CN1CC[C@@H](NC(=O)Nc2cc(Br)ccn2)[C@@H]1c1ccccc1 ZINC000499891804 567280914 /nfs/dbraw/zinc/28/09/14/567280914.db2.gz CVVOWIFIAAVVSC-ZBFHGGJFSA-N 0 3 375.270 3.411 10 0 GGAEHN CN1CC[C@H](NC(=O)Nc2cc(Br)ccn2)[C@@H]1c1ccccc1 ZINC000499891803 567281121 /nfs/dbraw/zinc/28/11/21/567281121.db2.gz CVVOWIFIAAVVSC-HOCLYGCPSA-N 0 3 375.270 3.411 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)NC[C@H]1CCCCN1C1CC1 ZINC000433904973 567283039 /nfs/dbraw/zinc/28/30/39/567283039.db2.gz AWTSULNZRWDFOB-MRXNPFEDSA-N 0 3 396.329 3.274 10 0 GGAEHN CC(C)(C)C(=O)N1CCC[C@@H](CN[C@H](CO)c2cccc(Br)c2)C1 ZINC000660237415 567283530 /nfs/dbraw/zinc/28/35/30/567283530.db2.gz CFOUVOPVHAPVRI-WMLDXEAASA-N 0 3 397.357 3.357 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NC[C@@H]1CSc2ccccc2O1 ZINC000567857915 567285057 /nfs/dbraw/zinc/28/50/57/567285057.db2.gz PQWVOPUHQOBXQY-TZMCWYRMSA-N 0 3 395.322 3.142 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)Cc1cc(Br)ccc1F ZINC000433982057 567285833 /nfs/dbraw/zinc/28/58/33/567285833.db2.gz VFZFTKLYHVPPPW-KRWDZBQOSA-N 0 3 393.300 3.420 10 0 GGAEHN CN(C)[C@@H]1CCCN(C(=O)N[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000591573537 567285785 /nfs/dbraw/zinc/28/57/85/567285785.db2.gz WMHUJHHAALSHFP-UKRRQHHQSA-N 0 3 382.302 3.008 10 0 GGAEHN Cc1ccc2c(c1Br)CN(C(=O)NC1CCN(C3CC3)CC1)C2 ZINC000660279341 567285832 /nfs/dbraw/zinc/28/58/32/567285832.db2.gz VDHNJXOVMJPLIX-UHFFFAOYSA-N 0 3 378.314 3.410 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)Cc1cc(F)ccc1Br ZINC000433980975 567286248 /nfs/dbraw/zinc/28/62/48/567286248.db2.gz KYDBOAOZZUQVFH-QGZVFWFLSA-N 0 3 393.300 3.420 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)Cc1cc(Br)ccc1F ZINC000433982059 567286358 /nfs/dbraw/zinc/28/63/58/567286358.db2.gz VFZFTKLYHVPPPW-QGZVFWFLSA-N 0 3 393.300 3.420 10 0 GGAEHN CC[C@H](NC[C@H](O)COc1c(Cl)cccc1Cl)[C@H](O)C(F)(F)F ZINC000567872483 567286393 /nfs/dbraw/zinc/28/63/93/567286393.db2.gz ADSOYSVNYPGEPA-QWRKXWFKSA-N 0 3 376.202 3.025 10 0 GGAEHN Cc1cc(C)c(C(=O)N(C)[C@H]2CN3CCC2CC3)cc1I ZINC000475933928 567288408 /nfs/dbraw/zinc/28/84/08/567288408.db2.gz QGMGHKSNCIFLAG-INIZCTEOSA-N 0 3 398.288 3.074 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)Nc1cc(Cl)ccc1I ZINC000455648839 567291245 /nfs/dbraw/zinc/29/12/45/567291245.db2.gz PAUBICBWKPXAGN-JTQLQIEISA-N 0 3 393.656 3.160 10 0 GGAEHN CN(C)CCOC1CCN(C(=O)[C@H]2CCc3cc(Br)ccc32)CC1 ZINC000567938826 567291746 /nfs/dbraw/zinc/29/17/46/567291746.db2.gz JISFSNUONZDGAX-SFHVURJKSA-N 0 3 395.341 3.048 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NCCc1nnn(C(C)(C)C)n1 ZINC000660391072 567291868 /nfs/dbraw/zinc/29/18/68/567291868.db2.gz DTEJKCBGRURRPJ-NSHDSACASA-N 0 3 382.306 3.093 10 0 GGAEHN COCCN(Cc1cc(Br)cs1)C[C@H](OC)[C@H]1CCOC1 ZINC000660411644 567292010 /nfs/dbraw/zinc/29/20/10/567292010.db2.gz SKRCDTJRSHITPC-WFASDCNBSA-N 0 3 378.332 3.011 10 0 GGAEHN Cc1cc(Br)ccc1CN(C)C(=O)Nc1ccnn1CCN(C)C ZINC000455653864 567293098 /nfs/dbraw/zinc/29/30/98/567293098.db2.gz FSLFOHSXVNYQPR-UHFFFAOYSA-N 0 3 394.317 3.180 10 0 GGAEHN C[C@H]1CN(C2CCOCC2)CCN1Cc1ncc(Br)cc1Cl ZINC000660438607 567295790 /nfs/dbraw/zinc/29/57/90/567295790.db2.gz ULRAOJJBHQRQPO-LBPRGKRZSA-N 0 3 388.737 3.183 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)COc1ccc(Br)cc1 ZINC000617288246 567295952 /nfs/dbraw/zinc/29/59/52/567295952.db2.gz FAGZJDHPGNBPBG-KRWDZBQOSA-N 0 3 391.309 3.117 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1cc(Br)ccc1F ZINC000617291009 567297459 /nfs/dbraw/zinc/29/74/59/567297459.db2.gz OXCWSDCDQMYXHI-OAHLLOKOSA-N 0 3 379.273 3.491 10 0 GGAEHN COc1ncc(Br)cc1CN[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000660490721 567301878 /nfs/dbraw/zinc/30/18/78/567301878.db2.gz YHAWKUJZRXNIOD-IRXDYDNUSA-N 0 3 376.298 3.388 10 0 GGAEHN CCO[C@@H]1C[C@@H](NC(=O)NC[C@@H](c2ccsc2)N(CC)CC)[C@@H]1SC ZINC000591903581 567304073 /nfs/dbraw/zinc/30/40/73/567304073.db2.gz PTWRGPNCUDOKNS-TWMKSMIVSA-N 0 3 385.599 3.339 10 0 GGAEHN COc1cc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc(Br)c1OC ZINC000568090602 567304682 /nfs/dbraw/zinc/30/46/82/567304682.db2.gz QHKIYYPMHLKZTD-AAEUAGOBSA-N 0 3 385.302 3.021 10 0 GGAEHN COc1cc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc(Br)c1OC ZINC000568090604 567304781 /nfs/dbraw/zinc/30/47/81/567304781.db2.gz QHKIYYPMHLKZTD-WCQYABFASA-N 0 3 385.302 3.021 10 0 GGAEHN CN1CCC[C@H](NC(=O)COc2ccc3cc(Br)ccc3c2)C1 ZINC000617416019 567305621 /nfs/dbraw/zinc/30/56/21/567305621.db2.gz YPWIAIPWRAWSJA-INIZCTEOSA-N 0 3 377.282 3.192 10 0 GGAEHN CN1CCC[C@H](NC(=O)COc2ccc3ccccc3c2Br)C1 ZINC000617414311 567306729 /nfs/dbraw/zinc/30/67/29/567306729.db2.gz FQMJAEZYRSFEBW-AWEZNQCLSA-N 0 3 377.282 3.192 10 0 GGAEHN CC(=O)N1C[C@@H]2CCC[C@H](NCc3ncc(Br)cc3Cl)[C@H]2C1 ZINC000660560970 567308366 /nfs/dbraw/zinc/30/83/66/567308366.db2.gz PMTZZWHGVGKQFP-WHOFXGATSA-N 0 3 386.721 3.234 10 0 GGAEHN CC(=O)N1C[C@@H]2CCC[C@H](NCc3ncc(Br)cc3Cl)[C@@H]2C1 ZINC000660560965 567308384 /nfs/dbraw/zinc/30/83/84/567308384.db2.gz PMTZZWHGVGKQFP-LNSITVRQSA-N 0 3 386.721 3.234 10 0 GGAEHN CSc1nnc(CNC(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)s1 ZINC000527081518 567310554 /nfs/dbraw/zinc/31/05/54/567310554.db2.gz ZPPSFQATPZPONJ-FZMZJTMJSA-N 0 3 397.595 3.204 10 0 GGAEHN COC(=O)c1cc(NC(=O)NCCN2CCCCCC2)ccc1Br ZINC000548409372 567314262 /nfs/dbraw/zinc/31/42/62/567314262.db2.gz JZSFOIXOPBWQRE-UHFFFAOYSA-N 0 3 398.301 3.233 10 0 GGAEHN COc1ccc([C@H](C)NC(=O)N(C)[C@H]2CCN(C3CC3)C2)cc1Br ZINC000476326581 567314789 /nfs/dbraw/zinc/31/47/89/567314789.db2.gz VFCLQOCHQBMMDO-WFASDCNBSA-N 0 3 396.329 3.397 10 0 GGAEHN O=c1cc(CN2CCC[C@@H](c3ccccn3)C2)nc2ccc(Br)cn12 ZINC000660629085 567315540 /nfs/dbraw/zinc/31/55/40/567315540.db2.gz ZUGQTEJASSZWEW-CQSZACIVSA-N 0 3 399.292 3.232 10 0 GGAEHN C[C@H](NCc1cc[nH]c(=O)c1)c1ccc(Br)cc1OCCCO ZINC000639651610 567316975 /nfs/dbraw/zinc/31/69/75/567316975.db2.gz BZBDNBWDNHFKQW-LBPRGKRZSA-N 0 3 381.270 3.162 10 0 GGAEHN Cc1ccc(I)cc1NC(=O)CCN(C)c1ccncc1 ZINC000548468565 567316993 /nfs/dbraw/zinc/31/69/93/567316993.db2.gz YWFZWOMZJUMBQB-UHFFFAOYSA-N 0 3 395.244 3.460 10 0 GGAEHN CCO[C@@H]1C[C@@H](NCC(=O)NCCc2cccc(Cl)c2Cl)[C@@H]1SC ZINC000592165945 567318384 /nfs/dbraw/zinc/31/83/84/567318384.db2.gz CLGFTAMWEKUKTC-CPUCHLNUSA-N 0 3 391.364 3.151 10 0 GGAEHN CCO[C@@H]1C[C@@H](NCC(=O)N(C)Cc2ccc(Cl)c(Cl)c2)[C@@H]1SC ZINC000592170049 567320224 /nfs/dbraw/zinc/32/02/24/567320224.db2.gz UKMQASWSWKZROR-INMHGKMJSA-N 0 3 391.364 3.450 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)N1CC[C@@H]1c1ccc(Br)cc1 ZINC000660699785 567321054 /nfs/dbraw/zinc/32/10/54/567321054.db2.gz GGVROXFSGJQAIB-IAGOWNOFSA-N 0 3 396.329 3.016 10 0 GGAEHN CCN(C(=O)c1cc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1CCN(C)C1 ZINC000617559345 567321808 /nfs/dbraw/zinc/32/18/08/567321808.db2.gz YNUOTKHRSAQYKI-CQSZACIVSA-N 0 3 377.286 3.005 10 0 GGAEHN CCN(C(=O)c1[nH]nc(-c2ccccc2)c1Br)[C@@H]1CCN(C)C1 ZINC000617556244 567322016 /nfs/dbraw/zinc/32/20/16/567322016.db2.gz MLFYUIGMRPOILN-CYBMUJFWSA-N 0 3 377.286 3.005 10 0 GGAEHN CCN(C(=O)c1cnn(-c2cccc(Br)c2)c1C)[C@@H]1CCN(C)C1 ZINC000617556423 567322363 /nfs/dbraw/zinc/32/23/63/567322363.db2.gz PYWJMDUACNEFMV-MRXNPFEDSA-N 0 3 391.313 3.109 10 0 GGAEHN CCN(C(=O)Cc1c(C)[nH]c2ccc(Br)cc21)[C@H]1CCN(C)C1 ZINC000617556924 567322431 /nfs/dbraw/zinc/32/24/31/567322431.db2.gz ABUIHHAWRMXSED-AWEZNQCLSA-N 0 3 378.314 3.334 10 0 GGAEHN CCN(C(=O)c1cc(Br)cc(N2CCCC2)c1)[C@@H]1CCN(C)C1 ZINC000617562717 567323157 /nfs/dbraw/zinc/32/31/57/567323157.db2.gz VOAQDRRGOISFDN-MRXNPFEDSA-N 0 3 380.330 3.216 10 0 GGAEHN O=C1C[C@@]2(CCN(Cc3ccc(-c4ccc(Br)cc4)o3)C2)CN1 ZINC000434747950 567323451 /nfs/dbraw/zinc/32/34/51/567323451.db2.gz NOPBIMUGBWJVSS-SFHVURJKSA-N 0 3 375.266 3.421 10 0 GGAEHN CCN1CCN(CC(C)(C)NCc2ncc(Br)cc2Cl)CC1 ZINC000660754306 567323824 /nfs/dbraw/zinc/32/38/24/567323824.db2.gz PHNSVYQKMOHZMQ-UHFFFAOYSA-N 0 3 389.769 3.003 10 0 GGAEHN CS(=O)(=O)NC[C@H]1CCC[C@H]1NCc1cc(C(F)(F)F)ccc1Cl ZINC000500476077 567325846 /nfs/dbraw/zinc/32/58/46/567325846.db2.gz QPWYUCAPIUQJCO-QMTHXVAHSA-N 0 3 384.851 3.166 10 0 GGAEHN CS(=O)(=O)NC[C@H]1CCC[C@@H]1NCc1cc(C(F)(F)F)ccc1Cl ZINC000500476078 567326230 /nfs/dbraw/zinc/32/62/30/567326230.db2.gz QPWYUCAPIUQJCO-YGRLFVJLSA-N 0 3 384.851 3.166 10 0 GGAEHN CN1CCC[C@H](CNC(=O)C(=O)Nc2cc(Cl)c(Cl)c(Cl)c2)C1 ZINC000568399869 567326345 /nfs/dbraw/zinc/32/63/45/567326345.db2.gz GCCUVQYVUQTNLD-SECBINFHSA-N 0 3 378.687 3.043 10 0 GGAEHN O=C(CCc1cc(Cl)cs1)NCc1ccc(CN2CC[C@H](O)C2)cc1 ZINC000617700642 567329036 /nfs/dbraw/zinc/32/90/36/567329036.db2.gz IOXCSIOFQDMHGN-KRWDZBQOSA-N 0 3 378.925 3.217 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1ccsc1Br ZINC000617696841 567329233 /nfs/dbraw/zinc/32/92/33/567329233.db2.gz PMQGNYPCQHYJOG-CQSZACIVSA-N 0 3 395.322 3.007 10 0 GGAEHN CN1CCC(NC(=O)NCC2(Cc3ccc(Br)cc3)CC2)CC1 ZINC000660821964 567329386 /nfs/dbraw/zinc/32/93/86/567329386.db2.gz LWKQLVLPWUMGGF-UHFFFAOYSA-N 0 3 380.330 3.165 10 0 GGAEHN C[C@H]1CN(CCCCNC(=O)COc2ccc(Cl)c(Cl)c2)C[C@H](C)O1 ZINC000434786475 567329436 /nfs/dbraw/zinc/32/94/36/567329436.db2.gz OVIITYHLRDMWDO-KBPBESRZSA-N 0 3 389.323 3.378 10 0 GGAEHN O=C(N[C@H]1CCN(C2CC2)C1)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000660840925 567329926 /nfs/dbraw/zinc/32/99/26/567329926.db2.gz NELQBZONSBJYKX-XJKSGUPXSA-N 0 3 396.354 3.273 10 0 GGAEHN O=C(N[C@H]1CCN(C2CC2)C1)N[C@H]1CSCc2ccc(Br)cc21 ZINC000660840921 567329967 /nfs/dbraw/zinc/32/99/67/567329967.db2.gz NELQBZONSBJYKX-BBRMVZONSA-N 0 3 396.354 3.273 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)c1cc(Cl)cc(Cl)c1 ZINC000617696835 567330135 /nfs/dbraw/zinc/33/01/35/567330135.db2.gz PIAKYOAUPRELAM-SFHVURJKSA-N 0 3 379.287 3.490 10 0 GGAEHN CN1CCC[C@H](CNC(=O)N[C@H]2CSCc3ccc(Br)cc32)C1 ZINC000660847080 567330371 /nfs/dbraw/zinc/33/03/71/567330371.db2.gz NEDFAKMRTFBRBR-WBMJQRKESA-N 0 3 398.370 3.378 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1ccc(Cl)cc1Cl ZINC000617696345 567330400 /nfs/dbraw/zinc/33/04/00/567330400.db2.gz HHSLDDLTTJHBJX-MRXNPFEDSA-N 0 3 379.287 3.490 10 0 GGAEHN CN1CCC(NC(=O)N[C@@H]2CSCc3ccc(Br)cc32)CC1 ZINC000660821807 567330402 /nfs/dbraw/zinc/33/04/02/567330402.db2.gz KDWQZADWWMLZDL-OAHLLOKOSA-N 0 3 384.343 3.130 10 0 GGAEHN CN1CCC[C@@H](CNC(=O)N[C@H]2CSCc3ccc(Br)cc32)C1 ZINC000660847078 567330441 /nfs/dbraw/zinc/33/04/41/567330441.db2.gz NEDFAKMRTFBRBR-LRDDRELGSA-N 0 3 398.370 3.378 10 0 GGAEHN CCO[C@@H]1C[C@@H](NCc2c(Cl)cccc2N2CCN(C)CC2)[C@@H]1SC ZINC000592376659 567334138 /nfs/dbraw/zinc/33/41/38/567334138.db2.gz CYSBJHABRGJXPN-QRQLOZEOSA-N 0 3 383.989 3.090 10 0 GGAEHN CC(C)(C)n1nnc(CCNC2(c3ccccc3Br)CCC2)n1 ZINC000660910945 567334465 /nfs/dbraw/zinc/33/44/65/567334465.db2.gz QCIFXYKBOHTTOT-UHFFFAOYSA-N 0 3 378.318 3.402 10 0 GGAEHN Cc1cc(C(=O)N[C@H]2CNCCC2(F)F)c2cc(Br)ccc2n1 ZINC000568510111 567335286 /nfs/dbraw/zinc/33/52/86/567335286.db2.gz BIUYXJIUOJHVTD-AWEZNQCLSA-N 0 3 384.224 3.033 10 0 GGAEHN O=C1C[C@@]2(CCN(Cc3ccc(-c4cccc(Br)c4)o3)C2)CN1 ZINC000435060163 567340886 /nfs/dbraw/zinc/34/08/86/567340886.db2.gz JTZQAFQEEVDITQ-SFHVURJKSA-N 0 3 375.266 3.421 10 0 GGAEHN O=C1C[C@]2(CCN(Cc3ccc(-c4cccc(Br)c4)o3)C2)CN1 ZINC000435060162 567341451 /nfs/dbraw/zinc/34/14/51/567341451.db2.gz JTZQAFQEEVDITQ-GOSISDBHSA-N 0 3 375.266 3.421 10 0 GGAEHN COc1ncc(NC(=O)CCN(C)c2ccncc2)c(C)c1Br ZINC000617893866 567342114 /nfs/dbraw/zinc/34/21/14/567342114.db2.gz LBSQGOSXFNIPAS-UHFFFAOYSA-N 0 3 379.258 3.021 10 0 GGAEHN CN(Cc1ccc2nc(NC(=O)CSc3nncs3)sc2c1)C1CC1 ZINC000617866526 567342661 /nfs/dbraw/zinc/34/26/61/567342661.db2.gz PIZDYEIOECUEOD-UHFFFAOYSA-N 0 3 391.547 3.473 10 0 GGAEHN CN(C(=O)NCc1cc(Cl)ccc1Br)[C@H]1CCN(C2CC2)C1 ZINC000568625457 567344983 /nfs/dbraw/zinc/34/49/83/567344983.db2.gz LDWQHIUJBVSTQZ-AWEZNQCLSA-N 0 3 386.721 3.481 10 0 GGAEHN OCC1([C@@H](NCc2ncc(Br)cc2Cl)C2CC2)CCOCC1 ZINC000661076224 567345279 /nfs/dbraw/zinc/34/52/79/567345279.db2.gz ALYZTJJLDNNXLB-HNNXBMFYSA-N 0 3 389.721 3.155 10 0 GGAEHN C[C@H](NC(=O)Cc1ccc(Br)cc1[O-])[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000548733969 567346085 /nfs/dbraw/zinc/34/60/85/567346085.db2.gz DBKPENJKGMFPQP-ZFWWWQNUSA-N 0 3 395.341 3.466 10 0 GGAEHN C[C@H](NC(=O)Cc1ccc(Br)cc1[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000548733969 567346090 /nfs/dbraw/zinc/34/60/90/567346090.db2.gz DBKPENJKGMFPQP-ZFWWWQNUSA-N 0 3 395.341 3.466 10 0 GGAEHN CCN(C(=O)c1ccn(-c2ccc(Br)cc2)n1)[C@@H]1CCN(CC)C1 ZINC000617924260 567346514 /nfs/dbraw/zinc/34/65/14/567346514.db2.gz RBWFXRBHSRRMLS-MRXNPFEDSA-N 0 3 391.313 3.191 10 0 GGAEHN CCN(C(=O)c1[nH]nc(-c2ccccc2)c1Br)[C@H]1CCN(CC)C1 ZINC000617929727 567346590 /nfs/dbraw/zinc/34/65/90/567346590.db2.gz PFPLLESILSRQDT-AWEZNQCLSA-N 0 3 391.313 3.396 10 0 GGAEHN CCN(C(=O)c1cc(=O)[nH]c2c(Br)cccc12)[C@H]1CCN(CC)C1 ZINC000617928181 567346921 /nfs/dbraw/zinc/34/69/21/567346921.db2.gz KSTKTGLGYRUPGN-LBPRGKRZSA-N 0 3 392.297 3.259 10 0 GGAEHN CCN(C(=O)Cc1c(F)ccc(Br)c1F)[C@H]1CCN(CC)C1 ZINC000617924172 567347101 /nfs/dbraw/zinc/34/71/01/567347101.db2.gz PEEQKGOKZPRIQH-NSHDSACASA-N 0 3 375.257 3.213 10 0 GGAEHN C[C@@H]1C[C@@H](NC(=O)N2CCc3ccc(F)c(Br)c3C2)CCN1C ZINC000527594687 567347100 /nfs/dbraw/zinc/34/71/00/567347100.db2.gz QCZIGYCIUIUCOR-YPMHNXCESA-N 0 3 384.293 3.139 10 0 GGAEHN CCN(C(=O)c1ccc(-n2cc(Br)cn2)cc1)[C@@H]1CCN(CC)C1 ZINC000617930798 567347135 /nfs/dbraw/zinc/34/71/35/567347135.db2.gz IRROTRIPSZWAKJ-QGZVFWFLSA-N 0 3 391.313 3.191 10 0 GGAEHN CCN(C(=O)Cc1noc2ccc(Br)cc21)[C@H]1CCN(CC)C1 ZINC000617922927 567347174 /nfs/dbraw/zinc/34/71/74/567347174.db2.gz VQJPJGNRWMJXAE-ZDUSSCGKSA-N 0 3 380.286 3.076 10 0 GGAEHN CCN(C(=O)c1ccc(-n2cc(Br)cn2)cc1)[C@H]1CCN(CC)C1 ZINC000617930797 567347256 /nfs/dbraw/zinc/34/72/56/567347256.db2.gz IRROTRIPSZWAKJ-KRWDZBQOSA-N 0 3 391.313 3.191 10 0 GGAEHN CCN(C(=O)Cc1noc2ccc(Br)cc21)[C@@H]1CCN(CC)C1 ZINC000617922926 567347280 /nfs/dbraw/zinc/34/72/80/567347280.db2.gz VQJPJGNRWMJXAE-CYBMUJFWSA-N 0 3 380.286 3.076 10 0 GGAEHN C[N@H+](CC[N-]S(=O)(=O)c1cc(F)ccc1Br)C1CCCCC1 ZINC000435216250 567348973 /nfs/dbraw/zinc/34/89/73/567348973.db2.gz MCDHYSQUDVHTPU-UHFFFAOYSA-N 0 3 393.322 3.131 10 0 GGAEHN C[N@@H+](CC[N-]S(=O)(=O)c1cc(F)ccc1Br)C1CCCCC1 ZINC000435216250 567348978 /nfs/dbraw/zinc/34/89/78/567348978.db2.gz MCDHYSQUDVHTPU-UHFFFAOYSA-N 0 3 393.322 3.131 10 0 GGAEHN CCN(CC)CCN(Cc1ccccc1)S(=O)(=O)c1nc(C)c(C)s1 ZINC000435221788 567349257 /nfs/dbraw/zinc/34/92/57/567349257.db2.gz DBAZVKKCGXMILN-UHFFFAOYSA-N 0 3 381.567 3.293 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000661127150 567349256 /nfs/dbraw/zinc/34/92/56/567349256.db2.gz IHLNJXLJROADHE-SWLSCSKDSA-N 0 3 396.329 3.445 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)Nc1ccc2nccnc2c1Br ZINC000548779396 567349431 /nfs/dbraw/zinc/34/94/31/567349431.db2.gz XFTQMTLWMWMOOY-LBPRGKRZSA-N 0 3 392.301 3.388 10 0 GGAEHN NC[C@@H](C(=O)N1CCc2ccc(F)c(Br)c2C1)c1ccccc1 ZINC000527617470 567350059 /nfs/dbraw/zinc/35/00/59/567350059.db2.gz MBSQPQIWLAHQLB-CQSZACIVSA-N 0 3 377.257 3.215 10 0 GGAEHN C[C@H](NCCn1cc(Br)ccc1=O)c1cnn(C2CCCC2)c1 ZINC000568721841 567350859 /nfs/dbraw/zinc/35/08/59/567350859.db2.gz OHALAEQNWVMHGI-ZDUSSCGKSA-N 0 3 379.302 3.273 10 0 GGAEHN C[C@H]1CCN(CC(=O)N2CCO[C@H](c3ccc(Br)cc3)[C@H]2C)C1 ZINC000618052460 567353844 /nfs/dbraw/zinc/35/38/44/567353844.db2.gz NXBGSZCYDAKWFL-IYOUNJFTSA-N 0 3 381.314 3.079 10 0 GGAEHN CN(CCC(=O)N[C@@H]1COc2cc(F)c(Br)cc21)c1ccncc1 ZINC000548819642 567354155 /nfs/dbraw/zinc/35/41/55/567354155.db2.gz YLCCVFSHAMRWSJ-OAHLLOKOSA-N 0 3 394.244 3.059 10 0 GGAEHN Fc1c(Br)ccc(CN[C@@H]2CCCN(c3ncccn3)C2)c1F ZINC000527642126 567354581 /nfs/dbraw/zinc/35/45/81/567354581.db2.gz XPMCCWWOOOWUCF-GFCCVEGCSA-N 0 3 383.240 3.276 10 0 GGAEHN CS(=O)(=O)NC[C@H]1CCC[C@H]1NCc1csc(-c2ccc(Cl)cc2)n1 ZINC000548847267 567355754 /nfs/dbraw/zinc/35/57/54/567355754.db2.gz ZQRANZBPXBIAGL-CZUORRHYSA-N 0 3 399.969 3.271 10 0 GGAEHN CO[C@@H]1CCC[C@@H]([C@H](CO)NCc2cc(Br)cc(F)c2F)C1 ZINC000661219560 567357505 /nfs/dbraw/zinc/35/75/05/567357505.db2.gz USJYIPNVHKWZOY-YVLXSGLVSA-N 0 3 378.257 3.383 10 0 GGAEHN COc1ccc([C@H](CNC(=O)[C@@H]2C[C@@]2(C)Br)N2CCCC2)cc1 ZINC000527668096 567358359 /nfs/dbraw/zinc/35/83/59/567358359.db2.gz CPTVEGQJGYPZPT-XYJFISCASA-N 0 3 381.314 3.122 10 0 GGAEHN COc1ccc(Br)c(CNC(=O)NC[C@H]2CCN2C2CCCC2)c1 ZINC000527668505 567358568 /nfs/dbraw/zinc/35/85/68/567358568.db2.gz GWUQLOZHUJVMBX-OAHLLOKOSA-N 0 3 396.329 3.274 10 0 GGAEHN CCCS(=O)(=O)c1ccccc1S(=O)(=O)CCN[C@@H](C)C(C)(C)CC ZINC000661231376 567359033 /nfs/dbraw/zinc/35/90/33/567359033.db2.gz MDIJUFVBDMEKDJ-HNNXBMFYSA-N 0 3 389.583 3.058 10 0 GGAEHN C[C@@H](COc1ccc2cc(Br)ccc2c1)N[C@H]1CCCNC1=O ZINC000568832257 567359127 /nfs/dbraw/zinc/35/91/27/567359127.db2.gz IKXUDTLONPUAEQ-SJCJKPOMSA-N 0 3 377.282 3.238 10 0 GGAEHN CO[C@@H]1CCC[C@H]([C@@H](CO)NCC(=O)Nc2cccc(Cl)c2Cl)C1 ZINC000661221321 567359242 /nfs/dbraw/zinc/35/92/42/567359242.db2.gz RHLBCQVGGPJYNB-YWPYICTPSA-N 0 3 375.296 3.088 10 0 GGAEHN CO[C@@H]1CCC[C@@H]([C@@H](CO)NCC(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000661221602 567359312 /nfs/dbraw/zinc/35/93/12/567359312.db2.gz WLRJPEVKUHRYAW-AXAPSJFSSA-N 0 3 375.296 3.088 10 0 GGAEHN C[C@H](COc1ccc2cc(Br)ccc2c1)N[C@H]1CCCNC1=O ZINC000568832256 567359665 /nfs/dbraw/zinc/35/96/65/567359665.db2.gz IKXUDTLONPUAEQ-PXAZEXFGSA-N 0 3 377.282 3.238 10 0 GGAEHN Nc1nccc([C@@H]2CCCN(CCOc3cc(F)cc(Br)c3)C2)n1 ZINC000548933136 567361623 /nfs/dbraw/zinc/36/16/23/567361623.db2.gz PLOYFYFZXCUXSW-GFCCVEGCSA-N 0 3 395.276 3.049 10 0 GGAEHN CS(=O)(=O)N1CC[C@H](CNC2(c3c(Cl)cccc3Cl)CCC2)C1 ZINC000548931603 567362060 /nfs/dbraw/zinc/36/20/60/567362060.db2.gz SARJSZBNRQCEMW-GFCCVEGCSA-N 0 3 377.337 3.244 10 0 GGAEHN CO[C@]1(CNCc2cc(Br)c(C)cc2Br)CCOC1 ZINC000527691815 567363606 /nfs/dbraw/zinc/36/36/06/567363606.db2.gz LLLAKMLHJXWIOV-AWEZNQCLSA-N 0 3 393.119 3.415 10 0 GGAEHN C[C@@H](CN(C)C)NC(=O)NCc1ccc(Br)cc1C(F)(F)F ZINC000501099149 567363789 /nfs/dbraw/zinc/36/37/89/567363789.db2.gz OHFYLJVGUINVCI-VIFPVBQESA-N 0 3 382.224 3.217 10 0 GGAEHN COc1ccc(Br)cc1CNC(=O)NC[C@@H]1CCN1C1CCCC1 ZINC000527707948 567366018 /nfs/dbraw/zinc/36/60/18/567366018.db2.gz CXFIXZRUDVBKSA-INIZCTEOSA-N 0 3 396.329 3.274 10 0 GGAEHN CC1(C)NC(=O)CC[C@H]1NCc1ccc(I)cc1Cl ZINC000548991980 567366371 /nfs/dbraw/zinc/36/63/71/567366371.db2.gz ZORISRSVWSHDFS-GFCCVEGCSA-N 0 3 392.668 3.091 10 0 GGAEHN COc1ccc(CNC(=O)NC[C@H]2CCN2C2CCCC2)cc1Br ZINC000527715942 567368594 /nfs/dbraw/zinc/36/85/94/567368594.db2.gz KYERBGALDWROIF-OAHLLOKOSA-N 0 3 396.329 3.274 10 0 GGAEHN CC(C)(CNCc1ccsc1Br)[C@@H]1COCC12OCCO2 ZINC000527721796 567370096 /nfs/dbraw/zinc/37/00/96/567370096.db2.gz SVJMFPHODLQDSV-LBPRGKRZSA-N 0 3 376.316 3.016 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000661397956 567370600 /nfs/dbraw/zinc/37/06/00/567370600.db2.gz GKSAXUFFGJKLMX-SNVBAGLBSA-N 0 3 375.357 3.386 10 0 GGAEHN O=C(NCc1ccc(F)cc1Br)NC[C@H]1CCN1C1CCCC1 ZINC000527750865 567371857 /nfs/dbraw/zinc/37/18/57/567371857.db2.gz CKJHENGIKCEFNF-OAHLLOKOSA-N 0 3 384.293 3.404 10 0 GGAEHN Ic1cnc(CNC[C@@H]2CCN2C2CCCCC2)s1 ZINC000527752304 567371960 /nfs/dbraw/zinc/37/19/60/567371960.db2.gz LJHJELNBZUUDJL-LBPRGKRZSA-N 0 3 391.322 3.244 10 0 GGAEHN CS(=O)(=O)c1cc(CNC[C@@H](O)CC2CCCC2)cc(C(F)(F)F)c1 ZINC000568993592 567372226 /nfs/dbraw/zinc/37/22/26/567372226.db2.gz RCDBFLTZMUTXMX-HNNXBMFYSA-N 0 3 379.444 3.140 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)N[C@@H](c1cncc(Br)c1)C1CC1 ZINC000661404765 567372719 /nfs/dbraw/zinc/37/27/19/567372719.db2.gz QYBQEXWDXHSIGI-HZPDHXFCSA-N 0 3 395.345 3.467 10 0 GGAEHN COc1ccc(Br)c(CN(C)C(=O)NC[C@@H]2CCN2C(C)(C)C)c1 ZINC000661405604 567373147 /nfs/dbraw/zinc/37/31/47/567373147.db2.gz XCJWCLGTFMWHOM-AWEZNQCLSA-N 0 3 398.345 3.472 10 0 GGAEHN COc1ccc(CN2CC[C@H]2CNCc2cncc(Br)c2)cc1 ZINC000527773150 567373245 /nfs/dbraw/zinc/37/32/45/567373245.db2.gz MVJHOXSCUMUVFY-KRWDZBQOSA-N 0 3 376.298 3.217 10 0 GGAEHN CS[C@@H]1CN(c2ccc(Br)c(C(F)(F)F)n2)C[C@H]1N(C)C ZINC000569010582 567373605 /nfs/dbraw/zinc/37/36/05/567373605.db2.gz QCFHPFRRBKKHGU-NXEZZACHSA-N 0 3 384.265 3.345 10 0 GGAEHN CC(C)Sc1ccc([C@H](C)N[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)cc1 ZINC000569018483 567373839 /nfs/dbraw/zinc/37/38/39/567373839.db2.gz MNSXFKOJMAEIFD-DOTOQJQBSA-N 0 3 385.599 3.109 10 0 GGAEHN C[C@H]1C[C@H](NC(=O)NCc2ccc(Br)c(F)c2F)CCN1C ZINC000527807551 567374952 /nfs/dbraw/zinc/37/49/52/567374952.db2.gz LCDRZXWKNLNAKF-GXSJLCMTSA-N 0 3 376.245 3.009 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)NCc2cc(F)c(Br)cc2F)CCN1C ZINC000527808348 567375843 /nfs/dbraw/zinc/37/58/43/567375843.db2.gz MXQIYGJCPLNXTD-MWLCHTKSSA-N 0 3 376.245 3.009 10 0 GGAEHN CN(CCc1ccccc1)[C@@H]1CCN(C(=O)c2nscc2Br)C1 ZINC000618351451 567376106 /nfs/dbraw/zinc/37/61/06/567376106.db2.gz XILFBXDADSGGGD-CQSZACIVSA-N 0 3 394.338 3.295 10 0 GGAEHN CN(CCc1ccccc1)[C@H]1CCN(C(=O)c2nscc2Br)C1 ZINC000618351450 567376500 /nfs/dbraw/zinc/37/65/00/567376500.db2.gz XILFBXDADSGGGD-AWEZNQCLSA-N 0 3 394.338 3.295 10 0 GGAEHN CCOc1c(Br)cc(Br)cc1CNCC1COC1 ZINC000527821768 567376757 /nfs/dbraw/zinc/37/67/57/567376757.db2.gz YXXQPESIPLUOFP-UHFFFAOYSA-N 0 3 379.092 3.346 10 0 GGAEHN C[C@@H](C(=O)N(C)Cc1ccc(Br)cc1)N1C[C@]2(C)COC[C@]2(C)C1 ZINC000661494607 567376611 /nfs/dbraw/zinc/37/66/11/567376611.db2.gz BILGWDMLJLCSCU-ZOCIIQOWSA-N 0 3 395.341 3.154 10 0 GGAEHN CCN1CC[C@H]2OCCN(c3nc(-c4cc(Cl)cc(Cl)c4)no3)[C@H]2C1 ZINC000549196539 567378219 /nfs/dbraw/zinc/37/82/19/567378219.db2.gz MIXSTIVEDAWDRJ-LSDHHAIUSA-N 0 3 383.279 3.343 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)NC[C@@H]1CCN1C1CCCC1 ZINC000527868580 567380061 /nfs/dbraw/zinc/38/00/61/567380061.db2.gz UOCRAAUEMNDCNS-INIZCTEOSA-N 0 3 396.329 3.274 10 0 GGAEHN C[C@@H](NC(=O)NC[C@H]1CCN1C1CCCC1)c1ccc(Br)cn1 ZINC000527893884 567381934 /nfs/dbraw/zinc/38/19/34/567381934.db2.gz LBLCOTCFAXVTFG-IUODEOHRSA-N 0 3 381.318 3.221 10 0 GGAEHN C[C@H](NC(=O)NC[C@H]1CCN1C1CCCC1)c1ccc(Br)cn1 ZINC000527893886 567382210 /nfs/dbraw/zinc/38/22/10/567382210.db2.gz LBLCOTCFAXVTFG-SWLSCSKDSA-N 0 3 381.318 3.221 10 0 GGAEHN C[C@H](NC[C@H]1CCCCN1CCO)c1cc(F)c(Br)cc1F ZINC000527900646 567383119 /nfs/dbraw/zinc/38/31/19/567383119.db2.gz DLAOACBYFUTWLM-NWDGAFQWSA-N 0 3 377.273 3.225 10 0 GGAEHN C[C@@H](NC[C@@H]1CCCCN1CCO)c1cc(F)c(Br)cc1F ZINC000527900641 567383262 /nfs/dbraw/zinc/38/32/62/567383262.db2.gz DLAOACBYFUTWLM-NEPJUHHUSA-N 0 3 377.273 3.225 10 0 GGAEHN C[C@@H]1CN(Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@@H](C)C1O ZINC000661624527 567383537 /nfs/dbraw/zinc/38/35/37/567383537.db2.gz KBYGMLDHFGVLQK-CHWSQXEVSA-N 0 3 376.298 3.355 10 0 GGAEHN C[C@@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CCC[C@](O)(C2CC2)C1 ZINC000661630872 567383557 /nfs/dbraw/zinc/38/35/57/567383557.db2.gz CYTFBSPBPZJZSJ-IFXJQAMLSA-N 0 3 395.341 3.033 10 0 GGAEHN C[C@@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CCC[C@@](O)(C2CC2)C1 ZINC000661630874 567383678 /nfs/dbraw/zinc/38/36/78/567383678.db2.gz CYTFBSPBPZJZSJ-LIRRHRJNSA-N 0 3 395.341 3.033 10 0 GGAEHN C[C@H]1CN(Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@H](C)C1O ZINC000661624532 567384128 /nfs/dbraw/zinc/38/41/28/567384128.db2.gz KBYGMLDHFGVLQK-STQMWFEESA-N 0 3 376.298 3.355 10 0 GGAEHN C[C@]1(Cc2ccc(OC(F)(F)F)cc2)CCCN1CCCS(C)(=O)=O ZINC000661616408 567384487 /nfs/dbraw/zinc/38/44/87/567384487.db2.gz RVOZQWOCRODGAA-MRXNPFEDSA-N 0 3 379.444 3.417 10 0 GGAEHN C[C@@H](NCC[C@@H]1CCCOC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000527924738 567385161 /nfs/dbraw/zinc/38/51/61/567385161.db2.gz HMTRJLTZTKTREG-MNOVXSKESA-N 0 3 381.325 3.108 10 0 GGAEHN C[C@H](NC[C@@H](O)[C@H]1CCCO1)c1ccc(Br)cc1Br ZINC000527953448 567386336 /nfs/dbraw/zinc/38/63/36/567386336.db2.gz QVBGUNYGDQQOPC-CUOATXAZSA-N 0 3 393.119 3.402 10 0 GGAEHN CNS(=O)(=O)c1cccc([C@H](C)N[C@@H]2[C@@H]3Cc4cc(Cl)ccc4[C@@H]32)c1 ZINC000527944072 567386445 /nfs/dbraw/zinc/38/64/45/567386445.db2.gz OHLZFSDUEMRYKI-NDYZWRROSA-N 0 3 376.909 3.237 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)COc1ccc(Br)cc1F ZINC000569225375 567388390 /nfs/dbraw/zinc/38/83/90/567388390.db2.gz LXWSYIOYGVRLMD-MRXNPFEDSA-N 0 3 393.256 3.052 10 0 GGAEHN CN(C(=O)C1(Cc2ccccc2Br)CC1)[C@@H]1CCN(C2CC2)C1 ZINC000569244479 567389718 /nfs/dbraw/zinc/38/97/18/567389718.db2.gz UGZLJGUENHUMIE-MRXNPFEDSA-N 0 3 377.326 3.467 10 0 GGAEHN COc1ccc([C@@H](N[C@H](C)Cn2cc(Br)ccc2=O)C2CC2)cn1 ZINC000528043710 567391144 /nfs/dbraw/zinc/39/11/44/567391144.db2.gz RKZGSVMRDBTXIE-XIKOKIGWSA-N 0 3 392.297 3.144 10 0 GGAEHN O=S(=O)([N-][C@@H]1CC[NH2+]C12CCC2)c1cc(Cl)ccc1OCC1CCC1 ZINC000528052785 567391774 /nfs/dbraw/zinc/39/17/74/567391774.db2.gz TVCWAXYRTOWYML-QGZVFWFLSA-N 0 3 384.929 3.082 10 0 GGAEHN Cn1cc(C[C@H]2CCC[C@H]2NCc2cn3cc(Br)ccc3n2)cn1 ZINC000661780280 567392633 /nfs/dbraw/zinc/39/26/33/567392633.db2.gz PTPPLSDRHONING-RHSMWYFYSA-N 0 3 388.313 3.331 10 0 GGAEHN Cn1cc(C[C@H]2CCC[C@@H]2NCC(=O)Nc2ccc(Br)cc2)cn1 ZINC000661777294 567392957 /nfs/dbraw/zinc/39/29/57/567392957.db2.gz GFPUUNYOZINYQJ-PBHICJAKSA-N 0 3 391.313 3.122 10 0 GGAEHN Cn1cc(C[C@@H]2CCC[C@H]2NCC(=O)Nc2ccc(Br)cc2)cn1 ZINC000661777296 567393198 /nfs/dbraw/zinc/39/31/98/567393198.db2.gz GFPUUNYOZINYQJ-WMLDXEAASA-N 0 3 391.313 3.122 10 0 GGAEHN O[C@@H](CN[C@H]1CCOc2c(Br)cccc21)COc1ccccc1 ZINC000501501069 567393211 /nfs/dbraw/zinc/39/32/11/567393211.db2.gz KVVCOPSDDMMCML-GUYCJALGSA-N 0 3 378.266 3.302 10 0 GGAEHN O[C@@H](CN[C@@H]1CCOc2c(Br)cccc21)COCc1ccccc1 ZINC000501501993 567393339 /nfs/dbraw/zinc/39/33/39/567393339.db2.gz IWCUJUVVDUVWSP-MAUKXSAKSA-N 0 3 392.293 3.440 10 0 GGAEHN O[C@H](CN[C@H]1CCOc2c(Br)cccc21)COCc1ccccc1 ZINC000501518997 567394656 /nfs/dbraw/zinc/39/46/56/567394656.db2.gz IWCUJUVVDUVWSP-QAPCUYQASA-N 0 3 392.293 3.440 10 0 GGAEHN O[C@H](CN[C@@H]1CCOc2c(Br)cccc21)COc1ccc(F)cc1 ZINC000501549063 567396038 /nfs/dbraw/zinc/39/60/38/567396038.db2.gz HQBBXZQIKMHNJJ-CXAGYDPISA-N 0 3 396.256 3.441 10 0 GGAEHN Cc1cc(Br)ccc1NC(=O)CN(C)C(=O)CN1CCCC1(C)C ZINC000477467779 567396312 /nfs/dbraw/zinc/39/63/12/567396312.db2.gz YLBCOTARXDMKJB-UHFFFAOYSA-N 0 3 396.329 3.029 10 0 GGAEHN CN(C)S(=O)(=O)c1ccc(CN[C@H]2C[C@H](OC(C)(C)C)C23CCC3)s1 ZINC000661846562 567396322 /nfs/dbraw/zinc/39/63/22/567396322.db2.gz VOMSXSCQZCSZHC-GJZGRUSLSA-N 0 3 386.583 3.214 10 0 GGAEHN CC(C)(C)O[C@H]1C[C@H](NCc2cc(Cl)cc(S(N)(=O)=O)c2)C12CCC2 ZINC000661846102 567397242 /nfs/dbraw/zinc/39/72/42/567397242.db2.gz YGHSHVWGSXEPJE-HOTGVXAUSA-N 0 3 386.945 3.203 10 0 GGAEHN C[C@@H]1CCN(C[C@@H](O)COc2ccc(Cl)cc2Br)C[C@H](C)O1 ZINC000661856911 567398589 /nfs/dbraw/zinc/39/85/89/567398589.db2.gz LLHTWEJQIQBAIU-MBNYWOFBSA-N 0 3 392.721 3.342 10 0 GGAEHN C[C@H](NC(=O)N1CCN2CCC1CC2)c1cc(F)c(Br)cc1F ZINC000528160284 567398666 /nfs/dbraw/zinc/39/86/66/567398666.db2.gz ZZPQTSHGCVHRFJ-JTQLQIEISA-N 0 3 388.256 3.278 10 0 GGAEHN C[C@@H]1CCN(C[C@H](O)COc2ccc(Cl)cc2Br)C[C@H](C)O1 ZINC000661856910 567398702 /nfs/dbraw/zinc/39/87/02/567398702.db2.gz LLHTWEJQIQBAIU-DYEKYZERSA-N 0 3 392.721 3.342 10 0 GGAEHN O=C(c1ccccc1)N1C[C@@H](CNCc2ccc(Cl)s2)N2CC[C@H]1C2 ZINC000501648785 567400402 /nfs/dbraw/zinc/40/04/02/567400402.db2.gz HXKLKGNYYSERMH-JKSUJKDBSA-N 0 3 375.925 3.090 10 0 GGAEHN CN1CCC[C@H](NC(=O)N[C@H]2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)C1 ZINC000618555779 567401108 /nfs/dbraw/zinc/40/11/08/567401108.db2.gz VTTAYOHPMHZBLF-WHOHXGKFSA-N 0 3 375.357 3.289 10 0 GGAEHN CCCN1CC[C@H](NC(=O)N[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000661953035 567401270 /nfs/dbraw/zinc/40/12/70/567401270.db2.gz KDXYKYXTRMNUEP-DZGCQCFKSA-N 0 3 382.302 3.056 10 0 GGAEHN CCCN1CC[C@H](NC(=O)N[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000661953041 567401695 /nfs/dbraw/zinc/40/16/95/567401695.db2.gz KDXYKYXTRMNUEP-ZFWWWQNUSA-N 0 3 382.302 3.056 10 0 GGAEHN OCCN(Cc1cc(Br)cs1)C[C@H](O)Cc1ccc(F)cc1 ZINC000549610492 567402199 /nfs/dbraw/zinc/40/21/99/567402199.db2.gz NKNKYNRJUFMBOY-OAHLLOKOSA-N 0 3 388.302 3.048 10 0 GGAEHN C[C@@H](NCc1nnnn1-c1ccccc1Br)C1CCC(F)CC1 ZINC000662001494 567402826 /nfs/dbraw/zinc/40/28/26/567402826.db2.gz VEPHITWLQRCJMR-PNESKVBLSA-N 0 3 382.281 3.431 10 0 GGAEHN CN(C)C(=O)N(C)[C@@H]1CCN(CCC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000662015134 567404818 /nfs/dbraw/zinc/40/48/18/567404818.db2.gz RYJOGQHWJHGNNO-GFCCVEGCSA-N 0 3 387.311 3.010 10 0 GGAEHN C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)Cc1ccc(Br)cc1[O-] ZINC000477612581 567404879 /nfs/dbraw/zinc/40/48/79/567404879.db2.gz WCBJFYVRXRYIGO-HZSPNIEDSA-N 0 3 383.330 3.180 10 0 GGAEHN C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)Cc1ccc(Br)cc1[O-] ZINC000477612581 567404885 /nfs/dbraw/zinc/40/48/85/567404885.db2.gz WCBJFYVRXRYIGO-HZSPNIEDSA-N 0 3 383.330 3.180 10 0 GGAEHN CC[N@H+](C)Cc1cccc(CNC(=O)Cc2ccc(Br)cc2[O-])c1 ZINC000477618481 567405075 /nfs/dbraw/zinc/40/50/75/567405075.db2.gz PCTUSVOSOWEXBM-UHFFFAOYSA-N 0 3 391.309 3.465 10 0 GGAEHN CC[N@@H+](C)Cc1cccc(CNC(=O)Cc2ccc(Br)cc2[O-])c1 ZINC000477618481 567405083 /nfs/dbraw/zinc/40/50/83/567405083.db2.gz PCTUSVOSOWEXBM-UHFFFAOYSA-N 0 3 391.309 3.465 10 0 GGAEHN C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)Cc2ccc(Br)cc2[O-])C1 ZINC000477620608 567405353 /nfs/dbraw/zinc/40/53/53/567405353.db2.gz HJLRRVZEWVVBEJ-CYBMUJFWSA-N 0 3 383.330 3.324 10 0 GGAEHN C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)Cc2ccc(Br)cc2[O-])C1 ZINC000477620608 567405357 /nfs/dbraw/zinc/40/53/57/567405357.db2.gz HJLRRVZEWVVBEJ-CYBMUJFWSA-N 0 3 383.330 3.324 10 0 GGAEHN C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)Cc1ccc(Br)cc1[O-] ZINC000477612588 567405437 /nfs/dbraw/zinc/40/54/37/567405437.db2.gz WCBJFYVRXRYIGO-MJBXVCDLSA-N 0 3 383.330 3.180 10 0 GGAEHN C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)Cc1ccc(Br)cc1[O-] ZINC000477612588 567405441 /nfs/dbraw/zinc/40/54/41/567405441.db2.gz WCBJFYVRXRYIGO-MJBXVCDLSA-N 0 3 383.330 3.180 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)NCc1ccc(Br)c(F)c1F ZINC000528256585 567405959 /nfs/dbraw/zinc/40/59/59/567405959.db2.gz GQELGEDXORDHMC-UHFFFAOYSA-N 0 3 390.272 3.211 10 0 GGAEHN CN1CCC[C@@H](NC(=O)CCc2ncc(-c3ccccc3Br)o2)C1 ZINC000618666655 567406304 /nfs/dbraw/zinc/40/63/04/567406304.db2.gz MOCYIDDIYVVUES-CYBMUJFWSA-N 0 3 392.297 3.247 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000618666312 567406946 /nfs/dbraw/zinc/40/69/46/567406946.db2.gz YROAHYLBXZASGP-OAHLLOKOSA-N 0 3 381.314 3.220 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000618666312 567406949 /nfs/dbraw/zinc/40/69/49/567406949.db2.gz YROAHYLBXZASGP-OAHLLOKOSA-N 0 3 381.314 3.220 10 0 GGAEHN CN1CC[C@H](NCC(=O)Nc2ccc(Cl)cn2)[C@@H]1c1ccc(Cl)cc1 ZINC000569533454 567410709 /nfs/dbraw/zinc/41/07/09/567410709.db2.gz ITVTXHQUPSNUAU-YJBOKZPZSA-N 0 3 379.291 3.362 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)CCc1nc2cc(Cl)ccc2s1 ZINC000593415982 567412352 /nfs/dbraw/zinc/41/23/52/567412352.db2.gz AQBRHBCPFGSEIV-AWEZNQCLSA-N 0 3 381.929 3.109 10 0 GGAEHN O=C(C[C@@H]1CSCCN1)Nc1nnc(SCc2ccc(F)cc2)s1 ZINC000569567772 567414243 /nfs/dbraw/zinc/41/42/43/567414243.db2.gz ZNUDZZGMCHRZEG-GFCCVEGCSA-N 0 3 384.527 3.003 10 0 GGAEHN CNS(=O)(=O)CCCN1CCC[C@@]1(C)Cc1ccccc1C(F)(F)F ZINC000662155387 567414483 /nfs/dbraw/zinc/41/44/83/567414483.db2.gz MLYUZEASUZGMME-INIZCTEOSA-N 0 3 378.460 3.042 10 0 GGAEHN C[C@@H]1CC[C@H](C)N1CC(=O)N1CCOC[C@@H]1c1cccc(Br)c1 ZINC000618775086 567414444 /nfs/dbraw/zinc/41/44/44/567414444.db2.gz TZKSATPHCCMFPH-JKIFEVAISA-N 0 3 381.314 3.222 10 0 GGAEHN C[C@@H]1CC[C@@H](C)N1CC(=O)N1CCOC[C@@H]1c1cccc(Br)c1 ZINC000618775084 567414478 /nfs/dbraw/zinc/41/44/78/567414478.db2.gz TZKSATPHCCMFPH-CKEIUWERSA-N 0 3 381.314 3.222 10 0 GGAEHN Cc1cccc(S(=O)(=O)N2CCc3ccccc3[C@H]2CN)c1Br ZINC000569604036 567417096 /nfs/dbraw/zinc/41/70/96/567417096.db2.gz JQAFUIYAMLYXBY-OAHLLOKOSA-N 0 3 395.322 3.004 10 0 GGAEHN Cc1cccc(S(=O)(=O)N2CCc3ccccc3[C@@H]2CN)c1Br ZINC000569604034 567417170 /nfs/dbraw/zinc/41/71/70/567417170.db2.gz JQAFUIYAMLYXBY-HNNXBMFYSA-N 0 3 395.322 3.004 10 0 GGAEHN COCCN1CCC(NC(=O)CSc2cccc(C(F)(F)F)c2)CC1 ZINC000502054634 567417444 /nfs/dbraw/zinc/41/74/44/567417444.db2.gz AWNOOUNRMDHBIJ-UHFFFAOYSA-N 0 3 376.444 3.025 10 0 GGAEHN C[NH+](C)CCOc1ccc(CNC(=O)c2cc([O-])cc(Br)c2)cc1 ZINC000528388695 567418332 /nfs/dbraw/zinc/41/83/32/567418332.db2.gz IDVZCUOEIIMNJG-UHFFFAOYSA-N 0 3 393.281 3.025 10 0 GGAEHN C[C@@H](NCCN(C)S(=O)(=O)c1ccc(F)cc1)c1cc2c(s1)CCC2 ZINC000436306415 567419176 /nfs/dbraw/zinc/41/91/76/567419176.db2.gz ICGCPWIWDOJQPQ-CYBMUJFWSA-N 0 3 382.526 3.347 10 0 GGAEHN CCN1CCN(CCC(=O)Nc2ccc(Br)cc2NC(C)C)CC1 ZINC000618883358 567420653 /nfs/dbraw/zinc/42/06/53/567420653.db2.gz QFCOGRDNXPASPA-UHFFFAOYSA-N 0 3 397.361 3.236 10 0 GGAEHN CC(C)(COc1ncccc1Br)NCc1cc(CO)ccc1F ZINC000528428377 567421245 /nfs/dbraw/zinc/42/12/45/567421245.db2.gz DXUZSFVKPILDTL-UHFFFAOYSA-N 0 3 383.261 3.423 10 0 GGAEHN COc1ccc([C@@H](NC[C@H]2CNCCO2)c2ccccc2)cc1Br ZINC000662259570 567422141 /nfs/dbraw/zinc/42/21/41/567422141.db2.gz YWPRUFMSMBGVSZ-APWZRJJASA-N 0 3 391.309 3.125 10 0 GGAEHN COc1ccc([C@H](NC[C@H]2CNCCO2)c2ccccc2)cc1Br ZINC000662259574 567422596 /nfs/dbraw/zinc/42/25/96/567422596.db2.gz YWPRUFMSMBGVSZ-VQIMIIECSA-N 0 3 391.309 3.125 10 0 GGAEHN COc1ccccc1[C@@H]1CNCCN1Cc1cc(Br)cnc1OC ZINC000662272483 567423925 /nfs/dbraw/zinc/42/39/25/567423925.db2.gz NZYZTWPUNAIYAD-INIZCTEOSA-N 0 3 392.297 3.008 10 0 GGAEHN Brc1cccc(C[C@H]2CCCCN2C[C@H]2CCC3(CNC3)O2)c1 ZINC000662282066 567424038 /nfs/dbraw/zinc/42/40/38/567424038.db2.gz CQJRHOIGLNQJJG-QZTJIDSGSA-N 0 3 379.342 3.367 10 0 GGAEHN C[C@@H](NC[C@H]1CNCCO1)c1nc(-c2ccc(Br)cc2)cs1 ZINC000662280152 567424460 /nfs/dbraw/zinc/42/44/60/567424460.db2.gz CXUATVOHQGVONH-BXUZGUMPSA-N 0 3 382.327 3.212 10 0 GGAEHN Brc1cccc(C[C@H]2CCCCN2C[C@@H]2CCC3(CNC3)O2)c1 ZINC000662282065 567424633 /nfs/dbraw/zinc/42/46/33/567424633.db2.gz CQJRHOIGLNQJJG-MSOLQXFVSA-N 0 3 379.342 3.367 10 0 GGAEHN CN(C)C[C@]1(O)CCCN(C(=O)CSCc2ccc(Cl)cc2Cl)C1 ZINC000618924526 567424801 /nfs/dbraw/zinc/42/48/01/567424801.db2.gz YRHFBPJHTMNMMY-QGZVFWFLSA-N 0 3 391.364 3.142 10 0 GGAEHN CN(C)C[C@@H](CNC(=O)C(C)(C)COCC(F)F)c1ccc(Cl)cc1 ZINC000569700447 567425608 /nfs/dbraw/zinc/42/56/08/567425608.db2.gz RVLNUBADVNPNRS-CQSZACIVSA-N 0 3 376.875 3.409 10 0 GGAEHN Cc1sc(NC(=O)CN2CC[C@@H](F)[C@H](N)C2)nc1-c1ccc(Cl)cc1 ZINC000662324011 567427020 /nfs/dbraw/zinc/42/70/20/567427020.db2.gz SOJZFEDWXPMZRD-ZIAGYGMSSA-N 0 3 382.892 3.082 10 0 GGAEHN C[C@H](NC(=O)[C@H](C)N(C)[C@H](CN)C(F)(F)F)c1ccc(Cl)cc1Cl ZINC000662329473 567427105 /nfs/dbraw/zinc/42/71/05/567427105.db2.gz KAWKLLBNJJTDSB-MWODSPESSA-N 0 3 386.245 3.381 10 0 GGAEHN CN(CC(=O)Nc1cc(Cl)c(Cl)cc1Cl)[C@H](CN)C(F)(F)F ZINC000662328538 567427725 /nfs/dbraw/zinc/42/77/25/567427725.db2.gz SBZNJEXGBNLGOJ-SNVBAGLBSA-N 0 3 378.609 3.407 10 0 GGAEHN CCc1cc(Br)ccc1NC(=O)NC[C@H]1CCCN1CCOC ZINC000477972420 567428744 /nfs/dbraw/zinc/42/87/44/567428744.db2.gz DHFZXYXQTRYCBW-OAHLLOKOSA-N 0 3 384.318 3.244 10 0 GGAEHN CCc1cc(Br)ccc1NC(=O)NC[C@@H]1CCCN1CCOC ZINC000477972419 567428845 /nfs/dbraw/zinc/42/88/45/567428845.db2.gz DHFZXYXQTRYCBW-HNNXBMFYSA-N 0 3 384.318 3.244 10 0 GGAEHN C/C(=C\c1ccccc1C(F)(F)F)CN1CCC[C@@H](CS(N)(=O)=O)C1 ZINC000502344833 567429963 /nfs/dbraw/zinc/42/99/63/567429963.db2.gz KAVKTFBEEOFTMW-KADHNRKRSA-N 0 3 376.444 3.109 10 0 GGAEHN COc1cc(C(=O)N[C@@H](CC(C)C)CN(C)C)cc(Br)c1OC ZINC000550185894 567432232 /nfs/dbraw/zinc/43/22/32/567432232.db2.gz CSQZLSVBRRKWCJ-ZDUSSCGKSA-N 0 3 387.318 3.172 10 0 GGAEHN OC[C@@]1([C@@H](NCc2ccc(Br)c(F)c2F)C2CC2)CCCO1 ZINC000528513612 567432090 /nfs/dbraw/zinc/43/20/90/567432090.db2.gz ARDQWBHPYZXPKF-JKSUJKDBSA-N 0 3 376.241 3.137 10 0 GGAEHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)[C@H]1C[C@]1(C)Br ZINC000528513154 567432387 /nfs/dbraw/zinc/43/23/87/567432387.db2.gz RLLZGHHBTSHWSJ-NUJGCVRESA-N 0 3 380.330 3.068 10 0 GGAEHN O=C(NCCCNCc1cccnc1)c1c(Cl)cccc1Br ZINC000662397429 567433466 /nfs/dbraw/zinc/43/34/66/567433466.db2.gz FGLZSEVFYKSCHI-UHFFFAOYSA-N 0 3 382.689 3.407 10 0 GGAEHN Ic1cnc(CN[C@@H](C2CC2)C2CCOCC2)s1 ZINC000593666388 567433527 /nfs/dbraw/zinc/43/35/27/567433527.db2.gz NFAVYOUVIAXCIE-ZDUSSCGKSA-N 0 3 378.279 3.043 10 0 GGAEHN COc1ccc(CCC(=O)NC[C@H](N)c2ccccc2)c(Br)c1 ZINC000662414445 567435024 /nfs/dbraw/zinc/43/50/24/567435024.db2.gz ZRMKWUGCXDZMRA-KRWDZBQOSA-N 0 3 377.282 3.207 10 0 GGAEHN N[C@H](CNC(=O)c1cc(Br)cc(N2CCCC2)c1)c1ccccc1 ZINC000662412195 567435182 /nfs/dbraw/zinc/43/51/82/567435182.db2.gz DOKVURPSLDRZSK-GOSISDBHSA-N 0 3 388.309 3.479 10 0 GGAEHN CN(C)Cc1ccc(S(=O)(=O)N[C@@H]2[C@@H]3Cc4c(cccc4Cl)[C@@H]32)cc1 ZINC000528550873 567437488 /nfs/dbraw/zinc/43/74/88/567437488.db2.gz FFOCUJCESBJWMJ-NZSAHSFTSA-N 0 3 376.909 3.018 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)c1sc2c(c1Br)CNC2 ZINC000662450228 567437822 /nfs/dbraw/zinc/43/78/22/567437822.db2.gz LFXDIWBJZOBTOY-QWRGUYRKSA-N 0 3 386.359 3.107 10 0 GGAEHN Cc1ccc(I)c(C(=O)N(C)[C@@H]2CCN(C(C)C)C2)c1 ZINC000457110703 567441451 /nfs/dbraw/zinc/44/14/51/567441451.db2.gz IHVYBXZHCBABAZ-CYBMUJFWSA-N 0 3 386.277 3.154 10 0 GGAEHN CN(C)CCOc1ccc(NC(=O)[C@@H]2C[C@]2(C)Br)cc1Cl ZINC000528590893 567441718 /nfs/dbraw/zinc/44/17/18/567441718.db2.gz IHNFHIXVFHJPHX-NHYWBVRUSA-N 0 3 375.694 3.392 10 0 GGAEHN CC(C)Oc1cc(Br)cc(NC(=O)c2cn[n-]c2[C@@H]2CC[NH2+]C2)c1 ZINC000662490664 567441772 /nfs/dbraw/zinc/44/17/72/567441772.db2.gz IOSGHGXAHOXIKB-LLVKDONJSA-N 0 3 393.285 3.289 10 0 GGAEHN O[C@H](CNCc1ccc2c(c1)OCCO2)COc1c(Cl)cccc1Cl ZINC000550349247 567442802 /nfs/dbraw/zinc/44/28/02/567442802.db2.gz FLAULAKTAURILK-CYBMUJFWSA-N 0 3 384.259 3.294 10 0 GGAEHN CN(C)Cc1cccc(CNC(=O)c2sc3c(c2Br)CNC3)c1 ZINC000662525186 567444417 /nfs/dbraw/zinc/44/44/17/567444417.db2.gz FKCZLOLKLPXAJP-UHFFFAOYSA-N 0 3 394.338 3.105 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@H](C)Cc3ccc(Cl)cc3Cl)[C@H]2C1 ZINC000502633863 567445270 /nfs/dbraw/zinc/44/52/70/567445270.db2.gz BHTMJXMMVCOBJZ-JEBQAFNWSA-N 0 3 385.335 3.494 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)CNC(=O)c1ccc(Cl)c(Cl)c1 ZINC000593876404 567445467 /nfs/dbraw/zinc/44/54/67/567445467.db2.gz WJBINPUXOSGSST-CHWSQXEVSA-N 0 3 386.323 3.102 10 0 GGAEHN COCCN1CC[C@H](NC(=O)c2cc(Br)cc3ccccc32)C1 ZINC000593915464 567446199 /nfs/dbraw/zinc/44/61/99/567446199.db2.gz NHCDDTVQAZTXSG-HNNXBMFYSA-N 0 3 377.282 3.053 10 0 GGAEHN O=C(N1CCO[C@@H](c2cccc(Br)c2)C1)C1(NC2CC2)CCC1 ZINC000662540660 567446327 /nfs/dbraw/zinc/44/63/27/567446327.db2.gz LTYBTRSJDJFTQA-MRXNPFEDSA-N 0 3 379.298 3.024 10 0 GGAEHN O=C(NCc1cc(Br)ccc1OC(F)F)C1(NC2CC2)CCC1 ZINC000662556494 567447759 /nfs/dbraw/zinc/44/77/59/567447759.db2.gz SOGBAODAFHLHDT-UHFFFAOYSA-N 0 3 389.240 3.341 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@H](C)Oc3ccc(Cl)c(Cl)c3)[C@H]2C1 ZINC000502711066 567448069 /nfs/dbraw/zinc/44/80/69/567448069.db2.gz HRGARUBOPLOTIB-AFAVFJNCSA-N 0 3 387.307 3.082 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3cc(C)cc(C)c3Br)[C@H]2C1 ZINC000502721159 567448127 /nfs/dbraw/zinc/44/81/27/567448127.db2.gz LFMYUEPVXAWNFE-JKSUJKDBSA-N 0 3 381.314 3.001 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)C[C@H](C)c3ccc(Br)cc3)[C@H]2C1 ZINC000502715207 567448151 /nfs/dbraw/zinc/44/81/51/567448151.db2.gz LOOYDEBZIPXKIX-JCGIZDLHSA-N 0 3 395.341 3.264 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3cc(Cl)cc(C(F)(F)F)c3)[C@H]2C1 ZINC000502711377 567448298 /nfs/dbraw/zinc/44/82/98/567448298.db2.gz JVHCIZVYYZEWRZ-LSDHHAIUSA-N 0 3 376.806 3.294 10 0 GGAEHN O=C(Nc1ccc2c(c1)OCCNC2)N1Cc2cccc(Br)c2C1 ZINC000528710383 567449894 /nfs/dbraw/zinc/44/98/94/567449894.db2.gz HDNMGVJAFRMUTE-UHFFFAOYSA-N 0 3 388.265 3.479 10 0 GGAEHN C[C@H](NC(=O)Nc1ccc2c(c1)OCCNC2)c1ccc(Br)cn1 ZINC000528708135 567449945 /nfs/dbraw/zinc/44/99/45/567449945.db2.gz JTFQPKWPFXRTFZ-NSHDSACASA-N 0 3 391.269 3.209 10 0 GGAEHN O=C(C[C@H]1NCc2ccccc21)N1CCOc2cccc(Br)c2C1 ZINC000662585236 567450707 /nfs/dbraw/zinc/45/07/07/567450707.db2.gz SWMBOWCNLXSCJT-QGZVFWFLSA-N 0 3 387.277 3.405 10 0 GGAEHN CC1(N2CCOCC2)CCN(Cc2cc(Br)cc(F)c2F)CC1 ZINC000528729406 567451013 /nfs/dbraw/zinc/45/10/13/567451013.db2.gz PRBVAULSRLCDLA-UHFFFAOYSA-N 0 3 389.284 3.414 10 0 GGAEHN O=C(c1cc2c(s1)CCNC2)N1CCOc2cccc(Br)c2C1 ZINC000662583782 567451680 /nfs/dbraw/zinc/45/16/80/567451680.db2.gz JXDZWETXFKOXHY-UHFFFAOYSA-N 0 3 393.306 3.191 10 0 GGAEHN CC1(N2CCOCC2)CCN(CCOc2ccc(Br)cc2)CC1 ZINC000528730494 567451674 /nfs/dbraw/zinc/45/16/74/567451674.db2.gz LZFOIJSYXIJSHP-UHFFFAOYSA-N 0 3 383.330 3.015 10 0 GGAEHN CC1(N2CCOCC2)CCN(Cc2cn3cc(Cl)cc(Cl)c3n2)CC1 ZINC000528726590 567451731 /nfs/dbraw/zinc/45/17/31/567451731.db2.gz FCBIYUIVYAAPOG-UHFFFAOYSA-N 0 3 383.323 3.328 10 0 GGAEHN C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1NCC(=O)Nc1c(F)cc(F)cc1Br ZINC000528757963 567453268 /nfs/dbraw/zinc/45/32/68/567453268.db2.gz DFCKSMSHINLXPC-FJBRNLEUSA-N 0 3 377.229 3.067 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)N1CCc2ccc(Cl)c(Cl)c2C1 ZINC000662627932 567453505 /nfs/dbraw/zinc/45/35/05/567453505.db2.gz LORZTCSKTABQNR-CRFBAAHOSA-N 0 3 383.319 3.411 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)N1CCc2ccc(Cl)c(Cl)c2C1 ZINC000662627933 567454149 /nfs/dbraw/zinc/45/41/49/567454149.db2.gz LORZTCSKTABQNR-NRXGSXMXSA-N 0 3 383.319 3.411 10 0 GGAEHN CN(C)C[C@@H](NC[C@@H]1CCCS(=O)(=O)C1)c1ccc(Cl)c(Cl)c1 ZINC000528770530 567454410 /nfs/dbraw/zinc/45/44/10/567454410.db2.gz XQBNSSFWCFYOPE-BLLLJJGKSA-N 0 3 379.353 3.011 10 0 GGAEHN CN(C)C[C@@H](NC[C@H]1CCCS(=O)(=O)C1)c1ccc(Cl)c(Cl)c1 ZINC000528770536 567454559 /nfs/dbraw/zinc/45/45/59/567454559.db2.gz XQBNSSFWCFYOPE-MLGOLLRUSA-N 0 3 379.353 3.011 10 0 GGAEHN COC(=O)c1cnc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)c(Cl)c1 ZINC000594031925 567454682 /nfs/dbraw/zinc/45/46/82/567454682.db2.gz QROBFZCTXVTBKC-UWVGGRQHSA-N 0 3 380.750 3.208 10 0 GGAEHN COc1cc(Br)ccc1CCCN1CC[C@H]2CC[C@@H](C1)[S@@]2=O ZINC000528782155 567454951 /nfs/dbraw/zinc/45/49/51/567454951.db2.gz HVEJQRRELODTLQ-ZMPRRUGASA-N 0 3 386.355 3.376 10 0 GGAEHN O=S(=O)(c1cccc(Br)c1)N1CCCC[C@@H](N2CCCC2)C1 ZINC000594044600 567455414 /nfs/dbraw/zinc/45/54/14/567455414.db2.gz RKKWYFLFNSTZMS-OAHLLOKOSA-N 0 3 387.343 3.088 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1cc(C)c(Br)c(Cl)c1 ZINC000550690977 567456925 /nfs/dbraw/zinc/45/69/25/567456925.db2.gz UMLNHSYGTZITIM-ZDUSSCGKSA-N 0 3 389.721 3.252 10 0 GGAEHN NC1(C(=O)NC[C@@H]2CCN(c3ccc(Br)cc3)C2)CC2(CCC2)C1 ZINC000662691122 567456905 /nfs/dbraw/zinc/45/69/05/567456905.db2.gz GGTDZNRBIRHHRM-AWEZNQCLSA-N 0 3 392.341 3.053 10 0 GGAEHN O=C(NC[C@H]1CCN(c2cccc(Br)c2)C1)C1(NC2CC2)CCC1 ZINC000662696077 567457806 /nfs/dbraw/zinc/45/78/06/567457806.db2.gz HXQHFQAZNVWJIZ-CQSZACIVSA-N 0 3 392.341 3.066 10 0 GGAEHN C[C@@]1(Br)C[C@@H]1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000528809617 567458015 /nfs/dbraw/zinc/45/80/15/567458015.db2.gz QKDCRHDYAZQDDE-SJLPKXTDSA-N 0 3 381.314 3.003 10 0 GGAEHN CC(C)[C@H](C(=O)NCc1ccc(I)cc1Cl)N(C)C ZINC000478502597 567463544 /nfs/dbraw/zinc/46/35/44/567463544.db2.gz POKKILVMFWKACJ-CYBMUJFWSA-N 0 3 394.684 3.147 10 0 GGAEHN NC1(C(=O)NC[C@@H]2CCN(c3cccc(Br)c3)C2)CC2(CCC2)C1 ZINC000662696064 567458188 /nfs/dbraw/zinc/45/81/88/567458188.db2.gz HPFFKZOFGGVUCD-AWEZNQCLSA-N 0 3 392.341 3.053 10 0 GGAEHN Cc1ccc2c(c1Br)CN(C(=O)[C@]1(N)[C@H]3CCCO[C@@H]3C1(C)C)C2 ZINC000662740102 567459061 /nfs/dbraw/zinc/45/90/61/567459061.db2.gz WREKYNJONYDRIL-URLQWDBASA-N 0 3 393.325 3.132 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2ccc(Br)cc2C)CC1 ZINC000478467666 567459498 /nfs/dbraw/zinc/45/94/98/567459498.db2.gz LHRGWBUDQUVCMX-UHFFFAOYSA-N 0 3 390.281 3.124 10 0 GGAEHN CCO[C@H]1C[C@@](N)(C(=O)N2Cc3ccc(C)c(Br)c3C2)C1(C)C ZINC000662737673 567459709 /nfs/dbraw/zinc/45/97/09/567459709.db2.gz APHRYUSHDORMJR-KBXCAEBGSA-N 0 3 381.314 3.132 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)CSc2ccc(Cl)cc2)CC1 ZINC000478461820 567459810 /nfs/dbraw/zinc/45/98/10/567459810.db2.gz QYILFTYJOSOXEJ-UHFFFAOYSA-N 0 3 377.897 3.185 10 0 GGAEHN O[C@@H](CNC[C@H]1COc2ccccc2O1)COc1ccc(Cl)c(Cl)c1 ZINC000641938789 567461015 /nfs/dbraw/zinc/46/10/15/567461015.db2.gz GOJKROIEBNDJTO-JSGCOSHPSA-N 0 3 384.259 3.163 10 0 GGAEHN CCN1CC[C@@H](N(C)C(=O)c2sc3c(c2Br)CNC3)C[C@@H]1C ZINC000662743909 567461148 /nfs/dbraw/zinc/46/11/48/567461148.db2.gz WZXTUZKPQNZWEZ-WDEREUQCSA-N 0 3 386.359 3.059 10 0 GGAEHN COc1ccccc1[C@H]1[C@@H](N)CCCN1C(=O)c1coc(Br)c1 ZINC000457367711 567461401 /nfs/dbraw/zinc/46/14/01/567461401.db2.gz XQXVFFUWTKJQHJ-BBRMVZONSA-N 0 3 379.254 3.355 10 0 GGAEHN COc1cccc2nc(NC(=O)NCC3(SC)CCN(C)CC3)sc21 ZINC000594154822 567462924 /nfs/dbraw/zinc/46/29/24/567462924.db2.gz XTCKDPLCPTZBSD-UHFFFAOYSA-N 0 3 380.539 3.254 10 0 GGAEHN Cn1cc(CCN2CCC[C@@H]2c2ccccc2I)cn1 ZINC000503093344 567467973 /nfs/dbraw/zinc/46/79/73/567467973.db2.gz IIDSVYSSGGRQIF-MRXNPFEDSA-N 0 3 381.261 3.404 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NCc1ccccc1OC(F)F ZINC000550886281 567468231 /nfs/dbraw/zinc/46/82/31/567468231.db2.gz NQMNCFZWNGJHSO-LLVKDONJSA-N 0 3 387.224 3.391 10 0 GGAEHN O=C([N-]c1ccc(F)c(Br)c1F)c1cc(C2CC[NH2+]CC2)no1 ZINC000662921039 567469153 /nfs/dbraw/zinc/46/91/53/567469153.db2.gz GXBNFLBZKPJBAB-UHFFFAOYSA-N 0 3 386.196 3.435 10 0 GGAEHN CS[C@@H]1CN(C(=O)C[C@H]2OCc3cc(Cl)ccc32)C[C@@H]1N1CCCC1 ZINC000594339531 567469555 /nfs/dbraw/zinc/46/95/55/567469555.db2.gz QHGIFNJHHWJCRA-RCCFBDPRSA-N 0 3 380.941 3.340 10 0 GGAEHN CC(C)N1CCN(c2cccc(NC(=O)[C@H]3C[C@@]3(C)Br)c2)CC1 ZINC000528944498 567470986 /nfs/dbraw/zinc/47/09/86/567470986.db2.gz NFSWGZPGQBYVDZ-SJLPKXTDSA-N 0 3 380.330 3.329 10 0 GGAEHN COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H]2C[C@]2(C)Br)cc1 ZINC000528946433 567471088 /nfs/dbraw/zinc/47/10/88/567471088.db2.gz UIGNTBWTHHUVAO-RYRKJORJSA-N 0 3 381.314 3.122 10 0 GGAEHN C[C@H]1OC(C)(C)N[C@@H]1CNC(=O)Nc1cc(-c2ccc(Cl)s2)nn1C ZINC000570262764 567471898 /nfs/dbraw/zinc/47/18/98/567471898.db2.gz AKYBZFTWNRXJMQ-MWLCHTKSSA-N 0 3 383.905 3.037 10 0 GGAEHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)c1cc(Br)cc2[nH]cnc21 ZINC000503183376 567472721 /nfs/dbraw/zinc/47/27/21/567472721.db2.gz UXCRHRHDEXWCKM-RYUDHWBXSA-N 0 3 379.302 3.176 10 0 GGAEHN CC(=O)c1cccc(OC[C@@H](O)CNCc2cc(F)cc(Br)c2)c1 ZINC000551007859 567472778 /nfs/dbraw/zinc/47/27/78/567472778.db2.gz ODTZHUPNHUOPHH-KRWDZBQOSA-N 0 3 396.256 3.320 10 0 GGAEHN CC(=O)NCCN(Cc1ccc(Br)s1)C[C@@H]1CCO[C@@H](C)C1 ZINC000503248352 567476572 /nfs/dbraw/zinc/47/65/72/567476572.db2.gz YVQDEJLTEJPFNW-GXTWGEPZSA-N 0 3 389.359 3.264 10 0 GGAEHN CSCC[C@H](N)C(=O)N1CCN(c2cc(Cl)c(Cl)c(Cl)c2)CC1 ZINC000594456186 567477213 /nfs/dbraw/zinc/47/72/13/567477213.db2.gz XWEADDVDJZXPIN-ZDUSSCGKSA-N 0 3 396.771 3.376 10 0 GGAEHN O=C(NCCN1CCc2ccccc2C1)c1cc(Br)cc2nc[nH]c21 ZINC000503284822 567478454 /nfs/dbraw/zinc/47/84/54/567478454.db2.gz JMYIMBJFROQZPH-UHFFFAOYSA-N 0 3 399.292 3.114 10 0 GGAEHN C[C@H]1CC[C@@H](NCC(=O)Nc2ccc(I)cc2)CS1 ZINC000594503729 567482154 /nfs/dbraw/zinc/48/21/54/567482154.db2.gz IOWDWBRUXVZVDF-GXFFZTMASA-N 0 3 390.290 3.103 10 0 GGAEHN Cc1cc(F)cc(Br)c1OCC(=O)NC1CCN(C2CC2)CC1 ZINC000478828244 567485883 /nfs/dbraw/zinc/48/58/83/567485883.db2.gz PPPPOCNJXGTVOP-UHFFFAOYSA-N 0 3 385.277 3.018 10 0 GGAEHN CCCN1CC[C@H](NC(=O)c2cc(C)n(-c3ccc(Br)cc3)n2)C1 ZINC000619901794 567486624 /nfs/dbraw/zinc/48/66/24/567486624.db2.gz ZJCAQJHNVQKLKT-HNNXBMFYSA-N 0 3 391.313 3.157 10 0 GGAEHN C[C@@H](CNC(=O)N[C@H]1CCOc2c(Br)cccc21)N(C)C1CC1 ZINC000570464235 567487834 /nfs/dbraw/zinc/48/78/34/567487834.db2.gz OKIRZOHIHHOQIO-NHYWBVRUSA-N 0 3 382.302 3.055 10 0 GGAEHN C[C@H](CNC(=O)N[C@H]1CCOc2c(Br)cccc21)N(C)C1CC1 ZINC000570464233 567488088 /nfs/dbraw/zinc/48/80/88/567488088.db2.gz OKIRZOHIHHOQIO-ABAIWWIYSA-N 0 3 382.302 3.055 10 0 GGAEHN COC[C@](C)(CCO)NCc1cc(Br)c(C)c(Br)c1 ZINC000551244182 567492301 /nfs/dbraw/zinc/49/23/01/567492301.db2.gz ALHBNOVSYIHAQN-AWEZNQCLSA-N 0 3 395.135 3.397 10 0 GGAEHN C[C@H]1C[C@@H](c2nc(-c3cn4ccc(Br)cc4n3)no2)CCN1C ZINC000643119734 567493264 /nfs/dbraw/zinc/49/32/64/567493264.db2.gz KRWQNPCNWLLMLO-QWRGUYRKSA-N 0 3 376.258 3.345 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NC[C@@H]1CCC2(CCCCC2)O1 ZINC000551278346 567493680 /nfs/dbraw/zinc/49/36/80/567493680.db2.gz PZRMZICHQOJMSM-ZBFHGGJFSA-N 0 3 383.330 3.471 10 0 GGAEHN CCOC(=O)[C@@H]1CC[C@H](NCc2cc(Br)c3c(c2)OCCO3)C1 ZINC000437353274 567493635 /nfs/dbraw/zinc/49/36/35/567493635.db2.gz PPWVEVRMCVWADX-OLZOCXBDSA-N 0 3 384.270 3.042 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2sc(C)cc2Br)CC1 ZINC000457794637 567493738 /nfs/dbraw/zinc/49/37/38/567493738.db2.gz XGAGBQQYEBCLNR-UHFFFAOYSA-N 0 3 396.310 3.185 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NC[C@H]1CCC2(CCCCC2)O1 ZINC000551278343 567493817 /nfs/dbraw/zinc/49/38/17/567493817.db2.gz PZRMZICHQOJMSM-GDBMZVCRSA-N 0 3 383.330 3.471 10 0 GGAEHN CCN1CCCC[C@@H]1CNC(=O)Cc1c(F)ccc(Br)c1F ZINC000503644926 567499666 /nfs/dbraw/zinc/49/96/66/567499666.db2.gz ALNSENYFEORVPG-LLVKDONJSA-N 0 3 375.257 3.260 10 0 GGAEHN C[C@H](c1ccccc1)[C@@H](O)CNC[C@H](O)COc1c(Cl)cccc1Cl ZINC000663380776 567502057 /nfs/dbraw/zinc/50/20/57/567502057.db2.gz ZPOAEDAHPQVZLT-XUWXXGDYSA-N 0 3 384.303 3.487 10 0 GGAEHN C[C@@H](O)[C@@H](NCCC(=O)Nc1ccc(Br)cc1)c1ccccc1 ZINC000663374686 567502751 /nfs/dbraw/zinc/50/27/51/567502751.db2.gz DYDNMUQIPPZKPO-FZKQIMNGSA-N 0 3 377.282 3.489 10 0 GGAEHN CC(C)N1CC[C@H](NC(=O)C(N)C(F)(F)F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000570680068 567505312 /nfs/dbraw/zinc/50/53/12/567505312.db2.gz IYPYZTIPMZQXGH-MELADBBJSA-N 0 3 381.801 3.009 10 0 GGAEHN CC(C)N1CC[C@H](NC(=O)C(N)C(F)(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000570680070 567505590 /nfs/dbraw/zinc/50/55/90/567505590.db2.gz IYPYZTIPMZQXGH-MJBXVCDLSA-N 0 3 381.801 3.009 10 0 GGAEHN O=C(CCN1CC[C@@H](Oc2ccncc2)C1)Nc1ccccc1Br ZINC000570683166 567505656 /nfs/dbraw/zinc/50/56/56/567505656.db2.gz BOOMQEZBWSWCOT-OAHLLOKOSA-N 0 3 390.281 3.326 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)N[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000437728693 567506556 /nfs/dbraw/zinc/50/65/56/567506556.db2.gz FDBQCPGSMWMXTJ-GRDNDAEWSA-N 0 3 386.323 3.259 10 0 GGAEHN CC(C)N1CC[C@H](N(C)C(=O)N[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000457937938 567507299 /nfs/dbraw/zinc/50/72/99/567507299.db2.gz PEPJLLKHTSQFJQ-HOCLYGCPSA-N 0 3 396.329 3.397 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NCc1cnccc1C(F)(F)F ZINC000663470876 567510211 /nfs/dbraw/zinc/51/02/11/567510211.db2.gz NTULMNRUMUPCCA-SNVBAGLBSA-N 0 3 390.203 3.203 10 0 GGAEHN CC(C)Oc1ccc([C@H](CNC(=O)[C@@H]2C[C@@]2(C)Br)N(C)C)cc1 ZINC000529392702 567511189 /nfs/dbraw/zinc/51/11/89/567511189.db2.gz PCLDCYRKERNJSG-XYJFISCASA-N 0 3 383.330 3.366 10 0 GGAEHN CN(C)C[C@H](NC(=O)N1C[C@H]2CCC[C@@H](C1)N2)c1ccc(Cl)c(Cl)c1 ZINC000529387952 567511475 /nfs/dbraw/zinc/51/14/75/567511475.db2.gz QWFFPQKMRQUQGK-VBQJREDUSA-N 0 3 385.339 3.132 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1CC[C@@H](F)[C@H](N)C1 ZINC000663505037 567512489 /nfs/dbraw/zinc/51/24/89/567512489.db2.gz GRHUMRKTTSDHPH-IAGOWNOFSA-N 0 3 381.293 3.123 10 0 GGAEHN C[C@H](Oc1ccccc1Br)C(=O)N1CCc2ccccc2[C@H]1CN ZINC000570801883 567515106 /nfs/dbraw/zinc/51/51/06/567515106.db2.gz GMPDRHQBSVJPJR-SUMWQHHRSA-N 0 3 389.293 3.301 10 0 GGAEHN C[C@@H](Oc1ccccc1Br)C(=O)N1CCc2ccccc2[C@H]1CN ZINC000570801880 567515587 /nfs/dbraw/zinc/51/55/87/567515587.db2.gz GMPDRHQBSVJPJR-CXAGYDPISA-N 0 3 389.293 3.301 10 0 GGAEHN C[C@@H](CNC(=O)c1cc(Br)cc2[nH]cnc21)N1CCC[C@H](C)C1 ZINC000503975998 567516348 /nfs/dbraw/zinc/51/63/48/567516348.db2.gz ZPESLIYYGXJIMM-RYUDHWBXSA-N 0 3 379.302 3.176 10 0 GGAEHN C[C@H](CN1CCCCC1)NC(=O)Cc1c(F)ccc(Br)c1F ZINC000503992943 567518307 /nfs/dbraw/zinc/51/83/07/567518307.db2.gz WLOOEJAAJHGZLL-LLVKDONJSA-N 0 3 375.257 3.260 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NCc1cccc(N2CCOCC2)n1 ZINC000479283175 567522830 /nfs/dbraw/zinc/52/28/30/567522830.db2.gz JCWLZCZFPDWDLD-OAHLLOKOSA-N 0 3 390.325 3.402 10 0 GGAEHN NC(=O)[C@@H]1CCC[C@@H](NCc2cc(Cl)ccc2I)C1 ZINC000594923117 567524938 /nfs/dbraw/zinc/52/49/38/567524938.db2.gz SKLDLZMLNPMBMI-BXKDBHETSA-N 0 3 392.668 3.078 10 0 GGAEHN NC(=O)[C@H]1CCC[C@H](NCc2cc(Cl)ccc2I)C1 ZINC000594923118 567525118 /nfs/dbraw/zinc/52/51/18/567525118.db2.gz SKLDLZMLNPMBMI-CABZTGNLSA-N 0 3 392.668 3.078 10 0 GGAEHN CC[C@@H](Cc1ccccc1Br)NC(=O)N1CCN2CCC1CC2 ZINC000551644164 567525979 /nfs/dbraw/zinc/52/59/79/567525979.db2.gz KKIBMWRCVJWMBL-HNNXBMFYSA-N 0 3 380.330 3.260 10 0 GGAEHN O=C(NCCCc1ccc(Br)cc1F)N1CCN2CCC1CC2 ZINC000551655430 567527138 /nfs/dbraw/zinc/52/71/38/567527138.db2.gz HJQZHGZHRIDTBD-UHFFFAOYSA-N 0 3 384.293 3.010 10 0 GGAEHN Clc1ccc(I)c(CN[C@@H]2CCc3nc[nH]c3C2)c1 ZINC000594943192 567527512 /nfs/dbraw/zinc/52/75/12/567527512.db2.gz ICAHHYXHLQYETM-LLVKDONJSA-N 0 3 387.652 3.315 10 0 GGAEHN Clc1ccc(I)c(CN[C@@H]2CCc3[nH]cnc3C2)c1 ZINC000594943192 567527517 /nfs/dbraw/zinc/52/75/17/567527517.db2.gz ICAHHYXHLQYETM-LLVKDONJSA-N 0 3 387.652 3.315 10 0 GGAEHN Cc1c(Br)cncc1CNCC1(C(=O)OC(C)(C)C)CCOCC1 ZINC000594949959 567529429 /nfs/dbraw/zinc/52/94/29/567529429.db2.gz JMFZAGFLECCWEF-UHFFFAOYSA-N 0 3 399.329 3.381 10 0 GGAEHN COC[C@@H](CCNCc1cc(Cl)ccc1I)OC ZINC000594954567 567529436 /nfs/dbraw/zinc/52/94/36/567529436.db2.gz HWCNZKBGKAHVJN-GFCCVEGCSA-N 0 3 383.657 3.086 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000594977095 567530316 /nfs/dbraw/zinc/53/03/16/567530316.db2.gz YCNPUXKLDKELRR-SUMWQHHRSA-N 0 3 380.330 3.164 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000594977093 567530864 /nfs/dbraw/zinc/53/08/64/567530864.db2.gz YCNPUXKLDKELRR-DYVFJYSZSA-N 0 3 380.330 3.164 10 0 GGAEHN Cc1cc(Br)cc(C)c1CNC(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000594979418 567530897 /nfs/dbraw/zinc/53/08/97/567530897.db2.gz CYZZRMOCJXCNMD-INIZCTEOSA-N 0 3 380.330 3.349 10 0 GGAEHN Cn1ncc(Cl)c1CNCCc1ccc(I)cc1 ZINC000594995775 567532413 /nfs/dbraw/zinc/53/24/13/567532413.db2.gz KGWQBHVXVNGTRA-UHFFFAOYSA-N 0 3 375.641 3.010 10 0 GGAEHN CCN(C(=O)N[C@@H]1CCOc2ccc(Br)cc21)[C@H]1CCN(CC)C1 ZINC000663786596 567530889 /nfs/dbraw/zinc/53/08/89/567530889.db2.gz IURUIHWXFPCLAT-GOEBONIOSA-N 0 3 396.329 3.398 10 0 GGAEHN CCNC(=O)C[C@H]1CCCCN1C[C@H](O)COc1cc(Cl)ccc1Cl ZINC000551718521 567531867 /nfs/dbraw/zinc/53/18/67/567531867.db2.gz GWAKBGNLRYTKIC-CABCVRRESA-N 0 3 389.323 3.114 10 0 GGAEHN CCN(C(=O)NCCc1cc(Br)ccc1F)[C@@H]1CCN(CC)C1 ZINC000663826819 567534745 /nfs/dbraw/zinc/53/47/45/567534745.db2.gz URTUASZQEOTEQK-OAHLLOKOSA-N 0 3 386.309 3.256 10 0 GGAEHN C[C@@H](CSCCF)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O ZINC000595016916 567535487 /nfs/dbraw/zinc/53/54/87/567535487.db2.gz AWYBPXIJYMLGGS-WFASDCNBSA-N 0 3 376.444 3.464 10 0 GGAEHN COc1c(Br)cccc1CNC[C@H](Cc1ccc(F)cc1)C(N)=O ZINC000479441384 567535669 /nfs/dbraw/zinc/53/56/69/567535669.db2.gz UDMVILVWWUXRAM-AWEZNQCLSA-N 0 3 395.272 3.031 10 0 GGAEHN CC1(C)OC[C@H]2C[C@]21NCc1cc(Br)cc(Br)c1N ZINC000529645995 567538100 /nfs/dbraw/zinc/53/81/00/567538100.db2.gz VLMIDCUCEJPAJK-OTYXRUKQSA-N 0 3 390.119 3.451 10 0 GGAEHN C[C@@H](CSCCF)N[C@H]1CCN(c2cccc(Br)c2)C1=O ZINC000595049081 567538806 /nfs/dbraw/zinc/53/88/06/567538806.db2.gz UJYWWNDASYISOQ-FZMZJTMJSA-N 0 3 375.307 3.235 10 0 GGAEHN C[C@H](CCc1ccc(I)cc1)N[C@@H]1C[C@@H](C)n2ncnc21 ZINC000595065632 567540168 /nfs/dbraw/zinc/54/01/68/567540168.db2.gz ISQPNSAKPQMLNB-LALPHHSUSA-N 0 3 396.276 3.499 10 0 GGAEHN FC1(F)C[C@H]1OCCN[C@H]1CCc2ccc(I)cc21 ZINC000595067000 567540619 /nfs/dbraw/zinc/54/06/19/567540619.db2.gz DGMDVJWWIZHYEE-QWHCGFSZSA-N 0 3 379.188 3.292 10 0 GGAEHN FC1(F)C[C@@H]1OCCN[C@H]1CCc2ccc(I)cc21 ZINC000595067001 567540930 /nfs/dbraw/zinc/54/09/30/567540930.db2.gz DGMDVJWWIZHYEE-STQMWFEESA-N 0 3 379.188 3.292 10 0 GGAEHN FC1(F)C[C@@H]1OCCN[C@@H]1CCc2ccc(I)cc21 ZINC000595066999 567541113 /nfs/dbraw/zinc/54/11/13/567541113.db2.gz DGMDVJWWIZHYEE-OLZOCXBDSA-N 0 3 379.188 3.292 10 0 GGAEHN CCN(C(=O)NCC(C)(C)c1cccc(Br)c1)[C@H]1CCN(C)C1 ZINC000663915893 567541334 /nfs/dbraw/zinc/54/13/34/567541334.db2.gz PFXFYAILRQIHGM-INIZCTEOSA-N 0 3 382.346 3.462 10 0 GGAEHN CCSC1(CN[C@@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)CC1 ZINC000595092607 567542044 /nfs/dbraw/zinc/54/20/44/567542044.db2.gz LXBAWRNJPKQBLK-JTQLQIEISA-N 0 3 393.372 3.033 10 0 GGAEHN CCN(C(=O)NCc1ccc(OC)c(Br)c1)[C@@H]1CCN(CC)C1 ZINC000663916709 567542001 /nfs/dbraw/zinc/54/20/01/567542001.db2.gz WVRFULZHQOHOFA-CQSZACIVSA-N 0 3 384.318 3.083 10 0 GGAEHN O=C(CNC1(c2ccc(Cl)c(Cl)c2)CC1)NC1CCN(C2CC2)CC1 ZINC000438740472 567542634 /nfs/dbraw/zinc/54/26/34/567542634.db2.gz OHQWRFKBSSCRQW-UHFFFAOYSA-N 0 3 382.335 3.315 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N[C@H](CO)c1ccc(Br)cc1 ZINC000504695467 567544328 /nfs/dbraw/zinc/54/43/28/567544328.db2.gz PCGYEWGPRCJFHF-CKEIUWERSA-N 0 3 398.345 3.045 10 0 GGAEHN C[C@@H](Sc1ccc(Br)cc1)C(=O)N[C@H]1CNCCC1(F)F ZINC000571207142 567546578 /nfs/dbraw/zinc/54/65/78/567546578.db2.gz OZHUCJWPNPUSPH-SKDRFNHKSA-N 0 3 379.270 3.043 10 0 GGAEHN Brc1csc2cnc(N3CCC(N4CCCOCC4)CC3)nc12 ZINC000664009039 567549033 /nfs/dbraw/zinc/54/90/33/567549033.db2.gz QTTMDUCIUDOGOI-UHFFFAOYSA-N 0 3 397.342 3.145 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1ccc(Br)c(F)c1 ZINC000620915308 567549903 /nfs/dbraw/zinc/54/99/03/567549903.db2.gz HXBHIMQUSDQBHV-CQSZACIVSA-N 0 3 399.304 3.304 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1ccc(F)cc1Br ZINC000620914486 567549915 /nfs/dbraw/zinc/54/99/15/567549915.db2.gz PZUUCJPROLDPGH-AWEZNQCLSA-N 0 3 399.304 3.304 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N2C[C@@H](C)N[C@@H](CC)C2)cc1OC ZINC000620907179 567550190 /nfs/dbraw/zinc/55/01/90/567550190.db2.gz GWPQNEAXABJDTH-YPMHNXCESA-N 0 3 385.302 3.069 10 0 GGAEHN Cc1oc(Br)cc1C(=O)N1CC2(CCCC2)OC[C@@H]1CN(C)C ZINC000620917760 567550231 /nfs/dbraw/zinc/55/02/31/567550231.db2.gz MRJHCBAGAORKAS-ZDUSSCGKSA-N 0 3 385.302 3.066 10 0 GGAEHN NC1(C(=O)Nc2cc(F)c(I)c(F)c2)CC2(CCC2)C1 ZINC000595248833 567550143 /nfs/dbraw/zinc/55/01/43/567550143.db2.gz IHHDYKVAWNBOJN-UHFFFAOYSA-N 0 3 392.187 3.170 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1cccc(F)c1Br ZINC000620907552 567550369 /nfs/dbraw/zinc/55/03/69/567550369.db2.gz SQAVOUHKGNFHIB-CYBMUJFWSA-N 0 3 399.304 3.304 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1sccc1Br ZINC000620914639 567550465 /nfs/dbraw/zinc/55/04/65/567550465.db2.gz UAXYRUNPVQNCOX-LBPRGKRZSA-N 0 3 387.343 3.226 10 0 GGAEHN Cc1nc(NC(=O)C[C@@H]2NCc3ccccc32)ccc1I ZINC000595252159 567550324 /nfs/dbraw/zinc/55/03/24/567550324.db2.gz BBVHFUJEDHDIBN-AWEZNQCLSA-N 0 3 393.228 3.168 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1ccccc1Br ZINC000620917470 567550646 /nfs/dbraw/zinc/55/06/46/567550646.db2.gz JKGIGIVFBDQCQN-AWEZNQCLSA-N 0 3 381.314 3.165 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1cscc1Br ZINC000620911453 567550845 /nfs/dbraw/zinc/55/08/45/567550845.db2.gz GCRSQTFKBRXSIT-LBPRGKRZSA-N 0 3 387.343 3.226 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1ccc(Br)s1 ZINC000620917476 567551012 /nfs/dbraw/zinc/55/10/12/567551012.db2.gz JNOSELHELVLATF-GFCCVEGCSA-N 0 3 387.343 3.226 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1ccsc1Br ZINC000620917884 567551092 /nfs/dbraw/zinc/55/10/92/567551092.db2.gz BHJQPSCBJNDITM-GFCCVEGCSA-N 0 3 387.343 3.226 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1ccccc1Br ZINC000620917471 567551102 /nfs/dbraw/zinc/55/11/02/567551102.db2.gz JKGIGIVFBDQCQN-CQSZACIVSA-N 0 3 381.314 3.165 10 0 GGAEHN CC[C@@H]1CN(C(=O)c2nc(C)n(-c3c(Cl)cccc3Cl)n2)C[C@H](C)N1 ZINC000620904499 567551154 /nfs/dbraw/zinc/55/11/54/567551154.db2.gz OPFOIYOMNUUHJO-CMPLNLGQSA-N 0 3 382.295 3.095 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1cccc(Br)c1F ZINC000620912301 567551164 /nfs/dbraw/zinc/55/11/64/567551164.db2.gz OBSXWQVHNKEJAL-ZDUSSCGKSA-N 0 3 399.304 3.304 10 0 GGAEHN C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)NC1COCCOC1 ZINC000644422300 567552314 /nfs/dbraw/zinc/55/23/14/567552314.db2.gz NXXHKAQKFACPEO-JTQLQIEISA-N 0 3 380.794 3.081 10 0 GGAEHN CCN(C(=O)NCC1(c2cccc(Br)c2)CC1)[C@@H]1CCN(C)C1 ZINC000664136712 567553782 /nfs/dbraw/zinc/55/37/82/567553782.db2.gz VEGFCGNJOAQIPJ-MRXNPFEDSA-N 0 3 380.330 3.216 10 0 GGAEHN C[C@H](N[C@@H](CO)c1cccc(Br)c1)c1ccccc1-n1ccnn1 ZINC000552063085 567555080 /nfs/dbraw/zinc/55/50/80/567555080.db2.gz OPEHSEHPHLHUCE-GUYCJALGSA-N 0 3 387.281 3.414 10 0 GGAEHN CCN(C(=O)NCC1(c2ccccc2Br)CC1)[C@H]1CCN(C)C1 ZINC000664208661 567557392 /nfs/dbraw/zinc/55/73/92/567557392.db2.gz NGDOSCKGVOQVQB-AWEZNQCLSA-N 0 3 380.330 3.216 10 0 GGAEHN C[C@@H](COc1ccc2cc(Br)ccc2c1)NC1COCCOC1 ZINC000644552053 567558275 /nfs/dbraw/zinc/55/82/75/567558275.db2.gz CVVSMWLJSQIGJC-ZDUSSCGKSA-N 0 3 380.282 3.375 10 0 GGAEHN Cc1cnc(NCc2ccc(CN3CC[C@H](O)C3)cc2)c(Br)c1 ZINC000664238131 567558587 /nfs/dbraw/zinc/55/85/87/567558587.db2.gz WPECHHDGVHIADA-INIZCTEOSA-N 0 3 376.298 3.331 10 0 GGAEHN COc1ccc2c(c1)[C@H](NC[C@@H]1CCCCN1S(C)(=O)=O)CCCS2 ZINC000552097015 567559460 /nfs/dbraw/zinc/55/94/60/567559460.db2.gz PZRAJWSXBWXQGX-WMLDXEAASA-N 0 3 384.567 3.026 10 0 GGAEHN CSc1cc(NCc2ccc(CN3CC[C@@H](O)C3)cc2)nc(SC)n1 ZINC000664236331 567559528 /nfs/dbraw/zinc/55/95/28/567559528.db2.gz KBMPCBODDOQLNF-OAHLLOKOSA-N 0 3 376.551 3.099 10 0 GGAEHN O=c1[nH]c2c(cc1CNC[C@@H](O)COc1c(Cl)cccc1Cl)CCC2 ZINC000644564231 567559959 /nfs/dbraw/zinc/55/99/59/567559959.db2.gz FXIGGIOWFVMLMZ-CYBMUJFWSA-N 0 3 383.275 3.112 10 0 GGAEHN CC(=O)Nc1ccccc1CNC[C@H](O)COc1c(Cl)cccc1Cl ZINC000644574689 567561265 /nfs/dbraw/zinc/56/12/65/567561265.db2.gz ATLNVUXQUWXCBS-AWEZNQCLSA-N 0 3 383.275 3.481 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCC1)c1ccc(I)cc1 ZINC000530031371 567561277 /nfs/dbraw/zinc/56/12/77/567561277.db2.gz HOPUICLZIHVXJK-HNNXBMFYSA-N 0 3 384.261 3.038 10 0 GGAEHN COc1ccc(Br)c(CC(=O)NC[C@H]2CCN2C2CCCC2)c1 ZINC000530023091 567561455 /nfs/dbraw/zinc/56/14/55/567561455.db2.gz LXEAFOVGPXGHSV-OAHLLOKOSA-N 0 3 381.314 3.133 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCC1)c1cc(Br)cc2[nH]cnc21 ZINC000530028135 567561795 /nfs/dbraw/zinc/56/17/95/567561795.db2.gz NXJROOCXEWDREN-ZDUSSCGKSA-N 0 3 377.286 3.072 10 0 GGAEHN Cc1c(I)cccc1C(=O)NC[C@@H]1CCN1C1CCCC1 ZINC000530022214 567562054 /nfs/dbraw/zinc/56/20/54/567562054.db2.gz DGGSRYIHGJVYSN-AWEZNQCLSA-N 0 3 398.288 3.346 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCC1)[C@@H]1COc2ccc(Br)cc21 ZINC000530022632 567562184 /nfs/dbraw/zinc/56/21/84/567562184.db2.gz IRVXDYVYPCKJMU-GDBMZVCRSA-N 0 3 379.298 3.058 10 0 GGAEHN CCN(C[C@@H]1CCCN1CC)C(=O)c1cc2c(c(Br)c1)OCO2 ZINC000571431764 567562311 /nfs/dbraw/zinc/56/23/11/567562311.db2.gz FQYUNNLTGPPBBL-ZDUSSCGKSA-N 0 3 383.286 3.124 10 0 GGAEHN C[C@H](Oc1ccccc1Br)C(=O)NC[C@@H]1CCN1C1CCCC1 ZINC000530031088 567562251 /nfs/dbraw/zinc/56/22/51/567562251.db2.gz ZEUJPVWPPRTTPQ-ZFWWWQNUSA-N 0 3 381.314 3.350 10 0 GGAEHN C[C@@H](Oc1ccccc1Br)C(=O)NC[C@H]1CCN1C1CCCC1 ZINC000530031087 567562460 /nfs/dbraw/zinc/56/24/60/567562460.db2.gz ZEUJPVWPPRTTPQ-UKRRQHHQSA-N 0 3 381.314 3.350 10 0 GGAEHN COc1cc(C[NH2+]C[C@H](O)[C@H](C)c2ccccc2)cc(Br)c1[O-] ZINC000644601352 567562739 /nfs/dbraw/zinc/56/27/39/567562739.db2.gz BHWOOTZKUREKPT-WBMJQRKESA-N 0 3 380.282 3.418 10 0 GGAEHN COc1cc(C[NH2+]C[C@@H](O)[C@H](C)c2ccccc2)cc(Br)c1[O-] ZINC000644601351 567562981 /nfs/dbraw/zinc/56/29/81/567562981.db2.gz BHWOOTZKUREKPT-MLGOLLRUSA-N 0 3 380.282 3.418 10 0 GGAEHN CN(C)C[C@@H](NC(=O)[C@@H]1CCc2nc[nH]c2C1)c1ccc(Cl)c(Cl)c1 ZINC000530032140 567563433 /nfs/dbraw/zinc/56/34/33/567563433.db2.gz FSLLOWKKHDFRJD-SJKOYZFVSA-N 0 3 381.307 3.241 10 0 GGAEHN CN(C)C[C@@H](NC(=O)[C@@H]1CCc2[nH]cnc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530032140 567563439 /nfs/dbraw/zinc/56/34/39/567563439.db2.gz FSLLOWKKHDFRJD-SJKOYZFVSA-N 0 3 381.307 3.241 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N(C)[C@@H]1CCN(C(C)C)C1 ZINC000458683721 567564389 /nfs/dbraw/zinc/56/43/89/567564389.db2.gz UDKQMFHCTLWMMP-OAHLLOKOSA-N 0 3 384.318 3.082 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N1CC[C@@]2(C1)CCCN(C)C2 ZINC000458679788 567564726 /nfs/dbraw/zinc/56/47/26/567564726.db2.gz QOASOUIMBSECFR-SFHVURJKSA-N 0 3 396.329 3.085 10 0 GGAEHN CC(C)[C@H]1CN(C(=O)c2cc(Br)cc(N3CCCC3)c2)CCN1 ZINC000621160593 567565151 /nfs/dbraw/zinc/56/51/51/567565151.db2.gz HQVFZNVYEHIQTE-QGZVFWFLSA-N 0 3 380.330 3.119 10 0 GGAEHN COc1cc(Br)ccc1CNC[C@@H](O)COCc1ccccc1F ZINC000644625793 567566155 /nfs/dbraw/zinc/56/61/55/567566155.db2.gz VDBNFGQKGMWCOD-MRXNPFEDSA-N 0 3 398.272 3.264 10 0 GGAEHN COc1cc(Br)ccc1CNC[C@@H](O)CN(C)Cc1ccccc1 ZINC000644625702 567566634 /nfs/dbraw/zinc/56/66/34/567566634.db2.gz KFIFNIWANCWDBO-GOSISDBHSA-N 0 3 393.325 3.040 10 0 GGAEHN COc1cc(Br)ccc1CNC[C@@H](O)COc1ccccc1F ZINC000644625637 567566822 /nfs/dbraw/zinc/56/68/22/567566822.db2.gz BUENUCSWHAEWRX-CQSZACIVSA-N 0 3 384.245 3.126 10 0 GGAEHN CC[C@H](CN1CCCC1)NC(=O)Cc1noc2ccc(Br)cc21 ZINC000644641276 567567820 /nfs/dbraw/zinc/56/78/20/567567820.db2.gz XBEMIFQVIYOQJN-CYBMUJFWSA-N 0 3 380.286 3.123 10 0 GGAEHN COC(=O)[C@](C)(O)CN1CCC(COc2cc(Cl)cc(Cl)c2)CC1 ZINC000571559834 567572221 /nfs/dbraw/zinc/57/22/21/567572221.db2.gz ZTYOWLSCUZJXKL-QGZVFWFLSA-N 0 3 376.280 3.008 10 0 GGAEHN CSC1(CNC(=O)N2CC[C@@H](C(F)(F)F)C(C)(C)C2)CCN(C)CC1 ZINC000571580453 567573265 /nfs/dbraw/zinc/57/32/65/567573265.db2.gz ZNZOGWMGBZIRAI-CYBMUJFWSA-N 0 3 381.508 3.434 10 0 GGAEHN CCN(C(=O)N[C@H](C)Cc1cc(Br)ccc1F)[C@H]1CCN(C)C1 ZINC000664527800 567573609 /nfs/dbraw/zinc/57/36/09/567573609.db2.gz WHIULBRXTNFVFC-DOMZBBRYSA-N 0 3 386.309 3.255 10 0 GGAEHN COC[C@@H](NCC[S@](=O)c1cc(Cl)ccc1Cl)C1CCOCC1 ZINC000595617603 567574207 /nfs/dbraw/zinc/57/42/07/567574207.db2.gz XGMVLHCJLVQUNJ-CMJOXMDJSA-N 0 3 380.337 3.132 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)N[C@@H]2C[C@H]2c2cccc(Br)c2)CCN1C ZINC000571600597 567574563 /nfs/dbraw/zinc/57/45/63/567574563.db2.gz QKJRVULWHSNNHN-ISWURRPUSA-N 0 3 380.330 3.429 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)CCCSc3ccc(Br)cc3)[C@H]2C1 ZINC000644812071 567579026 /nfs/dbraw/zinc/57/90/26/567579026.db2.gz CUMAPMFORNWAMW-CJNGLKHVSA-N 0 3 383.355 3.484 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3ccc(Br)c(C(F)(F)F)c3)[C@@H]2C1 ZINC000644812437 567579181 /nfs/dbraw/zinc/57/91/81/567579181.db2.gz CSRWSBKHOVXQHP-ZWNOBZJWSA-N 0 3 377.204 3.244 10 0 GGAEHN C[C@@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccc(Br)c(F)c1 ZINC000552333389 567579389 /nfs/dbraw/zinc/57/93/89/567579389.db2.gz CZTDWZDJJVXTJP-YPMHNXCESA-N 0 3 393.322 3.053 10 0 GGAEHN CC[C@@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccccc1OC(F)F ZINC000552333721 567579436 /nfs/dbraw/zinc/57/94/36/567579436.db2.gz MWKQBIYYCIGPEE-UKRRQHHQSA-N 0 3 376.469 3.143 10 0 GGAEHN O[C@H]1CCN(C2CCN(c3nc4c(cccc4Br)s3)CC2)C1 ZINC000621339970 567579734 /nfs/dbraw/zinc/57/97/34/567579734.db2.gz RPQDGBZAGZSAMW-LBPRGKRZSA-N 0 3 382.327 3.094 10 0 GGAEHN C[C@@H](NC(=O)N1CC[C@@H](N2CC=CC2)C1)c1ccc(F)c(Br)c1 ZINC000458858214 567579783 /nfs/dbraw/zinc/57/97/83/567579783.db2.gz SYKKXOXYBPSFAA-TZMCWYRMSA-N 0 3 382.277 3.305 10 0 GGAEHN CCN(C(=O)NCCCc1ccc(Br)cc1OC)[C@H]1CCN(C)C1 ZINC000664642320 567580046 /nfs/dbraw/zinc/58/00/46/567580046.db2.gz DWXZZEAMSUZVSH-INIZCTEOSA-N 0 3 398.345 3.126 10 0 GGAEHN CCN(C(=O)NCCCc1ccc(Br)cc1OC)[C@@H]1CCN(C)C1 ZINC000664642321 567580215 /nfs/dbraw/zinc/58/02/15/567580215.db2.gz DWXZZEAMSUZVSH-MRXNPFEDSA-N 0 3 398.345 3.126 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3cc(Br)cc(C(F)(F)F)c3)[C@H]2C1 ZINC000644813351 567580244 /nfs/dbraw/zinc/58/02/44/567580244.db2.gz BEGSXNXPKLXSBE-RNCFNFMXSA-N 0 3 377.204 3.244 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)c2cc(C(F)(F)F)ccc2Br)C1 ZINC000644821007 567580682 /nfs/dbraw/zinc/58/06/82/567580682.db2.gz GPHWWPUORRHVGT-ZANVPECISA-N 0 3 377.204 3.244 10 0 GGAEHN Cc1cc(SCC(=O)N2CC[C@H]3CN(C)C[C@H]32)c(C)cc1Br ZINC000644820136 567580907 /nfs/dbraw/zinc/58/09/07/567580907.db2.gz UQYMDEBRKXANCL-DZGCQCFKSA-N 0 3 383.355 3.321 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)Cc3csc4ccc(Br)cc34)[C@@H]2C1 ZINC000644820471 567581011 /nfs/dbraw/zinc/58/10/11/567581011.db2.gz WOHDBPHVFQCXPD-XHDPSFHLSA-N 0 3 379.323 3.369 10 0 GGAEHN CNC(=O)[C@@H](C)Oc1ccc(Br)cc1CNCC[C@H]1CC1(F)F ZINC000621377366 567580997 /nfs/dbraw/zinc/58/09/97/567580997.db2.gz WSIHISXBVSHIQR-PWSUYJOCSA-N 0 3 391.256 3.097 10 0 GGAEHN Cc1cc(C(=O)N2CC[C@H]3CN(C)C[C@@H]32)nn1-c1ccc(Cl)cc1Cl ZINC000644818376 567581170 /nfs/dbraw/zinc/58/11/70/567581170.db2.gz LVVRQLATAYIQLW-SJCJKPOMSA-N 0 3 379.291 3.264 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)c3csc(-c4ccc(Br)s4)n3)[C@@H]2C1 ZINC000644822369 567581385 /nfs/dbraw/zinc/58/13/85/567581385.db2.gz SCQMCNOVHYAWFY-GXSJLCMTSA-N 0 3 398.351 3.410 10 0 GGAEHN CCCOc1c(Br)cc(CN2CC[C@@H]3CN(C)C[C@H]32)cc1OC ZINC000644840508 567582466 /nfs/dbraw/zinc/58/24/66/567582466.db2.gz KPCFUZIRFAJLII-GDBMZVCRSA-N 0 3 383.330 3.382 10 0 GGAEHN CN(C)CCN(C)c1ccc(Br)cc1NC(=O)CCC(F)F ZINC000644834663 567582717 /nfs/dbraw/zinc/58/27/17/567582717.db2.gz MFZFRYOETFKFFZ-UHFFFAOYSA-N 0 3 378.261 3.431 10 0 GGAEHN O=C(NCCc1ccc(Br)cc1Cl)N1CC[C@@H](N2CC=CC2)C1 ZINC000458893608 567584826 /nfs/dbraw/zinc/58/48/26/567584826.db2.gz WMMWABSOGFAFFI-OAHLLOKOSA-N 0 3 398.732 3.301 10 0 GGAEHN O=C(NCCc1ccc(Br)cc1Cl)N1CC[C@H](N2CC=CC2)C1 ZINC000458893607 567585113 /nfs/dbraw/zinc/58/51/13/567585113.db2.gz WMMWABSOGFAFFI-HNNXBMFYSA-N 0 3 398.732 3.301 10 0 GGAEHN CCN(C(=O)N[C@H](C)c1ccc(Br)cc1OC)[C@@H]1CCN(C)C1 ZINC000664730153 567585284 /nfs/dbraw/zinc/58/52/84/567585284.db2.gz PUVKIWGIDJSKGD-TZMCWYRMSA-N 0 3 384.318 3.254 10 0 GGAEHN C[C@]1(CNC[C@@H](O)c2ccccc2Br)COc2ccccc2O1 ZINC000530234317 567585554 /nfs/dbraw/zinc/58/55/54/567585554.db2.gz ASPRXWJDNFJUQC-QAPCUYQASA-N 0 3 378.266 3.302 10 0 GGAEHN C[C@@]1(CNC[C@H](O)c2ccccc2Br)COc2ccccc2O1 ZINC000530234316 567586065 /nfs/dbraw/zinc/58/60/65/567586065.db2.gz ASPRXWJDNFJUQC-MAUKXSAKSA-N 0 3 378.266 3.302 10 0 GGAEHN CN1C(=O)c2ccccc2[C@@H]1CNC[C@@H](O)c1ccc(F)c(Br)c1 ZINC000530244895 567586096 /nfs/dbraw/zinc/58/60/96/567586096.db2.gz RAYMYJIUZNDJQO-DLBZAZTESA-N 0 3 393.256 3.038 10 0 GGAEHN CN(CCCN(C)C(=O)Cc1ccc(Br)cc1O)Cc1ccco1 ZINC000552390507 567586203 /nfs/dbraw/zinc/58/62/03/567586203.db2.gz CSQBYCLJLYVOBM-UHFFFAOYSA-N 0 3 395.297 3.271 10 0 GGAEHN C[C@]1(CNC[C@H](O)c2cccc(Br)c2)COc2ccccc2O1 ZINC000530236702 567586397 /nfs/dbraw/zinc/58/63/97/567586397.db2.gz WVAPQSQLCJXUTJ-YJBOKZPZSA-N 0 3 378.266 3.302 10 0 GGAEHN C[C@]1(CNC[C@@H](O)c2cccc(Br)c2)COc2ccccc2O1 ZINC000530236701 567586401 /nfs/dbraw/zinc/58/64/01/567586401.db2.gz WVAPQSQLCJXUTJ-QAPCUYQASA-N 0 3 378.266 3.302 10 0 GGAEHN CCC[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C(=O)N=c1[nH][n-]cc1Br ZINC000530264326 567587539 /nfs/dbraw/zinc/58/75/39/567587539.db2.gz BSYFUHRDJNDJAL-HUUCEWRRSA-N 0 3 391.313 3.081 10 0 GGAEHN CCC[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(=O)N=c1[nH][n-]cc1Br ZINC000530264326 567587545 /nfs/dbraw/zinc/58/75/45/567587545.db2.gz BSYFUHRDJNDJAL-HUUCEWRRSA-N 0 3 391.313 3.081 10 0 GGAEHN CN1C(=O)c2ccccc2[C@@H]1CNC[C@H](O)c1ccc(F)c(Br)c1 ZINC000530244904 567588015 /nfs/dbraw/zinc/58/80/15/567588015.db2.gz RAYMYJIUZNDJQO-IRXDYDNUSA-N 0 3 393.256 3.038 10 0 GGAEHN C[C@H](NC1CCN(CCC(F)(F)F)CC1)c1ncc(Br)cn1 ZINC000644895677 567588148 /nfs/dbraw/zinc/58/81/48/567588148.db2.gz QGRAXWHTFIGRNR-JTQLQIEISA-N 0 3 381.240 3.307 10 0 GGAEHN CCN(C(=O)N[C@@H]1CSc2ccc(Br)cc21)[C@H]1CCN(C)C1 ZINC000664773544 567588338 /nfs/dbraw/zinc/58/83/38/567588338.db2.gz UVFQCSDCJQMONX-GXTWGEPZSA-N 0 3 384.343 3.332 10 0 GGAEHN O=S1(=O)CC[C@H](NCCCc2ccccn2)c2cc(Br)ccc21 ZINC000480206317 567588508 /nfs/dbraw/zinc/58/85/08/567588508.db2.gz ZOSRQUNOEFJUHQ-INIZCTEOSA-N 0 3 395.322 3.285 10 0 GGAEHN COC[C@@H](NC[C@H](O)COc1cc(F)cc(Br)c1)c1ccccc1 ZINC000439459966 567589014 /nfs/dbraw/zinc/58/90/14/567589014.db2.gz WZCSJAFWCSZWQO-FUHWJXTLSA-N 0 3 398.272 3.305 10 0 GGAEHN O[C@H](CN[C@@H](c1cccnc1)C1CC1)COc1cc(F)cc(Br)c1 ZINC000439458262 567589475 /nfs/dbraw/zinc/58/94/75/567589475.db2.gz SOBJVVHOTOYRQC-SJLPKXTDSA-N 0 3 395.272 3.464 10 0 GGAEHN CN1CCC[C@@]2(CCN(C(=O)C3(c4ccccc4Br)CC3)C2)C1 ZINC000505680850 567591546 /nfs/dbraw/zinc/59/15/46/567591546.db2.gz HCXSWCNZAKEYGG-GOSISDBHSA-N 0 3 377.326 3.425 10 0 GGAEHN CCN(C(=O)N[C@@H]1CCOc2c(Br)cccc21)[C@@H]1CCN(C)C1 ZINC000664823749 567592858 /nfs/dbraw/zinc/59/28/58/567592858.db2.gz JUZQTKYSURQUKT-IUODEOHRSA-N 0 3 382.302 3.008 10 0 GGAEHN O=S1(=O)CCC(CCNCc2cc(Br)c(Cl)s2)CC1 ZINC000480288396 567594528 /nfs/dbraw/zinc/59/45/28/567594528.db2.gz USYKTRZVGYOVRP-UHFFFAOYSA-N 0 3 386.764 3.469 10 0 GGAEHN Cc1nccc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c1Br ZINC000530354407 567595473 /nfs/dbraw/zinc/59/54/73/567595473.db2.gz CXCSHUWXWIKKSM-WBVHZDCISA-N 0 3 389.297 3.141 10 0 GGAEHN O[C@@H](COc1c(Cl)cccc1Cl)CN1CCC(O[C@H]2CCOC2)CC1 ZINC000480309077 567595648 /nfs/dbraw/zinc/59/56/48/567595648.db2.gz RAWXLCVQNNKGPZ-HIFRSBDPSA-N 0 3 390.307 3.003 10 0 GGAEHN O[C@H](COc1c(Cl)cccc1Cl)CN1CCC(O[C@@H]2CCOC2)CC1 ZINC000480309075 567595992 /nfs/dbraw/zinc/59/59/92/567595992.db2.gz RAWXLCVQNNKGPZ-DZGCQCFKSA-N 0 3 390.307 3.003 10 0 GGAEHN O[C@@H](COc1c(Cl)cccc1Cl)CN1CCC(O[C@@H]2CCOC2)CC1 ZINC000480309079 567596030 /nfs/dbraw/zinc/59/60/30/567596030.db2.gz RAWXLCVQNNKGPZ-UKRRQHHQSA-N 0 3 390.307 3.003 10 0 GGAEHN COC(=O)CC[C@H](N)C(=O)NC1(c2ccc(Br)cc2)CCCCC1 ZINC000595959115 567596314 /nfs/dbraw/zinc/59/63/14/567596314.db2.gz BGQWCDWQJRJXCV-HNNXBMFYSA-N 0 3 397.313 3.005 10 0 GGAEHN C[C@H]1CN(CCCNc2ccc(Br)c(C(F)(F)F)n2)CCCO1 ZINC000571906196 567597659 /nfs/dbraw/zinc/59/76/59/567597659.db2.gz XPGNEWYUJXNBOE-NSHDSACASA-N 0 3 396.251 3.198 10 0 GGAEHN CN(C(=O)N[C@H]1CCc2c1ccc(F)c2Br)[C@H]1CCN(C2CC2)C1 ZINC000459070723 567598330 /nfs/dbraw/zinc/59/83/30/567598330.db2.gz RRNJAXCQSYVNAT-LRDDRELGSA-N 0 3 396.304 3.454 10 0 GGAEHN C[C@H]1CCN(Cc2ccccc2)CCN1Cc1nn(C)cc1Br ZINC000644995940 567598375 /nfs/dbraw/zinc/59/83/75/567598375.db2.gz GBYVSKZSQMTZRV-HNNXBMFYSA-N 0 3 377.330 3.279 10 0 GGAEHN C[C@@H]1CCN(Cc2ccccc2)CCN1Cc1nn(C)cc1Br ZINC000644995942 567598551 /nfs/dbraw/zinc/59/85/51/567598551.db2.gz GBYVSKZSQMTZRV-OAHLLOKOSA-N 0 3 377.330 3.279 10 0 GGAEHN CN(C(=O)N[C@@H]1CCc2c1ccc(F)c2Br)[C@H]1CCN(C2CC2)C1 ZINC000459070718 567598547 /nfs/dbraw/zinc/59/85/47/567598547.db2.gz RRNJAXCQSYVNAT-BLLLJJGKSA-N 0 3 396.304 3.454 10 0 GGAEHN CCN(C(=O)NCCc1ccc(Br)cc1Cl)[C@@H]1CCN(C)C1 ZINC000664971901 567603716 /nfs/dbraw/zinc/60/37/16/567603716.db2.gz VYINZPGJMQBGBM-CQSZACIVSA-N 0 3 388.737 3.381 10 0 GGAEHN CCN(CC)CC(=O)N1CCC[C@@H]1c1ccccc1I ZINC000505960685 567605096 /nfs/dbraw/zinc/60/50/96/567605096.db2.gz XUQJXNBDEKJUSI-OAHLLOKOSA-N 0 3 386.277 3.297 10 0 GGAEHN CC(C)N(C)CC(=O)N1CCC[C@@H]1c1ccccc1I ZINC000505960754 567605331 /nfs/dbraw/zinc/60/53/31/567605331.db2.gz YPTCRGOKJFIKNW-OAHLLOKOSA-N 0 3 386.277 3.295 10 0 GGAEHN O=C(Nc1ccc(Br)cc1)C(C[C@H]1COCCO1)C(F)(F)F ZINC000665074481 567607647 /nfs/dbraw/zinc/60/76/47/567607647.db2.gz CNDXIIJRCOQFAB-NWDGAFQWSA-N 0 3 382.176 3.372 10 0 GGAEHN CN(C(=O)c1cc(Br)cc(N2CCCC2)c1)C1CCN(C)CC1 ZINC000665073700 567607743 /nfs/dbraw/zinc/60/77/43/567607743.db2.gz CTIMSJWCCAGXFZ-UHFFFAOYSA-N 0 3 380.330 3.216 10 0 GGAEHN CCN1CCN([C@@H](C)CN[C@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621750131 567608109 /nfs/dbraw/zinc/60/81/09/567608109.db2.gz IZXQKQSCAGZUNL-XJKSGUPXSA-N 0 3 390.316 3.371 10 0 GGAEHN CCN1CCN([C@@H](C)CN[C@@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621750128 567608508 /nfs/dbraw/zinc/60/85/08/567608508.db2.gz IZXQKQSCAGZUNL-BBRMVZONSA-N 0 3 390.316 3.371 10 0 GGAEHN CCCN(C(=O)N[C@@H]1CCOc2ccc(Br)cc21)[C@H]1CCN(C)C1 ZINC000645204625 567612861 /nfs/dbraw/zinc/61/28/61/567612861.db2.gz LSZCZCGGJDHELF-GOEBONIOSA-N 0 3 396.329 3.398 10 0 GGAEHN CCc1ccc(S(=O)(=O)N2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)s1 ZINC000480600217 567614670 /nfs/dbraw/zinc/61/46/70/567614670.db2.gz INCOLQRQINYRKX-CALCHBBNSA-N 0 3 376.547 3.063 10 0 GGAEHN CC(C)[C@@]1(CO)CCCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000645248239 567614873 /nfs/dbraw/zinc/61/48/73/567614873.db2.gz LVKDOVAUQIRLIR-KSSFIOAISA-N 0 3 376.324 3.464 10 0 GGAEHN CC1(CC(F)F)CN(C(=O)NCC2(N3CCSCC3)CCCCC2)C1 ZINC000645283870 567616470 /nfs/dbraw/zinc/61/64/70/567616470.db2.gz BLUVIAFVLJWQQB-UHFFFAOYSA-N 0 3 375.529 3.425 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1c(C)cc(Br)cc1Cl ZINC000480650732 567618564 /nfs/dbraw/zinc/61/85/64/567618564.db2.gz ICBNUGBAEBHELJ-CYBMUJFWSA-N 0 3 389.721 3.252 10 0 GGAEHN CN(C(=O)c1cc(=O)[nH]c2c(Br)cccc12)[C@@H]1CCN(C2CC2)C1 ZINC000530694088 567619203 /nfs/dbraw/zinc/61/92/03/567619203.db2.gz VGJDPFODQBNKSY-GFCCVEGCSA-N 0 3 390.281 3.012 10 0 GGAEHN COC(=O)[C@H]1CC12CCN(C[C@H](O)COc1c(Cl)cccc1Cl)CC2 ZINC000506264396 567619491 /nfs/dbraw/zinc/61/94/91/567619491.db2.gz OLAQIKHIIPFHDZ-QWHCGFSZSA-N 0 3 388.291 3.008 10 0 GGAEHN COC(=O)[C@@H]1CC12CCN(C[C@@H](O)COc1c(Cl)cccc1Cl)CC2 ZINC000506264395 567619727 /nfs/dbraw/zinc/61/97/27/567619727.db2.gz OLAQIKHIIPFHDZ-OLZOCXBDSA-N 0 3 388.291 3.008 10 0 GGAEHN Cc1cc(OCC(=O)NC2CCN(C3CC3)CC2)c(C)c(C)c1Br ZINC000506270998 567620186 /nfs/dbraw/zinc/62/01/86/567620186.db2.gz XFXSPKNIPQPVDB-UHFFFAOYSA-N 0 3 395.341 3.496 10 0 GGAEHN CCOc1cc(C[NH2+]C[C@@H](O)Cc2ccccc2)cc(Br)c1[O-] ZINC000459399199 567621969 /nfs/dbraw/zinc/62/19/69/567621969.db2.gz ARIFCPSPRSZUAX-HNNXBMFYSA-N 0 3 380.282 3.247 10 0 GGAEHN COC(=O)c1cc(CNC2(c3ccc(Br)cc3)CCOCC2)c[nH]1 ZINC000530763648 567622277 /nfs/dbraw/zinc/62/22/77/567622277.db2.gz QYKHGDNBLCVFHT-UHFFFAOYSA-N 0 3 393.281 3.359 10 0 GGAEHN CCOc1cc(CN[C@@H]2CC(=O)N(C(C)(C)C)C2)cc(Br)c1O ZINC000459418633 567622779 /nfs/dbraw/zinc/62/27/79/567622779.db2.gz DLWWOUPMBCAEHL-GFCCVEGCSA-N 0 3 385.302 3.042 10 0 GGAEHN CCOc1cc(C[NH2+]C[C@@]2(N(C)C)CCSC2)cc(Br)c1[O-] ZINC000459428641 567623378 /nfs/dbraw/zinc/62/33/78/567623378.db2.gz OXMVTUOPDUWJCJ-INIZCTEOSA-N 0 3 389.359 3.080 10 0 GGAEHN CCOc1cc(C[NH2+]CCCN2CCCCC2=O)cc(Br)c1[O-] ZINC000459425502 567624065 /nfs/dbraw/zinc/62/40/65/567624065.db2.gz KSPOKWGQBXFILL-UHFFFAOYSA-N 0 3 385.302 3.046 10 0 GGAEHN CCOc1cc(C[NH2+]C[C@]2(N(C)C)CCSC2)cc(Br)c1[O-] ZINC000459428642 567624130 /nfs/dbraw/zinc/62/41/30/567624130.db2.gz OXMVTUOPDUWJCJ-MRXNPFEDSA-N 0 3 389.359 3.080 10 0 GGAEHN CCO[C@@H]1C[C@@H](NCc2nnc(-c3ccc(Br)cc3)[nH]2)[C@H]1SC ZINC000459458906 567626103 /nfs/dbraw/zinc/62/61/03/567626103.db2.gz HMPVTYNLLDOHOZ-UMVBOHGHSA-N 0 3 397.342 3.233 10 0 GGAEHN CCOc1cc(C[N@H+](C)C2CCC(NC(C)=O)CC2)cc(Br)c1[O-] ZINC000459472045 567627261 /nfs/dbraw/zinc/62/72/61/567627261.db2.gz CCIPAFJDOAFZMO-UHFFFAOYSA-N 0 3 399.329 3.433 10 0 GGAEHN CCOc1cc(C[N@@H+](C)C2CCC(NC(C)=O)CC2)cc(Br)c1[O-] ZINC000459472045 567627267 /nfs/dbraw/zinc/62/72/67/567627267.db2.gz CCIPAFJDOAFZMO-UHFFFAOYSA-N 0 3 399.329 3.433 10 0 GGAEHN CCn1ncc(Cl)c1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000621985932 567628523 /nfs/dbraw/zinc/62/85/23/567628523.db2.gz SZCGFZSSRRUDSI-UHFFFAOYSA-N 0 3 378.826 3.092 10 0 GGAEHN CCN1CCC(NC(=O)c2c(F)c(F)c(Br)c(F)c2F)CC1 ZINC000665530530 567628923 /nfs/dbraw/zinc/62/89/23/567628923.db2.gz SUJLHSMMAOKPAR-UHFFFAOYSA-N 0 3 383.183 3.220 10 0 GGAEHN CCOc1c(Br)cc(CNC[C@@H](CO)c2cccnc2)cc1OC ZINC000572318603 567631204 /nfs/dbraw/zinc/63/12/04/567631204.db2.gz PVPFWWWCQNZONY-HNNXBMFYSA-N 0 3 395.297 3.117 10 0 GGAEHN CCCN(C(=O)N[C@H]1CCOc2c(Br)cccc21)[C@@H]1CCN(C)C1 ZINC000645491988 567632621 /nfs/dbraw/zinc/63/26/21/567632621.db2.gz FZVJLKXXMWJJQZ-CJNGLKHVSA-N 0 3 396.329 3.398 10 0 GGAEHN CCOc1cc(C[NH2+][C@@H]2CCCC[C@@H]2C(=O)OC)cc(Br)c1[O-] ZINC000459568878 567637183 /nfs/dbraw/zinc/63/71/83/567637183.db2.gz CAICIEPHDVMTTC-GXTWGEPZSA-N 0 3 386.286 3.375 10 0 GGAEHN O=C(NC1CCN(C2CC2)CC1)c1c(F)c(F)c(Br)c(F)c1F ZINC000665802676 567639239 /nfs/dbraw/zinc/63/92/39/567639239.db2.gz LKVIJNZQQPLNHH-UHFFFAOYSA-N 0 3 395.194 3.362 10 0 GGAEHN COc1cc(C[NH2+]C[C@H](CO)Cc2ccc(F)cc2)cc(Br)c1[O-] ZINC000531094442 567640432 /nfs/dbraw/zinc/64/04/32/567640432.db2.gz BSRNFVBBIGKTEX-CQSZACIVSA-N 0 3 398.272 3.243 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1cc(Cl)c(C)cc1Br ZINC000553287552 567640720 /nfs/dbraw/zinc/64/07/20/567640720.db2.gz VVCICUWLRITGGV-GFCCVEGCSA-N 0 3 389.721 3.252 10 0 GGAEHN CCOc1cc(C[NH2+][C@H]([C@@H](CO)C2CC2)C2CC2)cc(Br)c1[O-] ZINC000459591082 567641410 /nfs/dbraw/zinc/64/14/10/567641410.db2.gz ZRBHQKGNGLGXDG-YOEHRIQHSA-N 0 3 384.314 3.440 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1cc(Cl)c(C)cc1Br ZINC000553287553 567642176 /nfs/dbraw/zinc/64/21/76/567642176.db2.gz VVCICUWLRITGGV-LBPRGKRZSA-N 0 3 389.721 3.252 10 0 GGAEHN CCN(C(=O)Nc1cc(Cl)ccc1N1CCSCC1)[C@H]1CCN(C)C1 ZINC000665913083 567642711 /nfs/dbraw/zinc/64/27/11/567642711.db2.gz BFZFGJXTCRERKP-HNNXBMFYSA-N 0 3 382.961 3.451 10 0 GGAEHN OC[C@@]1(O)CCCN(Cc2ccc(-c3ccc(Br)cc3)s2)C1 ZINC000459642866 567644164 /nfs/dbraw/zinc/64/41/64/567644164.db2.gz BYMOUBHJXHYTSL-QGZVFWFLSA-N 0 3 382.323 3.497 10 0 GGAEHN CCN(C(=O)Nc1ccccc1I)[C@@H]1CCN(CC)C1 ZINC000596627042 567644460 /nfs/dbraw/zinc/64/44/60/567644460.db2.gz SORDBTGGZIGHTN-GFCCVEGCSA-N 0 3 387.265 3.239 10 0 GGAEHN CCN(C(=O)Nc1ccc(I)cc1)[C@@H]1CCN(CC)C1 ZINC000596627727 567645669 /nfs/dbraw/zinc/64/56/69/567645669.db2.gz GJLRMAALZOPVRO-CQSZACIVSA-N 0 3 387.265 3.239 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N[C@H]1C[C@H](C)N(C2CC2)C1 ZINC000440910615 567647928 /nfs/dbraw/zinc/64/79/28/567647928.db2.gz DCYRXSSXGBEHGH-JSGCOSHPSA-N 0 3 390.325 3.454 10 0 GGAEHN OC[C@]1(O)CCCN(Cc2ccc(-c3cccc(Br)c3)s2)C1 ZINC000459726405 567654424 /nfs/dbraw/zinc/65/44/24/567654424.db2.gz QFTOUMBQAPXSPY-KRWDZBQOSA-N 0 3 382.323 3.497 10 0 GGAEHN COc1cccc2c1OCC[C@@H]2N[C@@H](C)Cn1cc(Br)ccc1=O ZINC000666100631 567654433 /nfs/dbraw/zinc/65/44/33/567654433.db2.gz PGZDHPDUKVRQOU-WFASDCNBSA-N 0 3 393.281 3.121 10 0 GGAEHN CCCOc1c(Br)cc(CNC2(CC(=O)OC)CC2)cc1OC ZINC000572651244 567654437 /nfs/dbraw/zinc/65/44/37/567654437.db2.gz SGLYCTWKIVQPSS-UHFFFAOYSA-N 0 3 386.286 3.432 10 0 GGAEHN COc1ccc2c(c1)OCC[C@H]2N[C@@H](C)Cn1cc(Br)ccc1=O ZINC000666093939 567654549 /nfs/dbraw/zinc/65/45/49/567654549.db2.gz VBUYAWWFSHQOEQ-BLLLJJGKSA-N 0 3 393.281 3.121 10 0 GGAEHN CCN(C(=O)Nc1ccc(Br)cc1C(=O)OC)[C@@H]1CCN(CC)C1 ZINC000596805119 567654674 /nfs/dbraw/zinc/65/46/74/567654674.db2.gz JFBOEMJEKPTBRG-CYBMUJFWSA-N 0 3 398.301 3.184 10 0 GGAEHN CCOC(=O)c1cc(Br)ccc1NC(=O)N(CC)[C@@H]1CCN(C)C1 ZINC000596805470 567654908 /nfs/dbraw/zinc/65/49/08/567654908.db2.gz FNWDUOMYOVMEIN-CYBMUJFWSA-N 0 3 398.301 3.184 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NC1(c2ccc3c(c2)OCO3)CC1 ZINC000666119889 567655833 /nfs/dbraw/zinc/65/58/33/567655833.db2.gz FGLFYAJNWTWETC-LBPRGKRZSA-N 0 3 391.265 3.007 10 0 GGAEHN O=C(NCCN1CCCCC1)N[C@H]1CCOc2c(Br)cccc21 ZINC000507047023 567656052 /nfs/dbraw/zinc/65/60/52/567656052.db2.gz QBAUTUCYPAIRND-HNNXBMFYSA-N 0 3 382.302 3.058 10 0 GGAEHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1ncsc1Br ZINC000553465256 567656215 /nfs/dbraw/zinc/65/62/15/567656215.db2.gz CNMXZMHAAGMLQB-ZDUSSCGKSA-N 0 3 380.311 3.300 10 0 GGAEHN COc1ccc([C@@H](CO)C[NH2+]Cc2cc(Br)c([O-])c(OC)c2)cc1 ZINC000459729857 567656790 /nfs/dbraw/zinc/65/67/90/567656790.db2.gz HDJCWFKPSCLQAQ-CQSZACIVSA-N 0 3 396.281 3.038 10 0 GGAEHN CO[C@H]1CCCC[C@@H]1N[C@@H](C)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000441242401 567657549 /nfs/dbraw/zinc/65/75/49/567657549.db2.gz FFSPFFNHAFKEDE-JQFCIGGWSA-N 0 3 383.330 3.343 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cnc(-c3ccc(F)c(F)c3)s2)C[C@@H]1N(C)C ZINC000507087742 567658080 /nfs/dbraw/zinc/65/80/80/567658080.db2.gz QKOZXPPIVHUMIU-ZFWWWQNUSA-N 0 3 383.489 3.206 10 0 GGAEHN C[C@@H](NC[C@H]1CCCNC1=O)c1ccc(Br)cc1Br ZINC000666188350 567658802 /nfs/dbraw/zinc/65/88/02/567658802.db2.gz ZURSAEJPHKPRQA-NXEZZACHSA-N 0 3 390.119 3.388 10 0 GGAEHN COc1cc(C[NH2+]CC[C@@H]2COc3ccccc3O2)cc(Br)c1[O-] ZINC000481088855 567658813 /nfs/dbraw/zinc/65/88/13/567658813.db2.gz JBHBZFZSSIGPPK-CYBMUJFWSA-N 0 3 394.265 3.483 10 0 GGAEHN C[C@H](NC[C@@H]1CCCNC1=O)c1ccc(Br)cc1Br ZINC000666188351 567658887 /nfs/dbraw/zinc/65/88/87/567658887.db2.gz ZURSAEJPHKPRQA-UWVGGRQHSA-N 0 3 390.119 3.388 10 0 GGAEHN O=C(CN1CCC[C@@H]([C@@H]2CCOC2)C1)NCCc1cccc(Cl)c1Cl ZINC000441283196 567659560 /nfs/dbraw/zinc/65/95/60/567659560.db2.gz WJQIFXJXJCTASX-HZPDHXFCSA-N 0 3 385.335 3.401 10 0 GGAEHN C[C@H]1CCCN(CCNC(=O)N[C@H]2CCOc3c(Br)cccc32)C1 ZINC000507100467 567660187 /nfs/dbraw/zinc/66/01/87/567660187.db2.gz HHOBGIZTQSITPB-BBRMVZONSA-N 0 3 396.329 3.304 10 0 GGAEHN Cc1ccc2c(c1)[C@H](NCc1ccc(S(N)(=O)=O)c(Br)c1)CC2 ZINC000666264770 567661067 /nfs/dbraw/zinc/66/10/67/567661067.db2.gz YMPHLWMWXNRYCA-MRXNPFEDSA-N 0 3 395.322 3.182 10 0 GGAEHN Cc1ccc2c(c1)[C@@H](NCc1ccc(S(N)(=O)=O)c(Br)c1)CC2 ZINC000666264769 567661307 /nfs/dbraw/zinc/66/13/07/567661307.db2.gz YMPHLWMWXNRYCA-INIZCTEOSA-N 0 3 395.322 3.182 10 0 GGAEHN COc1cc(CN[C@]2(CO)CCCc3ccccc32)cc(Br)c1O ZINC000441351534 567663360 /nfs/dbraw/zinc/66/33/60/567663360.db2.gz DAQOBEIWHHPJNO-IBGZPJMESA-N 0 3 392.293 3.477 10 0 GGAEHN CN(C)[C@]1(CNC(=O)CCOc2cccc(Cl)c2Cl)CCSC1 ZINC000481221150 567663725 /nfs/dbraw/zinc/66/37/25/567663725.db2.gz XYSWMOANWPLUHV-INIZCTEOSA-N 0 3 377.337 3.316 10 0 GGAEHN C[C@@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccc(OC(F)(F)F)cc1 ZINC000507245361 567669575 /nfs/dbraw/zinc/66/95/75/567669575.db2.gz ZBCNPFIQOGLYIV-TZMCWYRMSA-N 0 3 380.432 3.050 10 0 GGAEHN CN(C[C@H]1CCCN1C)C(=O)N[C@H]1CSCc2ccc(Br)cc21 ZINC000666400588 567672285 /nfs/dbraw/zinc/67/22/85/567672285.db2.gz NGKWOLBPNUZIKB-ZBFHGGJFSA-N 0 3 398.370 3.473 10 0 GGAEHN CS[C@H]1CN(C(=O)c2ccc(Br)c(F)c2)C[C@@H]1N1CCCC1 ZINC000460101421 567672415 /nfs/dbraw/zinc/67/24/15/567672415.db2.gz FFMFHGLKNCOUGD-GJZGRUSLSA-N 0 3 387.318 3.240 10 0 GGAEHN CSc1ccc(S(=O)(=O)NC[C@@H]2CN(C)C[C@H]2c2ccccc2)cc1 ZINC000645842816 567673950 /nfs/dbraw/zinc/67/39/50/567673950.db2.gz RKJSSMFZUXAVIT-APWZRJJASA-N 0 3 376.547 3.032 10 0 GGAEHN C[NH+](C)CC1CCC([N-]S(=O)(=O)c2csc(-c3ccccc3)n2)CC1 ZINC000441863608 567677147 /nfs/dbraw/zinc/67/71/47/567677147.db2.gz BUWJIPYWVYLEAF-UHFFFAOYSA-N 0 3 379.551 3.209 10 0 GGAEHN CCn1c(-c2ccc(Br)s2)nnc1N1CCCN(CC)CC1 ZINC000460189815 567677449 /nfs/dbraw/zinc/67/74/49/567677449.db2.gz CHPUILQHOKXIKM-UHFFFAOYSA-N 0 3 384.347 3.321 10 0 GGAEHN CCn1c(-c2ccccc2Br)nnc1N(C)[C@H]1CCN(C2CC2)C1 ZINC000460193291 567678024 /nfs/dbraw/zinc/67/80/24/567678024.db2.gz VBCGQSIZJHPCJJ-AWEZNQCLSA-N 0 3 390.329 3.400 10 0 GGAEHN CCn1c(-c2ccccc2Br)nnc1N(C)[C@@H]1CCN(C2CC2)C1 ZINC000460193293 567678277 /nfs/dbraw/zinc/67/82/77/567678277.db2.gz VBCGQSIZJHPCJJ-CQSZACIVSA-N 0 3 390.329 3.400 10 0 GGAEHN CCn1c(-c2ccc(Br)cc2)nnc1N1CCCN(CC)CC1 ZINC000460207880 567679202 /nfs/dbraw/zinc/67/92/02/567679202.db2.gz DQPUMFNYIJNFJN-UHFFFAOYSA-N 0 3 378.318 3.260 10 0 GGAEHN CSC1(CNC(=O)Nc2cnc(C(F)(F)F)c(C)c2)CCN(C)CC1 ZINC000597078174 567679984 /nfs/dbraw/zinc/67/99/84/567679984.db2.gz JOTPSCHUNMYYGF-UHFFFAOYSA-N 0 3 376.448 3.358 10 0 GGAEHN CC(C)C[C@H](C)C[C@H](C)NCc1ccc(S(=O)(=O)N2CCOCC2)s1 ZINC000507496354 567681896 /nfs/dbraw/zinc/68/18/96/567681896.db2.gz OHEDFGQJWXOYFX-HOTGVXAUSA-N 0 3 388.599 3.319 10 0 GGAEHN CCn1c(CN[C@H](C)[C@H]2C[C@H]2C(=O)OC)nc2cc(Br)ccc21 ZINC000597112682 567683944 /nfs/dbraw/zinc/68/39/44/567683944.db2.gz HMKZWLARBJBWFF-RAIGVLPGSA-N 0 3 380.286 3.106 10 0 GGAEHN CCn1c(CN[C@H](C)[C@H]2C[C@@H]2C(=O)OC)nc2cc(Br)ccc21 ZINC000597112683 567684116 /nfs/dbraw/zinc/68/41/16/567684116.db2.gz HMKZWLARBJBWFF-RTXFEEFZSA-N 0 3 380.286 3.106 10 0 GGAEHN CN1CC[C@@H](CNC(=O)c2cc(Oc3cccc(Br)c3)ccn2)C1 ZINC000531885581 567684658 /nfs/dbraw/zinc/68/46/58/567684658.db2.gz BOXRDGVXHQZCQG-ZDUSSCGKSA-N 0 3 390.281 3.318 10 0 GGAEHN CN1CCCN(C(=O)NCC2(Cc3ccc(Br)cc3)CC2)CC1 ZINC000666551235 567686060 /nfs/dbraw/zinc/68/60/60/567686060.db2.gz QLKDLMWHVVJRHJ-UHFFFAOYSA-N 0 3 380.330 3.119 10 0 GGAEHN CCO[C@@H]1C[C@](N)(C(=O)N[C@H](C)c2ccc(Br)cc2OC)C1(C)C ZINC000573088686 567686333 /nfs/dbraw/zinc/68/63/33/567686333.db2.gz YIGDUPPNLPJMQO-MZKGEVEHSA-N 0 3 399.329 3.167 10 0 GGAEHN CCN(C(=O)c1cc(Cl)ccc1I)[C@@H]1CCN(C)C1 ZINC000597946616 567728887 /nfs/dbraw/zinc/72/88/87/567728887.db2.gz QQAWVBSJFDXTGO-LLVKDONJSA-N 0 3 392.668 3.111 10 0 GGAEHN CN(C)C[C@@]1(O)CCCN(C(=O)CCCCc2ccc(Br)cc2)C1 ZINC000646024629 567689743 /nfs/dbraw/zinc/68/97/43/567689743.db2.gz ZDEJOFXHTIWTGL-IBGZPJMESA-N 0 3 397.357 3.077 10 0 GGAEHN COC(=O)c1coc(CNCCc2ccc(I)cc2)c1 ZINC000597228078 567690040 /nfs/dbraw/zinc/69/00/40/567690040.db2.gz CNHQNCFLXXZUFM-UHFFFAOYSA-N 0 3 385.201 3.003 10 0 GGAEHN Cc1cc(Br)c(CNC(=O)N2CCC[C@H]3CN(C)CC[C@H]32)s1 ZINC000666640882 567691224 /nfs/dbraw/zinc/69/12/24/567691224.db2.gz YRWDTAAFZNHYPA-GXTWGEPZSA-N 0 3 386.359 3.445 10 0 GGAEHN O=C(c1cccc2c1CNC2)N1CCc2ccc(F)c(Br)c2C1 ZINC000623232322 567692492 /nfs/dbraw/zinc/69/24/92/567692492.db2.gz FTRATNTXGRFENZ-UHFFFAOYSA-N 0 3 375.241 3.390 10 0 GGAEHN C[C@@H](CN1CCCCC1)NC(=O)N1CCc2cccc(Br)c2C1 ZINC000532051023 567695058 /nfs/dbraw/zinc/69/50/58/567695058.db2.gz ANXGBIREZLIHEA-AWEZNQCLSA-N 0 3 380.330 3.391 10 0 GGAEHN Cc1cc(Br)ccc1NC(=O)N1CCOC2(CCN(C)CC2)C1 ZINC000646180869 567699409 /nfs/dbraw/zinc/69/94/09/567699409.db2.gz HXTLBADAMUBNQY-UHFFFAOYSA-N 0 3 382.302 3.086 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NC[C@@H](C)N1CCC[C@@H](C)C1 ZINC000460718432 567699405 /nfs/dbraw/zinc/69/94/05/567699405.db2.gz LEWYCWYWCAYYOB-ZIAGYGMSSA-N 0 3 383.330 3.237 10 0 GGAEHN CO[C@H](C)CN(CC(=O)N(C)Cc1cc(Br)cs1)C(C)C ZINC000532160739 567700732 /nfs/dbraw/zinc/70/07/32/567700732.db2.gz MPRPOTXDGBSENM-GFCCVEGCSA-N 0 3 377.348 3.214 10 0 GGAEHN COC[C@H](C)CNCc1cc(Cl)cc(Cl)c1OCCN1CCOCC1 ZINC000623378001 567704295 /nfs/dbraw/zinc/70/42/95/567704295.db2.gz OQFAYGRADYSCRA-CQSZACIVSA-N 0 3 391.339 3.077 10 0 GGAEHN COc1ccc(COC[C@H](O)CNCc2csc(C(F)(F)F)c2)cc1 ZINC000623379242 567705136 /nfs/dbraw/zinc/70/51/36/567705136.db2.gz FVHAHPWIZAZGQP-CQSZACIVSA-N 0 3 375.412 3.443 10 0 GGAEHN CN(CCN(C)C1CC1)C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000507779580 567705268 /nfs/dbraw/zinc/70/52/68/567705268.db2.gz PUGTWGMZVABKJK-OAHLLOKOSA-N 0 3 382.302 3.008 10 0 GGAEHN CCS(=O)(=O)NCCCNCc1cc(Cl)c(OC(C)C)cc1Cl ZINC000623387287 567705902 /nfs/dbraw/zinc/70/59/02/567705902.db2.gz ULVOAHROGZOZSG-UHFFFAOYSA-N 0 3 383.341 3.200 10 0 GGAEHN C[C@H](N[C@H]1CN(Cc2ccccc2)C[C@@H]1C)c1ncc(Br)cn1 ZINC000573344264 567706492 /nfs/dbraw/zinc/70/64/92/567706492.db2.gz QAHIBVHWVDISRG-ZQIUZPCESA-N 0 3 375.314 3.410 10 0 GGAEHN CN(C[C@@H]1CCCN(C)C1)C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000507793961 567706776 /nfs/dbraw/zinc/70/67/76/567706776.db2.gz XMYRQKVFTPAKQD-CJNGLKHVSA-N 0 3 396.329 3.256 10 0 GGAEHN CN(C[C@@H]1CCCN(C)C1)C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000507793962 567707284 /nfs/dbraw/zinc/70/72/84/567707284.db2.gz XMYRQKVFTPAKQD-CZUORRHYSA-N 0 3 396.329 3.256 10 0 GGAEHN Fc1c(Br)ccc(CNC2CCN(C[C@H]3CCCO3)CC2)c1F ZINC000623418521 567708912 /nfs/dbraw/zinc/70/89/12/567708912.db2.gz UDXRYGWSTXVMEA-CQSZACIVSA-N 0 3 389.284 3.460 10 0 GGAEHN CSC1(CNS(=O)(=O)Cc2ccc(Cl)cc2Cl)CCN(C)CC1 ZINC000573369493 567708944 /nfs/dbraw/zinc/70/89/44/567708944.db2.gz GTJRECBETRIUBM-UHFFFAOYSA-N 0 3 397.393 3.240 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)N1CCc2cccc(Br)c2C1 ZINC000532310076 567708922 /nfs/dbraw/zinc/70/89/22/567708922.db2.gz FYXAYPLQKFDDGQ-HNNXBMFYSA-N 0 3 382.346 3.493 10 0 GGAEHN CN(C(=O)N[C@H]1CCOc2c(Br)cccc21)[C@H]1CCN(C2CC2)C1 ZINC000507827302 567709918 /nfs/dbraw/zinc/70/99/18/567709918.db2.gz RBENPQVSDYLZDY-BBRMVZONSA-N 0 3 394.313 3.151 10 0 GGAEHN O=S(=O)(c1ccccc1)N1CC[C@H](N[C@H]2CCc3cc(Cl)ccc32)C1 ZINC000554140897 567711703 /nfs/dbraw/zinc/71/17/03/567711703.db2.gz PDQZYYCVOQGFSL-LPHOPBHVSA-N 0 3 376.909 3.380 10 0 GGAEHN C[C@@H](CCC(F)(F)F)[NH2+]CC[N-]S(=O)(=O)c1ccc(Cl)cc1F ZINC000442857593 567712565 /nfs/dbraw/zinc/71/25/65/567712565.db2.gz GJPBLLORDNLBIK-VIFPVBQESA-N 0 3 376.803 3.078 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N1CC[C@]2(CCN(C)C2)C1 ZINC000554142709 567712609 /nfs/dbraw/zinc/71/26/09/567712609.db2.gz ZCKAUUFHKQGKDB-IBGZPJMESA-N 0 3 390.325 3.266 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cn3cc(Cl)cc(Cl)c3n2)C[C@@H]1N1CCCC1 ZINC000442889361 567715770 /nfs/dbraw/zinc/71/57/70/567715770.db2.gz GDJHPXSWBNYGJK-LSDHHAIUSA-N 0 3 399.347 3.293 10 0 GGAEHN FC(F)(F)Cn1cc(CNCCOc2ccc(Br)cc2)cn1 ZINC000532419570 567715727 /nfs/dbraw/zinc/71/57/27/567715727.db2.gz FEMXWUYEDAGFRK-UHFFFAOYSA-N 0 3 378.192 3.377 10 0 GGAEHN CN(Cc1cccc(Br)c1OC[C@H]1CCCO1)CC1(O)CCC1 ZINC000442890063 567716042 /nfs/dbraw/zinc/71/60/42/567716042.db2.gz GVGGKIIZEYAVCO-OAHLLOKOSA-N 0 3 384.314 3.354 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)C1(c2ccc(Br)cc2)CCCC1 ZINC000573490407 567716451 /nfs/dbraw/zinc/71/64/51/567716451.db2.gz PGPGRFQJEDVHLM-AWEZNQCLSA-N 0 3 387.268 3.374 10 0 GGAEHN CC(C)Oc1cc(Cl)c(CNCC2(OCCO)CCOCC2)cc1Cl ZINC000623515276 567717658 /nfs/dbraw/zinc/71/76/58/567717658.db2.gz VOCUDFGAHYBWMR-UHFFFAOYSA-N 0 3 392.323 3.428 10 0 GGAEHN Cc1cc(C(=O)N2CCOC[C@H]2[C@@H]2CCCN2C)c(C)cc1Br ZINC000646447140 567718173 /nfs/dbraw/zinc/71/81/73/567718173.db2.gz QLMUYGLXIZCTOL-IRXDYDNUSA-N 0 3 381.314 3.001 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)c1csc(-c2ccc(Cl)s2)n1 ZINC000646443608 567718202 /nfs/dbraw/zinc/71/82/02/567718202.db2.gz HFBOEOVDMMNCLB-CHWSQXEVSA-N 0 3 397.953 3.460 10 0 GGAEHN Cc1cc(CCC(=O)N2CCOC[C@H]2[C@H]2CCCN2C)ccc1Br ZINC000646456461 567718271 /nfs/dbraw/zinc/71/82/71/567718271.db2.gz UCXYXGMNWIHGPX-MSOLQXFVSA-N 0 3 395.341 3.012 10 0 GGAEHN C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CCOC[C@H]1[C@@H]1CCCN1C ZINC000646449962 567718303 /nfs/dbraw/zinc/71/83/03/567718303.db2.gz SDYUIESRPKTTMM-ZLIFDBKOSA-N 0 3 387.307 3.082 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1cc(Cl)cc(C(F)(F)F)c1 ZINC000646449727 567718456 /nfs/dbraw/zinc/71/84/56/567718456.db2.gz QNMXVKTVCGIWMM-LSDHHAIUSA-N 0 3 376.806 3.294 10 0 GGAEHN CC[C@H]1CCCCN1CCNC(=O)Cc1cc(Br)ccc1OC ZINC000461058254 567718534 /nfs/dbraw/zinc/71/85/34/567718534.db2.gz VCLBLUAWRNBWSO-INIZCTEOSA-N 0 3 383.330 3.381 10 0 GGAEHN C[C@H](Oc1cccc(Cl)c1Cl)C(=O)N1CCOC[C@H]1[C@@H]1CCCN1C ZINC000646447501 567719111 /nfs/dbraw/zinc/71/91/11/567719111.db2.gz UNISWQOALOZPGB-QEJZJMRPSA-N 0 3 387.307 3.082 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000646444103 567719325 /nfs/dbraw/zinc/71/93/25/567719325.db2.gz KFTHBEFBNDMUIY-IDCNUPLLSA-N 0 3 383.319 3.419 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)c1ccc(Br)cc1Cl ZINC000646456121 567719484 /nfs/dbraw/zinc/71/94/84/567719484.db2.gz SBRJMJAYSZCHRG-HUUCEWRRSA-N 0 3 387.705 3.038 10 0 GGAEHN Cc1sc(Br)c(C(=O)N2CCOC[C@@H]2[C@H]2CCCN2C)c1C ZINC000646445998 567719497 /nfs/dbraw/zinc/71/94/97/567719497.db2.gz XLZQBTUJFRKWFD-CHWSQXEVSA-N 0 3 387.343 3.063 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)c1cc(I)ccc1F ZINC000597856842 567719905 /nfs/dbraw/zinc/71/99/05/567719905.db2.gz BDWSIRTWINVVPB-LLVKDONJSA-N 0 3 390.240 3.033 10 0 GGAEHN CCOc1c(Br)cc(CN(C)CCCO)cc1Br ZINC000442962319 567719978 /nfs/dbraw/zinc/71/99/78/567719978.db2.gz KCHRFILNPMNEEK-UHFFFAOYSA-N 0 3 381.108 3.425 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)c1ccc(I)cc1F ZINC000597860025 567720720 /nfs/dbraw/zinc/72/07/20/567720720.db2.gz KBKADBDUJSZCFV-LLVKDONJSA-N 0 3 390.240 3.033 10 0 GGAEHN CS(=O)(=O)CC1(CCNCc2ccc(Br)c(F)c2F)CC1 ZINC000623562410 567721813 /nfs/dbraw/zinc/72/18/13/567721813.db2.gz QTJJPJCWAFRLPK-UHFFFAOYSA-N 0 3 382.270 3.032 10 0 GGAEHN Cc1cc(Br)c(CNCC[C@]2(O)CCOC2)cc1Br ZINC000623560052 567722019 /nfs/dbraw/zinc/72/20/19/567722019.db2.gz UIPVEZULRUATBI-AWEZNQCLSA-N 0 3 393.119 3.151 10 0 GGAEHN FC1(F)C[C@H]1OCCNCc1c[nH]nc1-c1ccc(Br)s1 ZINC000623564411 567722178 /nfs/dbraw/zinc/72/21/78/567722178.db2.gz BSAZAPKTYOYQNX-SNVBAGLBSA-N 0 3 378.242 3.415 10 0 GGAEHN Cc1cc(Br)c(CNCC2(CC(N)=O)CC2)cc1Br ZINC000623552819 567722408 /nfs/dbraw/zinc/72/24/08/567722408.db2.gz XOHHWQBFQYVHNG-UHFFFAOYSA-N 0 3 390.119 3.265 10 0 GGAEHN CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccnc(C)c1Br)c1ccco1 ZINC000554346352 567722507 /nfs/dbraw/zinc/72/25/07/567722507.db2.gz BOUFTVPTPOGBNM-RISCZKNCSA-N 0 3 395.301 3.418 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NCCN1[C@@H](C)CCC[C@@H]1C ZINC000461118697 567722511 /nfs/dbraw/zinc/72/25/11/567722511.db2.gz NNOVOPMUOCMLFW-KBPBESRZSA-N 0 3 383.330 3.379 10 0 GGAEHN Cc1nccc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c1Br ZINC000554344590 567722700 /nfs/dbraw/zinc/72/27/00/567722700.db2.gz FJUWKXBULSSIEV-OAHLLOKOSA-N 0 3 395.276 3.138 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)Nc1ccc2nccnc2c1Br ZINC000667080521 567723508 /nfs/dbraw/zinc/72/35/08/567723508.db2.gz UNYSWQHJDICIHJ-NSHDSACASA-N 0 3 392.301 3.387 10 0 GGAEHN Cc1ccc(I)c(C(=O)N[C@@H]2CCN(C(C)(C)C)C2)c1 ZINC000597923128 567724262 /nfs/dbraw/zinc/72/42/62/567724262.db2.gz LTYJDUOEIZMGPX-GFCCVEGCSA-N 0 3 386.277 3.202 10 0 GGAEHN CCN(C(=O)Nc1cnc2c(Br)cccn12)[C@@H]1CCN(CC)C1 ZINC000667097893 567724313 /nfs/dbraw/zinc/72/43/13/567724313.db2.gz FVVXVSIIUIVEMB-GFCCVEGCSA-N 0 3 380.290 3.045 10 0 GGAEHN COc1cccc(N2C[C@@H](NCc3ccc(Br)cc3)CC2=O)c1 ZINC000508078680 567726563 /nfs/dbraw/zinc/72/65/63/567726563.db2.gz NPHRAQIGDQRQRI-HNNXBMFYSA-N 0 3 375.266 3.353 10 0 GGAEHN O=C(NC1CCN(C2CC2)CC1)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000623629903 567726660 /nfs/dbraw/zinc/72/66/60/567726660.db2.gz RCRCTTRROQCCNS-CGTJXYLNSA-N 0 3 375.310 3.078 10 0 GGAEHN Cc1cc2c(o1)c(C(=O)NC[C@H](O)CN1CCCCC1)ccc2Br ZINC000443059709 567727211 /nfs/dbraw/zinc/72/72/11/567727211.db2.gz CXXSDKDWUYLNRG-ZDUSSCGKSA-N 0 3 395.297 3.080 10 0 GGAEHN O=C(Nc1cnc(-c2ccc(Cl)s2)nc1)N[C@@H]1CCN(CC2CC2)C1 ZINC000646543940 567727426 /nfs/dbraw/zinc/72/74/26/567727426.db2.gz VQIFYQCSSQLCSB-GFCCVEGCSA-N 0 3 377.901 3.464 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)Nc2cnc(-c3ccc(Cl)s3)nc2)CCSC1 ZINC000646543180 567727870 /nfs/dbraw/zinc/72/78/70/567727870.db2.gz JFAHRTFFOKKNNX-MRXNPFEDSA-N 0 3 397.957 3.417 10 0 GGAEHN CC(C)(C)n1cc(CN[C@]2(CO)CCc3cc(Br)ccc3C2)cn1 ZINC000623644222 567727947 /nfs/dbraw/zinc/72/79/47/567727947.db2.gz QDHCBUFQDGHPLN-LJQANCHMSA-N 0 3 392.341 3.410 10 0 GGAEHN CCCn1nccc1CN[C@]1(CO)CCc2cc(Br)ccc2C1 ZINC000623645309 567728014 /nfs/dbraw/zinc/72/80/14/567728014.db2.gz XCNZNSOYWQDTIZ-GOSISDBHSA-N 0 3 378.314 3.065 10 0 GGAEHN CCN(CC(=O)NC1CCN(C2CC2)CC1)c1ccc(Br)cc1 ZINC000532669253 567728010 /nfs/dbraw/zinc/72/80/10/567728010.db2.gz VLAHOGQDRJUENT-UHFFFAOYSA-N 0 3 380.330 3.018 10 0 GGAEHN Clc1ccc(N2CCO[C@H](CNCc3cncc(Br)c3)C2)cc1 ZINC000623655371 567728120 /nfs/dbraw/zinc/72/81/20/567728120.db2.gz WELAMEGGDPBTSE-QGZVFWFLSA-N 0 3 396.716 3.493 10 0 GGAEHN CCOc1cncc(CN[C@]2(CO)CCc3cc(Br)ccc3C2)c1 ZINC000623645098 567728238 /nfs/dbraw/zinc/72/82/38/567728238.db2.gz ODPGVUNXHZLFQG-LJQANCHMSA-N 0 3 391.309 3.252 10 0 GGAEHN CCN(C(=O)c1cc(I)c(C)cc1C)[C@H]1CCN(C)C1 ZINC000597947198 567728474 /nfs/dbraw/zinc/72/84/74/567728474.db2.gz VFILHSNNAWRYBD-ZDUSSCGKSA-N 0 3 386.277 3.074 10 0 GGAEHN CC(C)n1cncc1CN[C@]1(CO)CCc2cc(Br)ccc2C1 ZINC000623645147 567728387 /nfs/dbraw/zinc/72/83/87/567728387.db2.gz PUJVKDRUKCDTAC-GOSISDBHSA-N 0 3 378.314 3.236 10 0 GGAEHN CN1CC[C@@]2(CCN(C(=O)Nc3cnc(-c4ccc(Cl)s4)nc3)C2)C1 ZINC000646545778 567728825 /nfs/dbraw/zinc/72/88/25/567728825.db2.gz UGGDXCZTGOKVAQ-QGZVFWFLSA-N 0 3 377.901 3.418 10 0 GGAEHN CCN(C(=O)c1ccc(I)cc1Cl)[C@@H]1CCN(C)C1 ZINC000597947243 567729233 /nfs/dbraw/zinc/72/92/33/567729233.db2.gz WMXLISWDNZCGII-LLVKDONJSA-N 0 3 392.668 3.111 10 0 GGAEHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN[C@H]1C[C@H](C(N)=O)C1 ZINC000623662948 567729333 /nfs/dbraw/zinc/72/93/33/567729333.db2.gz RRLDUQZVWQVFSN-NNUKFRKNSA-N 0 3 391.313 3.112 10 0 GGAEHN CN1C[C@@H]2CCCN(C(=O)Nc3cnc(-c4ccc(Cl)s4)nc3)[C@@H]2C1 ZINC000646547818 567729429 /nfs/dbraw/zinc/72/94/29/567729429.db2.gz LSMPFFBBXVWEER-WCQYABFASA-N 0 3 377.901 3.416 10 0 GGAEHN COc1ncc(Br)cc1CNC1CCN(C(=O)CC(C)(C)C)CC1 ZINC000623665097 567729563 /nfs/dbraw/zinc/72/95/63/567729563.db2.gz YLNQVNHAOYACAN-UHFFFAOYSA-N 0 3 398.345 3.370 10 0 GGAEHN CN1CCC[C@H](CNC(=O)NCC/C=C\c2ccc(Br)cc2)C1 ZINC000623721850 567733492 /nfs/dbraw/zinc/73/34/92/567733492.db2.gz SIQHDEGONYQXNZ-SVERHTFXSA-N 0 3 380.330 3.493 10 0 GGAEHN C[C@H](CNC(=O)NCc1ccc(Br)c(F)c1F)N(C)C1CC1 ZINC000623725773 567733656 /nfs/dbraw/zinc/73/36/56/567733656.db2.gz JWVUDTUNKIZYBE-SECBINFHSA-N 0 3 376.245 3.009 10 0 GGAEHN C[C@@H](CNC(=O)N1CCc2cc(F)cc(Br)c2C1)N(C)C1CC1 ZINC000623725784 567733810 /nfs/dbraw/zinc/73/38/10/567733810.db2.gz KMYJVWFARGAVNC-NSHDSACASA-N 0 3 384.293 3.139 10 0 GGAEHN CCN(C(=O)c1ccc(C)c(I)c1)[C@H]1CCN(CC)C1 ZINC000598040912 567733833 /nfs/dbraw/zinc/73/38/33/567733833.db2.gz JDLIXARRABSXCG-AWEZNQCLSA-N 0 3 386.277 3.156 10 0 GGAEHN CN1C(=O)c2ccccc2[C@@H]1CNCc1cc2c(c(Br)c1)OCO2 ZINC000623725038 567733860 /nfs/dbraw/zinc/73/38/60/567733860.db2.gz HGQAPUMRDUFNFR-HNNXBMFYSA-N 0 3 389.249 3.094 10 0 GGAEHN CCN(C(=O)c1cccc(C)c1I)[C@@H]1CCN(CC)C1 ZINC000598041861 567733942 /nfs/dbraw/zinc/73/39/42/567733942.db2.gz OCKTWIZQEMDUQW-CYBMUJFWSA-N 0 3 386.277 3.156 10 0 GGAEHN CCN(C(=O)c1ccc(C)c(I)c1)[C@@H]1CCN(CC)C1 ZINC000598040913 567734018 /nfs/dbraw/zinc/73/40/18/567734018.db2.gz JDLIXARRABSXCG-CQSZACIVSA-N 0 3 386.277 3.156 10 0 GGAEHN CN(C)CCOCCNC(=O)Nc1ncc(Cc2cccc(Cl)c2)s1 ZINC000461410798 567735205 /nfs/dbraw/zinc/73/52/05/567735205.db2.gz VILGNFZYJNFLRT-UHFFFAOYSA-N 0 3 382.917 3.087 10 0 GGAEHN Cc1nc(C(=O)NCc2ccc(OCCN(C)C)cc2)c(Br)s1 ZINC000646687357 567735519 /nfs/dbraw/zinc/73/55/19/567735519.db2.gz DCAHDBKXZUXBMM-UHFFFAOYSA-N 0 3 398.326 3.084 10 0 GGAEHN CO[C@@]1(CNCc2cnc(-c3ccc(Br)cc3)s2)CCOC1 ZINC000461436864 567736880 /nfs/dbraw/zinc/73/68/80/567736880.db2.gz DUCLVFUTIGIPMV-MRXNPFEDSA-N 0 3 383.311 3.468 10 0 GGAEHN Cc1cc(Br)ccc1CNC[C@H]1CN(Cc2ccncc2)CCO1 ZINC000623781027 567737478 /nfs/dbraw/zinc/73/74/78/567737478.db2.gz FJKZFCACFUAZMG-IBGZPJMESA-N 0 3 390.325 3.143 10 0 GGAEHN Cc1ccc(CNC[C@@H]2CN(Cc3ccncc3)CCO2)cc1Br ZINC000623781048 567737994 /nfs/dbraw/zinc/73/79/94/567737994.db2.gz GHTCKZSORWNTRL-GOSISDBHSA-N 0 3 390.325 3.143 10 0 GGAEHN Cc1cc(C)c(CNCCC(=O)Nc2ccc(Br)cc2)c(=O)[nH]1 ZINC000554603868 567738753 /nfs/dbraw/zinc/73/87/53/567738753.db2.gz NHJAPIUAMPCFSY-UHFFFAOYSA-N 0 3 378.270 3.285 10 0 GGAEHN Cc1noc([C@@H]2OCC[C@@H]2NCc2ccc(Br)c3cccnc23)n1 ZINC000623815512 567738929 /nfs/dbraw/zinc/73/89/29/567738929.db2.gz FVZKLZPJPXNQGM-GOEBONIOSA-N 0 3 389.253 3.309 10 0 GGAEHN CN(C)c1ccc(Cl)cc1NC(=O)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000667289533 567740773 /nfs/dbraw/zinc/74/07/73/567740773.db2.gz TVYVEVBWYLSUOI-NEPJUHHUSA-N 0 3 380.794 3.329 10 0 GGAEHN CN1CC[C@@H](NCCS(=O)(=O)c2ccccc2)[C@H]1c1ccc(Cl)cc1 ZINC000573884977 567742924 /nfs/dbraw/zinc/74/29/24/567742924.db2.gz CFVXLLFSLSVNNW-RTBURBONSA-N 0 3 378.925 3.149 10 0 GGAEHN Cc1ccc([C@H](CNC(=O)c2cncc(Br)c2C)N(C)C)cc1 ZINC000667354677 567743188 /nfs/dbraw/zinc/74/31/88/567743188.db2.gz PIGDVUSUTAURCW-KRWDZBQOSA-N 0 3 376.298 3.494 10 0 GGAEHN C/C(=C/c1cccc(C(F)(F)F)c1)CNCCS(=O)(=O)NC(C)(C)C ZINC000554714327 567743959 /nfs/dbraw/zinc/74/39/59/567743959.db2.gz UOOANMSHTWTWGO-RAXLEYEMSA-N 0 3 378.460 3.416 10 0 GGAEHN C/C(=C\c1cccc(C(F)(F)F)c1)CNCCS(=O)(=O)NC(C)(C)C ZINC000554714326 567743993 /nfs/dbraw/zinc/74/39/93/567743993.db2.gz UOOANMSHTWTWGO-JLHYYAGUSA-N 0 3 378.460 3.416 10 0 GGAEHN CN(CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[C@@H]1CCN(C2CC2)C1 ZINC000532981536 567745705 /nfs/dbraw/zinc/74/57/05/567745705.db2.gz MRLBPYZNFJBBQI-CYBMUJFWSA-N 0 3 375.822 3.466 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000667432538 567746162 /nfs/dbraw/zinc/74/61/62/567746162.db2.gz HHPLCRXYIIDYTR-UHFFFAOYSA-N 0 3 394.288 3.496 10 0 GGAEHN Cc1cnn(C)c1NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000667432104 567746762 /nfs/dbraw/zinc/74/67/62/567746762.db2.gz SXHKYZOHNUHHMZ-UHFFFAOYSA-N 0 3 394.317 3.087 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000667426018 567746866 /nfs/dbraw/zinc/74/68/66/567746866.db2.gz TWCABSXGYFCJTI-UHFFFAOYSA-N 0 3 394.288 3.496 10 0 GGAEHN Cc1ccc(Br)cc1[C@@H](C)N[C@H]1CCN(C2CCOCC2)C1=O ZINC000623918578 567747203 /nfs/dbraw/zinc/74/72/03/567747203.db2.gz VKFVQODARSFDBW-DYVFJYSZSA-N 0 3 381.314 3.188 10 0 GGAEHN Cc1cc(N2CC[C@H](N[C@@H](C)c3cc(Br)ccc3C)C2=O)n(C)n1 ZINC000623918164 567747229 /nfs/dbraw/zinc/74/72/29/567747229.db2.gz JRJHOXRFKTYWJK-BBRMVZONSA-N 0 3 391.313 3.256 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3[nH]c4ccc(Br)cc4c3Cl)[C@@H]2C1 ZINC000646915666 567747886 /nfs/dbraw/zinc/74/78/86/567747886.db2.gz SHVICHALBNYUTR-NOZJJQNGSA-N 0 3 382.689 3.360 10 0 GGAEHN C[C@@H](NCc1ccc(Br)cc1N1CCOCC1)[C@H]1CCCCO1 ZINC000623922354 567748189 /nfs/dbraw/zinc/74/81/89/567748189.db2.gz XKHHGTMZAIOWCE-RDTXWAMCSA-N 0 3 383.330 3.333 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)C3(c4ccc(Br)cc4)CCCC3)[C@H]2C1 ZINC000646913396 567748254 /nfs/dbraw/zinc/74/82/54/567748254.db2.gz FPKAXIOJHHPOLU-PBHICJAKSA-N 0 3 377.326 3.423 10 0 GGAEHN Cc1cc(CC(C)(C)C(=O)N2CC[C@@H]3CN(C)C[C@@H]32)ccc1Br ZINC000646920371 567748502 /nfs/dbraw/zinc/74/85/02/567748502.db2.gz QISGVOQIPZSZSU-WBVHZDCISA-N 0 3 379.342 3.489 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)COc2ccc3cc(Br)ccc3c2)C1 ZINC000646937430 567749174 /nfs/dbraw/zinc/74/91/74/567749174.db2.gz LKFANQPKKRRPOU-YJBOKZPZSA-N 0 3 389.293 3.144 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3ccc(Br)cc3C(F)(F)F)[C@@H]2C1 ZINC000646937717 567749264 /nfs/dbraw/zinc/74/92/64/567749264.db2.gz QYRNLLCUPSHMGW-NOZJJQNGSA-N 0 3 377.204 3.244 10 0 GGAEHN Cc1ccc(Br)cc1[C@H](C)N[C@@H]1C[C@H](C)N(c2cnn(C)c2)C1=O ZINC000623939311 567749606 /nfs/dbraw/zinc/74/96/06/567749606.db2.gz MHFCTNVDXJDWQY-GDZNZVCISA-N 0 3 391.313 3.336 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)COc3ccc4ccccc4c3Br)[C@@H]2C1 ZINC000646927857 567749751 /nfs/dbraw/zinc/74/97/51/567749751.db2.gz SJBIFXAYKXEOQK-GDBMZVCRSA-N 0 3 389.293 3.144 10 0 GGAEHN OC[C@H]1CN(Cc2ccccc2)CC[C@H]1Nc1ncc(Br)cc1F ZINC000623989076 567751873 /nfs/dbraw/zinc/75/18/73/567751873.db2.gz IUFQRZVLYLQGDJ-RHSMWYFYSA-N 0 3 394.288 3.278 10 0 GGAEHN C[C@H](CNC(=O)N[C@H]1CCCN(C)C1)Sc1ccc(Br)cc1 ZINC000598258640 567752411 /nfs/dbraw/zinc/75/24/11/567752411.db2.gz NUNQOPMUQQWNKS-OCCSQVGLSA-N 0 3 386.359 3.323 10 0 GGAEHN C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@H]1C[C@@H]2CCCCN2C1=O ZINC000623998030 567753216 /nfs/dbraw/zinc/75/32/16/567753216.db2.gz FITOVPOLLSAFPW-GMXABZIVSA-N 0 3 375.822 3.428 10 0 GGAEHN O=C(CCSc1ccc(Br)cc1)N[C@@H]1CNCCC1(F)F ZINC000647076288 567758958 /nfs/dbraw/zinc/75/89/58/567758958.db2.gz HQTNYBNWXGYMNU-GFCCVEGCSA-N 0 3 379.270 3.045 10 0 GGAEHN FC(F)(F)c1ccc(Br)c(CNCCc2nnc3n2CCC3)c1 ZINC000554969348 567759976 /nfs/dbraw/zinc/75/99/76/567759976.db2.gz KLDNSVCUFTZXIC-UHFFFAOYSA-N 0 3 389.219 3.338 10 0 GGAEHN C[C@@H](N[C@H]1CCN(c2ccc3nncn3n2)C1)c1ccc(Cl)c(Cl)c1 ZINC000624113916 567760520 /nfs/dbraw/zinc/76/05/20/567760520.db2.gz PGBXBTZVZZNCEU-YPMHNXCESA-N 0 3 377.279 3.361 10 0 GGAEHN CC1CCN(CCNC(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)CC1 ZINC000624119826 567760568 /nfs/dbraw/zinc/76/05/68/567760568.db2.gz KPLYEBRUMSIPJG-CGTJXYLNSA-N 0 3 377.326 3.183 10 0 GGAEHN C[C@H](N[C@@H]1CCN(c2ccc3nncn3n2)C1)c1ccc(Cl)cc1Cl ZINC000624114039 567760723 /nfs/dbraw/zinc/76/07/23/567760723.db2.gz RTMHAUFNJMUXSE-WCQYABFASA-N 0 3 377.279 3.361 10 0 GGAEHN C[C@H](N[C@@H]1CCN(c2ccc3nncn3n2)C1)c1cccc(Cl)c1Cl ZINC000624113308 567760743 /nfs/dbraw/zinc/76/07/43/567760743.db2.gz CDKLFYYVQXKLMN-NWDGAFQWSA-N 0 3 377.279 3.361 10 0 GGAEHN C[C@@H](N[C@@H]1CCN(c2ccc3nncn3n2)C1)c1ccc(Cl)c(Cl)c1 ZINC000624113914 567760785 /nfs/dbraw/zinc/76/07/85/567760785.db2.gz PGBXBTZVZZNCEU-DGCLKSJQSA-N 0 3 377.279 3.361 10 0 GGAEHN Cc1c(Br)cc(CN[C@@H]2CCC(=O)N(C)C2)cc1Br ZINC000574182627 567761127 /nfs/dbraw/zinc/76/11/27/567761127.db2.gz AGNJQIOHGVVHRF-LLVKDONJSA-N 0 3 390.119 3.230 10 0 GGAEHN COC(=O)[C@H]1CCN(Cc2c(C)nn(-c3ccc(Br)cc3)c2C)C1 ZINC000508673833 567761611 /nfs/dbraw/zinc/76/16/11/567761611.db2.gz XOCPEJRAWLJPOF-AWEZNQCLSA-N 0 3 392.297 3.247 10 0 GGAEHN COc1ncc(Br)cc1CNC1CCN(c2ccccn2)CC1 ZINC000624133329 567761894 /nfs/dbraw/zinc/76/18/94/567761894.db2.gz LOEXPJOGPSYSMK-UHFFFAOYSA-N 0 3 377.286 3.006 10 0 GGAEHN COc1ncc(Br)cc1CNC1CCC(c2nc(C)no2)CC1 ZINC000624134482 567762482 /nfs/dbraw/zinc/76/24/82/567762482.db2.gz WQYMNYKWSDGCCJ-UHFFFAOYSA-N 0 3 381.274 3.360 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000624138448 567763224 /nfs/dbraw/zinc/76/32/24/567763224.db2.gz NWLCFKKUELVBJJ-ZYRRHWMLSA-N 0 3 377.326 3.325 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000624138447 567763388 /nfs/dbraw/zinc/76/33/88/567763388.db2.gz NWLCFKKUELVBJJ-UOAMXJAYSA-N 0 3 377.326 3.325 10 0 GGAEHN Brc1ccc(C2(NCc3cnc4cnccn34)CCOCC2)cc1 ZINC000533329864 567763398 /nfs/dbraw/zinc/76/33/98/567763398.db2.gz FVFLMVMTJAODRL-UHFFFAOYSA-N 0 3 387.281 3.287 10 0 GGAEHN CN1C[C@@H]2CCCN(C(=O)Nc3ccc(-c4ccc(Cl)s4)nn3)[C@@H]2C1 ZINC000667676314 567763697 /nfs/dbraw/zinc/76/36/97/567763697.db2.gz MCSNDHOGCDFPDW-WCQYABFASA-N 0 3 377.901 3.416 10 0 GGAEHN CC[C@@H](CO)N1CCN(c2ccnc3c(Br)ccc(F)c23)CC1 ZINC000443512297 567763780 /nfs/dbraw/zinc/76/37/80/567763780.db2.gz VOFNSRXBCQGQNE-LBPRGKRZSA-N 0 3 382.277 3.029 10 0 GGAEHN NC(=O)C1CCC(NCc2cc(OC(F)F)ccc2Br)CC1 ZINC000647183436 567767437 /nfs/dbraw/zinc/76/74/37/567767437.db2.gz XPUVFGLMSYHUST-UHFFFAOYSA-N 0 3 377.229 3.184 10 0 GGAEHN COc1ncncc1CNCC1(c2ccc(Br)cc2)CCOCC1 ZINC000647177620 567768001 /nfs/dbraw/zinc/76/80/01/567768001.db2.gz GUFISZDDEXIKLU-UHFFFAOYSA-N 0 3 392.297 3.086 10 0 GGAEHN CC(C)(CNCc1ccc(S(N)(=O)=O)cc1F)c1cccc(Cl)c1F ZINC000647202621 567769364 /nfs/dbraw/zinc/76/93/64/567769364.db2.gz IJMYWNGPIZDBNE-UHFFFAOYSA-N 0 3 388.867 3.333 10 0 GGAEHN C[C@H](NC[C@H]1CN(Cc2ccncc2)CCO1)c1cc(Br)cs1 ZINC000624263854 567770517 /nfs/dbraw/zinc/77/05/17/567770517.db2.gz PIIOIYNHWMIMNY-BBRMVZONSA-N 0 3 396.354 3.457 10 0 GGAEHN CNC(=O)[C@H](CNCc1ccc(SC)s1)Cc1ccc(OC)c(F)c1 ZINC000647222017 567771189 /nfs/dbraw/zinc/77/11/89/567771189.db2.gz RVWJFYLDIVNGCX-ZDUSSCGKSA-N 0 3 382.526 3.312 10 0 GGAEHN Cc1noc([C@H]2OCC[C@H]2N[C@@H](C)Cc2ccc(Br)c(F)c2)n1 ZINC000624303635 567772430 /nfs/dbraw/zinc/77/24/30/567772430.db2.gz INXNOTLJUSUSDQ-AMFBXLIHSA-N 0 3 384.249 3.330 10 0 GGAEHN c1nc(N2CCOCC2)sc1CNCC[C@H]1CSc2ccccc2O1 ZINC000647227550 567772872 /nfs/dbraw/zinc/77/28/72/567772872.db2.gz CKLLQHHIXZAOSR-AWEZNQCLSA-N 0 3 377.535 3.013 10 0 GGAEHN Cn1cnc(CCCNCc2csc(-c3cccc(Br)c3)n2)n1 ZINC000647230932 567772915 /nfs/dbraw/zinc/77/29/15/567772915.db2.gz ZJKNVDMRRBYBBI-UHFFFAOYSA-N 0 3 392.326 3.424 10 0 GGAEHN CS(=O)(=O)Nc1cccc(CNCC[C@H]2CSc3ccccc3O2)c1 ZINC000647227518 567772983 /nfs/dbraw/zinc/77/29/83/567772983.db2.gz BEMFNNLNPNGFBR-INIZCTEOSA-N 0 3 378.519 3.091 10 0 GGAEHN CC(C)(CNCc1cccc(Br)c1OC(F)F)[C@]1(O)CCOC1 ZINC000647247147 567774170 /nfs/dbraw/zinc/77/41/70/567774170.db2.gz ZKUFRTDNFPGZRR-INIZCTEOSA-N 0 3 394.256 3.318 10 0 GGAEHN O=C(Nc1cnc2c(c1)CNCC2)N1CCc2cccc(Br)c2C1 ZINC000667799208 567774351 /nfs/dbraw/zinc/77/43/51/567774351.db2.gz OVKUTFNKHUYBHE-UHFFFAOYSA-N 0 3 387.281 3.080 10 0 GGAEHN Cc1cc(S(=O)(=O)NCCN[C@H](CC(C)C)c2ccncc2)c(C)s1 ZINC000647294702 567777331 /nfs/dbraw/zinc/77/73/31/567777331.db2.gz LEBLMEAHHPFVIC-QGZVFWFLSA-N 0 3 381.567 3.415 10 0 GGAEHN Cc1c(Br)cccc1S(=O)(=O)N1CCCc2cccc(CN)c21 ZINC000624388772 567777588 /nfs/dbraw/zinc/77/75/88/567777588.db2.gz HEGGABSKMOSAJK-UHFFFAOYSA-N 0 3 395.322 3.358 10 0 GGAEHN CC(C)C[C@H](NCCNS(=O)(=O)c1cccc(Cl)c1)c1ccncc1 ZINC000647286034 567777993 /nfs/dbraw/zinc/77/79/93/567777993.db2.gz BRSOCWXZOUGVCK-SFHVURJKSA-N 0 3 381.929 3.390 10 0 GGAEHN Cc1ccc(S(=O)(=O)N2CCCc3cccc(CN)c32)cc1Br ZINC000624389090 567778029 /nfs/dbraw/zinc/77/80/29/567778029.db2.gz QFLUEIXRMPNUKO-UHFFFAOYSA-N 0 3 395.322 3.358 10 0 GGAEHN C[C@]1(CNS(=O)(=O)CCc2cccs2)CCCN1Cc1ccccc1 ZINC000443895983 567779186 /nfs/dbraw/zinc/77/91/86/567779186.db2.gz LJUMHCPNXCUWLZ-LJQANCHMSA-N 0 3 378.563 3.265 10 0 GGAEHN CC(C)(CN[C@@H]1CCCOc2cc(Br)ccc21)[C@@]1(O)CCOC1 ZINC000647340188 567779643 /nfs/dbraw/zinc/77/96/43/567779643.db2.gz GDFPRMMRDXXDGX-CRAIPNDOSA-N 0 3 384.314 3.430 10 0 GGAEHN CN1CCC[C@]2(CCN(S(=O)(=O)Cc3ccc(Cl)cc3Cl)C2)C1 ZINC000555405962 567782123 /nfs/dbraw/zinc/78/21/23/567782123.db2.gz MZOVKWNRIBONDG-INIZCTEOSA-N 0 3 377.337 3.241 10 0 GGAEHN CN1CCC[C@@]2(CCN(S(=O)(=O)Cc3ccc(Cl)cc3Cl)C2)C1 ZINC000555405966 567782564 /nfs/dbraw/zinc/78/25/64/567782564.db2.gz MZOVKWNRIBONDG-MRXNPFEDSA-N 0 3 377.337 3.241 10 0 GGAEHN CN1CC[C@H](CNC(=O)c2c(F)ccc(C(F)(F)F)c2Br)C1 ZINC000624485612 567783527 /nfs/dbraw/zinc/78/35/27/567783527.db2.gz ZKZMPHUZMAUEBY-MRVPVSSYSA-N 0 3 383.183 3.289 10 0 GGAEHN CC(C(=O)N1CCc2sccc2C1)S(=O)(=O)C(C)(C)c1ccccc1 ZINC000555464623 567785260 /nfs/dbraw/zinc/78/52/60/567785260.db2.gz MTKBXPJITCBKRO-AWEZNQCLSA-N 0 3 377.531 3.371 10 0 GGAEHN Cc1cc(N2CCC[C@H](NCc3ccc(Br)cc3F)C2)n(C)n1 ZINC000444014637 567785607 /nfs/dbraw/zinc/78/56/07/567785607.db2.gz QGRKVVYTSYNNRI-HNNXBMFYSA-N 0 3 381.293 3.389 10 0 GGAEHN O=C(c1cc(Br)cc(N2CCCC2)c1)N1CC[C@H](N2CCCC2)C1 ZINC000668009351 567787912 /nfs/dbraw/zinc/78/79/12/567787912.db2.gz UKVVADZNKIDDGV-KRWDZBQOSA-N 0 3 392.341 3.360 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)c1cc(-c2ccc(Br)cc2)no1 ZINC000668013476 567788600 /nfs/dbraw/zinc/78/86/00/567788600.db2.gz YYMGNZCZGKPAKN-AWEZNQCLSA-N 0 3 378.270 3.270 10 0 GGAEHN OC[C@H](Cc1ccc(F)cc1)NC[C@@H](O)COc1c(Cl)cccc1Cl ZINC000647529866 567789382 /nfs/dbraw/zinc/78/93/82/567789382.db2.gz NHEBHMUTMRUVGG-LSDHHAIUSA-N 0 3 388.266 3.065 10 0 GGAEHN O=C(c1c(F)c(F)c(Br)c(F)c1F)N1CC[C@H](N2CCCC2)C1 ZINC000668009531 567789313 /nfs/dbraw/zinc/78/93/13/567789313.db2.gz YJRXYZRNXZXALD-QMMMGPOBSA-N 0 3 395.194 3.316 10 0 GGAEHN CN(C)[C@H]1CCCN(C(=O)c2c(F)c(F)c(Br)c(F)c2F)C1 ZINC000668022841 567790408 /nfs/dbraw/zinc/79/04/08/567790408.db2.gz RMLUQEIIRBWDIV-ZETCQYMHSA-N 0 3 383.183 3.172 10 0 GGAEHN O=C(Nc1cncc(Br)c1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000533862313 567790588 /nfs/dbraw/zinc/79/05/88/567790588.db2.gz QWZBXKCHVCUUQJ-AWEZNQCLSA-N 0 3 375.270 3.090 10 0 GGAEHN Cc1ccsc1[C@@H](CO)NC[C@H](O)COc1ccc(Cl)cc1Cl ZINC000555589685 567791270 /nfs/dbraw/zinc/79/12/70/567791270.db2.gz CCWSDQCBEQXAMJ-GXTWGEPZSA-N 0 3 376.305 3.426 10 0 GGAEHN C[NH+](C)CCOc1cccc(NC(=O)Cc2ccc(Br)cc2[O-])c1 ZINC000555642382 567793432 /nfs/dbraw/zinc/79/34/32/567793432.db2.gz WKOBFTUHUSIPDK-UHFFFAOYSA-N 0 3 393.281 3.276 10 0 GGAEHN Cc1c(Br)cncc1C(=O)NCc1cccc(OCCN(C)C)c1 ZINC000668078970 567794749 /nfs/dbraw/zinc/79/47/49/567794749.db2.gz YJNVNLYNPWDCKM-UHFFFAOYSA-N 0 3 392.297 3.023 10 0 GGAEHN C[C@@H](CNC(=O)c1c(F)c(F)c(Br)c(F)c1F)N(C)C1CC1 ZINC000668095843 567795756 /nfs/dbraw/zinc/79/57/56/567795756.db2.gz RQHKYBTZRQAZSB-LURJTMIESA-N 0 3 383.183 3.218 10 0 GGAEHN Cc1nn(C)c(C)c1C[C@@H](C)NCc1cn2ccc(Br)cc2n1 ZINC000574764150 567796374 /nfs/dbraw/zinc/79/63/74/567796374.db2.gz LMZQUDXIEHFSHP-LLVKDONJSA-N 0 3 376.302 3.168 10 0 GGAEHN CN1CC[C@@H](NC(=O)COc2cccc(Br)c2)[C@@H]1c1ccccc1 ZINC000534022055 567796947 /nfs/dbraw/zinc/79/69/47/567796947.db2.gz UVQFXKONDNNGSW-MJGOQNOKSA-N 0 3 389.293 3.390 10 0 GGAEHN COc1c(Br)cc(Cl)cc1NC(=O)N[C@@H]1CNCCC1(F)F ZINC000574783120 567797350 /nfs/dbraw/zinc/79/73/50/567797350.db2.gz VZTFJJIBDRUAMJ-SNVBAGLBSA-N 0 3 398.635 3.230 10 0 GGAEHN C[C@H](N[C@H]1CO[C@H](C2CC2)C1)c1ccc(Br)cc1OCCCO ZINC000668183613 567799046 /nfs/dbraw/zinc/79/90/46/567799046.db2.gz KBKCPSLCPSEADU-MJEQTWJJSA-N 0 3 384.314 3.428 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCC1)N[C@@H](CO)c1cccc(Cl)c1Cl ZINC000624788564 567800530 /nfs/dbraw/zinc/80/05/30/567800530.db2.gz WAUZAWDHZLROAY-BBRMVZONSA-N 0 3 386.323 3.343 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCC1)N[C@H](CO)c1cccc(Cl)c1Cl ZINC000624788566 567800554 /nfs/dbraw/zinc/80/05/54/567800554.db2.gz WAUZAWDHZLROAY-CZUORRHYSA-N 0 3 386.323 3.343 10 0 GGAEHN COC[C@@H](CC1CCOCC1)N[C@@H](CO)c1ccc(Br)c(F)c1 ZINC000668188665 567800621 /nfs/dbraw/zinc/80/06/21/567800621.db2.gz LAGRBKGASPCSBN-PBHICJAKSA-N 0 3 390.293 3.043 10 0 GGAEHN COc1ccc(CCC(=O)N2CCCC[C@@H]2CN(C)C)c(Br)c1 ZINC000668211297 567801424 /nfs/dbraw/zinc/80/14/24/567801424.db2.gz BCLQZOVJDNXWCH-OAHLLOKOSA-N 0 3 383.330 3.333 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)CSc1cc(Cl)ccc1Cl ZINC000647822534 567802721 /nfs/dbraw/zinc/80/27/21/567802721.db2.gz VGIMKJJDSOCESM-GJZGRUSLSA-N 0 3 389.348 3.407 10 0 GGAEHN C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)N1CCOC[C@@H]1[C@@H]1CCCN1C ZINC000647823520 567802814 /nfs/dbraw/zinc/80/28/14/567802814.db2.gz JREKJTKDSZUAKX-JEBQAFNWSA-N 0 3 385.335 3.494 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)c1cccc(Br)c1Cl ZINC000647823037 567803159 /nfs/dbraw/zinc/80/31/59/567803159.db2.gz BUHQZRDQWMGGRJ-KBPBESRZSA-N 0 3 387.705 3.038 10 0 GGAEHN C[C@@H](N[C@H]1CCN(C2CCC2)C1=O)c1ccc(I)cc1 ZINC000599092944 567804680 /nfs/dbraw/zinc/80/46/80/567804680.db2.gz LBZDXQFUOJEIQR-ABAIWWIYSA-N 0 3 384.261 3.095 10 0 GGAEHN COC(=O)CCNC(=O)CCN[C@@H](c1ccc(Cl)c(Cl)c1)C(C)C ZINC000599089725 567804713 /nfs/dbraw/zinc/80/47/13/567804713.db2.gz WGCWNJMYVHPYCD-QGZVFWFLSA-N 0 3 375.296 3.350 10 0 GGAEHN CC[C@@H](N[C@@H]1CCN(C2CCC2)C1=O)c1ccc(I)cc1 ZINC000599093296 567804888 /nfs/dbraw/zinc/80/48/88/567804888.db2.gz OJICRMWNSDSLSP-HZPDHXFCSA-N 0 3 398.288 3.485 10 0 GGAEHN CCOC(=O)[C@@H]1CC[C@H](NCc2cc(Br)cnc2OC)C[C@H]1C ZINC000599069657 567804918 /nfs/dbraw/zinc/80/49/18/567804918.db2.gz GMEZHIUHNMBEGP-BYCMXARLSA-N 0 3 385.302 3.310 10 0 GGAEHN Cc1nn(C)c(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c1Br ZINC000647984302 567809043 /nfs/dbraw/zinc/80/90/43/567809043.db2.gz PTDDHLWSBLVGIY-DZGCQCFKSA-N 0 3 392.301 3.058 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)c1cc(Br)cc2[nH]c(=O)[nH]c21 ZINC000668430649 567809593 /nfs/dbraw/zinc/80/95/93/567809593.db2.gz LOZWBIVKAUXFGB-PHIMTYICSA-N 0 3 395.301 3.024 10 0 GGAEHN CC1(OCC(=O)N[C@H](c2ccccc2)c2ccc(Br)cc2)CNC1 ZINC000648019656 567810741 /nfs/dbraw/zinc/81/07/41/567810741.db2.gz PAHHEBCUNLJFFK-GOSISDBHSA-N 0 3 389.293 3.033 10 0 GGAEHN CC1(OCC(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)CNC1 ZINC000648032946 567812219 /nfs/dbraw/zinc/81/22/19/567812219.db2.gz ISAGPSXZSNRQTI-UHFFFAOYSA-N 0 3 382.247 3.498 10 0 GGAEHN CCOc1cc(CN(C)CC2CN(C)C2)cc(Br)c1OC(F)F ZINC000668539663 567813291 /nfs/dbraw/zinc/81/32/91/567813291.db2.gz HIQWZRQHQFKSDL-UHFFFAOYSA-N 0 3 393.272 3.443 10 0 GGAEHN COc1c(Br)cc(CN(C)CC2CN(C)C2)cc1Br ZINC000668537928 567813307 /nfs/dbraw/zinc/81/33/07/567813307.db2.gz QFWPOSBFYYWFAB-UHFFFAOYSA-N 0 3 392.135 3.214 10 0 GGAEHN C[C@H]1CC[C@H](NC2CC(c3ccc(Br)cc3F)C2)CS1(=O)=O ZINC000668563508 567813491 /nfs/dbraw/zinc/81/34/91/567813491.db2.gz YLQQHFPGDCOQRW-AKXGODRKSA-N 0 3 390.318 3.390 10 0 GGAEHN Cc1sc([C@H](C)NC(=O)COC2(C)CNC2)nc1-c1ccc(Cl)cc1 ZINC000648097558 567813474 /nfs/dbraw/zinc/81/34/74/567813474.db2.gz UNBXKLAVYRAYQF-NSHDSACASA-N 0 3 379.913 3.328 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1C[C@@H](C)C(O)[C@H](C)C1 ZINC000668554982 567813667 /nfs/dbraw/zinc/81/36/67/567813667.db2.gz VCOIKPOUECRRGA-CHWSQXEVSA-N 0 3 378.314 3.392 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1C[C@@H](C)[C@H](O)[C@@H](C)C1 ZINC000668554983 567813871 /nfs/dbraw/zinc/81/38/71/567813871.db2.gz VCOIKPOUECRRGA-MCBXIFIFSA-N 0 3 378.314 3.392 10 0 GGAEHN Cc1c2cc(C(=O)N(C)[C@H]3CN4CCC3CC4)[nH]c2ccc1Br ZINC000668589144 567814280 /nfs/dbraw/zinc/81/42/80/567814280.db2.gz ZIEZEOLOSKRFJV-KRWDZBQOSA-N 0 3 376.298 3.405 10 0 GGAEHN COc1ccc(CCC(=O)N(C)[C@@H]2CCN(C3CC3)C2)c(Br)c1 ZINC000668599130 567814524 /nfs/dbraw/zinc/81/45/24/567814524.db2.gz RCEMXELNIFNORR-OAHLLOKOSA-N 0 3 381.314 3.085 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)C1(N)Cc2ccccc2C1 ZINC000648159376 567814741 /nfs/dbraw/zinc/81/47/41/567814741.db2.gz CIIJOQJSTNVGKB-LBPRGKRZSA-N 0 3 389.293 3.131 10 0 GGAEHN CN(C(=O)C(C)(C)Oc1ccc(Br)cc1)[C@@H]1CCN(C2CC2)C1 ZINC000668599150 567814788 /nfs/dbraw/zinc/81/47/88/567814788.db2.gz RSDSXUKCYTYCOP-OAHLLOKOSA-N 0 3 381.314 3.302 10 0 GGAEHN Nc1c(Br)cc(Br)cc1CN[C@H]1C[C@@H](O)C12CCC2 ZINC000668623085 567815153 /nfs/dbraw/zinc/81/51/53/567815153.db2.gz ITMUHQQMZVTNNT-NWDGAFQWSA-N 0 3 390.119 3.187 10 0 GGAEHN Cc1ccc(CC(=O)N2CCCN(C[C@H]3CCCO3)CC2)c(Br)c1 ZINC000648208431 567815303 /nfs/dbraw/zinc/81/53/03/567815303.db2.gz MXDGMEVIAQOLAZ-QGZVFWFLSA-N 0 3 395.341 3.013 10 0 GGAEHN Cn1nc2cc(Br)ccc2c1C(=O)N1CCc2ccccc2[C@@H]1CN ZINC000648199243 567815379 /nfs/dbraw/zinc/81/53/79/567815379.db2.gz LYNBHVRGMHCSLF-KRWDZBQOSA-N 0 3 399.292 3.034 10 0 GGAEHN Cc1ccc(-c2nnc(CCC(=O)NC[C@@H](c3ccccc3)N(C)C)o2)cc1 ZINC000012807363 570221816 /nfs/dbraw/zinc/22/18/16/570221816.db2.gz IVDYSQGKTQVBCY-IBGZPJMESA-N 0 3 378.476 3.397 10 0 GGAEHN O=C(CN1CCC[C@H](C(F)(F)F)C1)NC1CCN(Cc2ccccc2)CC1 ZINC000012811503 570225724 /nfs/dbraw/zinc/22/57/24/570225724.db2.gz FNVCHDXPNYSLNN-KRWDZBQOSA-N 0 3 383.458 3.042 10 0 GGAEHN Cc1c(F)cc(C(N)=O)cc1NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000048309741 570232711 /nfs/dbraw/zinc/23/27/11/570232711.db2.gz ULOUIPUSUODGSS-HNNXBMFYSA-N 0 3 387.430 3.223 10 0 GGAEHN Cc1c(C(=O)N[C@H](C)C(C)C)nnn1-c1cccc2c1CCN(CC1CC1)C2 ZINC000071890395 570275202 /nfs/dbraw/zinc/27/52/02/570275202.db2.gz VQDGYWNGFBGPKG-OAHLLOKOSA-N 0 3 381.524 3.118 10 0 GGAEHN CCC(CC)NC(=O)c1nnn(-c2cccc3c2CCN(CC2CC2)C3)c1C ZINC000071890385 570275322 /nfs/dbraw/zinc/27/53/22/570275322.db2.gz DIMLQUHDYXPYQY-UHFFFAOYSA-N 0 3 381.524 3.262 10 0 GGAEHN CC[C@@H](C)N(C(=O)CN(C)C1CCN(Cc2cc(C)no2)CC1)[C@@H](C)CC ZINC000072308327 570303218 /nfs/dbraw/zinc/30/32/18/570303218.db2.gz QPWXLSYJABARCA-HDICACEKSA-N 0 3 378.561 3.305 10 0 GGAEHN CCOC(=O)c1cc2c(cc1F)[C@@H](N)C[C@@]1(CCN(C(=O)OC(C)(C)C)C1)O2 ZINC000725259952 570307498 /nfs/dbraw/zinc/30/74/98/570307498.db2.gz KWAKFVYOJIZAFV-MGPUTAFESA-N 0 3 394.443 3.164 10 0 GGAEHN CCOC(=O)c1ccc2c(c1)O[C@@]1(CCN(C(=O)OC(C)(C)C)C1)C[C@@H]2N ZINC000725260528 570310051 /nfs/dbraw/zinc/31/00/51/570310051.db2.gz RNRWPNQWSSYDHZ-YWZLYKJASA-N 0 3 376.453 3.025 10 0 GGAEHN CCOC(=O)c1cc(C)c2c(c1)O[C@@]1(CCN(C(=O)OC(C)(C)C)C1)C[C@@H]2N ZINC000725260783 570310618 /nfs/dbraw/zinc/31/06/18/570310618.db2.gz WSCGUPNRDWZURE-BTYIYWSLSA-N 0 3 390.480 3.334 10 0 GGAEHN COc1ccc(OC[C@H](O)CN(Cc2cccc(C)c2)C[C@H]2CCCO2)cc1 ZINC000247877484 570332790 /nfs/dbraw/zinc/33/27/90/570332790.db2.gz AYGNGCIRTBWTHL-NFBKMPQASA-N 0 3 385.504 3.425 10 0 GGAEHN Cc1cccc(-n2nc(C(=O)NC3CCN(C)CC3)nc2-c2ccccc2)c1 ZINC000034910991 570340812 /nfs/dbraw/zinc/34/08/12/570340812.db2.gz ZLVSIBNLKYONFC-UHFFFAOYSA-N 0 3 375.476 3.067 10 0 GGAEHN COc1c(C)cc([C@@H]2CCc3nc(C(=O)NCCN4CCCC4)cn3C2)cc1C ZINC000034899231 570343303 /nfs/dbraw/zinc/34/33/03/570343303.db2.gz YBVOUTPAIGUEHV-GOSISDBHSA-N 0 3 396.535 3.064 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)CC1CCN(C(=O)NC2CCCCC2)CC1 ZINC000035399193 570349779 /nfs/dbraw/zinc/34/97/79/570349779.db2.gz GTYBCVJGMFACDP-SFHVURJKSA-N 0 3 392.588 3.121 10 0 GGAEHN C[C@@H]1CN(C(=O)c2ccc(CNCc3ccc4c[nH]nc4c3)cc2)C[C@H](C)O1 ZINC000237765211 570395361 /nfs/dbraw/zinc/39/53/61/570395361.db2.gz MATFKIKIHWDSMO-IYBDPMFKSA-N 0 3 378.476 3.102 10 0 GGAEHN O=C(C1CCN(c2nc3ccccc3[nH]2)CC1)N1CCN(C2CCCCC2)CC1 ZINC000033070928 570401148 /nfs/dbraw/zinc/40/11/48/570401148.db2.gz GDHPQXKFFBOSOO-UHFFFAOYSA-N 0 3 395.551 3.256 10 0 GGAEHN C[C@H](N[C@@H]1CCCC[C@H]1NC(=O)OC(C)(C)C)C(=O)N1C[C@H](C)C[C@H](C)C1 ZINC000221907413 570403520 /nfs/dbraw/zinc/40/35/20/570403520.db2.gz JNRHZMFLPVOTPD-IGKNDFSCSA-N 0 3 381.561 3.305 10 0 GGAEHN Cc1cccc(Sc2nccnc2SCC(=O)NCCN2CCCC2)c1 ZINC000033289090 570405924 /nfs/dbraw/zinc/40/59/24/570405924.db2.gz DSGXPBLJPDGNRX-UHFFFAOYSA-N 0 3 388.562 3.240 10 0 GGAEHN CSc1ccc(N2C[C@@H](C(=O)NC[C@@H](c3ccccc3)N(C)C)CC2=O)cc1 ZINC000025238831 570408881 /nfs/dbraw/zinc/40/88/81/570408881.db2.gz ONFQUTAENVPJQS-PXNSSMCTSA-N 0 3 397.544 3.181 10 0 GGAEHN CCC(C)(C)NCC(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000013005424 570415147 /nfs/dbraw/zinc/41/51/47/570415147.db2.gz ZBSYGJDMFHNMDO-HZPDHXFCSA-N 0 3 395.569 3.070 10 0 GGAEHN Cc1ccc(CN(C(=O)C2CC2)c2ccc(CC(=O)NCCN(C)C)cc2)cc1 ZINC000037555927 570429995 /nfs/dbraw/zinc/42/99/95/570429995.db2.gz MZVAZWDSTNFANO-UHFFFAOYSA-N 0 3 393.531 3.159 10 0 GGAEHN CCC(=O)N(Cc1cccc(C)c1)c1ccc(CC(=O)NCCN(C)C)cc1 ZINC000037557182 570430244 /nfs/dbraw/zinc/43/02/44/570430244.db2.gz OQXDYLGJDJVYEZ-UHFFFAOYSA-N 0 3 381.520 3.159 10 0 GGAEHN COc1cc(C(=O)N[C@@H]2CN(C3CC3)C[C@H]2C)ccc1OCc1c(C)noc1C ZINC000241301101 570431445 /nfs/dbraw/zinc/43/14/45/570431445.db2.gz LQJDSGAJZLCDSC-BFUOFWGJSA-N 0 3 399.491 3.092 10 0 GGAEHN CC(C)CN1CCCC[C@@H]1C(=O)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1 ZINC000241930382 570431821 /nfs/dbraw/zinc/43/18/21/570431821.db2.gz UIBOGNJVVSJTRI-OXQOHEQNSA-N 0 3 379.495 3.418 10 0 GGAEHN CCOC(=O)c1ccc(OC[C@H](O)CN2CCC[C@H]2c2ccc(OC)cc2)cc1 ZINC000242389698 570432749 /nfs/dbraw/zinc/43/27/49/570432749.db2.gz ZZRPTXNTVANOOK-KNQAVFIVSA-N 0 3 399.487 3.449 10 0 GGAEHN CCCN(Cc1c(-c2ccccc2)noc1N1CCN(C)CC1)C[C@H](O)CC ZINC000035781189 570448257 /nfs/dbraw/zinc/44/82/57/570448257.db2.gz IINZNVBKRSLACC-LJQANCHMSA-N 0 3 386.540 3.076 10 0 GGAEHN COc1ccc(F)c(CN2CCC[C@]3(CCN(Cc4cccnc4)C3)C2=O)c1 ZINC000011937371 570449479 /nfs/dbraw/zinc/44/94/79/570449479.db2.gz LEDJJNXXFIOLQB-JOCHJYFZSA-N 0 3 383.467 3.244 10 0 GGAEHN COc1ccccc1[C@@H](CC(=O)NCCN(C)C)c1cn(C)c2ccccc12 ZINC000035910542 570477839 /nfs/dbraw/zinc/47/78/39/570477839.db2.gz SUCKIHAZPWKISR-LJQANCHMSA-N 0 3 379.504 3.387 10 0 GGAEHN Cc1ccc(Nc2nn[nH]c2C(=O)N2CCN(C3CCCCC3)CC2)cc1C ZINC000067284519 570496071 /nfs/dbraw/zinc/49/60/71/570496071.db2.gz RIVIEZBTDPVCEV-UHFFFAOYSA-N 0 3 382.512 3.256 10 0 GGAEHN CC(=O)Nc1nc2ccc(CC(=O)NCCN(C)Cc3ccccc3)cc2s1 ZINC000032959585 570516179 /nfs/dbraw/zinc/51/61/79/570516179.db2.gz WAOYOEVXKJQREO-UHFFFAOYSA-N 0 3 396.516 3.045 10 0 GGAEHN CN(C)[C@@H](CNC(=O)Cn1c2ccccc2nc1C(F)(F)F)c1ccccc1 ZINC000005265889 570533031 /nfs/dbraw/zinc/53/30/31/570533031.db2.gz QTZXNXNIOSKNPQ-KRWDZBQOSA-N 0 3 390.409 3.474 10 0 GGAEHN COc1ccc(CN(C[C@H](O)Cc2ccccc2)C[C@@H]2CCCO2)cc1OC ZINC000036096066 570533723 /nfs/dbraw/zinc/53/37/23/570533723.db2.gz WKOIPQHLGKCXDR-RTWAWAEBSA-N 0 3 385.504 3.288 10 0 GGAEHN COc1ccc(CN(C[C@H](O)COc2ccccc2C)C[C@@H]2CCCO2)cc1 ZINC000036095277 570534305 /nfs/dbraw/zinc/53/43/05/570534305.db2.gz RJDQZZHLYOTZFW-UNMCSNQZSA-N 0 3 385.504 3.425 10 0 GGAEHN COc1ccc(OC[C@@H](O)CN(Cc2ccc(OC)c(OC)c2)C(C)C)cc1 ZINC000036095795 570534957 /nfs/dbraw/zinc/53/49/57/570534957.db2.gz WMHDHLAZNVGNBE-SFHVURJKSA-N 0 3 389.492 3.363 10 0 GGAEHN COCCN(Cc1cccc(OC)c1)C[C@H](O)COc1ccc(Cl)cc1 ZINC000036100161 570538114 /nfs/dbraw/zinc/53/81/14/570538114.db2.gz QFTCHWCYRJHIEZ-SFHVURJKSA-N 0 3 379.884 3.237 10 0 GGAEHN COCCCN(Cc1ccc(C)s1)C[C@H](O)COc1ccc(OC)cc1 ZINC000036101418 570538608 /nfs/dbraw/zinc/53/86/08/570538608.db2.gz SLMKTNRWWMLMJQ-KRWDZBQOSA-N 0 3 379.522 3.344 10 0 GGAEHN COc1ccc(OC)c(CNC(=O)C2=CCN(Cc3ccc(C)cc3)CC2)c1 ZINC000064817978 570552915 /nfs/dbraw/zinc/55/29/15/570552915.db2.gz FNYVQCARCQUOPH-UHFFFAOYSA-N 0 3 380.488 3.461 10 0 GGAEHN C[C@@H](NC[C@@H](O)Cc1ccc2ccccc2c1)c1ccc2c(c1)NC(=O)CO2 ZINC000225396571 570569925 /nfs/dbraw/zinc/56/99/25/570569925.db2.gz JRINESWTMRLYRQ-QRWLVFNGSA-N 0 3 376.456 3.425 10 0 GGAEHN CCOc1cc(CNCCOCCO)ccc1OCc1ccc(Cl)cc1 ZINC000010435670 570570059 /nfs/dbraw/zinc/57/00/59/570570059.db2.gz PIUPPPJPMSCBIR-UHFFFAOYSA-N 0 3 379.884 3.416 10 0 GGAEHN CCOc1cc(CNCCOCCO)cc(Cl)c1OCc1ccccc1 ZINC000010435695 570570380 /nfs/dbraw/zinc/57/03/80/570570380.db2.gz WXJWZLNZODQUQX-UHFFFAOYSA-N 0 3 379.884 3.416 10 0 GGAEHN COc1cc(CNCCOCCO)cc(Cl)c1OCc1ccccc1F ZINC000010435707 570570425 /nfs/dbraw/zinc/57/04/25/570570425.db2.gz HDYLSHMPDUGGIB-UHFFFAOYSA-N 0 3 383.847 3.165 10 0 GGAEHN Cn1nnnc1SCCNCc1ccc(OCc2ccccc2)c(Cl)c1 ZINC000010475047 570571292 /nfs/dbraw/zinc/57/12/92/570571292.db2.gz ZQCSZQUFMZPRKY-UHFFFAOYSA-N 0 3 389.912 3.324 10 0 GGAEHN CN(C)CCNC(=O)c1ccc2c(c1)NC(=O)/C(=C/c1cccc(Cl)c1)O2 ZINC000032983935 570572050 /nfs/dbraw/zinc/57/20/50/570572050.db2.gz AERVDFCOPBGYTH-WQRHYEAKSA-N 0 3 385.851 3.003 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)[C@@H](C)NC(=O)Nc1ccccc1)c1ccccc1 ZINC000032983776 570572093 /nfs/dbraw/zinc/57/20/93/570572093.db2.gz QPAUDEDFTOUKCY-XLIONFOSSA-N 0 3 382.508 3.396 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1cnn(-c2ccccc2)c1-n1cccc1 ZINC000006807046 570607409 /nfs/dbraw/zinc/60/74/09/570607409.db2.gz QGDCUXGUOGCKLM-SFHVURJKSA-N 0 3 377.492 3.267 10 0 GGAEHN Cc1cc2nc3sc(C(=O)NCCN4CCCC[C@H]4C)cc(=O)n3c2cc1C ZINC000033009093 570620534 /nfs/dbraw/zinc/62/05/34/570620534.db2.gz NWAHEGSOFJDSLT-OAHLLOKOSA-N 0 3 398.532 3.130 10 0 GGAEHN Cc1nc2ccccn2c(=O)c1CCN1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000225846379 570625778 /nfs/dbraw/zinc/62/57/78/570625778.db2.gz RLNOQKOOWJOEQL-IBGZPJMESA-N 0 3 391.471 3.154 10 0 GGAEHN Cc1sc2ccn(CC(C)C)c(=O)c2c1C(=O)NCCN1CCCCC1 ZINC000097112821 570664547 /nfs/dbraw/zinc/66/45/47/570664547.db2.gz YRYMWKPFHQZNMD-UHFFFAOYSA-N 0 3 375.538 3.243 10 0 GGAEHN COc1cc(CN2CCC(CCC(=O)N3CCCC3)CC2)cc(OC)c1O ZINC000012576930 570682873 /nfs/dbraw/zinc/68/28/73/570682873.db2.gz UGRPTQRAYTZTBC-UHFFFAOYSA-N 0 3 376.497 3.024 10 0 GGAEHN COc1cc(CN(C)Cc2[nH]nc3c2CCC3)ccc1OCCN1CCCC1 ZINC000055211411 570687513 /nfs/dbraw/zinc/68/75/13/570687513.db2.gz KCYPWWVEIQYWFI-UHFFFAOYSA-N 0 3 384.524 3.014 10 0 GGAEHN Cn1cc([C@@H]2NC(=O)CC[C@H]2NCc2cccc(Oc3ccccc3)c2)cn1 ZINC000275721358 570698856 /nfs/dbraw/zinc/69/88/56/570698856.db2.gz ZAOJKMPPJJNMNF-IRLDBZIGSA-N 0 3 376.460 3.322 10 0 GGAEHN Cc1ccc2c(cc(NC(=O)C3CCC3)cc2C(=O)NC2CCN(C)CC2)n1 ZINC000065136076 570707248 /nfs/dbraw/zinc/70/72/48/570707248.db2.gz IWMDYZAAMUPCTM-UHFFFAOYSA-N 0 3 380.492 3.106 10 0 GGAEHN CCOC(=O)COc1cccc(C(=O)NC[C@H](c2ccc(CC)cc2)N(C)C)c1 ZINC000058028902 570708008 /nfs/dbraw/zinc/70/80/08/570708008.db2.gz XDPGEUODKREWND-OAQYLSRUSA-N 0 3 398.503 3.224 10 0 GGAEHN CN1CCCN(c2ccc(CNC(=O)c3occc3-c3ccccc3)cn2)CC1 ZINC000058101335 570709363 /nfs/dbraw/zinc/70/93/63/570709363.db2.gz GHIBLYWCGNTBLE-UHFFFAOYSA-N 0 3 390.487 3.414 10 0 GGAEHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1ccc(-c2ccncc2)[nH]c1=O ZINC000058132863 570710153 /nfs/dbraw/zinc/71/01/53/570710153.db2.gz XQQFRNOIKBAYOF-OAQYLSRUSA-N 0 3 388.471 3.004 10 0 GGAEHN Cc1nn(CC(C)C)c2sc(C(=O)N3CCN(c4ccncc4)CC3)cc12 ZINC000012791612 570714390 /nfs/dbraw/zinc/71/43/90/570714390.db2.gz JDUUUAABGLJCLS-UHFFFAOYSA-N 0 3 383.521 3.420 10 0 GGAEHN Cc1c(NC(=O)CCN(C)Cc2ccc(C)cc2)c(=O)n(-c2ccccc2)n1C ZINC000012793546 570714842 /nfs/dbraw/zinc/71/48/42/570714842.db2.gz SFDMEJCQALMHGK-UHFFFAOYSA-N 0 3 392.503 3.253 10 0 GGAEHN O=C(NCCN1CCCCCC1)c1csc(-c2ccc(N3CCCC3)nc2)n1 ZINC000065165318 570720946 /nfs/dbraw/zinc/72/09/46/570720946.db2.gz MWCJYBUGBJDQJE-UHFFFAOYSA-N 0 3 399.564 3.411 10 0 GGAEHN COc1ccc(OC)c(-c2cc(C(=O)NCc3ccccc3CN(C)C)no2)c1 ZINC000058265633 570723615 /nfs/dbraw/zinc/72/36/15/570723615.db2.gz XLEIFDWKBAOCMQ-UHFFFAOYSA-N 0 3 395.459 3.350 10 0 GGAEHN Cc1nc(C(=O)N(C)C2CCN(C(C)C)CC2)nn1-c1ccccc1Cl ZINC000058341096 570727693 /nfs/dbraw/zinc/72/76/93/570727693.db2.gz WGNXGVZCMUQMSK-UHFFFAOYSA-N 0 3 375.904 3.174 10 0 GGAEHN COc1ccc([C@H](CNC(=O)Nc2ccc(C(=O)NC3CC3)cc2)N(C)C)cc1 ZINC000058883265 570736326 /nfs/dbraw/zinc/73/63/26/570736326.db2.gz MWCCYHWDQSEZRU-FQEVSTJZSA-N 0 3 396.491 3.012 10 0 GGAEHN COc1ccc(NC(=O)c2cccnc2N2CCN[C@@H](c3ccccc3)C2)cc1 ZINC000065255743 570753841 /nfs/dbraw/zinc/75/38/41/570753841.db2.gz UPTIFQCEDBAPKL-OAQYLSRUSA-N 0 3 388.471 3.493 10 0 GGAEHN O=C(NCc1ccc(F)cc1)c1ccnc(N2CCN[C@@H](c3ccccc3)C2)c1 ZINC000065255922 570754199 /nfs/dbraw/zinc/75/41/99/570754199.db2.gz QBHWVNKVXNQHAJ-OAQYLSRUSA-N 0 3 390.462 3.302 10 0 GGAEHN Cc1ccc(CNC(=O)c2cccnc2N2CCN[C@H](c3ccccc3)C2)o1 ZINC000065255814 570754325 /nfs/dbraw/zinc/75/43/25/570754325.db2.gz QQAWNDUBPQWMEM-FQEVSTJZSA-N 0 3 376.460 3.064 10 0 GGAEHN O=C(NCc1ccc(F)cc1)c1ccnc(N2CCN[C@H](c3ccccc3)C2)c1 ZINC000065255921 570754410 /nfs/dbraw/zinc/75/44/10/570754410.db2.gz QBHWVNKVXNQHAJ-NRFANRHFSA-N 0 3 390.462 3.302 10 0 GGAEHN O=C(NCc1cccs1)c1ccnc(N2CCN[C@@H](c3ccccc3)C2)c1 ZINC000065255956 570754825 /nfs/dbraw/zinc/75/48/25/570754825.db2.gz JIGFBYWFCWCBAU-LJQANCHMSA-N 0 3 378.501 3.224 10 0 GGAEHN O=C(NCc1cccc(F)c1)c1ccnc(N2CCN[C@@H](c3ccccc3)C2)c1 ZINC000065255948 570754863 /nfs/dbraw/zinc/75/48/63/570754863.db2.gz KCCHDGXECVGGAJ-OAQYLSRUSA-N 0 3 390.462 3.302 10 0 GGAEHN O=C(NCc1cccs1)c1cccc(N2CCN[C@H](c3ccccc3)C2)n1 ZINC000065256287 570754974 /nfs/dbraw/zinc/75/49/74/570754974.db2.gz BXQRRICQBQJHMS-IBGZPJMESA-N 0 3 378.501 3.224 10 0 GGAEHN COc1ccccc1NC(=O)c1cccc(N2CCN[C@@H](c3ccccc3)C2)n1 ZINC000065256236 570755107 /nfs/dbraw/zinc/75/51/07/570755107.db2.gz PNELSKLEOIEYAF-HXUWFJFHSA-N 0 3 388.471 3.493 10 0 GGAEHN Cc1ccc(CNC(=O)c2cccc(N3CCN[C@@H](c4ccccc4)C3)n2)cc1 ZINC000065256258 570755214 /nfs/dbraw/zinc/75/52/14/570755214.db2.gz MQVDNKOAPUWGMS-JOCHJYFZSA-N 0 3 386.499 3.471 10 0 GGAEHN O=C(NCCc1cccs1)c1cccc(N2CCN[C@@H](c3ccccc3)C2)n1 ZINC000065256282 570755284 /nfs/dbraw/zinc/75/52/84/570755284.db2.gz PCBKBJDGVQEZMO-HXUWFJFHSA-N 0 3 392.528 3.267 10 0 GGAEHN O=C(NCc1ccc(F)cc1)c1cccc(N2CCN[C@H](c3ccccc3)C2)n1 ZINC000065256251 570755288 /nfs/dbraw/zinc/75/52/88/570755288.db2.gz WDQMSNQZWSQTRU-NRFANRHFSA-N 0 3 390.462 3.302 10 0 GGAEHN CCN(C(=O)C(=O)NC1CCN(Cc2cccc(C)c2)CC1)c1cccc(F)c1 ZINC000052677957 570759155 /nfs/dbraw/zinc/75/91/55/570759155.db2.gz OQWGJLNFZVYFAZ-UHFFFAOYSA-N 0 3 397.494 3.268 10 0 GGAEHN Cc1nnc(-c2nnc(N3CCN(C4CCCCC4)CC3)c3ccccc32)o1 ZINC000065258129 570759815 /nfs/dbraw/zinc/75/98/15/570759815.db2.gz NMWZAQRHWOBFTR-UHFFFAOYSA-N 0 3 378.480 3.443 10 0 GGAEHN CN(C)CCNc1nnc(-c2nc(-c3ccc(F)cc3)no2)c2ccccc21 ZINC000065258333 570760266 /nfs/dbraw/zinc/76/02/66/570760266.db2.gz OYKQHHCHDCVXSF-UHFFFAOYSA-N 0 3 378.411 3.459 10 0 GGAEHN Cc1cc(-n2nc(C3CC3)nc2Cn2cc(C(F)(F)F)ccc2=O)ccn1 ZINC000065535249 570772872 /nfs/dbraw/zinc/77/28/72/570772872.db2.gz LVHQZCICRYVJLE-UHFFFAOYSA-N 0 3 375.354 3.077 10 0 GGAEHN CCN(CC)c1cc(CCC(=O)NCCCN2CCc3ccccc3C2)ccn1 ZINC000065270059 570773002 /nfs/dbraw/zinc/77/30/02/570773002.db2.gz ANIYHAVRMQDGKR-UHFFFAOYSA-N 0 3 394.563 3.425 10 0 GGAEHN CCOc1ccccc1CN1CC[C@H](c2nc3cccnc3n2CCOC)C1 ZINC000065285380 570781036 /nfs/dbraw/zinc/78/10/36/570781036.db2.gz YZYREXNIORKJGM-SFHVURJKSA-N 0 3 380.492 3.466 10 0 GGAEHN COC1(c2nc(Cc3ccccc3)no2)CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000283937543 570786328 /nfs/dbraw/zinc/78/63/28/570786328.db2.gz FUFLTPYJEOWQRE-HXUWFJFHSA-N 0 3 393.487 3.332 10 0 GGAEHN CN(C)Cc1ccccc1CNC(=O)Cn1c2ccccc2nc1C(F)(F)F ZINC000007118824 570792711 /nfs/dbraw/zinc/79/27/11/570792711.db2.gz PCWYFZHRFREWLC-UHFFFAOYSA-N 0 3 390.409 3.433 10 0 GGAEHN O=C(CSc1nccnc1Oc1ccccc1)NCCN1CCCCCC1 ZINC000065111111 570816838 /nfs/dbraw/zinc/81/68/38/570816838.db2.gz XRKVZTRHMGLYFC-UHFFFAOYSA-N 0 3 386.521 3.353 10 0 GGAEHN Cc1ccc(C)c(N2CCN(C(=O)C3CCN(c4ccncc4)CC3)CC2)c1 ZINC000033128936 570817920 /nfs/dbraw/zinc/81/79/20/570817920.db2.gz QEVFORWKPNYMMK-UHFFFAOYSA-N 0 3 378.520 3.264 10 0 GGAEHN Cc1ccc(C)c(N2CCN(C(=O)[C@H]3CCCN(c4ccncc4)C3)CC2)c1 ZINC000033128824 570818013 /nfs/dbraw/zinc/81/80/13/570818013.db2.gz QBZJVTWNMLXKEP-FQEVSTJZSA-N 0 3 378.520 3.264 10 0 GGAEHN CCN1CCN(CCCNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]c2C)CC1 ZINC000033139661 570826486 /nfs/dbraw/zinc/82/64/86/570826486.db2.gz IWATYIKAPYYKNI-UHFFFAOYSA-N 0 3 382.552 3.364 10 0 GGAEHN COc1ccc(CN2CCCN(CCC(=O)N3CCc4ccccc43)CC2)cc1 ZINC000032825258 570839243 /nfs/dbraw/zinc/83/92/43/570839243.db2.gz PEUJCKZQIDACCJ-UHFFFAOYSA-N 0 3 393.531 3.182 10 0 GGAEHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(-n2cncn2)c(F)c1 ZINC000170597555 570855770 /nfs/dbraw/zinc/85/57/70/570855770.db2.gz JLKBXLZMXWSHSF-FQEVSTJZSA-N 0 3 395.482 3.293 10 0 GGAEHN COc1cc(CC(=O)NCCN2CC=C(C(C)(C)C)CC2)cc(OC)c1OC ZINC000170599182 570857356 /nfs/dbraw/zinc/85/73/56/570857356.db2.gz MDXFPLAYFBGSLT-UHFFFAOYSA-N 0 3 390.524 3.049 10 0 GGAEHN CC[C@@H]1CCCCN1CCCNC(=O)CCS(=O)(=O)Cc1ccc(C)cc1 ZINC000004711125 570857444 /nfs/dbraw/zinc/85/74/44/570857444.db2.gz IQHOSLHQFUBLKP-HXUWFJFHSA-N 0 3 394.581 3.071 10 0 GGAEHN Cc1nc(-c2ccc(C(=O)NC3CCN(Cc4ccccc4)CC3)cc2)no1 ZINC000033254171 570862262 /nfs/dbraw/zinc/86/22/62/570862262.db2.gz SARBUUIHSVPWID-UHFFFAOYSA-N 0 3 376.460 3.439 10 0 GGAEHN CC(C(=O)NC1CCC(C)CC1)S(=O)(=O)CCCOc1ccc(F)cc1 ZINC000032929859 570943024 /nfs/dbraw/zinc/94/30/24/570943024.db2.gz XIIHJJZDKWMNKI-ISXOHVOVSA-N 0 3 385.501 3.093 10 0 GGAEHN Cc1nc2cccnc2n1-c1cc(C(=O)NCCN2CCCC2)ccc1Cl ZINC000032932231 570946821 /nfs/dbraw/zinc/94/68/21/570946821.db2.gz STEPQWJXTVXUQY-UHFFFAOYSA-N 0 3 383.883 3.208 10 0 GGAEHN Cc1ccc2c(CN3CCC(C(=O)Nc4ccccn4)CC3)cc(=O)oc2c1 ZINC000052828470 570948911 /nfs/dbraw/zinc/94/89/11/570948911.db2.gz FMENRXORLWJNBV-UHFFFAOYSA-N 0 3 377.444 3.347 10 0 GGAEHN CC(C)c1ccc(-c2nc(N3CCN(C(C)C)CC3)nc3nn(C)c(N)c32)cc1 ZINC000037361544 570949520 /nfs/dbraw/zinc/94/95/20/570949520.db2.gz VQDXQIQVRQXIAA-UHFFFAOYSA-N 0 3 393.539 3.266 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)C1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000052954686 570958708 /nfs/dbraw/zinc/95/87/08/570958708.db2.gz DAJFELFOKCCXGU-KRWDZBQOSA-N 0 3 384.442 3.354 10 0 GGAEHN O=C(Nc1cccc(CN[C@H]2CCN(CCc3ccccc3)C2)c1)[C@H]1CCCO1 ZINC000107068679 570970589 /nfs/dbraw/zinc/97/05/89/570970589.db2.gz PJFXGOHPGYQHIS-XZOQPEGZSA-N 0 3 393.531 3.211 10 0 GGAEHN CC(C)OCCOCc1cccc(NC(=O)N(C)[C@@H]2CCN(C)C[C@H]2C)c1 ZINC000107076457 570970929 /nfs/dbraw/zinc/97/09/29/570970929.db2.gz OKZKMDVBTRPHKS-YLJYHZDGSA-N 0 3 377.529 3.432 10 0 GGAEHN CCN1CCc2c(cccc2NC(=O)c2cn(-c3ccc(F)cc3C)nn2)C1 ZINC000252571290 570996007 /nfs/dbraw/zinc/99/60/07/570996007.db2.gz XRITYAQOQOFXGO-UHFFFAOYSA-N 0 3 379.439 3.345 10 0 GGAEHN Cc1cccc(CN2CCC(NC(=O)N[C@H]3COc4ccccc4C3)CC2)c1 ZINC000045743946 570996084 /nfs/dbraw/zinc/99/60/84/570996084.db2.gz UFPVZRAKYWLLSO-OAQYLSRUSA-N 0 3 379.504 3.262 10 0 GGAEHN C[C@H]1CN(C(=O)C2CCN(CCOc3ccc(Cl)cc3)CC2)C[C@H](C)O1 ZINC000045803035 570997147 /nfs/dbraw/zinc/99/71/47/570997147.db2.gz MMJBEIBGIKQISQ-HOTGVXAUSA-N 0 3 380.916 3.067 10 0 GGAEHN CC(C)C[C@@H](N[C@H](C)C(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccccc1 ZINC000019625361 571021797 /nfs/dbraw/zinc/02/17/97/571021797.db2.gz ZOHDYDWKZVMLMB-DNVCBOLYSA-N 0 3 389.521 3.038 10 0 GGAEHN CC(=O)Nc1ccc(CNCc2cc(Br)c3c(c2)OCCO3)cc1 ZINC000054173333 1406639136 /nfs/dbraw/zinc/63/91/36/1406639136.db2.gz BOTKHKYIUUFLOL-UHFFFAOYSA-N 0 3 391.265 3.469 10 0 GGAEHN C[C@H](C(=O)N1CCN(c2ccccc2)CC1)N1CCC(c2ccc(O)cc2)CC1 ZINC000055103205 1406885702 /nfs/dbraw/zinc/88/57/02/1406885702.db2.gz GXECYWNSIDKREC-LJQANCHMSA-N 0 3 393.531 3.309 10 0 GGAEHN CC[NH+](CC)CCOc1ccccc1CNC(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000055255989 1406914703 /nfs/dbraw/zinc/91/47/03/1406914703.db2.gz GGOQGBZSDINOFV-UHFFFAOYSA-N 0 3 399.491 3.001 10 0 GGAEHN COc1ccc(C(=O)C2CCN(C[C@H](O)COCc3ccccc3)CC2)cc1 ZINC000055471988 1406974786 /nfs/dbraw/zinc/97/47/86/1406974786.db2.gz MDUNJVVXQILGSQ-NRFANRHFSA-N 0 3 383.488 3.168 10 0 GGAEHN Cc1nnsc1C(=O)Nc1ccc(N2CCN(Cc3ccccc3)CC2)cc1 ZINC000007965529 1398782908 /nfs/dbraw/zinc/78/29/08/1398782908.db2.gz SCNCTOGQEAZEJY-UHFFFAOYSA-N 0 3 393.516 3.421 10 0 GGAEHN CCn1nc(C(=O)NC[C@@H](c2cccs2)N2CCCC2)c2ccccc2c1=O ZINC000009516087 1398859886 /nfs/dbraw/zinc/85/98/86/1398859886.db2.gz CCNJKLAZNIRTJT-KRWDZBQOSA-N 0 3 396.516 3.045 10 0 GGAEHN CCN(Cc1ccccc1)C(=O)[C@H]1C[C@H]2CCCN2[C@]12c1ccccc1NC2=O ZINC000020512911 1399348035 /nfs/dbraw/zinc/34/80/35/1399348035.db2.gz UPUDLEFGJUKYTF-DRMXPCRNSA-N 0 3 389.499 3.367 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)c1cccc(OCC(=O)OC)c1)c1ccsc1 ZINC000056508215 1407349234 /nfs/dbraw/zinc/34/92/34/1407349234.db2.gz BGXOTLNWECMIJK-SFHVURJKSA-N 0 3 390.505 3.113 10 0 GGAEHN COC(=O)Nc1ccc(CNC(=O)N(CCc2ccccc2)CCN(C)C)cc1 ZINC000046976985 1404659206 /nfs/dbraw/zinc/65/92/06/1404659206.db2.gz FCZNKFWWEGGTHJ-UHFFFAOYSA-N 0 3 398.507 3.181 10 0 GGAEHN CS(=O)(=O)Nc1ccc(CNCc2ccc(OCc3ccncc3)cc2)cc1 ZINC000047750379 1404920901 /nfs/dbraw/zinc/92/09/01/1404920901.db2.gz FBTGAYONARUSIR-UHFFFAOYSA-N 0 3 397.500 3.322 10 0 GGAEHN COc1ccc([C@@H](C)NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(OC)c1 ZINC000047964800 1405012675 /nfs/dbraw/zinc/01/26/75/1405012675.db2.gz FMSOIKYGJNYJAU-SJLPKXTDSA-N 0 3 383.492 3.339 10 0 GGAEHN O=C(c1ccc(CNCc2ccc(-c3ccccc3)cc2)cc1)N1CCNC(=O)C1 ZINC000048716900 1405267199 /nfs/dbraw/zinc/26/71/99/1405267199.db2.gz AXOAOLXAICBNRA-UHFFFAOYSA-N 0 3 399.494 3.215 10 0 GGAEHN COc1cc(CN[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)cc(OC)c1 ZINC000048744803 1405278266 /nfs/dbraw/zinc/27/82/66/1405278266.db2.gz DJFOZPFIGWEZJV-OAHLLOKOSA-N 0 3 384.476 3.212 10 0 GGAEHN COc1ccccc1[C@@H](CNCc1ccc(C(N)=O)cc1)NC(=O)OC(C)(C)C ZINC000048750345 1405281285 /nfs/dbraw/zinc/28/12/85/1405281285.db2.gz DQKMPCCENLWYHM-GOSISDBHSA-N 0 3 399.491 3.150 10 0 GGAEHN Cc1ccc([C@H](CNC(=O)[C@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)N(C)C)cc1 ZINC000049407841 1405378309 /nfs/dbraw/zinc/37/83/09/1405378309.db2.gz FVQRDIOWFIWPCH-UNMCSNQZSA-N 0 3 393.531 3.384 10 0 GGAEHN Cc1ccc([C@@H](CNC(=O)[C@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)N(C)C)cc1 ZINC000049407838 1405378474 /nfs/dbraw/zinc/37/84/74/1405378474.db2.gz FVQRDIOWFIWPCH-RBBKRZOGSA-N 0 3 393.531 3.384 10 0 GGAEHN Cc1ccc(CN(CCN(C)C)C(=O)NCc2cnn(Cc3ccccc3)c2)o1 ZINC000056875043 1407462448 /nfs/dbraw/zinc/46/24/48/1407462448.db2.gz APERNJBXRKBLTR-UHFFFAOYSA-N 0 3 395.507 3.106 10 0 GGAEHN O=C(CNC(=O)c1ccccc1Cl)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000057615861 1407668011 /nfs/dbraw/zinc/66/80/11/1407668011.db2.gz UFHITHXKHJKPOV-IBGZPJMESA-N 0 3 385.895 3.023 10 0 GGAEHN CNC(=O)C1CCC(N[C@H](C(=O)Nc2cccc(OC)c2)c2ccccc2)CC1 ZINC000063311747 1408335212 /nfs/dbraw/zinc/33/52/12/1408335212.db2.gz HDHVMFXIEIRMNM-NGICGMGXSA-N 0 3 395.503 3.269 10 0 GGAEHN CCOc1c(OC)cc(CNCc2cn(C)nc2-c2ccncc2)cc1OC ZINC000064616226 1408586858 /nfs/dbraw/zinc/58/68/58/1408586858.db2.gz FSWSRHHASFMONE-UHFFFAOYSA-N 0 3 382.464 3.188 10 0 GGAEHN COc1ccc(OC)c(CCNC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1 ZINC000065539654 1408685707 /nfs/dbraw/zinc/68/57/07/1408685707.db2.gz CSCTUHGJCAZQMF-NRFANRHFSA-N 0 3 397.519 3.383 10 0 GGAEHN COc1ccc2ccccc2c1CNCc1cccnc1N1CCN(C)CC1 ZINC000066877009 1408939466 /nfs/dbraw/zinc/93/94/66/1408939466.db2.gz HAOQFJHCZBNNHN-UHFFFAOYSA-N 0 3 376.504 3.285 10 0 GGAEHN CN1CCN(c2ncccc2CNCc2c[nH]nc2-c2ccc(Cl)cc2)CC1 ZINC000066876879 1408939675 /nfs/dbraw/zinc/93/96/75/1408939675.db2.gz CNGQGLQUDSIXNH-UHFFFAOYSA-N 0 3 396.926 3.167 10 0 GGAEHN C[C@@H]1CN(Cc2ccc(CNCc3nc4ccccc4n3C)cc2)C[C@@H](C)O1 ZINC000066971275 1408968953 /nfs/dbraw/zinc/96/89/53/1408968953.db2.gz DJKOJCIRMVGOJE-QZTJIDSGSA-N 0 3 378.520 3.472 10 0 GGAEHN Cc1nn(-c2ccc(F)cc2)c(C)c1CNC[C@H](O)COc1ccc(F)cc1 ZINC000067252458 1409053282 /nfs/dbraw/zinc/05/32/82/1409053282.db2.gz GXSAHKHHMCOYTA-IBGZPJMESA-N 0 3 387.430 3.297 10 0 GGAEHN CN1CCN(C(=O)c2ccc(CNCc3ccc(C(F)(F)F)cc3)cc2)CC1 ZINC000067668701 1409203187 /nfs/dbraw/zinc/20/31/87/1409203187.db2.gz DOYZMVUWHKNECK-UHFFFAOYSA-N 0 3 391.437 3.383 10 0 GGAEHN O=C(NC[C@@H]1CCCO1)c1cccc(CNCc2ccc3ncccc3c2)c1 ZINC000067979582 1409268928 /nfs/dbraw/zinc/26/89/28/1409268928.db2.gz COJNFYIKIDCNJY-NRFANRHFSA-N 0 3 375.472 3.433 10 0 GGAEHN C[C@H](C(=O)N[C@@H](C)c1cccc2ccccc21)N1CCC[C@H](C(=O)N(C)C)C1 ZINC000068970932 1409535650 /nfs/dbraw/zinc/53/56/50/1409535650.db2.gz HTFFEVNORTWHST-SCTDSRPQSA-N 0 3 381.520 3.206 10 0 GGAEHN CCCOc1cccc(CNCc2ccc(C(=O)N3CCN(C)CC3)cc2)c1 ZINC000069706672 1409678450 /nfs/dbraw/zinc/67/84/50/1409678450.db2.gz HRJKROIYKXBDRC-UHFFFAOYSA-N 0 3 381.520 3.153 10 0 GGAEHN C[C@@H](NCc1ccc(OCC(N)=O)cc1)c1cccc(OCc2ccccn2)c1 ZINC000069755668 1409692724 /nfs/dbraw/zinc/69/27/24/1409692724.db2.gz FQUXGQRCLSFWIO-QGZVFWFLSA-N 0 3 391.471 3.376 10 0 GGAEHN CCCNC(=O)c1nnn(-c2cccc3c2CCN(Cc2ccccc2)C3)c1C ZINC000069848284 1409712859 /nfs/dbraw/zinc/71/28/59/1409712859.db2.gz KDCGPNCNGBNJGU-UHFFFAOYSA-N 0 3 389.503 3.274 10 0 GGAEHN Cc1c(C(=O)NC(C)C)nnn1-c1cccc2c1CCN(Cc1ccccc1)C2 ZINC000069878027 1409720126 /nfs/dbraw/zinc/72/01/26/1409720126.db2.gz PJGXHGNAEVZUEU-UHFFFAOYSA-N 0 3 389.503 3.272 10 0 GGAEHN Cc1nn(C)c(Cl)c1CNCc1ccc(CN2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000073803785 1409866026 /nfs/dbraw/zinc/86/60/26/1409866026.db2.gz DEUDOVRBMIMFRN-GASCZTMLSA-N 0 3 376.932 3.281 10 0 GGAEHN COc1cc(C(=O)N[C@H]2CN(C3CC3)C[C@@H]2C)ccc1OCc1c(C)noc1C ZINC000079099503 1409957557 /nfs/dbraw/zinc/95/75/57/1409957557.db2.gz LQJDSGAJZLCDSC-DJJJIMSYSA-N 0 3 399.491 3.092 10 0 GGAEHN Cn1cnnc1C1CCN(Cc2cccc3c2N(C(=O)OC(C)(C)C)CC3)CC1 ZINC000091795174 1410081947 /nfs/dbraw/zinc/08/19/47/1410081947.db2.gz HXSUZHNGNSMYGI-UHFFFAOYSA-N 0 3 397.523 3.492 10 0 GGAEHN CCNC(=O)Nc1c[nH]nc1[C@@H]1CCCN(Cc2c[nH]nc2-c2ccccc2)C1 ZINC000096000094 1410320384 /nfs/dbraw/zinc/32/03/84/1410320384.db2.gz TYEQKBQDVWAIGR-MRXNPFEDSA-N 0 3 393.495 3.321 10 0 GGAEHN Cc1noc(C)c1CN1CC[C@@]2(C1)COCc1cnc(-c3ccccc3)nc12 ZINC000096080380 1410322551 /nfs/dbraw/zinc/32/25/51/1410322551.db2.gz FAMMFKJWBNTCIB-JOCHJYFZSA-N 0 3 376.460 3.422 10 0 GGAEHN CN(C)C[C@@H](NC(=O)Nc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 ZINC000102796851 1410762979 /nfs/dbraw/zinc/76/29/79/1410762979.db2.gz RJZVZVWDYCBHSW-LJQANCHMSA-N 0 3 386.471 3.087 10 0 GGAEHN Cc1cccc(-c2n[nH]cc2CNCc2cccc(OCC(=O)N(C)C)c2)c1 ZINC000103342950 1410849944 /nfs/dbraw/zinc/84/99/44/1410849944.db2.gz DFALFWPPLBUSEY-UHFFFAOYSA-N 0 3 378.476 3.142 10 0 GGAEHN C[C@H](NCc1ccc2c(c1)OCCO2)c1cc(F)ccc1N1CCN(C)CC1 ZINC000105463025 1411069015 /nfs/dbraw/zinc/06/90/15/1411069015.db2.gz ANYIDSCIKXCFMY-INIZCTEOSA-N 0 3 385.483 3.200 10 0 GGAEHN COc1ccc(CNC[C@H](O)COc2ccc(F)c(F)c2)cc1OC(F)F ZINC000105499917 1411073198 /nfs/dbraw/zinc/07/31/98/1411073198.db2.gz ALNOJJHNDQKJGE-LBPRGKRZSA-N 0 3 389.345 3.104 10 0 GGAEHN COc1cc(OC)c(OC)cc1CN[C@@H]1CCN(c2ccc(F)cc2F)C1 ZINC000106488077 1411225307 /nfs/dbraw/zinc/22/53/07/1411225307.db2.gz BBXBXOXHGZHIJP-OAHLLOKOSA-N 0 3 378.419 3.359 10 0 GGAEHN CCN1CCN([C@H]2CCN([C@@H](C)c3nnc(-c4cccc(Cl)c4)o3)C2)CC1 ZINC000107371229 1411366445 /nfs/dbraw/zinc/36/64/45/1411366445.db2.gz HGWHMSBXQWYDCN-YJBOKZPZSA-N 0 3 389.931 3.163 10 0 GGAEHN CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)CC1CCC(c2ccccc2)CC1 ZINC000108264781 1411462315 /nfs/dbraw/zinc/46/23/15/1411462315.db2.gz HTISKTTUOOAXDU-KITAHSCOSA-N 0 3 399.579 3.409 10 0 GGAEHN C[C@@H](CNC(=O)NCc1cnn(Cc2ccccc2)c1)N(C)Cc1ccccc1 ZINC000111470635 1411972881 /nfs/dbraw/zinc/97/28/81/1411972881.db2.gz BUQZJBXAOIDSEN-IBGZPJMESA-N 0 3 391.519 3.251 10 0 GGAEHN C[C@H](C(=O)Nc1ncccn1)N1CCN(CCC23CC4CC(CC(C4)C2)C3)CC1 ZINC000112202427 1412092441 /nfs/dbraw/zinc/09/24/41/1412092441.db2.gz AMSBEALIUFJNQE-HYMXPIOVSA-N 0 3 397.567 3.028 10 0 GGAEHN COc1ccc(OC(F)F)c(CNC[C@@H](c2ccccc2)N2CCOCC2)c1 ZINC000112709509 1412200777 /nfs/dbraw/zinc/20/07/77/1412200777.db2.gz AYFNNSVSQJSCGY-IBGZPJMESA-N 0 3 392.446 3.460 10 0 GGAEHN COc1cccc([C@@H](O)CN2CCC(CN(C)C(=O)OC(C)(C)C)CC2)c1 ZINC000115542061 1412703793 /nfs/dbraw/zinc/70/37/93/1412703793.db2.gz MJFLXLAFAZLVIR-IBGZPJMESA-N 0 3 378.513 3.308 10 0 GGAEHN COc1cccc([C@@H](O)CN2CCC[C@H](CN(C)C(=O)OC(C)(C)C)C2)c1 ZINC000115539237 1412704171 /nfs/dbraw/zinc/70/41/71/1412704171.db2.gz FAWNOOHQEDSVGP-APWZRJJASA-N 0 3 378.513 3.308 10 0 GGAEHN Cc1ccc(-c2ncc(CNC[C@@H](O)COc3ccc4c(c3)OCO4)s2)cc1 ZINC000115613934 1412735296 /nfs/dbraw/zinc/73/52/96/1412735296.db2.gz FCDBHTCEHCCFDL-MRXNPFEDSA-N 0 3 398.484 3.377 10 0 GGAEHN CC(C)(C)OC(=O)N[C@@H](CC1CCCCC1)C(=O)NCCN1CCCCC1 ZINC000116206935 1412842606 /nfs/dbraw/zinc/84/26/06/1412842606.db2.gz HJVYALKIJSNAJK-SFHVURJKSA-N 0 3 381.561 3.452 10 0 GGAEHN CC(C)n1c2ccc(C(=O)N3CCO[C@@H](CN(C)C)C3)cc2nc1C(F)(F)F ZINC000116797023 1412925501 /nfs/dbraw/zinc/92/55/01/1412925501.db2.gz OBCHLIADFGRSJA-AWEZNQCLSA-N 0 3 398.429 3.039 10 0 GGAEHN Cc1ccc(CNCc2cccnc2N2CCN(C)CC2)cc1Br ZINC000119281381 1413398408 /nfs/dbraw/zinc/39/84/08/1413398408.db2.gz BIHGDKRWZQDTBW-UHFFFAOYSA-N 0 3 389.341 3.194 10 0 GGAEHN COc1cc(CNC[C@H]2CN(Cc3ccccc3)CCO2)ccc1OC(F)F ZINC000119696532 1413535677 /nfs/dbraw/zinc/53/56/77/1413535677.db2.gz FMKQMVCTHJAKIX-SFHVURJKSA-N 0 3 392.446 3.287 10 0 GGAEHN Cc1nn(Cc2ccccc2)c(C)c1CN1CCC(C(=O)N2CCCC2)CC1 ZINC000122446667 1414462674 /nfs/dbraw/zinc/46/26/74/1414462674.db2.gz ACICXRAOIGJGDO-UHFFFAOYSA-N 0 3 380.536 3.383 10 0 GGAEHN CCSc1cc(Cl)ccc1C(=O)NCCCN1CCC[C@H]1C(=O)N(C)C ZINC000123167261 1414658742 /nfs/dbraw/zinc/65/87/42/1414658742.db2.gz GKPSCIZXRYVUBO-INIZCTEOSA-N 0 3 397.972 3.125 10 0 GGAEHN CCOCCN(CCOCC)Cc1ccc(I)cc1 ZINC000123622815 1414798722 /nfs/dbraw/zinc/79/87/22/1414798722.db2.gz DTFGIHCODLCKKE-UHFFFAOYSA-N 0 3 377.266 3.166 10 0 GGAEHN COc1ccc(CN(C)C(=O)CN2CC[C@H](Cc3ccccc3)C2)cc1OC ZINC000124249278 1414919704 /nfs/dbraw/zinc/91/97/04/1414919704.db2.gz FGQALWLAIRDUPR-HXUWFJFHSA-N 0 3 382.504 3.227 10 0 GGAEHN C[C@@H](NC(=O)[C@@H](C)N1CCN(C2CCOCC2)CC1)c1cccc2ccccc21 ZINC000177746179 1428849061 /nfs/dbraw/zinc/84/90/61/1428849061.db2.gz BWOBULZMYWXMMV-RTBURBONSA-N 0 3 395.547 3.202 10 0 GGAEHN C[C@H](C(=O)N[C@@H](C)c1cccc2ccccc21)N1CCN(C2CCOCC2)CC1 ZINC000177746167 1428849109 /nfs/dbraw/zinc/84/91/09/1428849109.db2.gz BWOBULZMYWXMMV-RBUKOAKNSA-N 0 3 395.547 3.202 10 0 GGAEHN COC(=O)Nc1ccc(CNC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1 ZINC000125103924 1415109496 /nfs/dbraw/zinc/10/94/96/1415109496.db2.gz DYKNOFKXBNPXPC-OXJNMPFZSA-N 0 3 396.491 3.327 10 0 GGAEHN COC(=O)Nc1ccc(CNC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1 ZINC000125103403 1415109581 /nfs/dbraw/zinc/10/95/81/1415109581.db2.gz DYKNOFKXBNPXPC-UZLBHIALSA-N 0 3 396.491 3.327 10 0 GGAEHN c1nc(N2CCOCC2)sc1CNc1cccc(CN2CCSCC2)c1 ZINC000125256408 1415144328 /nfs/dbraw/zinc/14/43/28/1415144328.db2.gz BOMFQNKVIVCKFV-UHFFFAOYSA-N 0 3 390.578 3.141 10 0 GGAEHN CS[C@@H](CO)[C@H](C)NCc1cn(-c2ccc(Br)cc2)nc1C ZINC000125772009 1415276519 /nfs/dbraw/zinc/27/65/19/1415276519.db2.gz FEGRKUZIJZZRKI-LRDDRELGSA-N 0 3 384.343 3.145 10 0 GGAEHN O=C(CNCc1cccc(-c2ccccn2)c1)N1CCN(c2ccccc2)CC1 ZINC000127363577 1415753934 /nfs/dbraw/zinc/75/39/34/1415753934.db2.gz CEEKFULHERNHNK-UHFFFAOYSA-N 0 3 386.499 3.187 10 0 GGAEHN CCc1cc(N2CCC(NCc3cc(O)ccc3Br)CC2)ncn1 ZINC000127707717 1415836784 /nfs/dbraw/zinc/83/67/84/1415836784.db2.gz BUPKKSPZHWBEHE-UHFFFAOYSA-N 0 3 391.313 3.266 10 0 GGAEHN Cc1nn(C)c(OCC(F)(F)F)c1CN1CC[C@H](CNc2cccc(C)n2)C1 ZINC000128285202 1415954840 /nfs/dbraw/zinc/95/48/40/1415954840.db2.gz STNUIPXGIPHKOI-OAHLLOKOSA-N 0 3 397.445 3.307 10 0 GGAEHN COc1ccccc1CN(CCO)C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000128453521 1415990450 /nfs/dbraw/zinc/99/04/50/1415990450.db2.gz HFIRXWUZOFPENP-OAQYLSRUSA-N 0 3 397.519 3.036 10 0 GGAEHN Cc1cccc(OC[C@@H](O)CN2CCC(C(=O)N3CCc4ccccc43)CC2)c1 ZINC000129433822 1416208811 /nfs/dbraw/zinc/20/88/11/1416208811.db2.gz IPJNNJFQYYQJBN-NRFANRHFSA-N 0 3 394.515 3.036 10 0 GGAEHN O=S(=O)(C[C@@H](O)CNCc1ccc(-c2ccccc2)s1)c1cccs1 ZINC000129491250 1416218141 /nfs/dbraw/zinc/21/81/41/1416218141.db2.gz HPNYUYAILFCUDM-HNNXBMFYSA-N 0 3 393.555 3.401 10 0 GGAEHN CN(C)[C@@H](CNC(=O)[C@@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1)c1ccccc1 ZINC000129720909 1416253975 /nfs/dbraw/zinc/25/39/75/1416253975.db2.gz FMUKPAREIBOHCT-QRVBRYPASA-N 0 3 389.540 3.489 10 0 GGAEHN CNC(=O)c1cccc(CN(C)CC[C@@H](NC(=O)OC(C)(C)C)C(C)C)c1 ZINC000178468197 1429084428 /nfs/dbraw/zinc/08/44/28/1429084428.db2.gz AZYBXAIAVWMOGD-GOSISDBHSA-N 0 3 377.529 3.417 10 0 GGAEHN CN(C)[C@@H](CNC(=O)[C@H]1CCC[C@H]1NC(=O)OC(C)(C)C)c1ccccc1 ZINC000130600245 1416407666 /nfs/dbraw/zinc/40/76/66/1416407666.db2.gz ARIWFENGWPYEEM-KSZLIROESA-N 0 3 375.513 3.099 10 0 GGAEHN CCN(C(C)=O)c1nc(CNC2CCN([C@@H](C)c3ccncc3)CC2)cs1 ZINC000131176902 1416519766 /nfs/dbraw/zinc/51/97/66/1416519766.db2.gz CKQWFLHVPVOWLJ-HNNXBMFYSA-N 0 3 387.553 3.226 10 0 GGAEHN COc1cc(Br)c(CNCC2(SC)CCOCC2)c(OC)c1 ZINC000133132333 1416855311 /nfs/dbraw/zinc/85/53/11/1416855311.db2.gz GSPRSKMGEUZZAR-UHFFFAOYSA-N 0 3 390.343 3.468 10 0 GGAEHN C[C@H](C(=O)N[C@@H](C)c1cccc2ccccc21)N1CCN(C[C@@H]2CCOC2)CC1 ZINC000178831525 1429186524 /nfs/dbraw/zinc/18/65/24/1429186524.db2.gz FQOSTXVUTLBGMM-ZCNNSNEGSA-N 0 3 395.547 3.060 10 0 GGAEHN CN(C)C(=O)COc1ccccc1CNC[C@H](O)c1cc2ccccc2s1 ZINC000151341543 1417930617 /nfs/dbraw/zinc/93/06/17/1417930617.db2.gz FIHZAVITVLLHPA-KRWDZBQOSA-N 0 3 384.501 3.192 10 0 GGAEHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCCCNC(=O)OC(C)(C)C ZINC000152716603 1422221472 /nfs/dbraw/zinc/22/14/72/1422221472.db2.gz HCZDMGURWWRJEI-MJGOQNOKSA-N 0 3 389.540 3.318 10 0 GGAEHN CCc1nn(C)c(Cl)c1CNC[C@@H]1CCN(c2cc(OC)cc(OC)c2)C1 ZINC000153862165 1422801088 /nfs/dbraw/zinc/80/10/88/1422801088.db2.gz HZFDYDSJLONEQG-AWEZNQCLSA-N 0 3 392.931 3.269 10 0 GGAEHN COc1cc(CN[C@@H]2CCN(C(=O)CCc3ccccc3)C2)cc(OC)c1OC ZINC000153995606 1422822956 /nfs/dbraw/zinc/82/29/56/1422822956.db2.gz IBSLNWSNDFGDAZ-LJQANCHMSA-N 0 3 398.503 3.036 10 0 GGAEHN COc1cc(C(=O)Nc2ccc(N3CCN(Cc4ccccc4)CC3)cc2)on1 ZINC000154598693 1422954595 /nfs/dbraw/zinc/95/45/95/1422954595.db2.gz VJWZXARVVRMUDX-UHFFFAOYSA-N 0 3 392.459 3.258 10 0 GGAEHN CC(C)[C@@H](NC(=O)CN(C)CC1CCOCC1)c1ccc2c(c1)OCCCO2 ZINC000156143865 1423691952 /nfs/dbraw/zinc/69/19/52/1423691952.db2.gz DRTVQEYHLJYHPW-JOCHJYFZSA-N 0 3 390.524 3.020 10 0 GGAEHN CC(C)[C@H](NC(=O)CN(C)CC1CCOCC1)c1ccc2c(c1)OCCCO2 ZINC000156143743 1423692096 /nfs/dbraw/zinc/69/20/96/1423692096.db2.gz DRTVQEYHLJYHPW-QFIPXVFZSA-N 0 3 390.524 3.020 10 0 GGAEHN Cc1ccccc1CN1CCCN(CC(=O)Nc2ccnn2C2CCCC2)CC1 ZINC000164781045 1425141898 /nfs/dbraw/zinc/14/18/98/1425141898.db2.gz CHMAOZGPJMLCGB-UHFFFAOYSA-N 0 3 395.551 3.453 10 0 GGAEHN Cc1ccc([C@@H](CNC(=O)N(C)[C@H](C)CNC(=O)OC(C)(C)C)N(C)C)cc1 ZINC000171904954 1425848431 /nfs/dbraw/zinc/84/84/31/1425848431.db2.gz ALFZZYWAFVJTFJ-SJLPKXTDSA-N 0 3 392.544 3.152 10 0 GGAEHN CN(C(=O)c1ccc(-c2ncon2)cc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000173713438 1426828856 /nfs/dbraw/zinc/82/88/56/1426828856.db2.gz KVWOUQLYMIPFDH-FQEVSTJZSA-N 0 3 376.460 3.473 10 0 GGAEHN COCCOC[C@H]1CCN([C@@H](C)C(=O)N[C@H](C)c2cccc3ccccc32)C1 ZINC000173734866 1426834981 /nfs/dbraw/zinc/83/49/81/1426834981.db2.gz DDMPIJLSUFZACG-QYZOEREBSA-N 0 3 384.520 3.390 10 0 GGAEHN C[C@@H](N[C@H](C)c1ccc(-n2cccn2)cc1)C(=O)NC(=O)Nc1ccccc1F ZINC000174375229 1427127214 /nfs/dbraw/zinc/12/72/14/1427127214.db2.gz GFSIBDVFWKMTHP-HUUCEWRRSA-N 0 3 395.438 3.399 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)NC[C@@H](C)Oc3ccc(OC)cc3)cc2)CC1 ZINC000174566056 1427227465 /nfs/dbraw/zinc/22/74/65/1427227465.db2.gz VJWYTIYUJSXAJH-GOSISDBHSA-N 0 3 397.519 3.034 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)NC[C@H](C)Oc3ccc(OC)cc3)cc2)CC1 ZINC000174566070 1427227517 /nfs/dbraw/zinc/22/75/17/1427227517.db2.gz VJWYTIYUJSXAJH-SFHVURJKSA-N 0 3 397.519 3.034 10 0 GGAEHN CN1CCOc2ccc(NC(=O)NC[C@@H](c3ccccc3)N3CCCC3)cc21 ZINC000175079594 1427535489 /nfs/dbraw/zinc/53/54/89/1427535489.db2.gz CSMBKBSFRJWGBV-FQEVSTJZSA-N 0 3 380.492 3.474 10 0 GGAEHN O=C(Nc1ccc(CN2CCCC2=O)cc1)N1CCN([C@@H]2C[C@H]3CC[C@@H]2C3)CC1 ZINC000175213890 1427605462 /nfs/dbraw/zinc/60/54/62/1427605462.db2.gz FCYGBFMOCJSMNR-QKNQBKEWSA-N 0 3 396.535 3.147 10 0 GGAEHN COc1cccc(CS(=O)(=O)N[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)c1 ZINC000175844163 1427925760 /nfs/dbraw/zinc/92/57/60/1427925760.db2.gz NNJYGGLEKWXHOY-XLIONFOSSA-N 0 3 388.533 3.168 10 0 GGAEHN Cc1cccc(NC(=O)NC(=O)CN[C@H](C)c2ccc(-n3cccn3)cc2)c1C ZINC000180834574 1430063334 /nfs/dbraw/zinc/06/33/34/1430063334.db2.gz FWMFIWBBMGHBBO-QGZVFWFLSA-N 0 3 391.475 3.488 10 0 GGAEHN CC[C@@H](NCCNC(=O)C1N=CC=CC1=O)c1cc(F)cc(Br)c1 ZINC000181963203 1430389377 /nfs/dbraw/zinc/38/93/77/1430389377.db2.gz ABOFYBJSEUBLQQ-UPTRSRDDSA-N 0 3 396.260 3.155 10 0 GGAEHN CC(=O)c1oc2ccccc2c1NC(=O)[C@H](C)N[C@@H](CC(N)=O)C1CCCCC1 ZINC000182077395 1430406929 /nfs/dbraw/zinc/40/69/29/1430406929.db2.gz ICJQLXRHNDUZOK-GUYCJALGSA-N 0 3 399.491 3.376 10 0 GGAEHN CN(C)CCN(C)C(=O)Nc1c(Br)cc(F)cc1Br ZINC000182171362 1430423775 /nfs/dbraw/zinc/42/37/75/1430423775.db2.gz BKNKECDQVQEIIR-UHFFFAOYSA-N 0 3 397.086 3.376 10 0 GGAEHN CCC[C@H](NCC(=O)Nc1nc(CC(=O)OCC)cs1)c1ccccc1 ZINC000182329878 1430449323 /nfs/dbraw/zinc/44/93/23/1430449323.db2.gz CWVSGWZPAKHPAM-INIZCTEOSA-N 0 3 375.494 3.318 10 0 GGAEHN CC(C)(C)OC(=O)N1CC[C@H](N[C@H](CO)c2cccc(Br)c2)C1 ZINC000182619417 1430503592 /nfs/dbraw/zinc/50/35/92/1430503592.db2.gz GDJMHVVSDGQPKJ-LSDHHAIUSA-N 0 3 385.302 3.082 10 0 GGAEHN Cc1ccc(Cl)c(OC[C@@H](O)CN[C@@H](C)c2ccc(S(C)(=O)=O)cc2)c1 ZINC000182674486 1430514487 /nfs/dbraw/zinc/51/44/87/1430514487.db2.gz DHXKXEASNRKUQB-HOCLYGCPSA-N 0 3 397.924 3.142 10 0 GGAEHN CCc1cc(N2CCC(N[C@@H](COC)c3ccc(F)c(F)c3)CC2)ncn1 ZINC000183071813 1430605551 /nfs/dbraw/zinc/60/55/51/1430605551.db2.gz HOAYEEQOTIRKTR-IBGZPJMESA-N 0 3 376.451 3.263 10 0 GGAEHN Cc1cnc(C(C)(C)N[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)s1 ZINC000183921982 1430813558 /nfs/dbraw/zinc/81/35/58/1430813558.db2.gz CHQJBEISDTWZND-WMZOPIPTSA-N 0 3 386.565 3.055 10 0 GGAEHN COc1ccc(CN2C[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)[C@H]3C2)c(OC)c1 ZINC000184240933 1430861043 /nfs/dbraw/zinc/86/10/43/1430861043.db2.gz UVIYBWXVIVPXMZ-JCGIZDLHSA-N 0 3 376.497 3.439 10 0 GGAEHN CC[C@H](N[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1nc(C)cs1 ZINC000184346764 1430875974 /nfs/dbraw/zinc/87/59/74/1430875974.db2.gz DJUNIBGCGBNIAG-QRQLOZEOSA-N 0 3 386.565 3.271 10 0 GGAEHN CCOC(=O)c1nn(C)cc1CNc1cccc(CN2CCSCC2)c1C ZINC000186285693 1431371525 /nfs/dbraw/zinc/37/15/25/1431371525.db2.gz BCTFIDIUWYVOKV-UHFFFAOYSA-N 0 3 388.537 3.066 10 0 GGAEHN CCOC(=O)N1CCC(NCc2c(F)cc(Br)cc2F)CC1 ZINC000186548364 1431450995 /nfs/dbraw/zinc/45/09/95/1431450995.db2.gz VZMQHOATATYHTA-UHFFFAOYSA-N 0 3 377.229 3.438 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)N[C@H]3CCOc4c(C)cccc43)cc2)CC1 ZINC000188099794 1431846473 /nfs/dbraw/zinc/84/64/73/1431846473.db2.gz XGIHJXQLNKFDRE-NRFANRHFSA-N 0 3 379.504 3.391 10 0 GGAEHN CN(Cc1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)[C@H]1C[C@H](F)CN1 ZINC000188256977 1431866282 /nfs/dbraw/zinc/86/62/82/1431866282.db2.gz TZAHNHYTXKMAQM-AZUAARDMSA-N 0 3 378.451 3.198 10 0 GGAEHN CNC(=O)c1cccc(NC(=O)[C@H](C)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)c1 ZINC000192741813 1432883153 /nfs/dbraw/zinc/88/31/53/1432883153.db2.gz FECYZXSBTISHHP-FIKGOQFSSA-N 0 3 395.503 3.131 10 0 GGAEHN CNC(=O)c1cccc(NC(=O)[C@H](C)N[C@H](C[C@@H]2CCOC2)c2ccccc2)c1 ZINC000192741846 1432883208 /nfs/dbraw/zinc/88/32/08/1432883208.db2.gz FECYZXSBTISHHP-XGHQBKJUSA-N 0 3 395.503 3.131 10 0 GGAEHN CNC(=O)c1cccc(NC(=O)[C@@H](C)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)c1 ZINC000192741830 1432883263 /nfs/dbraw/zinc/88/32/63/1432883263.db2.gz FECYZXSBTISHHP-WWMYMODYSA-N 0 3 395.503 3.131 10 0 GGAEHN CNC(=O)c1cccc(NC(=O)[C@@H](C)SCCN(C)Cc2ccccc2)c1 ZINC000193626538 1433030633 /nfs/dbraw/zinc/03/06/33/1433030633.db2.gz GPJMSZJTGIUTPS-MRXNPFEDSA-N 0 3 385.533 3.238 10 0 GGAEHN COc1cccc([C@H](O)CN2CCC23CCN(C(=O)OC(C)(C)C)CC3)c1 ZINC000193749770 1433051748 /nfs/dbraw/zinc/05/17/48/1433051748.db2.gz KAZBIQQLDZSGTE-GOSISDBHSA-N 0 3 376.497 3.204 10 0 GGAEHN Cc1ccc(OC[C@H](O)CN2CCC23CCN(C(=O)OC(C)(C)C)CC3)cc1 ZINC000193752107 1433052444 /nfs/dbraw/zinc/05/24/44/1433052444.db2.gz LITUISLHQCCPQO-GOSISDBHSA-N 0 3 390.524 3.210 10 0 GGAEHN Cc1n[nH]cc1C(=O)Nc1ccc(N2CCN(Cc3ccccc3)CC2)cc1 ZINC000194022214 1433102319 /nfs/dbraw/zinc/10/23/19/1433102319.db2.gz ZGDZLGUDZZMXIB-UHFFFAOYSA-N 0 3 375.476 3.293 10 0 GGAEHN O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1coc(C2CCC2)n1 ZINC000194349764 1433165389 /nfs/dbraw/zinc/16/53/89/1433165389.db2.gz MULFNRSNTRPCOV-UHFFFAOYSA-N 0 3 382.464 3.020 10 0 GGAEHN CC(C)(C)OC(=O)N[C@H](CC1CCCCC1)C(=O)NCCN1CCCCC1 ZINC000212735784 1433358870 /nfs/dbraw/zinc/35/88/70/1433358870.db2.gz HJVYALKIJSNAJK-GOSISDBHSA-N 0 3 381.561 3.452 10 0 GGAEHN c1ccc(N2CCOCC2)c(CNCc2ccc(OC[C@@H]3CCCO3)cc2)c1 ZINC000236571295 1433374070 /nfs/dbraw/zinc/37/40/70/1433374070.db2.gz HKWRZZJNKFEJLV-QFIPXVFZSA-N 0 3 382.504 3.371 10 0 GGAEHN CN1CCN(c2ccc(CNCc3cccc(OC(F)(F)F)c3)cn2)CC1 ZINC000237035162 1433386513 /nfs/dbraw/zinc/38/65/13/1433386513.db2.gz HFXKRFQFAARNBU-UHFFFAOYSA-N 0 3 380.414 3.022 10 0 GGAEHN COc1ccc([C@@H](CNC(=O)[C@@H]2Cc3ccccc3CN2)N2CCCCC2)cc1 ZINC000237320193 1433397167 /nfs/dbraw/zinc/39/71/67/1433397167.db2.gz CEXNWWCOMMSGCJ-XZOQPEGZSA-N 0 3 393.531 3.053 10 0 GGAEHN CNS(=O)(=O)Cc1ccc(CNCc2ccc(OCC(C)C)cc2)cc1 ZINC000237326684 1433397505 /nfs/dbraw/zinc/39/75/05/1433397505.db2.gz CMGFVFAENMBIAZ-UHFFFAOYSA-N 0 3 376.522 3.060 10 0 GGAEHN COc1cc2c(c(CNC[C@@H](c3cccc(C)c3)N3CCOCC3)c1)O[C@H](C)C2 ZINC000237402275 1433400924 /nfs/dbraw/zinc/40/09/24/1433400924.db2.gz HMKCLKMKTHEDCV-JPYJTQIMSA-N 0 3 396.531 3.490 10 0 GGAEHN CC(=O)N1CC[C@H](CN(C)[C@@H](C)C(=O)N[C@@H](C)c2cccc3ccccc32)C1 ZINC000246036183 1433560338 /nfs/dbraw/zinc/56/03/38/1433560338.db2.gz AEIZZZFQFIYQBX-JENIJYKNSA-N 0 3 381.520 3.206 10 0 GGAEHN C[C@H](NC(=O)[C@H](C)N1CCN(C[C@H]2CCOC2)CC1)c1cccc2ccccc21 ZINC000246900703 1433685085 /nfs/dbraw/zinc/68/50/85/1433685085.db2.gz FQOSTXVUTLBGMM-SLFFLAALSA-N 0 3 395.547 3.060 10 0 GGAEHN CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(C[C@@H](O)c3ccc(F)c(F)c3)C[C@H]12 ZINC000248593608 1433810263 /nfs/dbraw/zinc/81/02/63/1433810263.db2.gz LSTMNBJZYBNANX-LTCOOKNTSA-N 0 3 382.451 3.233 10 0 GGAEHN COC(=O)c1ccc(CN2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)[C@@H]3C2)cc1F ZINC000248614601 1433811542 /nfs/dbraw/zinc/81/15/42/1433811542.db2.gz RGUYATHVHRIYPM-LESCRADOSA-N 0 3 392.471 3.347 10 0 GGAEHN CCOc1cc(CN2CC[C@@H](O)[C@@H](C)C2)ccc1OCC(=O)Nc1ccccc1 ZINC000249836989 1433853006 /nfs/dbraw/zinc/85/30/06/1433853006.db2.gz FOTVEOLOBUYTTH-FXAWDEMLSA-N 0 3 398.503 3.306 10 0 GGAEHN C[C@H](CS(=O)(=O)c1ccccc1)N[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1C ZINC000250109548 1433854474 /nfs/dbraw/zinc/85/44/74/1433854474.db2.gz SQQXZACDPSRJNE-NUJGCVRESA-N 0 3 396.553 3.084 10 0 GGAEHN CCOc1ccc(-c2n[nH]cc2C[N@@H+]2CCc3nc[n-]c(=O)c3CC2)cc1Cl ZINC000257174973 1433893256 /nfs/dbraw/zinc/89/32/56/1433893256.db2.gz MOOFYWNYIRARCP-UHFFFAOYSA-N 0 3 399.882 3.225 10 0 GGAEHN CCOc1ccc(-c2n[nH]cc2C[N@H+]2CCc3nc[n-]c(=O)c3CC2)cc1Cl ZINC000257174973 1433893257 /nfs/dbraw/zinc/89/32/57/1433893257.db2.gz MOOFYWNYIRARCP-UHFFFAOYSA-N 0 3 399.882 3.225 10 0 GGAEHN Cc1ncsc1CN1CCC[C@@H](c2nc(C(C)C)no2)CCNC(=O)CC1 ZINC000257177841 1433893529 /nfs/dbraw/zinc/89/35/29/1433893529.db2.gz FKASUGGTZAGDND-OAHLLOKOSA-N 0 3 391.541 3.234 10 0 GGAEHN CN(Cc1cccc(F)c1F)[C@H]1CCc2nnc(C3CCOCC3)n2CC1 ZINC000257177526 1433893672 /nfs/dbraw/zinc/89/36/72/1433893672.db2.gz WZEPDCOPDUMPEE-INIZCTEOSA-N 0 3 376.451 3.287 10 0 GGAEHN O=C(Cc1cccnc1)N1CCC(N2C[C@@H](OCC3CC3)C23CCCCC3)CC1 ZINC000257180270 1433893753 /nfs/dbraw/zinc/89/37/53/1433893753.db2.gz KLQNOBDROAQBHO-JOCHJYFZSA-N 0 3 397.563 3.429 10 0 GGAEHN CC(C)Oc1ccccc1CN1CCC2(CC[C@@H](CN3CCOCC3)O2)CC1 ZINC000257189467 1433894320 /nfs/dbraw/zinc/89/43/20/1433894320.db2.gz IYHRHHJWEOGOBL-NRFANRHFSA-N 0 3 388.552 3.320 10 0 GGAEHN COC(=O)C1CCN(CCCNC(=O)[C@H]2C[C@@H]2c2cccc3ccccc32)CC1 ZINC000264407006 1434108409 /nfs/dbraw/zinc/10/84/09/1434108409.db2.gz DMHRVEGAMRZDEF-YADHBBJMSA-N 0 3 394.515 3.335 10 0 GGAEHN CN(C)CCn1cc(NC(=O)c2cc(C3CC3)nc3ccc(F)cc32)ccc1=O ZINC000270071581 1434699340 /nfs/dbraw/zinc/69/93/40/1434699340.db2.gz GWQXXGPYUNXYHI-UHFFFAOYSA-N 0 3 394.450 3.227 10 0 GGAEHN CC(C)(C)OC(=O)N1CCc2cccc(CN3CCC4(CNC(=O)C4)CC3)c21 ZINC000271159134 1434805369 /nfs/dbraw/zinc/80/53/69/1434805369.db2.gz CQKKTKOICPFSPW-UHFFFAOYSA-N 0 3 385.508 3.086 10 0 GGAEHN CC[C@@H](N[C@@H](C)C(=O)Nc1cccc(NC(C)=O)c1)c1ccc2c(c1)OCCO2 ZINC000271635821 1434840736 /nfs/dbraw/zinc/84/07/36/1434840736.db2.gz FEHKWPZCTDDSEH-IFXJQAMLSA-N 0 3 397.475 3.484 10 0 GGAEHN C[C@H](NCc1ccc(N2CCOC2=O)cc1)c1ccc(N2CCOC2=O)cc1 ZINC000272829375 1434934328 /nfs/dbraw/zinc/93/43/28/1434934328.db2.gz HOQONFUJIYMSNF-HNNXBMFYSA-N 0 3 381.432 3.451 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cnc(-c3ccccc3)nc2C)C[C@H]1N1CCCC1 ZINC000273465202 1434990543 /nfs/dbraw/zinc/99/05/43/1434990543.db2.gz GBLKKYUBZWXXJQ-RTBURBONSA-N 0 3 382.533 3.104 10 0 GGAEHN CCN(CC)c1ncc(CN[C@@]2(CO)CCCN(Cc3ccccc3)C2)s1 ZINC000604769092 1126100573 /nfs/dbraw/zinc/10/05/73/1126100573.db2.gz HCJNNSOCJAGMNK-NRFANRHFSA-N 0 3 388.581 3.106 10 0 GGAEHN Cc1nn(C)c(Cl)c1CN[C@@]1(CO)CCc2cc(Br)ccc2C1 ZINC000859574731 1126112834 /nfs/dbraw/zinc/11/28/34/1126112834.db2.gz PQWCJABKUYKFBU-KRWDZBQOSA-N 0 3 398.732 3.154 10 0 GGAEHN CC(C)(C)OC(=O)N1CC[C@@H](NCc2cnc(-c3cccs3)s2)[C@H](O)C1 ZINC000865745654 1126116046 /nfs/dbraw/zinc/11/60/46/1126116046.db2.gz GKCROXWFKCMBPX-ZIAGYGMSSA-N 0 3 395.550 3.332 10 0 GGAEHN CC(C)(C)OC(=O)N1CC[C@H](NCc2cnc(-c3cccs3)s2)[C@@H](O)C1 ZINC000865745648 1126116070 /nfs/dbraw/zinc/11/60/70/1126116070.db2.gz GKCROXWFKCMBPX-KBPBESRZSA-N 0 3 395.550 3.332 10 0 GGAEHN C[C@](CO)(Cc1ccc(Br)cc1)NCc1cccc2c1OCCO2 ZINC001176587666 1126149634 /nfs/dbraw/zinc/14/96/34/1126149634.db2.gz NMCOFYODRIYOKR-LJQANCHMSA-N 0 3 392.293 3.304 10 0 GGAEHN COc1ccccc1C[C@](C)(CO)[NH2+]Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC001460698152 1126191870 /nfs/dbraw/zinc/19/18/70/1126191870.db2.gz PZRQIUOXEIVUBG-JOCHJYFZSA-N 0 3 393.443 3.174 10 0 GGAEHN COC(=O)c1ccc(OC)c(CN[C@](C)(CO)Cc2ccc(Cl)cc2)c1 ZINC001473839478 1126199883 /nfs/dbraw/zinc/19/98/83/1126199883.db2.gz BVEUWDRXVPLDBH-FQEVSTJZSA-N 0 3 377.868 3.219 10 0 GGAEHN COC(=O)c1cc(CN[C@](C)(CO)Cc2ccc(Br)cc2)cs1 ZINC001473839778 1126200075 /nfs/dbraw/zinc/20/00/75/1126200075.db2.gz JQPSFTZFMDKFCV-KRWDZBQOSA-N 0 3 398.322 3.381 10 0 GGAEHN C[C@@](CO)(Cc1ccc(Cl)cc1)NCc1ccc(Br)nc1N ZINC001560182836 1126208833 /nfs/dbraw/zinc/20/88/33/1126208833.db2.gz IQWXCJVBMZGJKL-INIZCTEOSA-N 0 3 384.705 3.163 10 0 GGAEHN CN(C)[C@@H](CNC(=O)CCc1nc(-c2ccc(F)cc2)no1)c1ccccc1 ZINC000016599818 210191380 /nfs/dbraw/zinc/19/13/80/210191380.db2.gz DMJCFVVZXBWQFL-SFHVURJKSA-N 0 3 382.439 3.227 10 0 GGAEHN O=C(NCC1CCN(Cc2ccccc2F)CC1)N[C@H]1COc2ccccc2C1 ZINC000015787347 210171805 /nfs/dbraw/zinc/17/18/05/210171805.db2.gz AQDSTIAXQSWVCH-HXUWFJFHSA-N 0 3 397.494 3.341 10 0 GGAEHN O=C(NCC1CCN(Cc2ccccc2F)CC1)[C@H]1COc2ccccc2C1 ZINC000015786169 210170438 /nfs/dbraw/zinc/17/04/38/210170438.db2.gz CREFFSQRQQRTGC-HXUWFJFHSA-N 0 3 382.479 3.405 10 0 GGAEHN O=C([C@@H]1CCN(c2ccc(Cl)cc2)C1=O)N1CCN(C2CCCCC2)CC1 ZINC000015782647 210169860 /nfs/dbraw/zinc/16/98/60/210169860.db2.gz GDWUHROVMIQBAS-IBGZPJMESA-N 0 3 389.927 3.170 10 0 GGAEHN Cc1cc(-c2ccc(C)c(S(=O)(=O)NCCCN3CCC[C@H](C)C3)c2)on1 ZINC000015730271 210166223 /nfs/dbraw/zinc/16/62/23/210166223.db2.gz XJZIZHPJUDHUOX-HNNXBMFYSA-N 0 3 391.537 3.359 10 0 GGAEHN CCOC(=O)c1c(C)oc2nc(C)nc(N3CCN(C4CCCCC4)CC3)c21 ZINC000015727410 210164587 /nfs/dbraw/zinc/16/45/87/210164587.db2.gz FATHQKROGWAWJG-UHFFFAOYSA-N 0 3 386.496 3.471 10 0 GGAEHN COc1ccc([C@H](CNC(=O)c2ccc3c(c2)NC(=O)[C@H](C)S3)N(C)C)cc1 ZINC000015387851 210157091 /nfs/dbraw/zinc/15/70/91/210157091.db2.gz CCKDCWXGOYKCJJ-UGSOOPFHSA-N 0 3 399.516 3.161 10 0 GGAEHN COCCc1ncc(CN2CC[C@]3(C2)CCCN(Cc2ccccc2F)C3)cn1 ZINC000015069887 210148121 /nfs/dbraw/zinc/14/81/21/210148121.db2.gz ABZOKCJQCQKUQF-HSZRJFAPSA-N 0 3 398.526 3.293 10 0 GGAEHN CN(Cc1cn(-c2ccccc2)nc1-c1ccc2c(c1)OCO2)[C@H]1CCOC1 ZINC000015064346 210146199 /nfs/dbraw/zinc/14/61/99/210146199.db2.gz HYAAUHBIBMOMFE-IBGZPJMESA-N 0 3 377.444 3.489 10 0 GGAEHN Cc1c2cc(C)cc(C)c2[nH]c1C(=O)N1CCC[C@@H](N2CCC(CO)CC2)C1 ZINC000014976467 210138928 /nfs/dbraw/zinc/13/89/28/210138928.db2.gz YJEWAKVKAWLBEQ-LJQANCHMSA-N 0 3 383.536 3.402 10 0 GGAEHN COC[C@@H](C)N1CCC2(CC1)C(=O)N(Cc1ccc3ccccc3c1)C(=O)N2C ZINC000014531527 210119638 /nfs/dbraw/zinc/11/96/38/210119638.db2.gz GPPPXNJEGYCWRI-QGZVFWFLSA-N 0 3 395.503 3.103 10 0 GGAEHN CCOC(=O)c1ccc(OC[C@H](O)CN2CCC[C@@H]2c2ccc(OC)cc2)cc1 ZINC000014200933 210110425 /nfs/dbraw/zinc/11/04/25/210110425.db2.gz ZZRPTXNTVANOOK-DENIHFKCSA-N 0 3 399.487 3.449 10 0 GGAEHN CCN(CC)[C@@H](CNC(=S)NCc1ccc2c(c1)OCO2)c1ccccc1 ZINC000013056145 210050133 /nfs/dbraw/zinc/05/01/33/210050133.db2.gz DBMCKBDJFQEVII-SFHVURJKSA-N 0 3 385.533 3.463 10 0 GGAEHN C[C@@H](C(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F)N1C[C@H](C)C[C@@H](C)C1 ZINC000012792212 210008581 /nfs/dbraw/zinc/00/85/81/210008581.db2.gz NTNOGZXQOWPDOJ-KFWWJZLASA-N 0 3 399.457 3.469 10 0 GGAEHN CN(C)[C@H](CNC(=O)Cn1c2ccccc2nc1C(F)(F)F)c1ccccc1 ZINC000005265894 209584714 /nfs/dbraw/zinc/58/47/14/209584714.db2.gz QTZXNXNIOSKNPQ-QGZVFWFLSA-N 0 3 390.409 3.474 10 0 GGAEHN CCCCN(CCC(=O)NCCN1CCCCC1)C(=O)c1cc(C)oc1C ZINC000004527856 209493936 /nfs/dbraw/zinc/49/39/36/209493936.db2.gz XBPNXOORXXECFR-UHFFFAOYSA-N 0 3 377.529 3.131 10 0 GGAEHN O=C(c1cccc(CN2CCCC2)c1)N1CCC(c2nnc3ccccn32)CC1 ZINC000359927691 209203940 /nfs/dbraw/zinc/20/39/40/209203940.db2.gz MWPDACOBDPOQMU-UHFFFAOYSA-N 0 3 389.503 3.345 10 0 GGAEHN O=c1c2cc(Cl)ccc2nc(N2CCNCC2)n1Cc1ccc(Cl)cc1 ZINC000040351906 209195294 /nfs/dbraw/zinc/19/52/94/209195294.db2.gz PURXKHCJOLNYRS-UHFFFAOYSA-N 0 3 389.286 3.161 10 0 GGAEHN COc1ccc(C(=O)Cn2c3ccccc3n(CCN3CCCCC3)c2=N)cc1 ZINC000032600369 209191732 /nfs/dbraw/zinc/19/17/32/209191732.db2.gz KLXHMWLIZJWEPC-UHFFFAOYSA-N 0 3 392.503 3.300 10 0 GGAEHN CC(=O)c1ccc(OCC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)cc1 ZINC000225326936 209187112 /nfs/dbraw/zinc/18/71/12/209187112.db2.gz KSKUFYIAYDLGLJ-HTAPYJJXSA-N 0 3 380.488 3.295 10 0 GGAEHN CC(=O)c1ccc(N2C(=O)C[C@H](NCCc3c[nH]c4ccc(C)cc34)C2=O)cc1 ZINC000005274899 212065223 /nfs/dbraw/zinc/06/52/23/212065223.db2.gz YXXKBRRIDRRJRJ-NRFANRHFSA-N 0 3 389.455 3.143 10 0 GGAEHN CCN1CCC[C@@H](CN(C)Cc2cc(C(N)=O)cs2)[C@@H]1c1cnn(C)c1 ZINC000328641571 209153133 /nfs/dbraw/zinc/15/31/33/209153133.db2.gz QPMGYKOZODDWJP-KBXCAEBGSA-N 0 3 375.542 3.270 10 0 GGAEHN CCN1CCC[C@@H](CN(C)Cc2cnc3c(C)cccn23)[C@@H]1c1cnn(C)c1 ZINC000328626866 209148870 /nfs/dbraw/zinc/14/88/70/209148870.db2.gz FODIYAZYDKXHBA-GHTZIAJQSA-N 0 3 380.540 3.281 10 0 GGAEHN CCN1CCC[C@@H](CN(C)Cc2cnc3ccc(C)cn23)[C@@H]1c1cnn(C)c1 ZINC000328623210 209148796 /nfs/dbraw/zinc/14/87/96/209148796.db2.gz BSRYAEABRPOYKW-PGRDOPGGSA-N 0 3 380.540 3.281 10 0 GGAEHN Cc1cc(NC(=O)[C@H](NC[C@H]2CCO[C@@H]2c2ccccc2)c2ccccc2)no1 ZINC000328614522 209147415 /nfs/dbraw/zinc/14/74/15/209147415.db2.gz AHHMTAIXMYXXHS-CEMLEFRQSA-N 0 3 391.471 3.452 10 0 GGAEHN C[C@@H]1CN(C(=O)c2ccc(CNCc3ccc4c[nH]nc4c3)cc2)C[C@@H](C)O1 ZINC000237560125 211476012 /nfs/dbraw/zinc/47/60/12/211476012.db2.gz MATFKIKIHWDSMO-HZPDHXFCSA-N 0 3 378.476 3.102 10 0 GGAEHN COc1ccccc1-n1c(O)c2c(-c3ccccc3)nn(-c3ccccc3)c2c1O ZINC000100909352 211392567 /nfs/dbraw/zinc/39/25/67/211392567.db2.gz ARQPBWSEFOXJPJ-UNMCSNQZSA-N 0 3 397.434 3.478 10 0 GGAEHN CC(C)CN1C[C@H](NCc2cccc(C(F)(F)F)c2)C[C@H]1C(=O)NC(C)C ZINC000097446940 211364130 /nfs/dbraw/zinc/36/41/30/211364130.db2.gz HKFKYQHDNZOUST-MSOLQXFVSA-N 0 3 385.474 3.419 10 0 GGAEHN C[C@@H](N[C@@H](C)c1nnc2n1CCCC2)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000097048755 211356187 /nfs/dbraw/zinc/35/61/87/211356187.db2.gz XFTRBDDRZMLNDR-OWCLPIDISA-N 0 3 377.533 3.301 10 0 GGAEHN C[C@H](NC(=O)/C=C\c1ccccc1)C(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000097013757 211354524 /nfs/dbraw/zinc/35/45/24/211354524.db2.gz CZEZYUOAKSKIBY-MFHWYPAGSA-N 0 3 397.544 3.219 10 0 GGAEHN Cc1cnccc1CN(C)Cc1ccc(OC[C@H](O)CN2CCCCC2)cc1 ZINC000096835295 211347445 /nfs/dbraw/zinc/34/74/45/211347445.db2.gz VXLKCGGFNCZGTP-JOCHJYFZSA-N 0 3 383.536 3.248 10 0 GGAEHN COc1ccc([C@H](CNC[C@@H](O)COc2c(C)ccc(C)c2C)N(C)C)cc1 ZINC000096662924 211345045 /nfs/dbraw/zinc/34/50/45/211345045.db2.gz HMUSVDFDDZBJJF-IRLDBZIGSA-N 0 3 386.536 3.253 10 0 GGAEHN C/C=C\c1ccc(OC[C@@H](O)CNCc2ccc(OC)c(OC)c2)c(OC)c1 ZINC000096635246 211345114 /nfs/dbraw/zinc/34/51/14/211345114.db2.gz MPWATAZEHXNZCX-XFHJGTJQSA-N 0 3 387.476 3.275 10 0 GGAEHN COc1ccc([C@@H](CNC[C@H](O)COc2c(C)ccc(C)c2C)N(C)C)cc1 ZINC000096662927 211344961 /nfs/dbraw/zinc/34/49/61/211344961.db2.gz HMUSVDFDDZBJJF-RBBKRZOGSA-N 0 3 386.536 3.253 10 0 GGAEHN Cc1cccc(-n2c(CC(=O)NCCN3CCCCC3)c3[nH]cccc-3c2=O)c1 ZINC000096387074 211339581 /nfs/dbraw/zinc/33/95/81/211339581.db2.gz KVNREIJAYQDYOD-HXUWFJFHSA-N 0 3 392.503 3.084 10 0 GGAEHN Fc1ccccc1CN1CC[C@]2(C1)COCc1cnc(-c3cccnc3)nc12 ZINC000096244273 211324925 /nfs/dbraw/zinc/32/49/25/211324925.db2.gz HXKGERUSELKHRL-QFIPXVFZSA-N 0 3 376.435 3.352 10 0 GGAEHN CCN1CCN([C@@H](C)CNC(=O)c2csc(-c3cc4ccccc4o3)n2)CC1 ZINC000095958266 211288226 /nfs/dbraw/zinc/28/82/26/211288226.db2.gz MTLSAWONUJXRGQ-HNNXBMFYSA-N 0 3 398.532 3.312 10 0 GGAEHN COc1ccc(CN2C(=O)CC3(CCN(Cc4ccccc4)CC3)C2=O)cc1 ZINC000095937488 211284266 /nfs/dbraw/zinc/28/42/66/211284266.db2.gz RTMNBXFZSSEEEK-UHFFFAOYSA-N 0 3 378.472 3.237 10 0 GGAEHN CN1CC[C@H]2CCN(C(=O)CCCOc3ccccc3Br)[C@@H]2C1 ZINC000095466170 211246208 /nfs/dbraw/zinc/24/62/08/211246208.db2.gz XUVWVRZVZAWBGP-GOEBONIOSA-N 0 3 381.314 3.161 10 0 GGAEHN COC(=O)C1CCN(CCCSc2nnc(Cc3cccc(F)c3)o2)CC1 ZINC000095468106 211245981 /nfs/dbraw/zinc/24/59/81/211245981.db2.gz PVMJDEGDSNPLNU-UHFFFAOYSA-N 0 3 393.484 3.167 10 0 GGAEHN CCNC(=O)N1CCC(NCc2cccc(OC)c2OC2CCCC2)CC1 ZINC000095462811 211244750 /nfs/dbraw/zinc/24/47/50/211244750.db2.gz RBVUMNMYQPLHOG-UHFFFAOYSA-N 0 3 375.513 3.300 10 0 GGAEHN CCCN1CCCN(C(=O)C(=O)Nc2ccc3c(ccn3CC(C)C)c2)CC1 ZINC000095461179 211244212 /nfs/dbraw/zinc/24/42/12/211244212.db2.gz KZQMDGISCIXLNV-UHFFFAOYSA-N 0 3 384.524 3.180 10 0 GGAEHN O=C(Nc1cnn(CCN2CCCCC2)c1)[C@@H]1SCCc2sccc21 ZINC000095459046 211243888 /nfs/dbraw/zinc/24/38/88/211243888.db2.gz JLEVPJXNYGAZRC-QGZVFWFLSA-N 0 3 376.551 3.400 10 0 GGAEHN CCN(Cc1nc2ccccc2c(=O)[nH]1)C1CCN(Cc2ccccc2)CC1 ZINC000095457006 211241760 /nfs/dbraw/zinc/24/17/60/211241760.db2.gz RBGPITXEWICADN-UHFFFAOYSA-N 0 3 376.504 3.410 10 0 GGAEHN O=C(Nc1ccccc1-n1ccnn1)NC1CCN(Cc2ccccc2)CC1 ZINC000089834910 211184938 /nfs/dbraw/zinc/18/49/38/211184938.db2.gz CCRUEPHZXYLKBL-UHFFFAOYSA-N 0 3 376.464 3.053 10 0 GGAEHN CCC(=O)N1CCc2cc(C(=O)NC3CCN(Cc4ccccc4)CC3)ccc21 ZINC000085653462 211178259 /nfs/dbraw/zinc/17/82/59/211178259.db2.gz UOKYXWDAWGJPER-UHFFFAOYSA-N 0 3 391.515 3.380 10 0 GGAEHN CCc1nc2cc(-n3ccnc3-c3cc4n(n3)CCCNC4)ccc2n1CC ZINC000072479037 211125207 /nfs/dbraw/zinc/12/52/07/211125207.db2.gz KSNMWGDWMOJXHL-UHFFFAOYSA-N 0 3 375.480 3.161 10 0 GGAEHN COc1cccc(NC(=O)CN(C)C(=O)CN2CCC[C@@H]2C2CCCCC2)c1 ZINC000070004438 211039825 /nfs/dbraw/zinc/03/98/25/211039825.db2.gz DRTKLJBHQHBQBS-HXUWFJFHSA-N 0 3 387.524 3.137 10 0 GGAEHN Cc1nc(-c2ccc(Cl)cc2Cl)cc(C(=O)N2CCOCC2)c1CN ZINC000066113160 211001556 /nfs/dbraw/zinc/00/15/56/211001556.db2.gz RDTQBSCOXACKEL-UHFFFAOYSA-N 0 3 380.275 3.295 10 0 GGAEHN O[C@@H](CNC[C@H](c1ccco1)N1CCCC1)COCc1ccccc1Cl ZINC000022038999 210404244 /nfs/dbraw/zinc/40/42/44/210404244.db2.gz BNABYTVVRHRFLS-PKOBYXMFSA-N 0 3 378.900 3.237 10 0 GGAEHN CC(=O)Nc1ccc(-c2cc(C(=O)NCCN(C)C)c3ccccc3n2)cc1 ZINC000021662803 210389091 /nfs/dbraw/zinc/38/90/91/210389091.db2.gz AYJCNNFBCCZFQT-UHFFFAOYSA-N 0 3 376.460 3.152 10 0 GGAEHN COc1ccc([C@H](CNC(=O)CCc2nnc(-c3ccccc3)o2)N(C)C)cc1 ZINC000021556434 210386058 /nfs/dbraw/zinc/38/60/58/210386058.db2.gz VHAKAUOBQXUPOL-IBGZPJMESA-N 0 3 394.475 3.097 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)c1cnc2c(-c3ccccc3)c(C)nn2c1C ZINC000021537968 210385539 /nfs/dbraw/zinc/38/55/39/210385539.db2.gz IDZFKKGLZCUSHX-GOSISDBHSA-N 0 3 377.492 3.227 10 0 GGAEHN Cc1ccccc1C(=O)N1CCC(C(=O)NC[C@H](c2ccccc2)N(C)C)CC1 ZINC000021869712 210397083 /nfs/dbraw/zinc/39/70/83/210397083.db2.gz MWARJZVCAYOXOG-JOCHJYFZSA-N 0 3 393.531 3.266 10 0 GGAEHN COCCn1c(C)cc(O)c([C@H](c2ccc(F)cc2)N2CCC(C)CC2)c1=O ZINC000021097897 210376171 /nfs/dbraw/zinc/37/61/71/210376171.db2.gz PZCOMTAOICELNI-NRFANRHFSA-N 0 3 388.483 3.469 10 0 GGAEHN Cc1ccc([C@@H](CC(=O)NCCN2CCCC2)N2Cc3ccccc3C2=O)cc1 ZINC000021530745 210383710 /nfs/dbraw/zinc/38/37/10/210383710.db2.gz JNFLQVWSFVQNDR-JOCHJYFZSA-N 0 3 391.515 3.294 10 0 GGAEHN CCN(CCNC(=O)c1nn(C)c2c1CCc1sccc1-2)Cc1ccccc1 ZINC000020993191 210373556 /nfs/dbraw/zinc/37/35/56/210373556.db2.gz ATOXMAQYNWNYNG-UHFFFAOYSA-N 0 3 394.544 3.499 10 0 GGAEHN CCN(Cc1ccncc1)[C@@H]1CCCN(Cc2ccc(N3CCNC3=O)cc2)C1 ZINC000020997896 210372025 /nfs/dbraw/zinc/37/20/25/210372025.db2.gz KHNAUVWEYPGNPW-JOCHJYFZSA-N 0 3 393.535 3.098 10 0 GGAEHN CCCOc1ccc(Cl)cc1CNCCc1ccc(S(N)(=O)=O)cc1 ZINC000020928878 210371714 /nfs/dbraw/zinc/37/17/14/210371714.db2.gz HJICMJKRMSJMAL-UHFFFAOYSA-N 0 3 382.913 3.109 10 0 GGAEHN COc1cccc(N2C(=O)CN([C@@H]3CCN(Cc4ccccc4)C3)C[C@H]2C)c1 ZINC000020599596 210350968 /nfs/dbraw/zinc/35/09/68/210350968.db2.gz KPXXDRXWXMBHBQ-WIYYLYMNSA-N 0 3 379.504 3.007 10 0 GGAEHN CCOC(=O)C1=C(CN(C)C2CCCCC2)NC(=O)N[C@H]1c1cccs1 ZINC000020559079 210347431 /nfs/dbraw/zinc/34/74/31/210347431.db2.gz BPBAVFVJPUWKTB-KRWDZBQOSA-N 0 3 377.510 3.184 10 0 GGAEHN CN(Cc1ccccc1)C[C@@H](O)COc1ccc(CN2CCSCC2)cc1 ZINC000020538972 210346751 /nfs/dbraw/zinc/34/67/51/210346751.db2.gz PFFILVKOBUYLSL-OAQYLSRUSA-N 0 3 386.561 3.107 10 0 GGAEHN CCOc1c(Br)cc(CNCCN(C)C)cc1Br ZINC000020477637 210339983 /nfs/dbraw/zinc/33/99/83/210339983.db2.gz FIWLLSQHRIVNMV-UHFFFAOYSA-N 0 3 380.124 3.262 10 0 GGAEHN Cc1ccc2c(c1)-c1c(cnn1CC(=O)N1CCN(C3CCCCC3)CC1)CO2 ZINC000020380057 210332281 /nfs/dbraw/zinc/33/22/81/210332281.db2.gz YVIDLUFLRABYFW-UHFFFAOYSA-N 0 3 394.519 3.228 10 0 GGAEHN O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)c1cn(C2CCCCC2)nn1 ZINC000011839498 221130311 /nfs/dbraw/zinc/13/03/11/221130311.db2.gz QHWZPFPPDYGPMP-LJQANCHMSA-N 0 3 381.524 3.425 10 0 GGAEHN CC(=O)N1c2ccccc2C(=O)C1N1CCN(c2cc(Cl)ccc2C)CC1 ZINC000102437824 136190111 /nfs/dbraw/zinc/19/01/11/136190111.db2.gz WOQJLYNARDFOEM-NRFANRHFSA-N 0 3 383.879 3.346 10 0 GGAEHN CCN(CC)Cc1cnc2c(C(=O)Nc3ccc(-n4cccn4)cc3)cnn2c1 ZINC000067588686 222150199 /nfs/dbraw/zinc/15/01/99/222150199.db2.gz AGSZDAYMTCGVAD-UHFFFAOYSA-N 0 3 389.463 3.009 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2 ZINC000072012936 222204122 /nfs/dbraw/zinc/20/41/22/222204122.db2.gz SVCIXTKHQPYMRG-AWEZNQCLSA-N 0 3 390.478 3.345 10 0 GGAEHN COc1ccc([C@@H](O)CN2CCC(N3Cc4ccccc4NC3=O)CC2)cc1 ZINC000033876516 525205395 /nfs/dbraw/zinc/20/53/95/525205395.db2.gz OVPWQOQFTIDOQX-NRFANRHFSA-N 0 3 381.476 3.241 10 0 GGAEHN N[C@@H]1CCCN(c2nc3ccsc3c(=O)n2Cc2ccc(F)cc2Cl)C1 ZINC000057344573 527348083 /nfs/dbraw/zinc/34/80/83/527348083.db2.gz FLFNUVLSFRXMEO-CYBMUJFWSA-N 0 3 392.887 3.226 10 0 GGAEHN N[C@H]1CCCN(c2nc3ccsc3c(=O)n2Cc2c(F)cccc2Cl)C1 ZINC000057344560 527402468 /nfs/dbraw/zinc/40/24/68/527402468.db2.gz YBZVUNYBYBCUBZ-NSHDSACASA-N 0 3 392.887 3.226 10 0 GGAEHN COc1ccc(-c2nnc(-c3cccnc3N3CCN(C(C)C)CC3)o2)cc1 ZINC000065117739 536528246 /nfs/dbraw/zinc/52/82/46/536528246.db2.gz AAMGTZNZIJCFBQ-UHFFFAOYSA-N 0 3 379.464 3.338 10 0 GGAEHN Cc1ccc(I)c(C(=O)NC[C@@H](CC(C)C)N(C)C)c1 ZINC000101686157 564920219 /nfs/dbraw/zinc/92/02/19/564920219.db2.gz GOZQAPJSFNQMSQ-CYBMUJFWSA-N 0 3 388.293 3.306 10 0 GGAEHN Cn1cnc(CCNCc2cc(Cl)ccc2I)c1 ZINC000405569536 565587466 /nfs/dbraw/zinc/58/74/66/565587466.db2.gz HCQASMUXZYRZGU-UHFFFAOYSA-N 0 3 375.641 3.010 10 0 GGAEHN CC(C)[C@@H](C(=O)NCc1cc(Cl)ccc1I)N(C)C ZINC000597898015 567723293 /nfs/dbraw/zinc/72/32/93/567723293.db2.gz NHTBOVNPJHCEDV-ZDUSSCGKSA-N 0 3 394.684 3.147 10 0 GGAEHN C[C@H](NC[C@@H](O)[C@@H]1CCCO1)c1ccc(Br)cc1Br ZINC000527953449 567386096 /nfs/dbraw/zinc/38/60/96/567386096.db2.gz QVBGUNYGDQQOPC-FZZIBODNSA-N 0 3 393.119 3.402 10 0 GGAEHN Cc1ccc(C(=O)N(C)C[C@H]2CCCN(C)C2)cc1I ZINC000115432352 564192964 /nfs/dbraw/zinc/19/29/64/564192964.db2.gz CFSLYTVWLKYXJY-ZDUSSCGKSA-N 0 3 386.277 3.013 10 0 GGAEHN Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)NCCSC1=NCCN1 ZINC000003137915 564193483 /nfs/dbraw/zinc/19/34/83/564193483.db2.gz DYFCASVBMLZJDE-UHFFFAOYSA-N 0 3 399.303 3.379 10 0 GGAEHN COc1ccc([C@@H](CNC(=O)c2ccc(Br)cc2)N(C)C)cc1 ZINC000003438872 564197457 /nfs/dbraw/zinc/19/74/57/564197457.db2.gz CNSXOKDZACWWDG-QGZVFWFLSA-N 0 3 377.282 3.490 10 0 GGAEHN COc1ccc([C@H](CNC(=O)c2ccc(Br)cc2)N(C)C)cc1 ZINC000003438870 564197483 /nfs/dbraw/zinc/19/74/83/564197483.db2.gz CNSXOKDZACWWDG-KRWDZBQOSA-N 0 3 377.282 3.490 10 0 GGAEHN CN(C[C@@H]1CCCN(C)C1)C(=O)N[C@@H]1CCc2cc(Br)ccc21 ZINC000115808889 564199410 /nfs/dbraw/zinc/19/94/10/564199410.db2.gz OKELBUWMRGTACX-CXAGYDPISA-N 0 3 380.330 3.420 10 0 GGAEHN Cn1cc([C@@H]2CCN(CCC(=O)Nc3ccccc3Br)C2)cn1 ZINC000116310052 564207493 /nfs/dbraw/zinc/20/74/93/564207493.db2.gz XXKLABHQCGXHNM-CYBMUJFWSA-N 0 3 377.286 3.001 10 0 GGAEHN Cn1cc([C@@H]2CCN(CCC(=O)Nc3ccc(Br)cc3F)C2)cn1 ZINC000116314237 564207633 /nfs/dbraw/zinc/20/76/33/564207633.db2.gz WNCIPUFAXYMXKF-GFCCVEGCSA-N 0 3 395.276 3.140 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)c1cc(Br)sc1Br ZINC000116763101 564216249 /nfs/dbraw/zinc/21/62/49/564216249.db2.gz XLLZHWYCZVZJBM-ZETCQYMHSA-N 0 3 382.121 3.097 10 0 GGAEHN NC(=O)[C@H](NCCc1c[nH]c2ccc(F)cc12)c1ccc(Br)cc1 ZINC000116907599 564219798 /nfs/dbraw/zinc/21/97/98/564219798.db2.gz GUWHLVWPIYYPNE-QGZVFWFLSA-N 0 3 390.256 3.428 10 0 GGAEHN CN(CC(=O)Nc1ccccc1Br)C(=O)CN(C)C1CCCCC1 ZINC000008427821 564249223 /nfs/dbraw/zinc/24/92/23/564249223.db2.gz VVHKXNWMNUQDAY-UHFFFAOYSA-N 0 3 396.329 3.111 10 0 GGAEHN CCN(CC)CCNS(=O)(=O)c1ccc(-c2cc(C(F)(F)F)on2)s1 ZINC000009268764 564253137 /nfs/dbraw/zinc/25/31/37/564253137.db2.gz MPQKYRQNTLIIRP-UHFFFAOYSA-N 0 3 397.444 3.042 10 0 GGAEHN OCCOCCNCc1cc(Br)ccc1OCc1ccccc1F ZINC000010435690 564257893 /nfs/dbraw/zinc/25/78/93/564257893.db2.gz ZCJHIGATHNSWST-UHFFFAOYSA-N 0 3 398.272 3.266 10 0 GGAEHN C[C@@H](NCCOc1ccc(S(=O)(=O)N(C)C)cc1)c1cccc(Cl)c1 ZINC000119666938 564282074 /nfs/dbraw/zinc/28/20/74/564282074.db2.gz AGHAKKBPAMTPJK-CQSZACIVSA-N 0 3 382.913 3.320 10 0 GGAEHN CCN1CCCC[C@@H]1CNC(=O)c1c(F)cccc1I ZINC000120029882 564301056 /nfs/dbraw/zinc/30/10/56/564301056.db2.gz QJCUXHIJTBAJGY-LLVKDONJSA-N 0 3 390.240 3.035 10 0 GGAEHN C[C@H](N[C@H]1CCN(c2ncccc2Cl)C1)c1ccc(S(C)(=O)=O)cc1 ZINC000120028968 564301243 /nfs/dbraw/zinc/30/12/43/564301243.db2.gz PLYPKEUMIIJYLJ-ZFWWWQNUSA-N 0 3 379.913 3.068 10 0 GGAEHN NC(=O)[C@H]1CCC[C@@H](NCc2cc(Br)ccc2OC(F)F)C1 ZINC000120068392 564302820 /nfs/dbraw/zinc/30/28/20/564302820.db2.gz GJJCQXSCWCURHW-JOYOIKCWSA-N 0 3 377.229 3.184 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000120369600 564317990 /nfs/dbraw/zinc/31/79/90/564317990.db2.gz PXMIXERIZBDMGU-WQVCFCJDSA-N 0 3 396.329 3.254 10 0 GGAEHN Cc1ccc(I)c(C(=O)N(C)[C@H]2CCN(C)C[C@@H]2C)c1 ZINC000120571799 564327021 /nfs/dbraw/zinc/32/70/21/564327021.db2.gz KDWYQASBGFCEIE-WFASDCNBSA-N 0 3 386.277 3.012 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)C[C@@H](C)c1ccc(Br)cc1 ZINC000120613366 564328439 /nfs/dbraw/zinc/32/84/39/564328439.db2.gz ITHZISLLQZBICB-PBHICJAKSA-N 0 3 383.330 3.170 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)C[C@@H](C)c1ccc(Br)cc1 ZINC000120613685 564329067 /nfs/dbraw/zinc/32/90/67/564329067.db2.gz ITHZISLLQZBICB-RHSMWYFYSA-N 0 3 383.330 3.170 10 0 GGAEHN Cc1ccc(C(=O)N(C)[C@H]2CCN(C)C[C@@H]2C)cc1I ZINC000121162382 564357333 /nfs/dbraw/zinc/35/73/33/564357333.db2.gz AGZGVCLLXXIYQC-WFASDCNBSA-N 0 3 386.277 3.012 10 0 GGAEHN O=C(NC1CCN(CCc2ccccc2)CC1)c1coc(Br)c1 ZINC000027938052 564357693 /nfs/dbraw/zinc/35/76/93/564357693.db2.gz UXSVOXWECUTBQM-UHFFFAOYSA-N 0 3 377.282 3.479 10 0 GGAEHN CC(=O)NCCCN[C@@H](C)c1ccc(Br)cc1Br ZINC000121373489 564366802 /nfs/dbraw/zinc/36/68/02/564366802.db2.gz IMVQYYIAELDTMF-VIFPVBQESA-N 0 3 378.108 3.388 10 0 GGAEHN Cc1cc(S(=O)(=O)N2CC[C@@H]3[C@H](CCCN3C3CC3)C2)c(Cl)cc1F ZINC000121680956 564381707 /nfs/dbraw/zinc/38/17/07/564381707.db2.gz FVMKKDVETITROC-CXAGYDPISA-N 0 3 386.920 3.425 10 0 GGAEHN C[C@H](NC[C@H](O)COc1ccc(Br)cc1)c1ccc2c(c1)OCO2 ZINC000030536009 564382253 /nfs/dbraw/zinc/38/22/53/564382253.db2.gz VAPVULBAABRVHJ-WFASDCNBSA-N 0 3 394.265 3.268 10 0 GGAEHN CN(C)C[C@@H](NC(=O)COc1ccccc1Br)c1ccccc1 ZINC000122507644 564416287 /nfs/dbraw/zinc/41/62/87/564416287.db2.gz XQBYOAMVMYLMQL-MRXNPFEDSA-N 0 3 377.282 3.247 10 0 GGAEHN Cc1cc(Br)c(NC(=O)N2CCO[C@H](CN(C)C)C2)cc1Cl ZINC000122588377 564420290 /nfs/dbraw/zinc/42/02/90/564420290.db2.gz BATWYBPWAQJMTL-LLVKDONJSA-N 0 3 390.709 3.205 10 0 GGAEHN Cc1ccc(NC(=O)NC2CCN(C3CC3)CC2)cc1I ZINC000040103605 564425927 /nfs/dbraw/zinc/42/59/27/564425927.db2.gz IYHIIQYIRFAPBU-UHFFFAOYSA-N 0 3 399.276 3.348 10 0 GGAEHN COc1ccc(CCC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1Br ZINC000122792908 564427981 /nfs/dbraw/zinc/42/79/81/564427981.db2.gz DBOXILBSCXYPAQ-ZFWWWQNUSA-N 0 3 383.330 3.331 10 0 GGAEHN COc1ccc(CCNc2nnc(SC[C@@H](C)N(C)C)s2)cc1OC ZINC000479209568 564431280 /nfs/dbraw/zinc/43/12/80/564431280.db2.gz UYJPGUZLDAIWQB-GFCCVEGCSA-N 0 3 382.555 3.252 10 0 GGAEHN CCOc1cc(CN(C)CC2CC2)cc(Br)c1OCC(=O)N(C)C ZINC000122942657 564432430 /nfs/dbraw/zinc/43/24/30/564432430.db2.gz LNFCXJKKFLQVKJ-UHFFFAOYSA-N 0 3 399.329 3.157 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)c2cnn(-c3cccc(Br)c3)c2)CCN1C ZINC000122972798 564434497 /nfs/dbraw/zinc/43/44/97/564434497.db2.gz SHXSRTMPHAQZGU-XJKSGUPXSA-N 0 3 391.313 3.190 10 0 GGAEHN Cc1ccc(I)c(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1 ZINC000122999712 564435319 /nfs/dbraw/zinc/43/53/19/564435319.db2.gz VEILBPBZOMXOOZ-CHWSQXEVSA-N 0 3 386.277 3.154 10 0 GGAEHN C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000123141983 564439194 /nfs/dbraw/zinc/43/91/94/564439194.db2.gz VXPKBQHUMKTQLA-ZFWWWQNUSA-N 0 3 396.304 3.175 10 0 GGAEHN C[C@H]1C[C@@H](N(C)Cc2nc(-c3cc(Br)cs3)no2)CCN1C ZINC000123389426 564447244 /nfs/dbraw/zinc/44/72/44/564447244.db2.gz SAQIQJVALIGAMQ-JQWIXIFHSA-N 0 3 385.331 3.475 10 0 GGAEHN COc1cc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc(OC)c1Br ZINC000123602878 564454829 /nfs/dbraw/zinc/45/48/29/564454829.db2.gz JZZWPAACFYCSMW-DGCLKSJQSA-N 0 3 385.302 3.021 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)c2ccc(-n3cc(Br)cn3)cc2)CCN1C ZINC000123848021 564463276 /nfs/dbraw/zinc/46/32/76/564463276.db2.gz FHBVTSMQCDDYRE-GUYCJALGSA-N 0 3 391.313 3.190 10 0 GGAEHN C[C@H]1C[C@H](N(C)Cc2nc(-c3ccc(Br)s3)no2)CCN1C ZINC000123928388 564466298 /nfs/dbraw/zinc/46/62/98/564466298.db2.gz FCVXGRNGTFDDMJ-WDEREUQCSA-N 0 3 385.331 3.475 10 0 GGAEHN C[C@H]1C[C@@H](N(C)Cc2nc(Cc3cccc(Br)c3)no2)CCN1C ZINC000123926527 564466714 /nfs/dbraw/zinc/46/67/14/564466714.db2.gz PGYJCQMNXFKTIR-BBRMVZONSA-N 0 3 393.329 3.337 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)c2ccn(-c3cccc(Br)c3)n2)CCN1C ZINC000124029187 564469159 /nfs/dbraw/zinc/46/91/59/564469159.db2.gz BHXBCEWBQVUHRA-UKRRQHHQSA-N 0 3 391.313 3.190 10 0 GGAEHN Cc1ccc(OCCC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c(Br)c1 ZINC000124036168 564469488 /nfs/dbraw/zinc/46/94/88/564469488.db2.gz ADWNMSIMKMSOFH-CABCVRRESA-N 0 3 383.330 3.468 10 0 GGAEHN Cn1nccc1C1CCN(CCC(=O)Nc2cccc(Br)c2)CC1 ZINC000124314165 564478201 /nfs/dbraw/zinc/47/82/01/564478201.db2.gz YNXOSYKVQYJDOW-UHFFFAOYSA-N 0 3 391.313 3.391 10 0 GGAEHN CCCC(=O)N[C@@H]1CCCN(CCC(=O)Nc2cccc(Br)c2)C1 ZINC000124358767 564479808 /nfs/dbraw/zinc/47/98/08/564479808.db2.gz WVEKMZIIVANXNP-MRXNPFEDSA-N 0 3 396.329 3.158 10 0 GGAEHN Cc1ccc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1I ZINC000124613812 564487294 /nfs/dbraw/zinc/48/72/94/564487294.db2.gz ZMFKRQOEMUWCFC-OCCSQVGLSA-N 0 3 386.277 3.154 10 0 GGAEHN C[C@H](NC(C)(C)CNC(=O)c1cc(S(C)(=O)=O)cs1)c1ccccc1 ZINC000124843590 564495005 /nfs/dbraw/zinc/49/50/05/564495005.db2.gz FSKKKDMEGJPKRC-ZDUSSCGKSA-N 0 3 380.535 3.011 10 0 GGAEHN CC(C(=O)NCc1ccccc1)S(=O)(=O)Cc1csc(C(C)(C)C)n1 ZINC000046184905 564498067 /nfs/dbraw/zinc/49/80/67/564498067.db2.gz JHSRALFOTUYOTP-CYBMUJFWSA-N 0 3 380.535 3.060 10 0 GGAEHN CC(C(=O)NC1CCC(C)CC1)S(=O)(=O)Cc1csc(C(C)(C)C)n1 ZINC000046185023 564498237 /nfs/dbraw/zinc/49/82/37/564498237.db2.gz UCVUGHIETTVOSV-MOKVOYLWSA-N 0 3 386.583 3.439 10 0 GGAEHN CN1CCN(CCCNC(=O)[C@@]2(C)CC2(Cl)Cl)[C@@H](c2ccccc2)C1 ZINC000046388194 564501427 /nfs/dbraw/zinc/50/14/27/564501427.db2.gz XYXIFIPMTXBTSZ-SJLPKXTDSA-N 0 3 384.351 3.065 10 0 GGAEHN CCOC(=O)[C@@H]1CCCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000046346035 564501982 /nfs/dbraw/zinc/50/19/82/564501982.db2.gz NRZXTYYBDZDQFM-OLZOCXBDSA-N 0 3 376.280 3.008 10 0 GGAEHN CN1CCC(n2ccc(NC(=O)N3CCc4sc(Cl)cc4C3)n2)CC1 ZINC000516768422 564511535 /nfs/dbraw/zinc/51/15/35/564511535.db2.gz SKCKFCGXWLLVGC-UHFFFAOYSA-N 0 3 379.917 3.455 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1ccc(-n2cc(Br)cn2)cc1 ZINC000047143862 564513421 /nfs/dbraw/zinc/51/34/21/564513421.db2.gz YVCYTOCUMOPOHK-AWEZNQCLSA-N 0 3 391.313 3.239 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1ccc(F)cc1I ZINC000047144274 564514280 /nfs/dbraw/zinc/51/42/80/564514280.db2.gz NAGBBBLCFIJMGS-NSHDSACASA-N 0 3 390.240 3.035 10 0 GGAEHN Brc1cncnc1NCCCCN1CCN(c2ccccc2)CC1 ZINC000481707002 564519568 /nfs/dbraw/zinc/51/95/68/564519568.db2.gz PYIUBVMAGUVYAC-UHFFFAOYSA-N 0 3 390.329 3.253 10 0 GGAEHN C[C@H](CNC(=O)c1ccc(Cl)cc1I)N1CCCC1 ZINC000048128678 564531880 /nfs/dbraw/zinc/53/18/80/564531880.db2.gz RTQGLPFYIACGAW-SNVBAGLBSA-N 0 3 392.668 3.159 10 0 GGAEHN CN1CCC[C@H](NC(=O)Nc2cc(Br)ccc2Br)C1 ZINC000048770456 564545923 /nfs/dbraw/zinc/54/59/23/564545923.db2.gz XYJBJYOQWRHKPM-JTQLQIEISA-N 0 3 391.107 3.427 10 0 GGAEHN CC(C(=O)N1CCC(c2nc3cc(Cl)ccc3s2)CC1)S(C)(=O)=O ZINC000049621318 564552014 /nfs/dbraw/zinc/55/20/14/564552014.db2.gz FUXNEEYEUSVURO-SNVBAGLBSA-N 0 3 386.926 3.089 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1[C@@H]2CC[C@H]1CC(O)C2 ZINC000126553460 564553575 /nfs/dbraw/zinc/55/35/75/564553575.db2.gz BXFWIKUUMRPXPU-JWTNVVGKSA-N 0 3 376.298 3.431 10 0 GGAEHN Cc1ccc(Cl)c(S(=O)(=O)NCc2ccc(OCCN(C)C)cc2)c1 ZINC000126571736 564554135 /nfs/dbraw/zinc/55/41/35/564554135.db2.gz CPQLHJHUVOQVIX-UHFFFAOYSA-N 0 3 382.913 3.067 10 0 GGAEHN CN(CCOc1ccccc1Br)[C@H]1CCCN(c2cccnn2)C1 ZINC000126619906 564555632 /nfs/dbraw/zinc/55/56/32/564555632.db2.gz FJAAVILJEFLUFV-HNNXBMFYSA-N 0 3 391.313 3.219 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)Nc1cncc(Br)c1 ZINC000126719755 564559181 /nfs/dbraw/zinc/55/91/81/564559181.db2.gz PEYCFSAXWKGTEK-MRXNPFEDSA-N 0 3 377.286 3.139 10 0 GGAEHN O=C(C(=O)N1CC[C@@H]2[C@H](CCCN2C2CC2)C1)c1ccc(Br)cc1 ZINC000126753541 564561037 /nfs/dbraw/zinc/56/10/37/564561037.db2.gz BKHXIKPEGXIPBY-RHSMWYFYSA-N 0 3 391.309 3.107 10 0 GGAEHN Cc1cscc1NC(=O)C(=O)NC[C@@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000126861556 564565925 /nfs/dbraw/zinc/56/59/25/564565925.db2.gz AIIHMJSZYYQPTA-BBRMVZONSA-N 0 3 377.535 3.256 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)NC(c1cccs1)c1cccs1 ZINC000127133642 564574091 /nfs/dbraw/zinc/57/40/91/564574091.db2.gz FKZQWBQAOUEZFY-CQSZACIVSA-N 0 3 379.551 3.309 10 0 GGAEHN O=C(CN[C@H](c1ccc(Cl)cc1)C1CC1)NC(=O)NCc1cccs1 ZINC000052661802 564575122 /nfs/dbraw/zinc/57/51/22/564575122.db2.gz ZYKLISWLXJSBLO-KRWDZBQOSA-N 0 3 377.897 3.468 10 0 GGAEHN Cc1c(I)cccc1C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C ZINC000127359927 564582089 /nfs/dbraw/zinc/58/20/89/564582089.db2.gz HLXIUKPSFSSZJH-NHYWBVRUSA-N 0 3 386.277 3.058 10 0 GGAEHN CC[C@H](Cc1ccccc1Br)C(=O)Nc1cnn(CCN(C)C)c1 ZINC000127453357 564584779 /nfs/dbraw/zinc/58/47/79/564584779.db2.gz INWOMMRMRCKNSR-CQSZACIVSA-N 0 3 393.329 3.415 10 0 GGAEHN CC(C)C[C@H](NC(=O)Nc1cccc(Cl)c1Cl)C(=O)NCCN(C)C ZINC000127533065 564586873 /nfs/dbraw/zinc/58/68/73/564586873.db2.gz RCTRXISKGDLZGP-AWEZNQCLSA-N 0 3 389.327 3.207 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=S)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000053537734 564590469 /nfs/dbraw/zinc/59/04/69/564590469.db2.gz YAULMRJFSSUCQG-UKRRQHHQSA-N 0 3 398.370 3.221 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(C)ccc2Br)[C@H](C)C1 ZINC000127812681 564596952 /nfs/dbraw/zinc/59/69/52/564596952.db2.gz QPIOSYBCDGKIQJ-UKRRQHHQSA-N 0 3 389.359 3.108 10 0 GGAEHN CN(C)CCOc1ccc(CNC(=O)c2ccc(F)cc2Br)cc1 ZINC000053992386 564597109 /nfs/dbraw/zinc/59/71/09/564597109.db2.gz CRWPKVANWOWZAA-UHFFFAOYSA-N 0 3 395.272 3.459 10 0 GGAEHN Cn1cc(CCN[C@H]2CCCOc3ccc(I)cc32)cn1 ZINC000127872071 564599035 /nfs/dbraw/zinc/59/90/35/564599035.db2.gz AABORSAVDNSQJD-HNNXBMFYSA-N 0 3 397.260 3.071 10 0 GGAEHN C[C@H](NC(=O)N1CCN(c2ccncc2)CC1)c1ccccc1Br ZINC000054391202 564604538 /nfs/dbraw/zinc/60/45/38/564604538.db2.gz OBRQDFHYILEBMO-AWEZNQCLSA-N 0 3 389.297 3.437 10 0 GGAEHN C[C@@H]1CCCN(CCNC(=O)N[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000054817128 564610221 /nfs/dbraw/zinc/61/02/21/564610221.db2.gz VXXVKZPHPGHKPV-CZUORRHYSA-N 0 3 396.329 3.304 10 0 GGAEHN CN(CCc1ccc(F)cc1)Cc1cc(=O)n2cc(Br)ccc2n1 ZINC000055022522 564613431 /nfs/dbraw/zinc/61/34/31/564613431.db2.gz CSQHEFGPKSLAED-UHFFFAOYSA-N 0 3 390.256 3.271 10 0 GGAEHN CCC(C)(C)NC(=O)CNC1(c2cccc(Br)c2)CCOCC1 ZINC000055055630 564614316 /nfs/dbraw/zinc/61/43/16/564614316.db2.gz RSQVKIWWQLPNFP-UHFFFAOYSA-N 0 3 383.330 3.349 10 0 GGAEHN Cc1ccc(S(=O)(=O)NCc2ccc(OCCN(C)C)cc2)c(Cl)c1 ZINC000055246475 564616960 /nfs/dbraw/zinc/61/69/60/564616960.db2.gz CNWFCEWONIHJSG-UHFFFAOYSA-N 0 3 382.913 3.067 10 0 GGAEHN O=C(CN[C@H]1CCCC[C@@H]1n1cccn1)Nc1ccccc1Br ZINC000129119225 564638989 /nfs/dbraw/zinc/63/89/89/564638989.db2.gz LATXKGVYBKMDRM-HOTGVXAUSA-N 0 3 377.286 3.358 10 0 GGAEHN CC(C)COC1CCN(C[C@H](O)COc2cccc(Br)c2)CC1 ZINC000056293117 564645214 /nfs/dbraw/zinc/64/52/14/564645214.db2.gz KKKPVSDEQDOOSO-INIZCTEOSA-N 0 3 386.330 3.326 10 0 GGAEHN CN(C(=O)c1coc(Br)c1)C1CCN(CCc2ccccn2)CC1 ZINC000129372331 564646827 /nfs/dbraw/zinc/64/68/27/564646827.db2.gz DSOGOYUSDYCNCV-UHFFFAOYSA-N 0 3 392.297 3.216 10 0 GGAEHN CC(C)S(=O)(=O)C(C)C(=O)NC1(c2cccc(Br)c2)CCC1 ZINC000056378374 564647086 /nfs/dbraw/zinc/64/70/86/564647086.db2.gz CGQHDHYOANPOBT-GFCCVEGCSA-N 0 3 388.327 3.156 10 0 GGAEHN C[C@H](CCNCc1ccc(Br)c(Br)c1)[S@@](C)=O ZINC000129405872 564647289 /nfs/dbraw/zinc/64/72/89/564647289.db2.gz HGORVVZKAVAOHG-XLFHBGCDSA-N 0 3 383.149 3.458 10 0 GGAEHN CCOc1c(Br)cc(CNCC[C@@H](C)[S@@](C)=O)cc1OC ZINC000129434061 564648531 /nfs/dbraw/zinc/64/85/31/564648531.db2.gz ASDSJBXOKZWSDB-FIKIJFGZSA-N 0 3 378.332 3.103 10 0 GGAEHN Cc1ccc(C(=O)NCc2ccc(OCCN(C)C)cc2)c(Br)n1 ZINC000129549092 564652498 /nfs/dbraw/zinc/65/24/98/564652498.db2.gz GNSIKJJJEAODIZ-UHFFFAOYSA-N 0 3 392.297 3.023 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N[C@@H]1CCN(C2CC2)C1 ZINC000057554430 564669458 /nfs/dbraw/zinc/66/94/58/564669458.db2.gz DHRSBAHLGBWALZ-CYBMUJFWSA-N 0 3 376.298 3.065 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N[C@H]1CCN(C2CC2)C1 ZINC000057554433 564669496 /nfs/dbraw/zinc/66/94/96/564669496.db2.gz DHRSBAHLGBWALZ-ZDUSSCGKSA-N 0 3 376.298 3.065 10 0 GGAEHN CCc1c(C)sc2nc(SCCN(C)C)n(C[C@@H]3CCCO3)c(=O)c12 ZINC000058153050 564680564 /nfs/dbraw/zinc/68/05/64/564680564.db2.gz DKUUIWSAQHLMQW-ZDUSSCGKSA-N 0 3 381.567 3.162 10 0 GGAEHN O[C@@H](Cn1nnc2cc(Cl)c(Cl)cc21)CN1CCc2ccccc2C1 ZINC000130601580 564687122 /nfs/dbraw/zinc/68/71/22/564687122.db2.gz TYBHLWGDRVCKCJ-CQSZACIVSA-N 0 3 377.275 3.157 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)Cc1c[nH]c2cccc(Br)c12 ZINC000130771248 564691513 /nfs/dbraw/zinc/69/15/13/564691513.db2.gz KKZOBJXKMTXDPE-ZDUSSCGKSA-N 0 3 378.314 3.464 10 0 GGAEHN Cc1ccc(CN(Cc2ccco2)C[C@@H]2CCCN(S(C)(=O)=O)C2)s1 ZINC000131191531 564704420 /nfs/dbraw/zinc/70/44/20/564704420.db2.gz PSRCHIWBRYQAFM-INIZCTEOSA-N 0 3 382.551 3.323 10 0 GGAEHN CC(C)(CNC(=O)N1CC[C@H](N2CC=CC2)C1)c1ccccc1Br ZINC000131383538 564710115 /nfs/dbraw/zinc/71/01/15/564710115.db2.gz DJWVGHAPLYPDFZ-HNNXBMFYSA-N 0 3 392.341 3.382 10 0 GGAEHN CC(C)N(C(=O)C(C)S(=O)(=O)Cc1csc(Br)c1)C(C)C ZINC000131385898 564710243 /nfs/dbraw/zinc/71/02/43/564710243.db2.gz HSPBKXYZQOGFNZ-LLVKDONJSA-N 0 3 396.372 3.459 10 0 GGAEHN Cc1cc(Br)cc2cc(C(=O)NC[C@H](O)CN3CCCCC3)oc21 ZINC000131437057 564711940 /nfs/dbraw/zinc/71/19/40/564711940.db2.gz BMJQTDBZHFVRGD-HNNXBMFYSA-N 0 3 395.297 3.080 10 0 GGAEHN CC(C)(CN[C@H]1CCCSC1)S(=O)(=O)c1ccc(Br)cc1 ZINC000131533528 564714968 /nfs/dbraw/zinc/71/49/68/564714968.db2.gz OHSJJNYWVBFLPD-ZDUSSCGKSA-N 0 3 392.384 3.487 10 0 GGAEHN CS(=O)(=O)c1cccc(Oc2ncccc2CN[C@H]2CCCSC2)c1 ZINC000131581542 564716811 /nfs/dbraw/zinc/71/68/11/564716811.db2.gz KZKUOHKXQGFBEX-HNNXBMFYSA-N 0 3 378.519 3.263 10 0 GGAEHN O[C@H](COC[C@@H]1CCCO1)CN1CCC[C@H]1c1ccccc1Br ZINC000131613755 564718474 /nfs/dbraw/zinc/71/84/74/564718474.db2.gz SLLQXEGZVAELDV-MPGHIAIKSA-N 0 3 384.314 3.143 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1[nH]nc(-c2ccccc2)c1Br ZINC000065107294 564739303 /nfs/dbraw/zinc/73/93/03/564739303.db2.gz DFYRBFJOZJMNSH-ZDUSSCGKSA-N 0 3 391.313 3.443 10 0 GGAEHN OC[C@]1(NC[C@H](O)COc2c(Cl)cccc2Cl)CCc2ccccc21 ZINC000132316439 564739772 /nfs/dbraw/zinc/73/97/72/564739772.db2.gz YGCDLOKNQIPRLO-IFXJQAMLSA-N 0 3 382.287 3.157 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)N1CC[C@@H](N2CCCC2)C1 ZINC000066186697 564756979 /nfs/dbraw/zinc/75/69/79/564756979.db2.gz AQDYXCOZOLYORX-WMLDXEAASA-N 0 3 380.330 3.260 10 0 GGAEHN CCS(=O)(=O)C[C@H](C)N[C@@H]1CCN(C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000133175323 564765318 /nfs/dbraw/zinc/76/53/18/564765318.db2.gz XACHKBMQPXZJEN-MORSLUCNSA-N 0 3 390.952 3.416 10 0 GGAEHN C[C@@H]1CN(C2CCN(CC(=O)Nc3c(Cl)cccc3Cl)CC2)CCO1 ZINC000066561752 564769175 /nfs/dbraw/zinc/76/91/75/564769175.db2.gz PTLFUSZKFNMPQQ-CYBMUJFWSA-N 0 3 386.323 3.117 10 0 GGAEHN CN(CCc1nccs1)C(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1 ZINC000133303067 564769295 /nfs/dbraw/zinc/76/92/95/564769295.db2.gz MGLZXULPPIHMSM-RHSMWYFYSA-N 0 3 378.567 3.472 10 0 GGAEHN Ic1cnc(NC2CCN(Cc3ccccc3)CC2)nc1 ZINC000133429191 564773740 /nfs/dbraw/zinc/77/37/40/564773740.db2.gz KIGYRKNQCUJVMF-UHFFFAOYSA-N 0 3 394.260 3.158 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNCC[C@@H](C)[S@@](C)=O ZINC000133435873 564773860 /nfs/dbraw/zinc/77/38/60/564773860.db2.gz AHRXUAJKRLVDRA-SPSFWMDKSA-N 0 3 398.370 3.498 10 0 GGAEHN CCN1CCC[C@H](NC(=O)N2CCO[C@H](c3ccc(Br)cc3)C2)C1 ZINC000067605523 564796356 /nfs/dbraw/zinc/79/63/56/564796356.db2.gz ORCSKBHTXUBZPH-IRXDYDNUSA-N 0 3 396.329 3.016 10 0 GGAEHN C[C@@H](NC[C@@H](O)c1ccc(Cl)cc1Cl)c1ccc(S(N)(=O)=O)cc1 ZINC000134284816 564799043 /nfs/dbraw/zinc/79/90/43/564799043.db2.gz SNKKGGSSBVMTLZ-QLJPJBMISA-N 0 3 389.304 3.025 10 0 GGAEHN CC(C(=O)N[C@H](C)c1ccccc1)S(=O)(=O)Cc1csc(C2CC2)n1 ZINC000134654328 564810670 /nfs/dbraw/zinc/81/06/70/564810670.db2.gz UNWZXTFWBNTXNN-CHWSQXEVSA-N 0 3 378.519 3.201 10 0 GGAEHN CC(C)C[C@H](CN(C)C)NC(=O)[C@@H](C)NC(=O)c1cccc(Cl)c1Cl ZINC000068224105 564812143 /nfs/dbraw/zinc/81/21/43/564812143.db2.gz GDUYUZMJFSDDAG-CHWSQXEVSA-N 0 3 388.339 3.204 10 0 GGAEHN O[C@H](COC[C@@H]1CCCO1)CN1CCC(Sc2ccc(Cl)cc2)CC1 ZINC000134854946 564816996 /nfs/dbraw/zinc/81/69/96/564816996.db2.gz WVEMGUMYQMHSBR-IRXDYDNUSA-N 0 3 385.957 3.453 10 0 GGAEHN O[C@@H](COC[C@@H]1CCCO1)CN1CCC(Sc2ccc(Cl)cc2)CC1 ZINC000134854969 564817192 /nfs/dbraw/zinc/81/71/92/564817192.db2.gz WVEMGUMYQMHSBR-SJORKVTESA-N 0 3 385.957 3.453 10 0 GGAEHN CCN1CCC[C@@H](NCc2ncc(Br)cc2Br)C1 ZINC000135296738 564826968 /nfs/dbraw/zinc/82/69/68/564826968.db2.gz SOSNDTRNYBMGSS-LLVKDONJSA-N 0 3 377.124 3.181 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)C1(c2ccc(Br)cc2)CCC1 ZINC000069577679 564842064 /nfs/dbraw/zinc/84/20/64/564842064.db2.gz HXLZWSUHKSDYJA-QGZVFWFLSA-N 0 3 395.341 3.098 10 0 GGAEHN CCN(CC)C(=O)C1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000069682590 564842924 /nfs/dbraw/zinc/84/29/24/564842924.db2.gz SWWJYNYWEPYGEO-UHFFFAOYSA-N 0 3 383.330 3.408 10 0 GGAEHN CCC(CC)N(C)CC(=O)N(C)CC(=O)Nc1ccc(Br)cc1C ZINC000072308070 564862992 /nfs/dbraw/zinc/86/29/92/564862992.db2.gz LYOQGRTWIKQWSJ-UHFFFAOYSA-N 0 3 398.345 3.275 10 0 GGAEHN COc1c(Br)cc(CN[C@@H]2CCO[C@@H]2C)cc1Br ZINC000149453985 564885753 /nfs/dbraw/zinc/88/57/53/564885753.db2.gz PRHJNXPAXQZFHE-PRHODGIISA-N 0 3 379.092 3.487 10 0 GGAEHN COc1c(Br)cc(CN[C@H]2CCO[C@@H]2C)cc1Br ZINC000149454398 564885910 /nfs/dbraw/zinc/88/59/10/564885910.db2.gz PRHJNXPAXQZFHE-PELKAZGASA-N 0 3 379.092 3.487 10 0 GGAEHN CC[C@H]1CCCCCN1CC(=O)NCC(=O)Nc1ccccc1Br ZINC000150748873 564888906 /nfs/dbraw/zinc/88/89/06/564888906.db2.gz CVPPJVRWOVFCHI-AWEZNQCLSA-N 0 3 396.329 3.158 10 0 GGAEHN CC(C)(C)CCN1CCN(c2cc(Br)cc(F)c2C(N)=O)CC1 ZINC000094149334 564897283 /nfs/dbraw/zinc/89/72/83/564897283.db2.gz GIKXLYAXQPCEQD-UHFFFAOYSA-N 0 3 386.309 3.245 10 0 GGAEHN CCOc1c(Br)cc(CNCC[C@@H](C)O)cc1Br ZINC000096593357 564903337 /nfs/dbraw/zinc/90/33/37/564903337.db2.gz ZGKSDJKPCDUFMU-SECBINFHSA-N 0 3 381.108 3.471 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)CCCOc1ccc(Cl)cc1Cl ZINC000097529364 564908476 /nfs/dbraw/zinc/90/84/76/564908476.db2.gz ABIQBMHPHRBXMQ-HNNXBMFYSA-N 0 3 389.323 3.379 10 0 GGAEHN Cc1cc(Br)ccc1CNC[C@H](O)COc1ccc2c(c1)OCO2 ZINC000151426583 564919674 /nfs/dbraw/zinc/91/96/74/564919674.db2.gz XGAKCSJMAUHRKH-HNNXBMFYSA-N 0 3 394.265 3.016 10 0 GGAEHN CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000102052237 564924857 /nfs/dbraw/zinc/92/48/57/564924857.db2.gz DGQWBPPUQQGECP-OAHLLOKOSA-N 0 3 387.311 3.058 10 0 GGAEHN C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1cccc(Br)c1 ZINC000102675210 564931850 /nfs/dbraw/zinc/93/18/50/564931850.db2.gz VELBMWUJHMQYID-LBPRGKRZSA-N 0 3 383.311 3.290 10 0 GGAEHN O=C(NC[C@@H](O)CN1CCCCC1)Nc1ccc(Cl)c(Br)c1 ZINC000151721876 564934660 /nfs/dbraw/zinc/93/46/60/564934660.db2.gz NLCDQKYFBDGPJI-GFCCVEGCSA-N 0 3 390.709 3.071 10 0 GGAEHN COc1ccc(S(=O)(=O)[N-]C2CCC(C[NH+](C)C)CC2)c(Cl)c1Cl ZINC000151775988 564936750 /nfs/dbraw/zinc/93/67/50/564936750.db2.gz OFIYANCSWGYJGW-UHFFFAOYSA-N 0 3 395.352 3.401 10 0 GGAEHN CC(C)(C)OC(=O)NC1CCN(C[C@H](O)c2ccc(Br)cc2)CC1 ZINC000103467280 564948664 /nfs/dbraw/zinc/94/86/64/564948664.db2.gz GWBICIATZWRCEJ-INIZCTEOSA-N 0 3 399.329 3.472 10 0 GGAEHN C[C@H](CCC1CCCC1)NCc1ccc(S(=O)(=O)N2CCOCC2)s1 ZINC000152150839 564948856 /nfs/dbraw/zinc/94/88/56/564948856.db2.gz YYWQGSSOYXTBFF-OAHLLOKOSA-N 0 3 386.583 3.218 10 0 GGAEHN O=C(Nc1ccc(Br)cn1)[C@H]1CCCN(CCc2ccccn2)C1 ZINC000103469104 564949075 /nfs/dbraw/zinc/94/90/75/564949075.db2.gz ABYMTMJSZVPLND-AWEZNQCLSA-N 0 3 389.297 3.132 10 0 GGAEHN CN(C)[C@H]1CCCN(C(=O)CSCc2ccc(Br)cc2F)C1 ZINC000105327900 564964117 /nfs/dbraw/zinc/96/41/17/564964117.db2.gz YVULPCDPBNMUBD-AWEZNQCLSA-N 0 3 389.334 3.374 10 0 GGAEHN Cc1nc(CS(=O)(=O)C(C)C(=O)N[C@@H](C)c2ccc(Cl)cc2)cs1 ZINC000105523171 564968064 /nfs/dbraw/zinc/96/80/64/564968064.db2.gz DKZCLUIZTGIZNJ-WDEREUQCSA-N 0 3 386.926 3.286 10 0 GGAEHN O=C(NC[C@@H](O)CN1CCCCC1)Nc1ccc(Cl)cc1Br ZINC000152864769 564974628 /nfs/dbraw/zinc/97/46/28/564974628.db2.gz GBDNLZRWUNIVKE-GFCCVEGCSA-N 0 3 390.709 3.071 10 0 GGAEHN CC[C@@H]1CN(CCC(=O)Nc2cc(Cl)ccc2Cl)CCN1C[C@@H](C)O ZINC000106102757 564978458 /nfs/dbraw/zinc/97/84/58/564978458.db2.gz SVWNYZDULMDBGR-UKRRQHHQSA-N 0 3 388.339 3.099 10 0 GGAEHN CN(Cc1ccccc1Br)C1CCN(CCn2cccn2)CC1 ZINC000106130883 564978963 /nfs/dbraw/zinc/97/89/63/564978963.db2.gz GBMJWYXWJSZMFX-UHFFFAOYSA-N 0 3 377.330 3.242 10 0 GGAEHN Cc1cnn([C@H]2CCCN(C[C@H](O)COc3ccc(Br)cc3)C2)c1 ZINC000106222960 564980499 /nfs/dbraw/zinc/98/04/99/564980499.db2.gz OOOIRNZZGSXBLF-IRXDYDNUSA-N 0 3 394.313 3.031 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)c2cn(-c3ccc(Br)cc3)cn2)CCN1C ZINC000153247362 564989025 /nfs/dbraw/zinc/98/90/25/564989025.db2.gz BABPFJOWGKFYRD-CJNGLKHVSA-N 0 3 391.313 3.190 10 0 GGAEHN CC(C)c1n[nH]c(C(=O)N[C@H](CN(C)C)c2ccccc2)c1Br ZINC000106902136 564991768 /nfs/dbraw/zinc/99/17/68/564991768.db2.gz CNEDEYNODABPOP-CYBMUJFWSA-N 0 3 379.302 3.328 10 0 GGAEHN COCCN(C)CCCNC(=O)N[C@@H](c1ccc(Cl)cc1)C(F)(F)F ZINC000153411220 564993579 /nfs/dbraw/zinc/99/35/79/564993579.db2.gz VHCJLXHHUNKOOA-AWEZNQCLSA-N 0 3 381.826 3.211 10 0 GGAEHN COCCN(C)CCCNC(=O)N[C@H](c1ccc(Cl)cc1)C(F)(F)F ZINC000153411334 564993881 /nfs/dbraw/zinc/99/38/81/564993881.db2.gz VHCJLXHHUNKOOA-CQSZACIVSA-N 0 3 381.826 3.211 10 0 GGAEHN O=S(=O)(c1ccccc1Br)N1CCCC[C@H](N2CCCC2)C1 ZINC000107707582 565002540 /nfs/dbraw/zinc/00/25/40/565002540.db2.gz FJHPSNWQRIWFLW-AWEZNQCLSA-N 0 3 387.343 3.088 10 0 GGAEHN CCc1nc(CNC(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)cs1 ZINC000107741759 565002598 /nfs/dbraw/zinc/00/25/98/565002598.db2.gz OJCCAKQXFJVHMR-AWEZNQCLSA-N 0 3 378.567 3.478 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)NC[C@H]1CCCN(C)C1 ZINC000108325870 565009453 /nfs/dbraw/zinc/00/94/53/565009453.db2.gz GHHKYFXVOFUBBT-CQSZACIVSA-N 0 3 378.314 3.170 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)NC[C@@H]1CCCN(C)C1 ZINC000108325868 565010298 /nfs/dbraw/zinc/01/02/98/565010298.db2.gz GHHKYFXVOFUBBT-AWEZNQCLSA-N 0 3 378.314 3.170 10 0 GGAEHN CC[C@@H](CNC(=O)N1CC[C@H](N(C)C)C1)Cc1cccc(Br)c1 ZINC000153828029 565013218 /nfs/dbraw/zinc/01/32/18/565013218.db2.gz QSROQWPCYXKCLG-PBHICJAKSA-N 0 3 382.346 3.363 10 0 GGAEHN CC[C@H](CNC(=O)N1CC[C@@H](N(C)C)C1)Cc1cccc(Br)c1 ZINC000153828140 565013503 /nfs/dbraw/zinc/01/35/03/565013503.db2.gz QSROQWPCYXKCLG-WMLDXEAASA-N 0 3 382.346 3.363 10 0 GGAEHN CN(C(=O)c1cccc(Cl)c1Cl)C1CCN(CCn2cccn2)CC1 ZINC000109293186 565024046 /nfs/dbraw/zinc/02/40/46/565024046.db2.gz BBONMDIHVCWNRB-UHFFFAOYSA-N 0 3 381.307 3.427 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)[C@@H]1CCCN1c1nccs1)c1ccsc1 ZINC000110629046 565043301 /nfs/dbraw/zinc/04/33/01/565043301.db2.gz QBVFMUJBZGXXSA-JKSUJKDBSA-N 0 3 378.567 3.373 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1[C@@H](C)C(=O)Nc1ccc(Br)cc1 ZINC000154575680 565045110 /nfs/dbraw/zinc/04/51/10/565045110.db2.gz PTTFGFTXXSWINK-SUMWQHHRSA-N 0 3 391.313 3.446 10 0 GGAEHN O=C(CCN1CC[C@H](Oc2cccnc2)C1)Nc1ccccc1Br ZINC000154659607 565047950 /nfs/dbraw/zinc/04/79/50/565047950.db2.gz NWQSKDQINIYOSL-HNNXBMFYSA-N 0 3 390.281 3.326 10 0 GGAEHN O=C(NCC1(N2CCCCC2)CCOCC1)c1csc(Br)c1 ZINC000111101356 565049860 /nfs/dbraw/zinc/04/98/60/565049860.db2.gz XGXCDXHFVDAUJZ-UHFFFAOYSA-N 0 3 387.343 3.276 10 0 GGAEHN Brc1cccc(OCCN2CCCC[C@H]2CN2CCOCC2)c1 ZINC000111302255 565051726 /nfs/dbraw/zinc/05/17/26/565051726.db2.gz FURPMSGKTCZISD-KRWDZBQOSA-N 0 3 383.330 3.015 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)N(C)[C@H](C)c1ccccc1Br ZINC000111864423 565058357 /nfs/dbraw/zinc/05/83/57/565058357.db2.gz BUFLZNYUBBEWFA-HUUCEWRRSA-N 0 3 398.345 3.262 10 0 GGAEHN COc1ccc(CN(C)[C@H]2CCCN(c3cccnn3)C2)cc1Br ZINC000155042831 565060265 /nfs/dbraw/zinc/06/02/65/565060265.db2.gz ULUDWXXRRMSASL-HNNXBMFYSA-N 0 3 391.313 3.349 10 0 GGAEHN CCc1nc2n(n1)C[C@H](N[C@@H](C)C(=O)Nc1cccc(Cl)c1Cl)CC2 ZINC000112550595 565064263 /nfs/dbraw/zinc/06/42/63/565064263.db2.gz VSTOLIUKPCVLRV-WDEREUQCSA-N 0 3 382.295 3.079 10 0 GGAEHN CCc1nc2n(n1)C[C@H](N[C@H](C)C(=O)Nc1cccc(Cl)c1Cl)CC2 ZINC000112550597 565064441 /nfs/dbraw/zinc/06/44/41/565064441.db2.gz VSTOLIUKPCVLRV-GHMZBOCLSA-N 0 3 382.295 3.079 10 0 GGAEHN COc1ccc(Br)c(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)c1 ZINC000155309518 565066080 /nfs/dbraw/zinc/06/60/80/565066080.db2.gz SKLUCDQDGQEJCE-HNNXBMFYSA-N 0 3 391.309 3.360 10 0 GGAEHN CCN1CCN(C[C@@H](C)CNc2ncnc3ccc(Br)cc32)CC1 ZINC000112964938 565067324 /nfs/dbraw/zinc/06/73/24/565067324.db2.gz JYJXQFMUTZOARX-AWEZNQCLSA-N 0 3 392.345 3.078 10 0 GGAEHN CC(C)[C@H](CNc1ncnc2ccc(Br)cc21)N1CCN(C)CC1 ZINC000112964054 565067392 /nfs/dbraw/zinc/06/73/92/565067392.db2.gz OJTJXECOPPMBTA-KRWDZBQOSA-N 0 3 392.345 3.076 10 0 GGAEHN C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1 ZINC000113228547 565068329 /nfs/dbraw/zinc/06/83/29/565068329.db2.gz RQQXLRUDVINRML-GXTWGEPZSA-N 0 3 379.291 3.488 10 0 GGAEHN C[C@@H]1CN2CCC[C@@H]2CN1Cc1nc(-c2cccc(Br)c2)no1 ZINC000113268794 565068808 /nfs/dbraw/zinc/06/88/08/565068808.db2.gz SJCBLYREPBXKDP-IUODEOHRSA-N 0 3 377.286 3.168 10 0 GGAEHN CC(C)(C)CNC(=O)C(C)(C)NC[C@H](O)COc1c(Cl)cccc1Cl ZINC000155564283 565069270 /nfs/dbraw/zinc/06/92/70/565069270.db2.gz BPZAHUBSLRIRKO-LBPRGKRZSA-N 0 3 391.339 3.264 10 0 GGAEHN Cc1sc2ncnc(SCC(=O)N[C@H]3CN(C(C)C)C[C@@H]3C)c2c1C ZINC000155624552 565069985 /nfs/dbraw/zinc/06/99/85/565069985.db2.gz RVJFBDKGOSWQJS-FZMZJTMJSA-N 0 3 378.567 3.245 10 0 GGAEHN CCC[C@H](C(=O)NC1CCN(Cc2ccc(Br)cc2)CC1)N(C)C ZINC000155662348 565070312 /nfs/dbraw/zinc/07/03/12/565070312.db2.gz XTMJHLLDCAODNF-GOSISDBHSA-N 0 3 396.373 3.260 10 0 GGAEHN CCC[C@@H](C(=O)NC1CCN(Cc2ccc(Br)cc2)CC1)N(C)C ZINC000155662232 565070389 /nfs/dbraw/zinc/07/03/89/565070389.db2.gz XTMJHLLDCAODNF-SFHVURJKSA-N 0 3 396.373 3.260 10 0 GGAEHN CN(C)Cc1cccc(CNC(=O)C(=O)c2ccc(Br)cc2)c1 ZINC000114316376 565073624 /nfs/dbraw/zinc/07/36/24/565073624.db2.gz QKLSXDBGDJYRKR-UHFFFAOYSA-N 0 3 375.266 3.010 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)Cc2c[nH]c3cccc(Br)c23)CCN1C ZINC000155994233 565073773 /nfs/dbraw/zinc/07/37/73/565073773.db2.gz QXOMTPKKFHNTOT-GXTWGEPZSA-N 0 3 378.314 3.414 10 0 GGAEHN C[C@@H]1CN2CCC[C@@H]2CN1Cc1nc(-c2ccc(Br)s2)no1 ZINC000114481338 565074685 /nfs/dbraw/zinc/07/46/85/565074685.db2.gz CKEGYXGSNHRKAD-GHMZBOCLSA-N 0 3 383.315 3.229 10 0 GGAEHN Cc1ccc(I)cc1C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1 ZINC000156316277 565080411 /nfs/dbraw/zinc/08/04/11/565080411.db2.gz DRDSIWUDAYPYTL-OCCSQVGLSA-N 0 3 386.277 3.154 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cccc(C)c2Br)[C@H](C)C1 ZINC000156348553 565081841 /nfs/dbraw/zinc/08/18/41/565081841.db2.gz TXQNIXSQHXOCOZ-KGLIPLIRSA-N 0 3 389.359 3.108 10 0 GGAEHN Cc1nc(C(F)(F)F)c(CN2CCCC[C@H](N3CCN(C)CC3)C2)s1 ZINC000183615861 565082480 /nfs/dbraw/zinc/08/24/80/565082480.db2.gz RSAVGPHZZCGMLL-AWEZNQCLSA-N 0 3 376.492 3.072 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N(CCN(C)C)Cc1ccco1 ZINC000156471451 565089995 /nfs/dbraw/zinc/08/99/95/565089995.db2.gz RUFIRPWNDWPAKD-UHFFFAOYSA-N 0 3 395.297 3.184 10 0 GGAEHN Cc1nc(C(F)(F)F)c(CS(=O)(=O)C(C)C(=O)N2CCC(C)CC2)s1 ZINC000183708469 565090205 /nfs/dbraw/zinc/09/02/05/565090205.db2.gz DJISQCXIHXENGR-SNVBAGLBSA-N 0 3 398.472 3.032 10 0 GGAEHN CCC(C)(C)NC(=O)C(C)S(=O)(=O)Cc1sc(C)nc1C(F)(F)F ZINC000183714994 565091023 /nfs/dbraw/zinc/09/10/23/565091023.db2.gz TWNFTVLAEHCQAI-MRVPVSSYSA-N 0 3 386.461 3.078 10 0 GGAEHN CC[C@H]1CN(CCC(=O)Nc2ccccc2Br)C[C@]2(CCOC2)O1 ZINC000369545696 565096445 /nfs/dbraw/zinc/09/64/45/565096445.db2.gz JEZBJWLLYJKZMH-KSSFIOAISA-N 0 3 397.313 3.048 10 0 GGAEHN CC[C@H]1CN(CCC(=O)Nc2ccccc2Br)C[C@@]2(CCOC2)O1 ZINC000369545694 565097052 /nfs/dbraw/zinc/09/70/52/565097052.db2.gz JEZBJWLLYJKZMH-KBXCAEBGSA-N 0 3 397.313 3.048 10 0 GGAEHN CN(C)C[C@H]1CN(Cc2cc(Br)cc(C(F)(F)F)c2)CCO1 ZINC000156645961 565099417 /nfs/dbraw/zinc/09/94/17/565099417.db2.gz WGOIIJXIXLJGFA-AWEZNQCLSA-N 0 3 381.236 3.230 10 0 GGAEHN C[C@@H]1CN(C2CCOCC2)CCN1Cc1nc2cc(Br)ccc2[nH]1 ZINC000369661337 565104721 /nfs/dbraw/zinc/10/47/21/565104721.db2.gz ATCNRLNEZVSHCJ-CYBMUJFWSA-N 0 3 393.329 3.011 10 0 GGAEHN C[C@@H](CN(C)C[C@H](O)COc1cccc(Br)c1)c1nccs1 ZINC000183938077 565105540 /nfs/dbraw/zinc/10/55/40/565105540.db2.gz WYBUTTGURGLTNM-JSGCOSHPSA-N 0 3 385.327 3.381 10 0 GGAEHN O=C1[C@H](NC2CC(c3cccc(Br)c3)C2)CCN1C1CCOCC1 ZINC000369732774 565109960 /nfs/dbraw/zinc/10/99/60/565109960.db2.gz QXFSXQLJIXILEN-JFUPDXTOSA-N 0 3 393.325 3.065 10 0 GGAEHN COc1ccc(Br)cc1CN(C)C1CCN(c2cnccn2)CC1 ZINC000369956667 565119559 /nfs/dbraw/zinc/11/95/59/565119559.db2.gz CVDWOAHBQQNXNO-UHFFFAOYSA-N 0 3 391.313 3.349 10 0 GGAEHN CCN1CCN(c2cccc(NC(=O)c3coc(Br)c3)c2)CC1 ZINC000184270107 565124053 /nfs/dbraw/zinc/12/40/53/565124053.db2.gz GGXYLNUXRPZLRM-UHFFFAOYSA-N 0 3 378.270 3.436 10 0 GGAEHN Cc1noc([C@@H]2CCCN(C[C@](C)(O)c3ccc(Br)cc3F)C2)n1 ZINC000292688997 565128868 /nfs/dbraw/zinc/12/88/68/565128868.db2.gz AHZYSMZYMYNEFF-PXAZEXFGSA-N 0 3 398.276 3.367 10 0 GGAEHN O=C(Nc1ccc([S@](=O)C(F)(F)F)cc1)N1CC[C@@H](N2CCCC2)C1 ZINC000370136906 565129242 /nfs/dbraw/zinc/12/92/42/565129242.db2.gz VWGFDDAMQXOHLJ-SHZVTRLKSA-N 0 3 375.416 3.016 10 0 GGAEHN C[C@@H](CCN1CCN(C)CC1)NC(=O)C[C@H](C)c1ccc(Br)cc1 ZINC000184334396 565129404 /nfs/dbraw/zinc/12/94/04/565129404.db2.gz TVVGOIPYBLVXEK-HOTGVXAUSA-N 0 3 396.373 3.085 10 0 GGAEHN C[C@H](CCN1CCN(C)CC1)NC(=O)C[C@H](C)c1ccc(Br)cc1 ZINC000184334412 565130004 /nfs/dbraw/zinc/13/00/04/565130004.db2.gz TVVGOIPYBLVXEK-JKSUJKDBSA-N 0 3 396.373 3.085 10 0 GGAEHN CN1CC[C@]2(CCN(C(=O)N[C@@H]3CCOc4c(Br)cccc43)C2)C1 ZINC000292740826 565132237 /nfs/dbraw/zinc/13/22/37/565132237.db2.gz TXEDWNILDYFDIJ-QAPCUYQASA-N 0 3 394.313 3.010 10 0 GGAEHN Cc1nc([C@@H]2CCCN(C[C@](C)(O)c3ccc(Br)cc3F)C2)n[nH]1 ZINC000292774489 565133497 /nfs/dbraw/zinc/13/34/97/565133497.db2.gz KALLMIRCRCHBNX-PXAZEXFGSA-N 0 3 397.292 3.102 10 0 GGAEHN Cc1n[nH]c([C@@H]2CCCN(C[C@](C)(O)c3ccc(Br)cc3F)C2)n1 ZINC000292774489 565133501 /nfs/dbraw/zinc/13/35/01/565133501.db2.gz KALLMIRCRCHBNX-PXAZEXFGSA-N 0 3 397.292 3.102 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(Cl)cc1OC(F)F ZINC000184397101 565133616 /nfs/dbraw/zinc/13/36/16/565133616.db2.gz SABKCJCHAUPVPQ-GFCCVEGCSA-N 0 3 377.819 3.174 10 0 GGAEHN CN1CCC(CC(=O)N[C@@H](CO)c2ccc(Cl)cc2C(F)(F)F)CC1 ZINC000292797931 565134634 /nfs/dbraw/zinc/13/46/34/565134634.db2.gz HTVIXCMOUVJKBI-HNNXBMFYSA-N 0 3 378.822 3.240 10 0 GGAEHN C[C@@H]1CN(CCCCNC(=O)Cc2ccc(Br)s2)C[C@H](C)O1 ZINC000268025960 565138503 /nfs/dbraw/zinc/13/85/03/565138503.db2.gz SVSHTXKWEFYKFO-BETUJISGSA-N 0 3 389.359 3.059 10 0 GGAEHN CCC[C@H](C(=O)N1CCO[C@@H](c2ccc(F)c(Br)c2)C1)N(C)C ZINC000184493601 565139349 /nfs/dbraw/zinc/13/93/49/565139349.db2.gz OWIFTSXIQANQIQ-HZPDHXFCSA-N 0 3 387.293 3.218 10 0 GGAEHN C[C@@H](NC[C@@H]1CCCN(S(C)(=O)=O)C1)c1nc(-c2ccccc2)cs1 ZINC000184516981 565140340 /nfs/dbraw/zinc/14/03/40/565140340.db2.gz FCWDNGKPKXGFRP-CABCVRRESA-N 0 3 379.551 3.132 10 0 GGAEHN Cc1cnc(CCN(C)C[C@H](O)COc2ccc(Br)cc2)s1 ZINC000157838982 565144704 /nfs/dbraw/zinc/14/47/04/565144704.db2.gz PHKYFPSKQHGSBA-AWEZNQCLSA-N 0 3 385.327 3.128 10 0 GGAEHN C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1cccnc1Br ZINC000268255984 565145713 /nfs/dbraw/zinc/14/57/13/565145713.db2.gz XYLFRYVCZIPIHA-RHSMWYFYSA-N 0 3 388.309 3.485 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)c2ccn(-c3ccc(Br)cc3)n2)CCN1C ZINC000293050019 565148573 /nfs/dbraw/zinc/14/85/73/565148573.db2.gz AFYLBFOJJPGLJB-CZUORRHYSA-N 0 3 391.313 3.190 10 0 GGAEHN C[C@@H]1CN(C2CCN(Cc3nc4cc(Br)ccc4[nH]3)CC2)CCO1 ZINC000184953032 565167896 /nfs/dbraw/zinc/16/78/96/565167896.db2.gz PCBSIRQJWSFVSS-CYBMUJFWSA-N 0 3 393.329 3.011 10 0 GGAEHN C[C@@H]1CN(C2CCN(Cc3nc4ccc(Br)cc4[nH]3)CC2)CCO1 ZINC000184953032 565167902 /nfs/dbraw/zinc/16/79/02/565167902.db2.gz PCBSIRQJWSFVSS-CYBMUJFWSA-N 0 3 393.329 3.011 10 0 GGAEHN O=c1ccc2c([nH]1)CCC[C@H]2NCc1cc(Br)c2c(c1)OCCO2 ZINC000268813300 565169732 /nfs/dbraw/zinc/16/97/32/565169732.db2.gz JRQHDJBURXRWLR-CQSZACIVSA-N 0 3 391.265 3.488 10 0 GGAEHN CC(=O)NC1CCC(N[C@H](C)c2ccccc2I)CC1 ZINC000268852822 565170899 /nfs/dbraw/zinc/17/08/99/565170899.db2.gz POTVUFSGIVCLHJ-LMWSTFAQSA-N 0 3 386.277 3.389 10 0 GGAEHN C[C@@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2cccs2)CC1 ZINC000158742832 565180311 /nfs/dbraw/zinc/18/03/11/565180311.db2.gz YBOCQGUDQYXHNX-INIZCTEOSA-N 0 3 378.563 3.370 10 0 GGAEHN COCCN(C)CCNC(=O)[C@H]1CCCO[C@@H]1c1ccc(Cl)cc1Cl ZINC000185169643 565183045 /nfs/dbraw/zinc/18/30/45/565183045.db2.gz YCHNSJLWRADJRE-DOTOQJQBSA-N 0 3 389.323 3.156 10 0 GGAEHN COCCN(C)CCNC(=O)[C@@H]1CCCO[C@@H]1c1ccc(Cl)cc1Cl ZINC000185169623 565183200 /nfs/dbraw/zinc/18/32/00/565183200.db2.gz YCHNSJLWRADJRE-NVXWUHKLSA-N 0 3 389.323 3.156 10 0 GGAEHN C[C@](O)(CN1CCC[C@H](c2ncc[nH]2)C1)c1ccc(Br)cc1F ZINC000293836406 565186958 /nfs/dbraw/zinc/18/69/58/565186958.db2.gz QECSLLIXUWWOFC-SJCJKPOMSA-N 0 3 382.277 3.398 10 0 GGAEHN C[C@@](O)(CN1CCC[C@@H](c2ncc[nH]2)C1)c1ccc(Br)cc1F ZINC000293836410 565187483 /nfs/dbraw/zinc/18/74/83/565187483.db2.gz QECSLLIXUWWOFC-SJKOYZFVSA-N 0 3 382.277 3.398 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000371911879 565215824 /nfs/dbraw/zinc/21/58/24/565215824.db2.gz PXMIXERIZBDMGU-KCXAZCMYSA-N 0 3 396.329 3.254 10 0 GGAEHN Cc1ccc(S(=O)(=O)C[C@@H](C)NC2CCN(c3cccs3)CC2)cc1 ZINC000185692808 565216808 /nfs/dbraw/zinc/21/68/08/565216808.db2.gz RIVYIEJWTJLILD-MRXNPFEDSA-N 0 3 378.563 3.477 10 0 GGAEHN COc1cc(Br)c(C(=O)NCCN2CCCC[C@@H]2C)cc1OC ZINC000294548146 565218091 /nfs/dbraw/zinc/21/80/91/565218091.db2.gz QTDIMWFTBVTSMC-LBPRGKRZSA-N 0 3 385.302 3.071 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(SC)c(Cl)c2)[C@H](C)C1 ZINC000185755883 565219983 /nfs/dbraw/zinc/21/99/83/565219983.db2.gz RZSOVZGRCZDKSG-IUODEOHRSA-N 0 3 376.975 3.413 10 0 GGAEHN C[C@@H](NCc1cc(Br)cc(Br)c1N)[C@@H]1CCCO1 ZINC000185776363 565220363 /nfs/dbraw/zinc/22/03/63/565220363.db2.gz LPYVAKVJMKDZRK-PELKAZGASA-N 0 3 378.108 3.451 10 0 GGAEHN NC(=O)[C@H](N[C@@H]1CCOC2(CCSCC2)C1)c1cccc(Br)c1 ZINC000270597823 565223728 /nfs/dbraw/zinc/22/37/28/565223728.db2.gz KQJGNWKMLOMLEQ-HUUCEWRRSA-N 0 3 399.354 3.010 10 0 GGAEHN C[C@@H]1CN(Cc2nnc(-c3ccccc3Br)o2)CCN(C2CC2)C1 ZINC000294952324 565237099 /nfs/dbraw/zinc/23/70/99/565237099.db2.gz AWKAOUGREHFUAN-CYBMUJFWSA-N 0 3 391.313 3.415 10 0 GGAEHN CCN1CCC[C@@H]1CN[C@@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186083165 565238385 /nfs/dbraw/zinc/23/83/85/565238385.db2.gz ZAZNCEYABBINNF-MSOLQXFVSA-N 0 3 375.314 3.402 10 0 GGAEHN CC(C)OCCN1CCC(NC(=O)Cc2sccc2Br)CC1 ZINC000295168867 565248950 /nfs/dbraw/zinc/24/89/50/565248950.db2.gz RKUSPWDENBYXME-UHFFFAOYSA-N 0 3 389.359 3.059 10 0 GGAEHN CCO[C@H]1C[C@H](NCc2cc3c(c(Br)c2)OCO3)C12CCOCC2 ZINC000186277950 565250599 /nfs/dbraw/zinc/25/05/99/565250599.db2.gz MEEJCMSOKJZWKI-HOTGVXAUSA-N 0 3 398.297 3.242 10 0 GGAEHN CCOC(=O)c1nn(C)cc1CNCC1(c2cccc(Br)c2)CC1 ZINC000186357036 565257414 /nfs/dbraw/zinc/25/74/14/565257414.db2.gz FXYUNWFRDAHPEB-UHFFFAOYSA-N 0 3 392.297 3.181 10 0 GGAEHN CCO[C@H]1C[C@H](NCc2cc(Br)cc3c2OCC3)C12CCOCC2 ZINC000186508015 565264192 /nfs/dbraw/zinc/26/41/92/565264192.db2.gz BMFKOHYMRZEBCR-IRXDYDNUSA-N 0 3 396.325 3.448 10 0 GGAEHN CCO[C@@H]1C[C@H](NCc2cc(Br)cc3c2OCC3)C12CCOCC2 ZINC000186507996 565264480 /nfs/dbraw/zinc/26/44/80/565264480.db2.gz BMFKOHYMRZEBCR-DLBZAZTESA-N 0 3 396.325 3.448 10 0 GGAEHN Fc1ccc2c(c1Br)CC[C@H]2NC[C@@H]1COC2(CCOCC2)O1 ZINC000295551394 565272334 /nfs/dbraw/zinc/27/23/34/565272334.db2.gz YIVDDLKNYKIAKI-IAQYHMDHSA-N 0 3 386.261 3.087 10 0 GGAEHN COc1c(Br)cc(CNC(C)(C)[C@@H](C)O)cc1Br ZINC000161149980 565274691 /nfs/dbraw/zinc/27/46/91/565274691.db2.gz DWVPHPPAESIULU-MRVPVSSYSA-N 0 3 381.108 3.469 10 0 GGAEHN COCCCN(C(=O)Cc1sccc1Br)C1CCN(C)CC1 ZINC000295606504 565275769 /nfs/dbraw/zinc/27/57/69/565275769.db2.gz NKYJOZQLBNSCAU-UHFFFAOYSA-N 0 3 389.359 3.012 10 0 GGAEHN O=S(=O)(c1c(Cl)ccnc1Cl)N1CCCC[C@H](N2CCCC2)C1 ZINC000272253216 565283306 /nfs/dbraw/zinc/28/33/06/565283306.db2.gz TVHLWYVZYKSJTG-LBPRGKRZSA-N 0 3 378.325 3.027 10 0 GGAEHN CCC[C@@H](C(=O)NCC1(c2cccc(Br)c2)CCOCC1)N(C)C ZINC000161682186 565290152 /nfs/dbraw/zinc/29/01/52/565290152.db2.gz ILMGAFCSTJLGCM-KRWDZBQOSA-N 0 3 397.357 3.344 10 0 GGAEHN NC(=O)COc1cccc(CN[C@@H]2CCc3c2ccc(F)c3Br)c1 ZINC000295866233 565290738 /nfs/dbraw/zinc/29/07/38/565290738.db2.gz XBQQNNODMSQVHC-MRXNPFEDSA-N 0 3 393.256 3.229 10 0 GGAEHN CS(=O)(=O)CCCCCN[C@H]1CCCOc2ccc(Br)cc21 ZINC000186866744 565291944 /nfs/dbraw/zinc/29/19/44/565291944.db2.gz SWNHKGVOYHGDLO-HNNXBMFYSA-N 0 3 390.343 3.467 10 0 GGAEHN CCN1CCC[C@@H](NCc2cc(Br)cc(Br)c2N)C1 ZINC000187135907 565312190 /nfs/dbraw/zinc/31/21/90/565312190.db2.gz VEJJFHLHTJRSMU-GFCCVEGCSA-N 0 3 391.151 3.368 10 0 GGAEHN C[C@H](NC(=O)N1CCc2cccc(Br)c2C1)C1=CCN(C)CC1 ZINC000272904054 565301901 /nfs/dbraw/zinc/30/19/01/565301901.db2.gz IYJYSKSZJUNZFS-ZDUSSCGKSA-N 0 3 378.314 3.167 10 0 GGAEHN CCN1CCN([C@H](C)CNC(=O)C[C@@H](C)c2ccc(Br)cc2)CC1 ZINC000162101221 565305708 /nfs/dbraw/zinc/30/57/08/565305708.db2.gz FVCOSYIUANJSRU-HZPDHXFCSA-N 0 3 396.373 3.085 10 0 GGAEHN CCN1CCN([C@@H](C)CNC(=O)C[C@@H](C)c2ccc(Br)cc2)CC1 ZINC000162101104 565305721 /nfs/dbraw/zinc/30/57/21/565305721.db2.gz FVCOSYIUANJSRU-CVEARBPZSA-N 0 3 396.373 3.085 10 0 GGAEHN C[C@@H]1CCSCCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000373842453 565305897 /nfs/dbraw/zinc/30/58/97/565305897.db2.gz QUGDUUDOLVYJBH-LRVUVFPRSA-N 0 3 379.492 3.329 10 0 GGAEHN NC(=O)[C@H](NCCc1c[nH]c2ccc(F)cc12)c1cccc(Br)c1 ZINC000162134256 565306833 /nfs/dbraw/zinc/30/68/33/565306833.db2.gz KEGPFYPBSALYEH-QGZVFWFLSA-N 0 3 390.256 3.428 10 0 GGAEHN COc1c(Br)cccc1CNC1CCN(c2ncccn2)CC1 ZINC000187123650 565310869 /nfs/dbraw/zinc/31/08/69/565310869.db2.gz ICCNFNBDPVLHMM-UHFFFAOYSA-N 0 3 377.286 3.006 10 0 GGAEHN Cc1ccc(OC[C@H](O)CN2CCC(n3cc(Br)cn3)CC2)cc1 ZINC000374010288 565314680 /nfs/dbraw/zinc/31/46/80/565314680.db2.gz NUCYOFGQTBJRKM-QGZVFWFLSA-N 0 3 394.313 3.031 10 0 GGAEHN O=C1CC[C@H](CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)CCN1 ZINC000296430797 565317225 /nfs/dbraw/zinc/31/72/25/565317225.db2.gz YHMRQPFVPYZRAF-INIZCTEOSA-N 0 3 384.351 3.070 10 0 GGAEHN CC[C@H]1CN(Cc2cc(Br)cc3cccnc32)CCN1C[C@@H](C)O ZINC000162557673 565321341 /nfs/dbraw/zinc/32/13/41/565321341.db2.gz NGZWVYIEKRSVQC-KDOFPFPSSA-N 0 3 392.341 3.274 10 0 GGAEHN CN(C)C(=O)C1CCN(CC2=Cc3cc(Br)ccc3OC2)CC1 ZINC000162617008 565322490 /nfs/dbraw/zinc/32/24/90/565322490.db2.gz QGUYWSRHNJQHBC-UHFFFAOYSA-N 0 3 379.298 3.025 10 0 GGAEHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)NCc1cc(F)cc(Br)c1 ZINC000273482836 565322577 /nfs/dbraw/zinc/32/25/77/565322577.db2.gz QSURODAHWBSWBC-LBPRGKRZSA-N 0 3 386.309 3.460 10 0 GGAEHN O=C(CCN1CCC(c2c[nH]cn2)CC1)Nc1ccc(Br)cc1 ZINC000374212586 565325042 /nfs/dbraw/zinc/32/50/42/565325042.db2.gz QSMCQHUTKNNWCC-UHFFFAOYSA-N 0 3 377.286 3.380 10 0 GGAEHN Nc1c(Br)cc(Br)cc1CN[C@H]1CCCC[C@H]1O ZINC000187355454 565326744 /nfs/dbraw/zinc/32/67/44/565326744.db2.gz RYWCHWWNANEEBB-NWDGAFQWSA-N 0 3 378.108 3.187 10 0 GGAEHN C[C@@H](c1ccc(CN2CCC[C@@H](CNS(C)(=O)=O)C2)cc1)C(F)(F)F ZINC000296862275 565340936 /nfs/dbraw/zinc/34/09/36/565340936.db2.gz VEUOVOVJRINQCJ-ZFWWWQNUSA-N 0 3 378.460 3.114 10 0 GGAEHN C[C@H](c1ccc(CN2CCC[C@@H](CNS(C)(=O)=O)C2)cc1)C(F)(F)F ZINC000296862267 565341465 /nfs/dbraw/zinc/34/14/65/565341465.db2.gz VEUOVOVJRINQCJ-HIFRSBDPSA-N 0 3 378.460 3.114 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1cc(Br)c(C)cc1C ZINC000187564703 565341804 /nfs/dbraw/zinc/34/18/04/565341804.db2.gz FEZKVHNGKZOSDD-AWEZNQCLSA-N 0 3 384.318 3.298 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)NCc1ccc(Br)cc1OC ZINC000187585666 565343002 /nfs/dbraw/zinc/34/30/02/565343002.db2.gz NOYKJYAVAPFLKW-HNNXBMFYSA-N 0 3 384.318 3.083 10 0 GGAEHN COc1cc(Br)ccc1CNC[C@@H]1CCC2(CCOCC2)[C@@H]1O ZINC000374724126 565353546 /nfs/dbraw/zinc/35/35/46/565353546.db2.gz UEOKMMAZDVWIFS-WMLDXEAASA-N 0 3 384.314 3.115 10 0 GGAEHN C[C@H](CO)[C@H](C)NCC(=O)N1N=C(c2cccs2)C[C@@H]1c1cccs1 ZINC000274104645 565357522 /nfs/dbraw/zinc/35/75/22/565357522.db2.gz VCVTWRFKIKNTRO-VNHYZAJKSA-N 0 3 377.535 3.094 10 0 GGAEHN CC(C)N1C[C@@H](C)[C@@H](NC(=O)Nc2ccccc2I)C1 ZINC000164264719 565357835 /nfs/dbraw/zinc/35/78/35/565357835.db2.gz BXGKTKXJUKKMFF-RISCZKNCSA-N 0 3 387.265 3.141 10 0 GGAEHN C[C@@H]1CN(Cc2cc(Br)cc3cccnc32)C[C@@H]1N1CCOCC1 ZINC000164298157 565358697 /nfs/dbraw/zinc/35/86/97/565358697.db2.gz RLCIBAACGNEMLI-KDOFPFPSSA-N 0 3 390.325 3.150 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)Nc2cnc(Cl)c(Br)c2)CCN1C ZINC000274327934 565367284 /nfs/dbraw/zinc/36/72/84/565367284.db2.gz DKEKPAASJVRWIP-MWLCHTKSSA-N 0 3 375.698 3.444 10 0 GGAEHN C[C@H](NC(=O)CN(C)[C@]1(CO)CC[C@@H](C)C1)c1ccc(Br)cc1 ZINC000188002880 565369866 /nfs/dbraw/zinc/36/98/66/565369866.db2.gz NRAHRCUIOARXMC-QWQRMKEZSA-N 0 3 383.330 3.109 10 0 GGAEHN CC(C)N1CCC[C@H](NC(=O)c2c(F)cccc2I)C1 ZINC000274442969 565370824 /nfs/dbraw/zinc/37/08/24/565370824.db2.gz HRUKOWHEYJUKPZ-NSHDSACASA-N 0 3 390.240 3.033 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(Cl)c(F)c2Cl)[C@H](C)C1 ZINC000188049389 565373720 /nfs/dbraw/zinc/37/37/20/565373720.db2.gz GLLMSOFTQPKPBM-ZYHUDNBSSA-N 0 3 383.316 3.483 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(Cl)c(F)c2Cl)[C@H](C)C1 ZINC000188049358 565373773 /nfs/dbraw/zinc/37/37/73/565373773.db2.gz GLLMSOFTQPKPBM-PWSUYJOCSA-N 0 3 383.316 3.483 10 0 GGAEHN CN(C)[C@H](CNC(=O)CSc1nnc(C(F)(F)F)s1)c1ccccc1 ZINC000188136034 565381291 /nfs/dbraw/zinc/38/12/91/565381291.db2.gz RVNPKTZPVFKHEP-LLVKDONJSA-N 0 3 390.456 3.068 10 0 GGAEHN O=C1CCCN1C[C@@H](O)CN[C@@H](CC1CC1)c1cc(F)cc(Br)c1 ZINC000188188432 565387484 /nfs/dbraw/zinc/38/74/84/565387484.db2.gz VDBGNLZQBCUNJM-IRXDYDNUSA-N 0 3 399.304 3.002 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)c1scc(C)c1I ZINC000188222896 565387894 /nfs/dbraw/zinc/38/78/94/565387894.db2.gz LQCJPCDGXOMAID-LLVKDONJSA-N 0 3 392.306 3.217 10 0 GGAEHN CN1CCO[C@H](CN[C@@H](c2ccccc2)c2ccc(Br)cc2)C1 ZINC000188268532 565391569 /nfs/dbraw/zinc/39/15/69/565391569.db2.gz ICRTYELWIXRIGJ-MOPGFXCFSA-N 0 3 375.310 3.459 10 0 GGAEHN C[C@H](NC[C@H]1CN(C)CCO1)c1ccc(Br)cc1C(F)(F)F ZINC000188268471 565391837 /nfs/dbraw/zinc/39/18/37/565391837.db2.gz NXGYDQYYWKYQNQ-JQWIXIFHSA-N 0 3 381.236 3.449 10 0 GGAEHN C[C@H](NC[C@@H]1CN(C)CCO1)c1ccc(Br)cc1C(F)(F)F ZINC000188268427 565391964 /nfs/dbraw/zinc/39/19/64/565391964.db2.gz NXGYDQYYWKYQNQ-CMPLNLGQSA-N 0 3 381.236 3.449 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cccn2Cc2cccs2)C[C@H]1N1CCCC1 ZINC000275075384 565393219 /nfs/dbraw/zinc/39/32/19/565393219.db2.gz CMBDRZNOJWYHTM-QZTJIDSGSA-N 0 3 375.563 3.250 10 0 GGAEHN Cc1csc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1I ZINC000188321807 565394188 /nfs/dbraw/zinc/39/41/88/565394188.db2.gz RWVGXHOVADWOBP-GXSJLCMTSA-N 0 3 392.306 3.120 10 0 GGAEHN CCN1CCC[C@H](NC(=O)c2ccc(I)cc2Cl)C1 ZINC000170827892 565394346 /nfs/dbraw/zinc/39/43/46/565394346.db2.gz YSBCPZVAQFBFEJ-NSHDSACASA-N 0 3 392.668 3.159 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)COc2ccc3cc(Br)ccc3c2)C1 ZINC000170865580 565395855 /nfs/dbraw/zinc/39/58/55/565395855.db2.gz DDTVVERSRWORFN-MRXNPFEDSA-N 0 3 377.282 3.144 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)c2ccc(Oc3cccc(Br)c3)nc2)C1 ZINC000170866162 565396053 /nfs/dbraw/zinc/39/60/53/565396053.db2.gz RUGXZRAJAQECBQ-HNNXBMFYSA-N 0 3 390.281 3.413 10 0 GGAEHN Cc1c(Cl)cccc1-n1ccnc1SCC(=O)N1CC[C@@H](N(C)C)C1 ZINC000170859831 565396191 /nfs/dbraw/zinc/39/61/91/565396191.db2.gz OMACOQLRMLCNDO-CQSZACIVSA-N 0 3 378.929 3.089 10 0 GGAEHN Cc1c(Cl)cccc1-n1ccnc1SCC(=O)N1CC[C@H](N(C)C)C1 ZINC000170859828 565396221 /nfs/dbraw/zinc/39/62/21/565396221.db2.gz OMACOQLRMLCNDO-AWEZNQCLSA-N 0 3 378.929 3.089 10 0 GGAEHN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1CC[C@@H](N(C)C)C1 ZINC000170857554 565396226 /nfs/dbraw/zinc/39/62/26/565396226.db2.gz YTWTWMGXYVVFNY-CQSZACIVSA-N 0 3 379.913 3.460 10 0 GGAEHN CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)CC1(O)CCOCC1 ZINC000298008825 565396346 /nfs/dbraw/zinc/39/63/46/565396346.db2.gz YTUWVYUWARHPMT-UHFFFAOYSA-N 0 3 375.296 3.185 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)COc2ccc3ccccc3c2Br)C1 ZINC000170867167 565396676 /nfs/dbraw/zinc/39/66/76/565396676.db2.gz YGAKKLNIPXSVIE-AWEZNQCLSA-N 0 3 377.282 3.144 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)c2cccnc2Oc2cccc(Br)c2)C1 ZINC000170866178 565396829 /nfs/dbraw/zinc/39/68/29/565396829.db2.gz SKVKLARRBSABIC-AWEZNQCLSA-N 0 3 390.281 3.413 10 0 GGAEHN Cc1nc(CS(=O)(=O)C(C)C(=O)N(Cc2ccccc2)C(C)C)cs1 ZINC000170925926 565399909 /nfs/dbraw/zinc/39/99/09/565399909.db2.gz XKZNJDNRSYATAH-CQSZACIVSA-N 0 3 380.535 3.192 10 0 GGAEHN CCOC(=O)c1csc(CC[NH2+]Cc2cc(Cl)c([O-])c(OCC)c2)n1 ZINC000298214649 565405381 /nfs/dbraw/zinc/40/53/81/565405381.db2.gz ZKMBDWPVPRMDHC-UHFFFAOYSA-N 0 3 384.885 3.410 10 0 GGAEHN CC(C)NC(=O)CCN1CCC(C(=O)Nc2ccccc2Br)CC1 ZINC000171100856 565410537 /nfs/dbraw/zinc/41/05/37/565410537.db2.gz FGCOMXYHYGMACV-UHFFFAOYSA-N 0 3 396.329 3.014 10 0 GGAEHN COCCCN1CCC(NC(=O)C(C)(C)c2cccc(Br)c2)CC1 ZINC000171137697 565413275 /nfs/dbraw/zinc/41/32/75/565413275.db2.gz DJVBERKWDLHNHQ-UHFFFAOYSA-N 0 3 397.357 3.344 10 0 GGAEHN CC[C@H]1CN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCS1 ZINC000376099169 565421910 /nfs/dbraw/zinc/42/19/10/565421910.db2.gz XLCMHQSAALIWOD-NRXISQOPSA-N 0 3 379.492 3.329 10 0 GGAEHN CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1coc(Br)c1 ZINC000298603302 565422982 /nfs/dbraw/zinc/42/29/82/565422982.db2.gz VQPAAJTZLNCMEQ-UHFFFAOYSA-N 0 3 376.254 3.118 10 0 GGAEHN Cc1cnn([C@H]2CCCN(C[C@H](O)COc3cccc(Br)c3)C2)c1 ZINC000171529492 565435903 /nfs/dbraw/zinc/43/59/03/565435903.db2.gz BEOQJFBOKBVMGO-IRXDYDNUSA-N 0 3 394.313 3.031 10 0 GGAEHN COc1cc(C[NH2+][C@H](CO)Cc2ccc(C)cc2)cc(Br)c1[O-] ZINC000188989529 565436512 /nfs/dbraw/zinc/43/65/12/565436512.db2.gz HPSXKVONZQFKSP-HNNXBMFYSA-N 0 3 380.282 3.165 10 0 GGAEHN CN1CC[C@H](NC(=O)Nc2ccncc2Br)[C@H]1c1ccccc1 ZINC000276386389 565447217 /nfs/dbraw/zinc/44/72/17/565447217.db2.gz MJBLYMNPTALLKZ-JKSUJKDBSA-N 0 3 375.270 3.411 10 0 GGAEHN CC(C)(CNC(=O)N1CCN2CCC[C@H]2C1)c1cccc(Br)c1 ZINC000171906466 565456007 /nfs/dbraw/zinc/45/60/07/565456007.db2.gz BJFOPNYIUPJXQW-INIZCTEOSA-N 0 3 380.330 3.216 10 0 GGAEHN Cc1nc(-c2ccc(CCNC(=O)N3CCN4CCC[C@H]4C3)s2)cs1 ZINC000171899519 565456468 /nfs/dbraw/zinc/45/64/68/565456468.db2.gz BHRRGEBNKHIHEP-AWEZNQCLSA-N 0 3 376.551 3.212 10 0 GGAEHN C[C@@H](CCc1ccc(Br)cc1)NC(=O)N1CCN2CCC[C@@H]2C1 ZINC000171903865 565456699 /nfs/dbraw/zinc/45/66/99/565456699.db2.gz GXBKBRNYCUXIOA-WMLDXEAASA-N 0 3 380.330 3.260 10 0 GGAEHN COc1ccc([C@H](C)NC(=O)N2CCN3CCC[C@@H]3C2)cc1Br ZINC000171899230 565456732 /nfs/dbraw/zinc/45/67/32/565456732.db2.gz OMTOZPUJDZYZQI-GXTWGEPZSA-N 0 3 382.302 3.008 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000171899428 565456948 /nfs/dbraw/zinc/45/69/48/565456948.db2.gz WNDWMYRMVWVLGN-GOEBONIOSA-N 0 3 383.945 3.287 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000171899427 565456992 /nfs/dbraw/zinc/45/69/92/565456992.db2.gz WNDWMYRMVWVLGN-GDBMZVCRSA-N 0 3 383.945 3.287 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)NC[C@H]1CCCN(C)C1 ZINC000189489960 565468543 /nfs/dbraw/zinc/46/85/43/565468543.db2.gz MPXBTBGQUBWEAB-QWHCGFSZSA-N 0 3 384.318 3.160 10 0 GGAEHN CCN1CCC[C@H](NC(=O)Nc2cc(Br)c(OC)cc2OC)C1 ZINC000189621955 565478557 /nfs/dbraw/zinc/47/85/57/565478557.db2.gz DJKUDDIHFJMQBO-NSHDSACASA-N 0 3 386.290 3.072 10 0 GGAEHN CCN1CCN(CCCCNC(=O)c2c(Cl)cc(F)cc2Cl)CC1 ZINC000277147247 565478994 /nfs/dbraw/zinc/47/89/94/565478994.db2.gz APUULQXWGZBWFJ-UHFFFAOYSA-N 0 3 376.303 3.280 10 0 GGAEHN CN(C)CCN(C)c1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl ZINC000301457274 565487344 /nfs/dbraw/zinc/48/73/44/565487344.db2.gz CLONKOHFEGFAPW-UHFFFAOYSA-N 0 3 375.687 3.191 10 0 GGAEHN COc1cc(C[NH2+]CCOCC(F)(F)C(F)F)cc(Br)c1[O-] ZINC000277496987 565500999 /nfs/dbraw/zinc/50/09/99/565500999.db2.gz OQZDWDZBBAPVBS-UHFFFAOYSA-N 0 3 390.171 3.170 10 0 GGAEHN CC[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc(CC(F)(F)F)cc1 ZINC000190023133 565503041 /nfs/dbraw/zinc/50/30/41/565503041.db2.gz GUAAHRZCNRELMQ-LSDHHAIUSA-N 0 3 376.444 3.039 10 0 GGAEHN C[C@H]1C[C@H](N(C)c2ncnc3ccc(I)cc32)CCN1C ZINC000172765328 565503818 /nfs/dbraw/zinc/50/38/18/565503818.db2.gz BHBNHBRJHABPEW-WCQYABFASA-N 0 3 396.276 3.153 10 0 GGAEHN CN1CCC(CNCc2ncc(C(F)(F)F)s2)(N2CCCCC2)CC1 ZINC000377887985 565503976 /nfs/dbraw/zinc/50/39/76/565503976.db2.gz ODFCAOLVUFINMI-UHFFFAOYSA-N 0 3 376.492 3.202 10 0 GGAEHN Cc1nc2ccc(Br)cc2c(N2C[C@@H]3OCCN(C)[C@H]3C2)c1C ZINC000301687361 565504471 /nfs/dbraw/zinc/50/44/71/565504471.db2.gz XHUVYFQNNIASBI-IRXDYDNUSA-N 0 3 376.298 3.133 10 0 GGAEHN O=C(CCN1CCN2CCCC[C@@H]2C1)Nc1ccc(Br)cc1F ZINC000172805184 565505346 /nfs/dbraw/zinc/50/53/46/565505346.db2.gz YVLGCPFMAXEGQY-CQSZACIVSA-N 0 3 384.293 3.087 10 0 GGAEHN Cc1cc(F)ccc1[C@H](O)CN1CCC(n2cc(Br)cn2)CC1 ZINC000377932233 565505719 /nfs/dbraw/zinc/50/57/19/565505719.db2.gz NNNLONMGZBAQKJ-QGZVFWFLSA-N 0 3 382.277 3.464 10 0 GGAEHN Nc1c(Br)cc(Br)cc1CNCC1(CCO)CC1 ZINC000190307804 565521250 /nfs/dbraw/zinc/52/12/50/565521250.db2.gz GXJJTFFWLXWBGV-UHFFFAOYSA-N 0 3 378.108 3.046 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2cc(OC)ccc2Br)n1 ZINC000190337911 565523293 /nfs/dbraw/zinc/52/32/93/565523293.db2.gz YKBILQAOZNDLQZ-UHFFFAOYSA-N 0 3 399.310 3.423 10 0 GGAEHN CC(C)C[C@H](CN(C)C)NC(=O)C(=O)Nc1cc(Cl)c(F)c(Cl)c1 ZINC000190366601 565526713 /nfs/dbraw/zinc/52/67/13/565526713.db2.gz ALACGCCELWBPAL-LLVKDONJSA-N 0 3 378.275 3.164 10 0 GGAEHN CO[C@@H]1CC[C@H](NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)C1 ZINC000190393122 565528635 /nfs/dbraw/zinc/52/86/35/565528635.db2.gz MPJXEYUQUFRTRI-DLBZAZTESA-N 0 3 398.345 3.090 10 0 GGAEHN O=C(CN[C@H](c1ccccc1)[C@@H]1CCOC1)Nc1ccc(Br)cn1 ZINC000378504951 565530999 /nfs/dbraw/zinc/53/09/99/565530999.db2.gz CLAGEHJUOVYCKL-RDTXWAMCSA-N 0 3 390.281 3.150 10 0 GGAEHN CCN(CC)CC(=O)N1CCC[C@H]1c1ccc(I)cc1 ZINC000173182378 565535272 /nfs/dbraw/zinc/53/52/72/565535272.db2.gz IFCSLCPJDCQSBQ-HNNXBMFYSA-N 0 3 386.277 3.297 10 0 GGAEHN C[C@H]1OCCC[C@@H]1C(=O)N(CCN(C)C)Cc1ccc(Br)cc1 ZINC000190479609 565535398 /nfs/dbraw/zinc/53/53/98/565535398.db2.gz GXERSQCNNCHJKG-PBHICJAKSA-N 0 3 383.330 3.154 10 0 GGAEHN COc1cc(C)sc1C(=O)N1CC[C@@H](CN(C)Cc2scnc2C)C1 ZINC000190515447 565537821 /nfs/dbraw/zinc/53/78/21/565537821.db2.gz DTOXLECAXVNIJB-AWEZNQCLSA-N 0 3 379.551 3.424 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)c2ccc(Cl)nc2C)C1 ZINC000190525258 565538974 /nfs/dbraw/zinc/53/89/74/565538974.db2.gz IJZWNZNBTBNQNY-AWEZNQCLSA-N 0 3 378.929 3.402 10 0 GGAEHN CC[C@H](C)[N@H+](C)CC[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000380108713 565539986 /nfs/dbraw/zinc/53/99/86/565539986.db2.gz OPBJAKUZNWWNEB-JTQLQIEISA-N 0 3 383.739 3.111 10 0 GGAEHN CC[C@H](C)[N@@H+](C)CC[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000380108713 565539990 /nfs/dbraw/zinc/53/99/90/565539990.db2.gz OPBJAKUZNWWNEB-JTQLQIEISA-N 0 3 383.739 3.111 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)c2csc(C3CC3)n2)C1 ZINC000190537583 565540450 /nfs/dbraw/zinc/54/04/50/565540450.db2.gz BLAFVOUPAVXLFH-CYBMUJFWSA-N 0 3 376.551 3.380 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(Cl)c(OC)cc2Cl)[C@H](C)C1 ZINC000173261048 565541843 /nfs/dbraw/zinc/54/18/43/565541843.db2.gz ZZGSLPTWRFYGCO-BXUZGUMPSA-N 0 3 395.352 3.353 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)Cc2c(Cl)cccc2Cl)[C@H](C)C1 ZINC000173257249 565541902 /nfs/dbraw/zinc/54/19/02/565541902.db2.gz QDTRTSBQXAPPLJ-WBMJQRKESA-N 0 3 379.353 3.485 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(OC(F)F)c(Cl)c2)[C@H](C)C1 ZINC000173260573 565541937 /nfs/dbraw/zinc/54/19/37/565541937.db2.gz AVVVHIFLXUBLJO-RISCZKNCSA-N 0 3 396.887 3.292 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(C)cc2Br)[C@H](C)C1 ZINC000173259416 565541991 /nfs/dbraw/zinc/54/19/91/565541991.db2.gz JWLTUQQSKAVLQR-HIFRSBDPSA-N 0 3 389.359 3.108 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(F)cc2C(F)(F)F)[C@H](C)C1 ZINC000173260155 565542360 /nfs/dbraw/zinc/54/23/60/565542360.db2.gz DPKSHJHQHUUFJC-RISCZKNCSA-N 0 3 382.423 3.195 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)c2occc2Br)C1 ZINC000190571471 565542454 /nfs/dbraw/zinc/54/24/54/565542454.db2.gz HHXGFSDXRSEILV-GFCCVEGCSA-N 0 3 398.326 3.401 10 0 GGAEHN CCN1CC[C@@H](NC(=O)c2cc(Br)cc(Br)c2)C1 ZINC000389964463 565554479 /nfs/dbraw/zinc/55/44/79/565554479.db2.gz GKXOXAOCOPOVHL-GFCCVEGCSA-N 0 3 376.092 3.036 10 0 GGAEHN CN1CCN([C@@H]2CCCCN(C(=O)Cc3c(Cl)cccc3Cl)C2)CC1 ZINC000173295141 565545465 /nfs/dbraw/zinc/54/54/65/565545465.db2.gz SEKQCSMKVOXUBX-OAHLLOKOSA-N 0 3 384.351 3.164 10 0 GGAEHN O=S(=O)([N-][C@@H]1CC[N@@H+]2CCCC[C@H]12)c1c(Cl)cccc1Br ZINC000385913423 565546417 /nfs/dbraw/zinc/54/64/17/565546417.db2.gz HUYUCAXKQWYJDF-CHWSQXEVSA-N 0 3 393.734 3.008 10 0 GGAEHN O=S(=O)([N-][C@@H]1CC[N@H+]2CCCC[C@H]12)c1c(Cl)cccc1Br ZINC000385913423 565546421 /nfs/dbraw/zinc/54/64/21/565546421.db2.gz HUYUCAXKQWYJDF-CHWSQXEVSA-N 0 3 393.734 3.008 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)NCCc2cccs2)C1 ZINC000190676302 565551725 /nfs/dbraw/zinc/55/17/25/565551725.db2.gz UVDDGMSNRRLUFH-OAHLLOKOSA-N 0 3 378.567 3.219 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)NCCc2cccs2)C1 ZINC000190676284 565551930 /nfs/dbraw/zinc/55/19/30/565551930.db2.gz UVDDGMSNRRLUFH-HNNXBMFYSA-N 0 3 378.567 3.219 10 0 GGAEHN Cc1ccc(Br)cc1CN[C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000190699588 565552632 /nfs/dbraw/zinc/55/26/32/565552632.db2.gz HIMQQPXGZAKAGP-LBPRGKRZSA-N 0 3 383.311 3.256 10 0 GGAEHN CCSCC[C@@H](C)NC(=O)N1CC[C@@H](CN(C)Cc2scnc2C)C1 ZINC000190721410 565554216 /nfs/dbraw/zinc/55/42/16/565554216.db2.gz ZJTNDOSTPCOXGP-ZBFHGGJFSA-N 0 3 384.615 3.447 10 0 GGAEHN CCSCC[C@H](C)NC(=O)N1CC[C@H](CN(C)Cc2scnc2C)C1 ZINC000190721393 565554386 /nfs/dbraw/zinc/55/43/86/565554386.db2.gz ZJTNDOSTPCOXGP-GOEBONIOSA-N 0 3 384.615 3.447 10 0 GGAEHN C[C@H](CNC(=O)N[C@@H](C)c1ccc(Cl)c(Cl)c1)CN1CCN(C)CC1 ZINC000173398852 565555344 /nfs/dbraw/zinc/55/53/44/565555344.db2.gz FALMGFPXMKOFOG-KGLIPLIRSA-N 0 3 387.355 3.237 10 0 GGAEHN CCc1cnc(CCNC(=O)NC[C@H](c2cccs2)N2CCCC2)s1 ZINC000173414456 565556335 /nfs/dbraw/zinc/55/63/35/565556335.db2.gz NMVITISGKGLDGH-OAHLLOKOSA-N 0 3 378.567 3.446 10 0 GGAEHN Cc1cc(N2CCC[C@@H](N[C@H](C)c3cccc(Br)c3)C2=O)n(C)n1 ZINC000173455236 565558437 /nfs/dbraw/zinc/55/84/37/565558437.db2.gz WZEDGSHEIDCLHM-CZUORRHYSA-N 0 3 391.313 3.337 10 0 GGAEHN Cc1cc(N2CCC[C@H](N[C@H](C)c3cccc(Br)c3)C2=O)n(C)n1 ZINC000173455219 565558726 /nfs/dbraw/zinc/55/87/26/565558726.db2.gz WZEDGSHEIDCLHM-CJNGLKHVSA-N 0 3 391.313 3.337 10 0 GGAEHN C[C@H]1CCCCN1CCNc1ncc(Cn2cc(Br)cn2)s1 ZINC000302839530 565560099 /nfs/dbraw/zinc/56/00/99/565560099.db2.gz ZJCVRQPAJXEXPK-LBPRGKRZSA-N 0 3 384.347 3.437 10 0 GGAEHN CN(Cc1c(Br)cnn1C)C1CCN(Cc2ccccc2)CC1 ZINC000278491659 565562386 /nfs/dbraw/zinc/56/23/86/565562386.db2.gz UARMPHHAGZFEDF-UHFFFAOYSA-N 0 3 377.330 3.279 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)C(=O)Nc2cc(Cl)c(F)c(Cl)c2)CCN1C ZINC000190836715 565563055 /nfs/dbraw/zinc/56/30/55/565563055.db2.gz HRJNPZIRLMXTKJ-MWLCHTKSSA-N 0 3 376.259 3.012 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)C(=O)Nc2cc(Cl)c(F)c(Cl)c2)CCN1C ZINC000190836729 565563302 /nfs/dbraw/zinc/56/33/02/565563302.db2.gz HRJNPZIRLMXTKJ-GXSJLCMTSA-N 0 3 376.259 3.012 10 0 GGAEHN CC[NH+]1CCC(CC[N-]S(=O)(=O)c2ccc(F)cc2C(F)(F)F)CC1 ZINC000173514336 565563705 /nfs/dbraw/zinc/56/37/05/565563705.db2.gz DLZFXEIAGRKXSU-UHFFFAOYSA-N 0 3 382.423 3.245 10 0 GGAEHN Cc1cc(N2CCC[C@@H](N[C@H](C)c3cc(Br)ncc3F)C2)n(C)n1 ZINC000278530390 565564289 /nfs/dbraw/zinc/56/42/89/565564289.db2.gz UBOSYBCWYOTQJN-CHWSQXEVSA-N 0 3 396.308 3.345 10 0 GGAEHN OC1CCC(CNCc2c(Br)cncc2Br)CC1 ZINC000394536200 565570757 /nfs/dbraw/zinc/57/07/57/565570757.db2.gz SCDDFVAQDOTMBL-UHFFFAOYSA-N 0 3 378.108 3.247 10 0 GGAEHN COCC[C@H](COC)NCc1cc(Br)cc(Br)c1 ZINC000394536991 565570924 /nfs/dbraw/zinc/57/09/24/565570924.db2.gz SSZZELOTOFVAHC-CYBMUJFWSA-N 0 3 381.108 3.353 10 0 GGAEHN CC[C@H](Cc1cccc(Br)c1)C(=O)NC[C@@H]1CCCN1CCOC ZINC000303679877 565574255 /nfs/dbraw/zinc/57/42/55/565574255.db2.gz MBOSZSXXNSTVQZ-AEFFLSMTSA-N 0 3 397.357 3.245 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N(C)[C@H]1CCCN(C)C1 ZINC000303906168 565575375 /nfs/dbraw/zinc/57/53/75/565575375.db2.gz LWHCAYZDHDJYCX-AWEZNQCLSA-N 0 3 378.314 3.265 10 0 GGAEHN Cn1ncc(Br)c1CNC[C@]1(C)CCCN1Cc1ccccc1 ZINC000397911633 565576932 /nfs/dbraw/zinc/57/69/32/565576932.db2.gz IACAKCXSRDZFHB-SFHVURJKSA-N 0 3 377.330 3.327 10 0 GGAEHN CN(C(=O)c1cc(Br)cn1C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000309804414 565578258 /nfs/dbraw/zinc/57/82/58/565578258.db2.gz TUHMWVOXDQRZQQ-INIZCTEOSA-N 0 3 376.298 3.134 10 0 GGAEHN CC[C@@H](NC(=O)N1CCCN(C2CC2)CC1)c1nc(C(F)(F)F)cs1 ZINC000173743118 565581611 /nfs/dbraw/zinc/58/16/11/565581611.db2.gz VYJPWPZEGPCZND-GFCCVEGCSA-N 0 3 376.448 3.493 10 0 GGAEHN COc1c(Br)c(C)sc1C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1 ZINC000173749377 565583026 /nfs/dbraw/zinc/58/30/26/565583026.db2.gz CMXNKEMBSTWZDB-KOLCDFICSA-N 0 3 375.332 3.382 10 0 GGAEHN O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)c1nscc1Br ZINC000404887733 565583959 /nfs/dbraw/zinc/58/39/59/565583959.db2.gz GNYNIAKMBQFRGM-ZDUSSCGKSA-N 0 3 380.311 3.158 10 0 GGAEHN O=C(NC[C@H]1CCN(Cc2ccccc2)C1)c1nscc1Br ZINC000404887732 565584300 /nfs/dbraw/zinc/58/43/00/565584300.db2.gz GNYNIAKMBQFRGM-CYBMUJFWSA-N 0 3 380.311 3.158 10 0 GGAEHN CCN(CC)[C@@H]1CCN(S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000314434104 565586258 /nfs/dbraw/zinc/58/62/58/565586258.db2.gz FXSHSINIVHLVGS-LLVKDONJSA-N 0 3 395.750 3.207 10 0 GGAEHN CC[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc(C)cc1Br ZINC000173829630 565591365 /nfs/dbraw/zinc/59/13/65/565591365.db2.gz YYJSWMSYIRKFAL-UONOGXRCSA-N 0 3 387.343 3.005 10 0 GGAEHN C[C@@H](NC(=O)Nc1ccn(CCN(C)C)n1)c1ccccc1Br ZINC000173925213 565599475 /nfs/dbraw/zinc/59/94/75/565599475.db2.gz XHJPIFYXEFKJNZ-GFCCVEGCSA-N 0 3 380.290 3.090 10 0 GGAEHN CN1C[C@@H](NCc2ccc(OC(F)(F)F)c(Br)c2)CCC1=O ZINC000319474910 565599683 /nfs/dbraw/zinc/59/96/83/565599683.db2.gz RGZWMCOAWBYJPW-JTQLQIEISA-N 0 3 381.192 3.058 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000191446732 565604685 /nfs/dbraw/zinc/60/46/85/565604685.db2.gz BUYFDBOTJZZZRE-UKRRQHHQSA-N 0 3 394.313 3.174 10 0 GGAEHN CCOc1cc(CN2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)cc(Br)c1[O-] ZINC000321827381 565606990 /nfs/dbraw/zinc/60/69/90/565606990.db2.gz BQKYAKRTTIIXMK-ZBFHGGJFSA-N 0 3 383.330 3.470 10 0 GGAEHN CCOc1cc(CN2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc(Br)c1[O-] ZINC000321827381 565606994 /nfs/dbraw/zinc/60/69/94/565606994.db2.gz BQKYAKRTTIIXMK-ZBFHGGJFSA-N 0 3 383.330 3.470 10 0 GGAEHN O=C(CN1CCCC[C@@H]1[C@H]1CCC[C@@H]1O)Nc1ccc(Br)cc1 ZINC000322656197 565610840 /nfs/dbraw/zinc/61/08/40/565610840.db2.gz ZJADWMRICATEQQ-ZACQAIPSSA-N 0 3 381.314 3.403 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C ZINC000174075913 565611233 /nfs/dbraw/zinc/61/12/33/565611233.db2.gz JGGOZMIHIOZMHG-XYPHTWIQSA-N 0 3 380.330 3.258 10 0 GGAEHN COc1ccc(Br)cc1C(=O)N1CCc2ccccc2[C@@H]1CN ZINC000323564102 565613780 /nfs/dbraw/zinc/61/37/80/565613780.db2.gz UVINYDWGQMLZSC-INIZCTEOSA-N 0 3 375.266 3.156 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)NCCc2ccc(F)c(Br)c2)CCN1C ZINC000174183147 565619179 /nfs/dbraw/zinc/61/91/79/565619179.db2.gz AYKHZXIPSMZLDU-TZMCWYRMSA-N 0 3 386.309 3.255 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1cccc(Cl)c1Br ZINC000191719103 565623945 /nfs/dbraw/zinc/62/39/45/565623945.db2.gz VDWUTZSHYZGDSJ-NSHDSACASA-N 0 3 390.709 3.335 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)Nc2ccc(I)cc2)CCN1C ZINC000174288768 565627491 /nfs/dbraw/zinc/62/74/91/565627491.db2.gz PFOQJZUAVDHQRB-SMDDNHRTSA-N 0 3 387.265 3.238 10 0 GGAEHN CCN1CCCC[C@H]1CNC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000409677380 565632789 /nfs/dbraw/zinc/63/27/89/565632789.db2.gz AIWCOLSIPMKGFL-BBRMVZONSA-N 0 3 396.329 3.446 10 0 GGAEHN C[C@@H](Cn1cncn1)NCc1ccc(OC(F)(F)F)c(Br)c1 ZINC000279817031 565635166 /nfs/dbraw/zinc/63/51/66/565635166.db2.gz GBMNHUMRIXYUIN-VIFPVBQESA-N 0 3 379.180 3.118 10 0 GGAEHN COc1ccc(CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1Br ZINC000174572389 565644156 /nfs/dbraw/zinc/64/41/56/565644156.db2.gz RXBKNHJNFCRNSD-JSGCOSHPSA-N 0 3 384.318 3.082 10 0 GGAEHN COc1ccc(CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1Br ZINC000174572351 565644608 /nfs/dbraw/zinc/64/46/08/565644608.db2.gz RXBKNHJNFCRNSD-TZMCWYRMSA-N 0 3 384.318 3.082 10 0 GGAEHN COc1cccc(CN(CCN(C)C)C(=O)c2coc(Br)c2)c1 ZINC000191952928 565645490 /nfs/dbraw/zinc/64/54/90/565645490.db2.gz SMQKCCZPZLCKAG-UHFFFAOYSA-N 0 3 381.270 3.255 10 0 GGAEHN O=C(N[C@@H]1CCc2c1cccc2Br)N1CC[C@@H](N2CC=CC2)C1 ZINC000174666590 565650572 /nfs/dbraw/zinc/65/05/72/565650572.db2.gz WSXFMPNFRBGVHK-CXAGYDPISA-N 0 3 376.298 3.092 10 0 GGAEHN O=C(N[C@@H]1CCc2c1cccc2Br)N1CC[C@H](N2CC=CC2)C1 ZINC000174666563 565650636 /nfs/dbraw/zinc/65/06/36/565650636.db2.gz WSXFMPNFRBGVHK-SUMWQHHRSA-N 0 3 376.298 3.092 10 0 GGAEHN O=C(c1n[nH]c2ccc(Br)cc21)N1CC[C@H](N2CCCCC2)C1 ZINC000329369702 565664304 /nfs/dbraw/zinc/66/43/04/565664304.db2.gz LPTOMURTCFUPDN-ZDUSSCGKSA-N 0 3 377.286 3.026 10 0 GGAEHN CC(C)NC(=O)CCN[C@H](CO)c1ccc(Br)cc1C(F)(F)F ZINC000280349911 565667294 /nfs/dbraw/zinc/66/72/94/565667294.db2.gz IYQIASCWLPYMMD-CYBMUJFWSA-N 0 3 397.235 3.006 10 0 GGAEHN CN(C(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O)[C@@H]1CN2CCC1CC2 ZINC000329514709 565669980 /nfs/dbraw/zinc/66/99/80/565669980.db2.gz YFMNKEMUBXAUMR-ZBFHGGJFSA-N 0 3 379.913 3.345 10 0 GGAEHN C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)N[C@@H]1C[C@H]1c1ccccc1Br ZINC000280418637 565670710 /nfs/dbraw/zinc/67/07/10/565670710.db2.gz AHORFLJXQKNOIE-SDNTUTLCSA-N 0 3 380.330 3.287 10 0 GGAEHN O=C(NCCCc1ccc(Br)cc1F)N1CC[C@H](N2CC=CC2)C1 ZINC000175021095 565674965 /nfs/dbraw/zinc/67/49/65/565674965.db2.gz IHYYFXQDHPHIBP-INIZCTEOSA-N 0 3 396.304 3.177 10 0 GGAEHN C[C@@H](NC[C@]1(C)CCCS1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280558482 565680149 /nfs/dbraw/zinc/68/01/49/565680149.db2.gz JHMIJUGECSJRHM-YGRLFVJLSA-N 0 3 393.372 3.033 10 0 GGAEHN C[C@H](NCCc1cccs1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280572023 565680778 /nfs/dbraw/zinc/68/07/78/565680778.db2.gz KNEZPHIXLRRCLZ-JTQLQIEISA-N 0 3 389.340 3.051 10 0 GGAEHN COC(=O)c1cccc(NC(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1Br ZINC000192424954 565689873 /nfs/dbraw/zinc/68/98/73/565689873.db2.gz FPKIBFWUBVLPIY-FZMZJTMJSA-N 0 3 398.301 3.086 10 0 GGAEHN C[C@H](NCCc1ccsc1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280739803 565692427 /nfs/dbraw/zinc/69/24/27/565692427.db2.gz OYPZBSFYVOVDID-JTQLQIEISA-N 0 3 389.340 3.051 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)Cc1nc(-c2ccc(Br)s2)no1 ZINC000175339240 565693797 /nfs/dbraw/zinc/69/37/97/565693797.db2.gz OFWDQERFRCUMJF-LLVKDONJSA-N 0 3 385.331 3.477 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)Cc1nnc(-c2ccccc2Br)o1 ZINC000175350041 565694568 /nfs/dbraw/zinc/69/45/68/565694568.db2.gz NYJACVVRRIWZPP-CYBMUJFWSA-N 0 3 379.302 3.415 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1cc2c(cc1Br)CCC2 ZINC000192473263 565694948 /nfs/dbraw/zinc/69/49/48/565694948.db2.gz MUGNECBPSPRDHE-OAHLLOKOSA-N 0 3 396.329 3.170 10 0 GGAEHN CCN1CCC[C@H]1CN(C)Cc1nc(Cc2cccc(Br)c2)no1 ZINC000175351815 565695346 /nfs/dbraw/zinc/69/53/46/565695346.db2.gz ROWBATPAFHUQSC-INIZCTEOSA-N 0 3 393.329 3.339 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)N2CCc3cccc(Br)c3C2)CN1C1CC1 ZINC000175556473 565708230 /nfs/dbraw/zinc/70/82/30/565708230.db2.gz MSJIUYOOWYCDFX-OCCSQVGLSA-N 0 3 378.314 3.142 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)N[C@@H]1CCC[C@H](S(C)(=O)=O)C1 ZINC000330493506 565709024 /nfs/dbraw/zinc/70/90/24/565709024.db2.gz MUCHPNQTLCAXSI-YUTCNCBUSA-N 0 3 390.343 3.464 10 0 GGAEHN O=C(NC[C@H](O)CN1CCCCC1)N[C@H]1CCSc2ccc(Cl)cc21 ZINC000192803275 565710842 /nfs/dbraw/zinc/71/08/42/565710842.db2.gz HISXFGKGMDJTNY-HOCLYGCPSA-N 0 3 383.945 3.023 10 0 GGAEHN O=C(NC[C@H](O)CN1CCCCC1)N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000192803255 565711506 /nfs/dbraw/zinc/71/15/06/565711506.db2.gz HISXFGKGMDJTNY-GOEBONIOSA-N 0 3 383.945 3.023 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)N[C@@H]2C[C@H]2c2ccc(Br)cc2)CCN1C ZINC000281181740 565716306 /nfs/dbraw/zinc/71/63/06/565716306.db2.gz FFHQSJJEFWANSG-OSMBCOQSSA-N 0 3 380.330 3.429 10 0 GGAEHN CC(C)C(=O)N1CCC(N[C@H](C)C(=O)Nc2ccc(Br)cc2)CC1 ZINC000192884034 565716440 /nfs/dbraw/zinc/71/64/40/565716440.db2.gz ILJJNDJJLQAFAO-CYBMUJFWSA-N 0 3 396.329 3.013 10 0 GGAEHN Cc1cc(S(=O)(=O)N2CC[C@@H](CN(C)Cc3scnc3C)C2)c(C)s1 ZINC000192935049 565719707 /nfs/dbraw/zinc/71/97/07/565719707.db2.gz WJPUTDPKFXJLRX-HNNXBMFYSA-N 0 3 399.607 3.272 10 0 GGAEHN C[C@H]1CCCCN1C(=O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000411341169 565725217 /nfs/dbraw/zinc/72/52/17/565725217.db2.gz PEZDYRQSWYCSCR-HNNXBMFYSA-N 0 3 395.341 3.445 10 0 GGAEHN COc1cc(NC(=O)CCN[C@@H](CO)c2ccsc2)c(OC)cc1Cl ZINC000411545462 565734766 /nfs/dbraw/zinc/73/47/66/565734766.db2.gz QVHAPQWLZFLUIX-AWEZNQCLSA-N 0 3 384.885 3.071 10 0 GGAEHN O=C(CCN[C@@H](CO)c1ccsc1)Nc1ccc(Br)cc1F ZINC000411542535 565734792 /nfs/dbraw/zinc/73/47/92/565734792.db2.gz ISOJKUFPCIUKGC-AWEZNQCLSA-N 0 3 387.274 3.302 10 0 GGAEHN CN1CCN([C@H]2CCCCN(C(=O)Cc3cc(Cl)ccc3Cl)C2)CC1 ZINC000175991890 565740101 /nfs/dbraw/zinc/74/01/01/565740101.db2.gz FJVPOGAQUPNQFN-KRWDZBQOSA-N 0 3 384.351 3.164 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)N(C)[C@H]1CCN(C)C[C@H]1C ZINC000176048937 565743584 /nfs/dbraw/zinc/74/35/84/565743584.db2.gz ZOFCRKUNBCOGQP-KEYYUXOJSA-N 0 3 382.346 3.362 10 0 GGAEHN CN(C(=O)CCN[C@@](C)(CO)c1ccc(Br)cc1)c1ccccc1 ZINC000411714884 565747454 /nfs/dbraw/zinc/74/74/54/565747454.db2.gz AABOTZBBFUYYNC-IBGZPJMESA-N 0 3 391.309 3.299 10 0 GGAEHN C[C@@](CO)(NCCC(=O)NCC1CCCCC1)c1ccc(Br)cc1 ZINC000411718352 565747935 /nfs/dbraw/zinc/74/79/35/565747935.db2.gz KUSIJMXBCCDTHM-IBGZPJMESA-N 0 3 397.357 3.333 10 0 GGAEHN C[C@](CO)(NCCC(=O)NCC1CCCCC1)c1ccc(Br)cc1 ZINC000411718353 565748107 /nfs/dbraw/zinc/74/81/07/565748107.db2.gz KUSIJMXBCCDTHM-LJQANCHMSA-N 0 3 397.357 3.333 10 0 GGAEHN C[C@](CO)(NCCC(=O)Nc1ccccc1F)c1ccc(Br)cc1 ZINC000411723121 565748284 /nfs/dbraw/zinc/74/82/84/565748284.db2.gz WNYIFDKYVRJMOG-GOSISDBHSA-N 0 3 395.272 3.414 10 0 GGAEHN COC(=O)C[C@@](C)(NCCc1ccccn1)c1ccc(Br)cc1 ZINC000411727854 565748509 /nfs/dbraw/zinc/74/85/09/565748509.db2.gz QKAXHYSAPZTEMM-GOSISDBHSA-N 0 3 377.282 3.455 10 0 GGAEHN CN(Cc1cccs1)C(=O)CN[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000411749907 565748974 /nfs/dbraw/zinc/74/89/74/565748974.db2.gz PRNPBZWOGOLEBL-HKUYNNGSSA-N 0 3 377.941 3.395 10 0 GGAEHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(Br)cc2nc[nH]c21 ZINC000281905730 565755229 /nfs/dbraw/zinc/75/52/29/565755229.db2.gz AQBNTTVCQRNHAS-OLZOCXBDSA-N 0 3 377.286 3.024 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)Nc1ccccc1I ZINC000176251785 565759661 /nfs/dbraw/zinc/75/96/61/565759661.db2.gz XKCMPPHRMRQRHZ-GFCCVEGCSA-N 0 3 387.265 3.239 10 0 GGAEHN CC(C)N(CCOc1ccc(Cl)cc1Br)C[C@H]1CCC(=O)N1 ZINC000412076017 565769134 /nfs/dbraw/zinc/76/91/34/565769134.db2.gz KNXOWTGYVLPBFF-CYBMUJFWSA-N 0 3 389.721 3.470 10 0 GGAEHN CCN1CC[C@H](N(C)C(=O)CSCC(=O)c2ccc(Cl)cc2)[C@H](C)C1 ZINC000176430490 565772047 /nfs/dbraw/zinc/77/20/47/565772047.db2.gz GYZMJNPDEFOWMX-PBHICJAKSA-N 0 3 382.957 3.445 10 0 GGAEHN C[C@@H](NC(=O)NC[C@@H](O)CN1CCCCC1)c1c(Cl)ccc(F)c1Cl ZINC000193902033 565782596 /nfs/dbraw/zinc/78/25/96/565782596.db2.gz OXCYXKCVXDPRAW-VXGBXAGGSA-N 0 3 392.302 3.340 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CCOc3c(Br)cccc32)CCN1C ZINC000282570353 565786006 /nfs/dbraw/zinc/78/60/06/565786006.db2.gz VPGQVDZNUXAYKH-XJKCOSOUSA-N 0 3 396.329 3.397 10 0 GGAEHN CC(C)OCCN1CCC(NC(=O)COc2ccc(Cl)c(Cl)c2)CC1 ZINC000176691111 565795160 /nfs/dbraw/zinc/79/51/60/565795160.db2.gz HAVFIJKHOBZVEE-UHFFFAOYSA-N 0 3 389.323 3.378 10 0 GGAEHN O=C(NCC1(N2CCSCC2)CCCC1)N1CCC[C@H](C(F)(F)F)C1 ZINC000194286649 565805906 /nfs/dbraw/zinc/80/59/06/565805906.db2.gz CRDQYUGGCBARKD-AWEZNQCLSA-N 0 3 379.492 3.332 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)CSc1ncnc2sc(C)c(C)c21 ZINC000176995246 565821611 /nfs/dbraw/zinc/82/16/11/565821611.db2.gz LMLLUVIPEVHQQP-CQSZACIVSA-N 0 3 378.567 3.343 10 0 GGAEHN CCN1CCC[C@H](NC(=O)N2CCO[C@H](c3cccc(Br)c3)C2)C1 ZINC000194543008 565822053 /nfs/dbraw/zinc/82/20/53/565822053.db2.gz LTOKFVNRXGYZDJ-IRXDYDNUSA-N 0 3 396.329 3.016 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)c1ccc(C)c(I)c1 ZINC000177009157 565822822 /nfs/dbraw/zinc/82/28/22/565822822.db2.gz JTHJHNSSOYNDGI-AWEZNQCLSA-N 0 3 386.277 3.156 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)CCc1ccc(OC)c(Br)c1 ZINC000177019874 565822924 /nfs/dbraw/zinc/82/29/24/565822924.db2.gz VCLFHPVYISWWBK-OAHLLOKOSA-N 0 3 383.330 3.333 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)c1ccc(C)c(I)c1 ZINC000177009142 565823038 /nfs/dbraw/zinc/82/30/38/565823038.db2.gz JTHJHNSSOYNDGI-CQSZACIVSA-N 0 3 386.277 3.156 10 0 GGAEHN O=C(Cc1csc(Cc2cccc(Cl)c2)n1)N1CCN2CCC[C@@H]2C1 ZINC000194580770 565824431 /nfs/dbraw/zinc/82/44/31/565824431.db2.gz FJYUDMUEWFFHDV-QGZVFWFLSA-N 0 3 375.925 3.236 10 0 GGAEHN CCCOc1c(Br)cc(C(=O)N[C@@H]2CCCN(CC)C2)cc1OC ZINC000194624186 565827115 /nfs/dbraw/zinc/82/71/15/565827115.db2.gz VWNXARYOQGTROG-CQSZACIVSA-N 0 3 399.329 3.461 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N[C@@H]2CCCN(CC)C2)cc1OC ZINC000194625418 565827577 /nfs/dbraw/zinc/82/75/77/565827577.db2.gz SZSPNPPXYQKMHD-CYBMUJFWSA-N 0 3 385.302 3.071 10 0 GGAEHN CC(C)[C@@H](CNc1nccc2cc(Br)ccc21)N1CCN(C)CC1 ZINC000413044547 565832279 /nfs/dbraw/zinc/83/22/79/565832279.db2.gz OPRPAIFPASNVLQ-GOSISDBHSA-N 0 3 391.357 3.103 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 ZINC000194733625 565833203 /nfs/dbraw/zinc/83/32/03/565833203.db2.gz VQAUWUHTBIMGSF-ZDUSSCGKSA-N 0 3 377.897 3.478 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000177176338 565833571 /nfs/dbraw/zinc/83/35/71/565833571.db2.gz VZTZFYDHRXJOEQ-CYBMUJFWSA-N 0 3 388.269 3.135 10 0 GGAEHN CN1CC[C@H](NCC(=O)Nc2ccccc2Br)[C@@H]1c1ccccc1 ZINC000283918575 565834963 /nfs/dbraw/zinc/83/49/63/565834963.db2.gz GIFAUJAHZBZPBU-HKUYNNGSSA-N 0 3 388.309 3.423 10 0 GGAEHN Brc1ccc2c(ccnc2N2CCN(C3CCOCC3)CC2)c1 ZINC000413174700 565838896 /nfs/dbraw/zinc/83/88/96/565838896.db2.gz FBXDGECWIUCZNL-UHFFFAOYSA-N 0 3 376.298 3.298 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)NCc1cc(Br)ccc1OC ZINC000177451261 565851571 /nfs/dbraw/zinc/85/15/71/565851571.db2.gz RTDFMFBRHGSARR-HNNXBMFYSA-N 0 3 384.318 3.083 10 0 GGAEHN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCN2CCCC[C@H]2C1 ZINC000195045264 565855908 /nfs/dbraw/zinc/85/59/08/565855908.db2.gz YBRPVKJAEVIEIT-AWEZNQCLSA-N 0 3 389.297 3.150 10 0 GGAEHN CC[C@H](C(=O)N1CCC[C@@H]1c1ccc(I)cc1)N(C)C ZINC000413528049 565858543 /nfs/dbraw/zinc/85/85/43/565858543.db2.gz CXAVNXAAMLLJSG-HUUCEWRRSA-N 0 3 386.277 3.295 10 0 GGAEHN CCCCOC[C@@H](O)CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000195186022 565863308 /nfs/dbraw/zinc/86/33/08/565863308.db2.gz BUINQEMYACTSHU-KRWDZBQOSA-N 0 3 386.330 3.222 10 0 GGAEHN O=C(NCc1cccc(Br)c1Cl)N1CC[C@H](N2CC=CC2)C1 ZINC000413661424 565866224 /nfs/dbraw/zinc/86/62/24/565866224.db2.gz XUOYSFSHBYXULN-ZDUSSCGKSA-N 0 3 384.705 3.258 10 0 GGAEHN CN(Cc1ccc(Br)c(F)c1)[C@@H]1CCCN(c2cccnn2)C1 ZINC000177708670 565869253 /nfs/dbraw/zinc/86/92/53/565869253.db2.gz DXVDNMFKUODDJJ-CQSZACIVSA-N 0 3 379.277 3.479 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)CC(=O)Nc1c(F)cc(F)cc1Br ZINC000177709422 565869317 /nfs/dbraw/zinc/86/93/17/565869317.db2.gz YSARGMFWQSIBBD-GFCCVEGCSA-N 0 3 390.272 3.082 10 0 GGAEHN O=C(Nc1nc(SCc2ccccc2)ns1)N1CCN2CCC[C@H]2C1 ZINC000177710274 565869420 /nfs/dbraw/zinc/86/94/20/565869420.db2.gz XLBWDJXDOVRHKO-AWEZNQCLSA-N 0 3 375.523 3.142 10 0 GGAEHN Brc1cccc(-c2noc(CN3CCN4CCCC[C@@H]4C3)n2)c1 ZINC000177754645 565871421 /nfs/dbraw/zinc/87/14/21/565871421.db2.gz KQBAGNTUSDNXOY-OAHLLOKOSA-N 0 3 377.286 3.169 10 0 GGAEHN O=C(COc1ccc(C2SCCCS2)cc1)N1CCN2CCC[C@H]2C1 ZINC000195318985 565875698 /nfs/dbraw/zinc/87/56/98/565875698.db2.gz RBIKPKUZYIWIIP-INIZCTEOSA-N 0 3 378.563 3.241 10 0 GGAEHN CN1C(=O)CC[C@@H](N[C@@H]2CCCc3c4cc(Br)ccc4[nH]c32)C1=O ZINC000333462999 565882921 /nfs/dbraw/zinc/88/29/21/565882921.db2.gz GVYYEOUHUYAFJC-HUUCEWRRSA-N 0 3 390.281 3.045 10 0 GGAEHN CN(C)CCOc1ccc(CNC(=O)c2cscc2Br)cc1 ZINC000285144381 565890565 /nfs/dbraw/zinc/89/05/65/565890565.db2.gz AZJDFQKXUVWZLV-UHFFFAOYSA-N 0 3 383.311 3.381 10 0 GGAEHN COc1ccc(OC)c([C@H](C)N[C@H](C)Cn2cc(Br)ccc2=O)c1 ZINC000414058280 565890870 /nfs/dbraw/zinc/89/08/70/565890870.db2.gz GXHGYERRLKSAHB-OLZOCXBDSA-N 0 3 395.297 3.367 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NC[C@@H](c1cccc(F)c1)N(C)C ZINC000414052165 565891577 /nfs/dbraw/zinc/89/15/77/565891577.db2.gz KSKWBRMMHDIBBT-GUYCJALGSA-N 0 3 396.304 3.031 10 0 GGAEHN C[C@@H](NCc1cccnc1-n1cncn1)c1ccc(F)c(Br)c1 ZINC000178049309 565892235 /nfs/dbraw/zinc/89/22/35/565892235.db2.gz KXBUMIIPDLPABC-LLVKDONJSA-N 0 3 376.233 3.415 10 0 GGAEHN C[C@@H](N[C@@H](C)Cn1cc(Br)ccc1=O)c1ccc2c(c1)OCO2 ZINC000414059812 565892827 /nfs/dbraw/zinc/89/28/27/565892827.db2.gz IUOBADUMBHLYAS-NWDGAFQWSA-N 0 3 379.254 3.079 10 0 GGAEHN C[C@@H](NCCOCCN(C)C)c1ccc(Br)cc1Br ZINC000219324655 565902303 /nfs/dbraw/zinc/90/23/03/565902303.db2.gz BXDQKTGBHKGRAE-LLVKDONJSA-N 0 3 394.151 3.440 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000414092025 565894406 /nfs/dbraw/zinc/89/44/06/565894406.db2.gz DSGYUKXXQIHOMC-PSVOKBTDSA-N 0 3 397.338 3.088 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@H](CCO)c1ccc(Cl)cc1 ZINC000414123904 565896825 /nfs/dbraw/zinc/89/68/25/565896825.db2.gz CAUNNPJHQOCMHS-MLGOLLRUSA-N 0 3 399.716 3.366 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@H](C)[C@@H]1OCCc2sccc21 ZINC000414138776 565897999 /nfs/dbraw/zinc/89/79/99/565897999.db2.gz KIDTVFKYIDQEHT-QFSBIZTOSA-N 0 3 397.338 3.353 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NCc1cc(Cl)cc2c1OCC2 ZINC000414129829 565898171 /nfs/dbraw/zinc/89/81/71/565898171.db2.gz IUECJHWXIXCKCG-NSHDSACASA-N 0 3 397.700 3.377 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NC[C@@]1(C)OCCc2sccc21 ZINC000414140956 565898384 /nfs/dbraw/zinc/89/83/84/565898384.db2.gz HZRWRAJXMOIKQY-SJKOYZFVSA-N 0 3 397.338 3.139 10 0 GGAEHN Cc1cc([C@H](Cc2ccccc2Cl)NC[C@@H](O)Cn2ccnn2)cs1 ZINC000414190539 565901793 /nfs/dbraw/zinc/90/17/93/565901793.db2.gz RIGWUJBAYWPSKK-AEFFLSMTSA-N 0 3 376.913 3.236 10 0 GGAEHN Cc1cc([C@@H](Cc2ccccc2Cl)NC[C@@H](O)Cn2ccnn2)cs1 ZINC000414190545 565902630 /nfs/dbraw/zinc/90/26/30/565902630.db2.gz RIGWUJBAYWPSKK-SJLPKXTDSA-N 0 3 376.913 3.236 10 0 GGAEHN Cc1cc([C@@H](Cc2ccccc2Cl)NC[C@H](O)Cn2ccnn2)cs1 ZINC000414190543 565902823 /nfs/dbraw/zinc/90/28/23/565902823.db2.gz RIGWUJBAYWPSKK-FUHWJXTLSA-N 0 3 376.913 3.236 10 0 GGAEHN Cc1cc([C@@H](NC[C@@H](O)Cn2ccnn2)c2cccc(Cl)c2)c(C)s1 ZINC000414203534 565902942 /nfs/dbraw/zinc/90/29/42/565902942.db2.gz ZKEKXIJBIYTTLK-AEFFLSMTSA-N 0 3 376.913 3.350 10 0 GGAEHN Cc1cc([C@@H](NC[C@H](O)Cn2ccnn2)c2cccc(Cl)c2)c(C)s1 ZINC000414203541 565903249 /nfs/dbraw/zinc/90/32/49/565903249.db2.gz ZKEKXIJBIYTTLK-WMZOPIPTSA-N 0 3 376.913 3.350 10 0 GGAEHN NS(=O)(=O)c1ccc(CN[C@@H]2CCCc3ccccc32)cc1Br ZINC000414233985 565905233 /nfs/dbraw/zinc/90/52/33/565905233.db2.gz CDOANOOYLIDKOU-MRXNPFEDSA-N 0 3 395.322 3.264 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1Cc1nnc(-c2ccc(Br)o2)o1 ZINC000178332728 565913604 /nfs/dbraw/zinc/91/36/04/565913604.db2.gz VUWLMUZAATWXBW-GFCCVEGCSA-N 0 3 392.257 3.262 10 0 GGAEHN CN1CC[C@H](NCc2ccc(S(C)(=O)=O)s2)[C@@H]1c1ccc(Cl)cc1 ZINC000414362234 565915709 /nfs/dbraw/zinc/91/57/09/565915709.db2.gz DQFUROKBARIKHF-RDJZCZTQSA-N 0 3 384.954 3.340 10 0 GGAEHN CN1CC[C@@H](NCc2ccc(S(C)(=O)=O)s2)[C@@H]1c1ccc(Cl)cc1 ZINC000414362236 565916475 /nfs/dbraw/zinc/91/64/75/565916475.db2.gz DQFUROKBARIKHF-WBVHZDCISA-N 0 3 384.954 3.340 10 0 GGAEHN Cn1nccc1C1=CCN(CCC(=O)Nc2ccccc2Br)CC1 ZINC000285618098 565916676 /nfs/dbraw/zinc/91/66/76/565916676.db2.gz NCHYHPRPHUXZIS-UHFFFAOYSA-N 0 3 389.297 3.301 10 0 GGAEHN COC(=O)c1ccc(CNCc2ccc(I)cc2)cc1 ZINC000225936855 565917361 /nfs/dbraw/zinc/91/73/61/565917361.db2.gz KQJRVQHNFQQWGX-UHFFFAOYSA-N 0 3 381.213 3.368 10 0 GGAEHN OC[C@@H](NC1CCN(Cc2ccccn2)CC1)c1cccc(Br)c1 ZINC000414375176 565918621 /nfs/dbraw/zinc/91/86/21/565918621.db2.gz DWTRDSJPUDCLTC-LJQANCHMSA-N 0 3 390.325 3.132 10 0 GGAEHN C[C@@H](NCCCOCCO)c1ccc(Br)cc1Br ZINC000227500504 565922880 /nfs/dbraw/zinc/92/28/80/565922880.db2.gz TULPUFAIDHGCKY-SNVBAGLBSA-N 0 3 381.108 3.261 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)c1csc(I)c1 ZINC000227721668 565923412 /nfs/dbraw/zinc/92/34/12/565923412.db2.gz WNSPENFTGUAEMF-CYBMUJFWSA-N 0 3 398.269 3.051 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)c1csc(I)c1 ZINC000227721673 565923525 /nfs/dbraw/zinc/92/35/25/565923525.db2.gz WNSPENFTGUAEMF-ZDUSSCGKSA-N 0 3 398.269 3.051 10 0 GGAEHN C[C@H](NC[C@@]1(O)CCO[C@@H]1C)c1ccc(Br)cc1Br ZINC000228065220 565924831 /nfs/dbraw/zinc/92/48/31/565924831.db2.gz GSWYOPIIHMTTJZ-RBZYPMLTSA-N 0 3 393.119 3.402 10 0 GGAEHN CN(C)Cc1cccc(NC(=O)N[C@@H](CO)c2cccc(Br)c2)c1 ZINC000178620615 565929266 /nfs/dbraw/zinc/92/92/66/565929266.db2.gz QOCQHBNRSHVFAD-KRWDZBQOSA-N 0 3 392.297 3.366 10 0 GGAEHN C[C@]1(CNCc2ccc(S(C)(=O)=O)s2)CCCN1Cc1ccccc1 ZINC000414431917 565930887 /nfs/dbraw/zinc/93/08/87/565930887.db2.gz LWAJWOOFGGYMOJ-LJQANCHMSA-N 0 3 378.563 3.296 10 0 GGAEHN C[C@H](C(=O)Nc1ccc(Cl)cc1C(F)(F)F)N1CCN2CCC[C@@H]2C1 ZINC000178640290 565931493 /nfs/dbraw/zinc/93/14/93/565931493.db2.gz CTHZPUNCFMFULI-DGCLKSJQSA-N 0 3 375.822 3.466 10 0 GGAEHN Cc1cc(CN2CCC[C@@H](CN(C)S(C)(=O)=O)C2)ccc1C(F)(F)F ZINC000414447162 565933028 /nfs/dbraw/zinc/93/30/28/565933028.db2.gz ZGSWHEPPZXQLLW-HNNXBMFYSA-N 0 3 378.460 3.117 10 0 GGAEHN Cc1cc(CN2CCC[C@H](CN(C)S(C)(=O)=O)C2)ccc1C(F)(F)F ZINC000414447165 565933545 /nfs/dbraw/zinc/93/35/45/565933545.db2.gz ZGSWHEPPZXQLLW-OAHLLOKOSA-N 0 3 378.460 3.117 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1CC(=O)Nc1ccc(Br)cc1 ZINC000178750028 565936840 /nfs/dbraw/zinc/93/68/40/565936840.db2.gz MKIBFVQBRBBPIU-MRXNPFEDSA-N 0 3 377.286 3.057 10 0 GGAEHN CC(C)(C)OC(=O)[C@@H]1CCN(CCC(=O)Nc2ccccc2Br)C1 ZINC000178835730 565940342 /nfs/dbraw/zinc/94/03/42/565940342.db2.gz LHGWURQGXNDESA-CYBMUJFWSA-N 0 3 397.313 3.441 10 0 GGAEHN CN(C)C(=O)[C@@H]1CCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000414503158 565943363 /nfs/dbraw/zinc/94/33/63/565943363.db2.gz VTQXBRDVUOZHIR-CYBMUJFWSA-N 0 3 394.338 3.483 10 0 GGAEHN OC[C@H](NCc1cnc(-c2ccc(Br)cc2)s1)[C@@H]1CCCOC1 ZINC000414544771 565947229 /nfs/dbraw/zinc/94/72/29/565947229.db2.gz FHEJFHILGYRDQQ-CJNGLKHVSA-N 0 3 397.338 3.450 10 0 GGAEHN CCOc1cc(CN(C[C@H]2CCC(=O)N2)C(C)C)cc(Br)c1OC ZINC000414554598 565948776 /nfs/dbraw/zinc/94/87/76/565948776.db2.gz HFJMRVKGYADKTR-CQSZACIVSA-N 0 3 399.329 3.345 10 0 GGAEHN CN(C)CCn1cc(NCc2cnn(-c3ccc(Br)cc3)c2)cn1 ZINC000237009153 565949046 /nfs/dbraw/zinc/94/90/46/565949046.db2.gz AHXGGJHGNIOFAM-UHFFFAOYSA-N 0 3 389.301 3.005 10 0 GGAEHN CN(C)CCn1cc(NCC2=Cc3cc(Br)ccc3OC2)cn1 ZINC000237003531 565949401 /nfs/dbraw/zinc/94/94/01/565949401.db2.gz PLAFFRSICKWGIP-UHFFFAOYSA-N 0 3 377.286 3.095 10 0 GGAEHN CN(C)CCn1cc(NCc2cc(Br)ccc2OC(F)F)cn1 ZINC000236994016 565949470 /nfs/dbraw/zinc/94/94/70/565949470.db2.gz GHRVNAKFEKONSS-UHFFFAOYSA-N 0 3 389.244 3.421 10 0 GGAEHN CCOc1cc(C[N@H+](C[C@H]2CCC(=O)N2)C(C)C)cc(Br)c1[O-] ZINC000414577663 565949489 /nfs/dbraw/zinc/94/94/89/565949489.db2.gz OWZHCGPMUJHJAP-CYBMUJFWSA-N 0 3 385.302 3.042 10 0 GGAEHN CCOc1cc(C[N@@H+](C[C@H]2CCC(=O)N2)C(C)C)cc(Br)c1[O-] ZINC000414577663 565949491 /nfs/dbraw/zinc/94/94/91/565949491.db2.gz OWZHCGPMUJHJAP-CYBMUJFWSA-N 0 3 385.302 3.042 10 0 GGAEHN CC(C)N(CC1=Cc2cc(Br)ccc2OC1)C[C@H]1CCC(=O)N1 ZINC000414565905 565949926 /nfs/dbraw/zinc/94/99/26/565949926.db2.gz ZNQRCGSWPLTMKO-MRXNPFEDSA-N 0 3 379.298 3.214 10 0 GGAEHN COc1cc(CNCCOc2ccc(Br)cc2)cc2c1OCCO2 ZINC000237181148 565952544 /nfs/dbraw/zinc/95/25/44/565952544.db2.gz FCFNYPSFMIVCPD-UHFFFAOYSA-N 0 3 394.265 3.398 10 0 GGAEHN C[C@@H](C(=O)N1CCN(Cc2ccc(Cl)s2)CC1)[C@H](N)c1ccccc1 ZINC000237697340 565967574 /nfs/dbraw/zinc/96/75/74/565967574.db2.gz ZCBGIWPAKDRPPG-KDOFPFPSSA-N 0 3 377.941 3.382 10 0 GGAEHN CCCOc1c(Br)cc(CN[C@@H]2CNCCC2(F)F)cc1OC ZINC000415005192 565969264 /nfs/dbraw/zinc/96/92/64/565969264.db2.gz RFKOMHVTFHFQJD-CQSZACIVSA-N 0 3 393.272 3.333 10 0 GGAEHN FC1(F)CCNC[C@@H]1NCc1ccc(Br)c(Br)c1 ZINC000415008446 565969718 /nfs/dbraw/zinc/96/97/18/565969718.db2.gz WAFCBENQXCKLIX-NSHDSACASA-N 0 3 384.062 3.298 10 0 GGAEHN Cc1cc(CNC[C@H](O)COc2ccc3c(c2)OCO3)ccc1Br ZINC000237744539 565969984 /nfs/dbraw/zinc/96/99/84/565969984.db2.gz QGTBIAZRAIOXFC-AWEZNQCLSA-N 0 3 394.265 3.016 10 0 GGAEHN COc1ccc(Br)c(NC(=O)NCCCNCc2cccnc2)c1 ZINC000415088056 565972991 /nfs/dbraw/zinc/97/29/91/565972991.db2.gz WZUQXWQSLAFCDH-UHFFFAOYSA-N 0 3 393.285 3.154 10 0 GGAEHN C[C@@H]1C[C@H](N[C@@H]2CCN(C3CCOCC3)C2=O)c2cccc(Br)c21 ZINC000362303198 565978776 /nfs/dbraw/zinc/97/87/76/565978776.db2.gz JPJCYXZDTUKMRZ-JLZZUVOBSA-N 0 3 393.325 3.367 10 0 GGAEHN CNCc1ccccc1NC(=O)C(=O)N[C@H]1CCCc2sc(Cl)cc21 ZINC000415262400 565983004 /nfs/dbraw/zinc/98/30/04/565983004.db2.gz IIDSWFGXONEMOB-AWEZNQCLSA-N 0 3 377.897 3.253 10 0 GGAEHN C[C@H](NC[C@@H]1CCCN(S(C)(=O)=O)C1)c1c(Cl)ccc(F)c1Cl ZINC000179540909 565987587 /nfs/dbraw/zinc/98/75/87/565987587.db2.gz HZJYGVCIPKVICH-QWRGUYRKSA-N 0 3 383.316 3.455 10 0 GGAEHN CCC[C@@H](C(=O)NC[C@H]1CCN(c2ccc(Br)cc2)C1)N(C)C ZINC000179575779 565989774 /nfs/dbraw/zinc/98/97/74/565989774.db2.gz RECOOJRQBKJNQX-PBHICJAKSA-N 0 3 382.346 3.122 10 0 GGAEHN CCN1CC[C@H](N(C)CCS(=O)(=O)c2cc(Cl)ccc2Cl)[C@@H](C)C1 ZINC000245442671 565990511 /nfs/dbraw/zinc/99/05/11/565990511.db2.gz WNKKKCAEURTFFP-BBRMVZONSA-N 0 3 393.380 3.429 10 0 GGAEHN Cc1ccc(Br)c(NC(=O)NCCCNCc2cccnc2)c1 ZINC000415367549 565991694 /nfs/dbraw/zinc/99/16/94/565991694.db2.gz KGDWYAPMPJWXPM-UHFFFAOYSA-N 0 3 377.286 3.454 10 0 GGAEHN C[C@@H](CN1CCC[C@@H](C(=O)N2CCOCC2)C1)c1cccc(Br)c1 ZINC000245501674 565992728 /nfs/dbraw/zinc/99/27/28/565992728.db2.gz DFAXTLVOPIQQQU-DOTOQJQBSA-N 0 3 395.341 3.123 10 0 GGAEHN O=C(NCCCNCc1cccnc1)Nc1cc(F)c(Br)c(F)c1 ZINC000415401837 565994222 /nfs/dbraw/zinc/99/42/22/565994222.db2.gz HVYGBZKTCVWIKU-UHFFFAOYSA-N 0 3 399.239 3.424 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1C[C@H](C(N)=O)CC[C@H]1C ZINC000245549431 565996119 /nfs/dbraw/zinc/99/61/19/565996119.db2.gz ZBYXTUSANXAXOJ-TZMCWYRMSA-N 0 3 391.313 3.029 10 0 GGAEHN CN1CC[C@H]2[C@@H](CCCN2C(=O)c2c[nH]c3cccc(Br)c23)C1 ZINC000245596579 565997570 /nfs/dbraw/zinc/99/75/70/565997570.db2.gz NHVLUSNVAOOUMR-LRDDRELGSA-N 0 3 376.298 3.487 10 0 GGAEHN O=C(N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F)N[C@H]1CNCCC1(F)F ZINC000415618855 566008965 /nfs/dbraw/zinc/00/89/65/566008965.db2.gz RSVCYPSHVFCNEC-WDEREUQCSA-N 0 3 389.727 3.379 10 0 GGAEHN O=C(NC[C@@H]1CCCN(Cc2cccs2)C1)NC[C@H]1CSCCS1 ZINC000245867075 566009388 /nfs/dbraw/zinc/00/93/88/566009388.db2.gz FHCXWRFNYIZXOH-HOCLYGCPSA-N 0 3 385.624 3.108 10 0 GGAEHN CN1CCC[C@H](CNC(=O)NC[C@@H]2CSCCS2)[C@H]1c1cccs1 ZINC000245865847 566009431 /nfs/dbraw/zinc/00/94/31/566009431.db2.gz DVLRNYRLFRZOMB-FMKPAKJESA-N 0 3 385.624 3.279 10 0 GGAEHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)NCc2cc(F)cc(Br)c2)C1 ZINC000245950462 566012084 /nfs/dbraw/zinc/01/20/84/566012084.db2.gz LBFNIXOOXPCOHW-XJKSGUPXSA-N 0 3 384.293 3.214 10 0 GGAEHN CS(=O)(=O)N1CCC[C@H](CN[C@H](CC(F)(F)F)c2ccc(F)cc2)C1 ZINC000246009923 566013083 /nfs/dbraw/zinc/01/30/83/566013083.db2.gz HZCDPCHVWXIDIP-IUODEOHRSA-N 0 3 382.423 3.080 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(Br)c(C)c2)[C@@H](C)C1 ZINC000246045462 566014685 /nfs/dbraw/zinc/01/46/85/566014685.db2.gz BPZCTKLDXHJDCC-BBRMVZONSA-N 0 3 389.359 3.108 10 0 GGAEHN Cc1c(I)cccc1C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000246071746 566015173 /nfs/dbraw/zinc/01/51/73/566015173.db2.gz YCIYQKUIGUQZRD-WCQYABFASA-N 0 3 386.277 3.154 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(C)c(Br)c2)[C@@H](C)C1 ZINC000246118986 566017823 /nfs/dbraw/zinc/01/78/23/566017823.db2.gz IYCMZUBYFKUCMG-BBRMVZONSA-N 0 3 389.359 3.108 10 0 GGAEHN O=C(Nc1cccc2c(Br)ccnc12)N[C@@H]1CNCCC1(F)F ZINC000415783136 566018984 /nfs/dbraw/zinc/01/89/84/566018984.db2.gz CFTSXCFONRRZKP-GFCCVEGCSA-N 0 3 385.212 3.116 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(C)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC000246180483 566019738 /nfs/dbraw/zinc/01/97/38/566019738.db2.gz NFWRBMRCLGCOCN-XJKSGUPXSA-N 0 3 378.460 3.365 10 0 GGAEHN Cc1ccc(-n2ncc(N3CCN4CCC[C@H]4C3)c(Cl)c2=O)cc1Cl ZINC000246186568 566019886 /nfs/dbraw/zinc/01/98/86/566019886.db2.gz RELJTWBRRMBBKW-AWEZNQCLSA-N 0 3 379.291 3.132 10 0 GGAEHN Brc1ccccc1-c1nnc(CN2CCN3CCCC[C@H]3C2)o1 ZINC000246175953 566020122 /nfs/dbraw/zinc/02/01/22/566020122.db2.gz JWRSKVCJTBJUJM-ZDUSSCGKSA-N 0 3 377.286 3.169 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)Cc2c(Cl)cccc2Cl)[C@@H](C)C1 ZINC000246222988 566021376 /nfs/dbraw/zinc/02/13/76/566021376.db2.gz QDTRTSBQXAPPLJ-LRDDRELGSA-N 0 3 379.353 3.485 10 0 GGAEHN CNCc1cccc(NC(=O)N[C@@](C)(CO)c2ccc(Br)cc2)c1 ZINC000415929727 566022543 /nfs/dbraw/zinc/02/25/43/566022543.db2.gz JLLWDDNIISVNKY-SFHVURJKSA-N 0 3 392.297 3.198 10 0 GGAEHN Brc1ccc([C@@H](NC[C@H]2COC3(CCOCC3)O2)C2CC2)cc1 ZINC000179984429 566022799 /nfs/dbraw/zinc/02/27/99/566022799.db2.gz AEWVKGZKPIMPFG-IRXDYDNUSA-N 0 3 382.298 3.412 10 0 GGAEHN CCN(CC)[C@H](CN[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccsc1 ZINC000180014922 566025078 /nfs/dbraw/zinc/02/50/78/566025078.db2.gz LRRINLOMSCYALP-RDTXWAMCSA-N 0 3 381.567 3.129 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(Br)sc2C)[C@@H](C)C1 ZINC000246312538 566025105 /nfs/dbraw/zinc/02/51/05/566025105.db2.gz WHYQOXWYKLQIEJ-JQWIXIFHSA-N 0 3 395.388 3.170 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cccc(C)c2Br)[C@@H](C)C1 ZINC000246326078 566025235 /nfs/dbraw/zinc/02/52/35/566025235.db2.gz TXQNIXSQHXOCOZ-UONOGXRCSA-N 0 3 389.359 3.108 10 0 GGAEHN C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccn(-c2ccc(Cl)cc2Cl)n1 ZINC000246322189 566025593 /nfs/dbraw/zinc/02/55/93/566025593.db2.gz FMATUTVCIBJDRS-OCCSQVGLSA-N 0 3 379.291 3.488 10 0 GGAEHN O=S(=O)(c1ccc(Cl)nc1Cl)N1CC[C@H]2[C@@H](CCCN2C2CC2)C1 ZINC000246380248 566027362 /nfs/dbraw/zinc/02/73/62/566027362.db2.gz OPIFLVJMMVPIQK-AAEUAGOBSA-N 0 3 390.336 3.026 10 0 GGAEHN CN1CCC[C@H](CNC(=O)NC[C@H](O)c2ccsc2)[C@H]1c1cccs1 ZINC000246429795 566028795 /nfs/dbraw/zinc/02/87/95/566028795.db2.gz SWQGSYSHJXDRTB-KMFMINBZSA-N 0 3 379.551 3.225 10 0 GGAEHN CC(C)N1C[C@H](C)[C@H](NC(=O)C(=O)Nc2cc(Cl)c(Cl)cc2Cl)C1 ZINC000246478282 566030987 /nfs/dbraw/zinc/03/09/87/566030987.db2.gz QNBMFZQRNKVRIG-LKFCYVNXSA-N 0 3 392.714 3.430 10 0 GGAEHN COCc1c(Br)cccc1NC(=O)N[C@@H]1CN(C(C)C)C[C@H]1C ZINC000246536212 566032461 /nfs/dbraw/zinc/03/24/61/566032461.db2.gz VEJLCQYCBBJVGM-MLGOLLRUSA-N 0 3 384.318 3.446 10 0 GGAEHN CC(C)c1csc([C@H]2CCCN(C[C@H]3CCCN(S(C)(=O)=O)C3)C2)n1 ZINC000246578010 566033849 /nfs/dbraw/zinc/03/38/49/566033849.db2.gz WNVVYLREUXWOSO-CVEARBPZSA-N 0 3 385.599 3.118 10 0 GGAEHN CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccc([O-])c(Br)c2)[C@@H](C)C1 ZINC000246570555 566034096 /nfs/dbraw/zinc/03/40/96/566034096.db2.gz YLWHCYXCOVTYLX-WFASDCNBSA-N 0 3 384.318 3.026 10 0 GGAEHN CC[N@H+]1CC[C@H](N(C)C(=O)NCc2ccc([O-])c(Br)c2)[C@@H](C)C1 ZINC000246570555 566034101 /nfs/dbraw/zinc/03/41/01/566034101.db2.gz YLWHCYXCOVTYLX-WFASDCNBSA-N 0 3 384.318 3.026 10 0 GGAEHN CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2ccc([O-])c(Br)c2)[C@@H](C)C1 ZINC000246570549 566034228 /nfs/dbraw/zinc/03/42/28/566034228.db2.gz YLWHCYXCOVTYLX-SWLSCSKDSA-N 0 3 384.318 3.026 10 0 GGAEHN CC[N@H+]1CC[C@@H](N(C)C(=O)NCc2ccc([O-])c(Br)c2)[C@@H](C)C1 ZINC000246570549 566034234 /nfs/dbraw/zinc/03/42/34/566034234.db2.gz YLWHCYXCOVTYLX-SWLSCSKDSA-N 0 3 384.318 3.026 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(Cl)c(OC(F)F)c1 ZINC000180133016 566035122 /nfs/dbraw/zinc/03/51/22/566035122.db2.gz QJUYUPOUHKLYLH-GFCCVEGCSA-N 0 3 377.819 3.174 10 0 GGAEHN CN(Cc1cc(Br)ccc1F)C(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C ZINC000364123103 566035997 /nfs/dbraw/zinc/03/59/97/566035997.db2.gz VRIKEWORJQFTOT-DDUZABMNSA-N 0 3 399.304 3.079 10 0 GGAEHN CN(Cc1cc(Br)ccc1F)C(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C ZINC000364123108 566036294 /nfs/dbraw/zinc/03/62/94/566036294.db2.gz VRIKEWORJQFTOT-JCKWVBRZSA-N 0 3 399.304 3.079 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)Cc2ccc(Cl)c(Cl)c2)[C@@H](C)C1 ZINC000246698682 566036620 /nfs/dbraw/zinc/03/66/20/566036620.db2.gz ZGRLURAPVCYLLL-LRDDRELGSA-N 0 3 379.353 3.485 10 0 GGAEHN CCc1cnc(CCNCc2c(Cl)cccc2N2CCN(C)CC2)s1 ZINC000180145912 566037545 /nfs/dbraw/zinc/03/75/45/566037545.db2.gz UUPDYKXPIRTGDM-UHFFFAOYSA-N 0 3 378.973 3.443 10 0 GGAEHN C[C@@H](N[C@@H]1CCc2c1cccc2Br)c1ccc(S(N)(=O)=O)cc1 ZINC000180165801 566040065 /nfs/dbraw/zinc/04/00/65/566040065.db2.gz KTGUJSXSFOUFOH-PIGZYNQJSA-N 0 3 395.322 3.435 10 0 GGAEHN C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cc2c(cc(Br)cc2F)[nH]1 ZINC000246770738 566041340 /nfs/dbraw/zinc/04/13/40/566041340.db2.gz AWKRYEABENXYLG-PWSUYJOCSA-N 0 3 380.261 3.378 10 0 GGAEHN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)N[C@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000180179664 566041318 /nfs/dbraw/zinc/04/13/18/566041318.db2.gz FIPQALNQDXVLRB-VFVRVIDISA-N 0 3 382.913 3.414 10 0 GGAEHN C[C@H]1CN2CCC[C@H]2CN1Cc1nc(Cc2cccc(Br)c2)no1 ZINC000246809583 566042985 /nfs/dbraw/zinc/04/29/85/566042985.db2.gz CBERCYMUCLCDIV-BBRMVZONSA-N 0 3 391.313 3.091 10 0 GGAEHN Cc1cnn([C@@H]2CCCN(C[C@@H](O)COc3cccc(Br)c3)C2)c1 ZINC000246946229 566047143 /nfs/dbraw/zinc/04/71/43/566047143.db2.gz BEOQJFBOKBVMGO-IAGOWNOFSA-N 0 3 394.313 3.031 10 0 GGAEHN C[C@H](NC[C@](C)(O)c1ccc(S(C)(=O)=O)cc1)c1ccc(F)c(Cl)c1 ZINC000180246104 566047766 /nfs/dbraw/zinc/04/77/66/566047766.db2.gz XNDKPJPUYZVNFF-SGTLLEGYSA-N 0 3 385.888 3.441 10 0 GGAEHN C[C@@H](NC[C@](C)(O)c1ccc(S(C)(=O)=O)cc1)c1ccc(F)c(Cl)c1 ZINC000180246123 566048170 /nfs/dbraw/zinc/04/81/70/566048170.db2.gz XNDKPJPUYZVNFF-XIKOKIGWSA-N 0 3 385.888 3.441 10 0 GGAEHN FC(F)(F)c1nc(N2CCN(C[C@H]3CCOC3)CC2)ccc1Br ZINC000287979579 566050738 /nfs/dbraw/zinc/05/07/38/566050738.db2.gz UWIFZPJQJFBVNC-LLVKDONJSA-N 0 3 394.235 3.021 10 0 GGAEHN Cc1ccc(I)c(C(=O)N(C)[C@@H]2CCN(C)C[C@H]2C)c1 ZINC000247361470 566058547 /nfs/dbraw/zinc/05/85/47/566058547.db2.gz KDWYQASBGFCEIE-IUODEOHRSA-N 0 3 386.277 3.012 10 0 GGAEHN Cc1sc2ncnc(SCC(=O)N(C)[C@H]3CCN(C)[C@@H](C)C3)c2c1C ZINC000247479768 566061006 /nfs/dbraw/zinc/06/10/06/566061006.db2.gz SQYSOTWYDDVWBA-FZMZJTMJSA-N 0 3 378.567 3.341 10 0 GGAEHN C[C@@H]1CN2CCC[C@H]2CN1Cc1nnc(-c2ccccc2Br)o1 ZINC000247478033 566061464 /nfs/dbraw/zinc/06/14/64/566061464.db2.gz SJUMBQHLCUTQCA-OLZOCXBDSA-N 0 3 377.286 3.168 10 0 GGAEHN CN1CC[C@H]2[C@H](CCCN2C(=O)c2c[nH]c3cccc(Br)c23)C1 ZINC000180423181 566061706 /nfs/dbraw/zinc/06/17/06/566061706.db2.gz NHVLUSNVAOOUMR-WBMJQRKESA-N 0 3 376.298 3.487 10 0 GGAEHN O=C(c1ccc(Br)cc1C(F)(F)F)N1CCN2CCC[C@H]2C1 ZINC000180449207 566063028 /nfs/dbraw/zinc/06/30/28/566063028.db2.gz HWXMBHYPMUNJIB-NSHDSACASA-N 0 3 377.204 3.388 10 0 GGAEHN C[C@H](NC(=O)C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1)c1cccc(Cl)c1Cl ZINC000288241877 566064057 /nfs/dbraw/zinc/06/40/57/566064057.db2.gz QPODXMYGBMSLCL-AGIUHOORSA-N 0 3 386.323 3.112 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(C)ccc2Br)[C@@H](C)C1 ZINC000247689889 566064972 /nfs/dbraw/zinc/06/49/72/566064972.db2.gz QPIOSYBCDGKIQJ-DZGCQCFKSA-N 0 3 389.359 3.108 10 0 GGAEHN CC[C@@H]1CN(CCC(=O)Nc2c(Cl)cccc2Cl)CCN1C[C@H](C)O ZINC000247806958 566066481 /nfs/dbraw/zinc/06/64/81/566066481.db2.gz SYDREPRJGHLYFJ-UONOGXRCSA-N 0 3 388.339 3.099 10 0 GGAEHN Cc1c([C@H](C)NC[C@H]2CN(C)CCO2)cnn1-c1ccc(Cl)cc1Cl ZINC000180501447 566067552 /nfs/dbraw/zinc/06/75/52/566067552.db2.gz GNCXAANBDABGFB-WFASDCNBSA-N 0 3 383.323 3.469 10 0 GGAEHN Cc1c([C@@H](C)NC[C@@H]2CN(C)CCO2)cnn1-c1ccc(Cl)cc1Cl ZINC000180501388 566067818 /nfs/dbraw/zinc/06/78/18/566067818.db2.gz GNCXAANBDABGFB-IUODEOHRSA-N 0 3 383.323 3.469 10 0 GGAEHN CN(Cc1ccc(Br)cc1F)C1CCN(c2cnccn2)CC1 ZINC000364816522 566070409 /nfs/dbraw/zinc/07/04/09/566070409.db2.gz GZDDFTFRDCZMMG-UHFFFAOYSA-N 0 3 379.277 3.479 10 0 GGAEHN CS(=O)(=O)N1CCC[C@@H](CN[C@@H](CC(F)(F)F)c2ccc(F)cc2)C1 ZINC000180566159 566073950 /nfs/dbraw/zinc/07/39/50/566073950.db2.gz HZCDPCHVWXIDIP-WFASDCNBSA-N 0 3 382.423 3.080 10 0 GGAEHN CCc1nc2n(n1)C[C@@H](N[C@@H]1CCCOc3ccc(Br)cc31)CC2 ZINC000180612342 566076591 /nfs/dbraw/zinc/07/65/91/566076591.db2.gz PFXQZVHABJVMJB-DZGCQCFKSA-N 0 3 391.313 3.421 10 0 GGAEHN CCc1nc2n(n1)C[C@H](N[C@@H]1CCCOc3ccc(Br)cc31)CC2 ZINC000180612323 566077129 /nfs/dbraw/zinc/07/71/29/566077129.db2.gz PFXQZVHABJVMJB-UKRRQHHQSA-N 0 3 391.313 3.421 10 0 GGAEHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1n[nH]c2ccc(Br)cc21 ZINC000288511461 566078146 /nfs/dbraw/zinc/07/81/46/566078146.db2.gz STDXVWRAQDADEW-YPMHNXCESA-N 0 3 377.286 3.024 10 0 GGAEHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1n[nH]c2ccc(Br)cc21 ZINC000288511452 566078236 /nfs/dbraw/zinc/07/82/36/566078236.db2.gz STDXVWRAQDADEW-DGCLKSJQSA-N 0 3 377.286 3.024 10 0 GGAEHN CC[C@@H]1CN(CCCc2ccc(Br)cc2OC)CCN1C[C@H](C)O ZINC000248455167 566078389 /nfs/dbraw/zinc/07/83/89/566078389.db2.gz KTXKNKXBSMUDFP-MAUKXSAKSA-N 0 3 399.373 3.167 10 0 GGAEHN C[C@@H](NCCS(=O)(=O)NCC1CCC1)[C@@H](C)c1nc2ccccc2s1 ZINC000180719720 566084344 /nfs/dbraw/zinc/08/43/44/566084344.db2.gz CWNXMVYJHGHBFS-ZIAGYGMSSA-N 0 3 381.567 3.097 10 0 GGAEHN CCN1CCC[C@H](NC(=O)N[C@H](C)c2ccc(Br)cc2OC)C1 ZINC000248689748 566086447 /nfs/dbraw/zinc/08/64/47/566086447.db2.gz ITSPCJSLUGIALD-OCCSQVGLSA-N 0 3 384.318 3.302 10 0 GGAEHN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1ncsc1Br ZINC000288687624 566086600 /nfs/dbraw/zinc/08/66/00/566086600.db2.gz QVSMNIGIGRVFSR-CYBMUJFWSA-N 0 3 380.311 3.473 10 0 GGAEHN Cc1csc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1I ZINC000248710172 566086997 /nfs/dbraw/zinc/08/69/97/566086997.db2.gz PTKARVCXFWIUBD-QWRGUYRKSA-N 0 3 392.306 3.216 10 0 GGAEHN CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)c1ncsc1Br ZINC000288736813 566089052 /nfs/dbraw/zinc/08/90/52/566089052.db2.gz BTTYADSBOCLQAB-AWEZNQCLSA-N 0 3 394.338 3.500 10 0 GGAEHN O=C(NC1CCN(Cc2ccccc2)CC1)c1ncsc1Br ZINC000288788604 566090952 /nfs/dbraw/zinc/09/09/52/566090952.db2.gz ZBIHAOIGCBVWES-UHFFFAOYSA-N 0 3 380.311 3.300 10 0 GGAEHN COC(=O)c1cccc(NC(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1Br ZINC000248981444 566093983 /nfs/dbraw/zinc/09/39/83/566093983.db2.gz FPKIBFWUBVLPIY-SMDDNHRTSA-N 0 3 398.301 3.086 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(C)cc(Br)c2)[C@@H](C)C1 ZINC000249062365 566095925 /nfs/dbraw/zinc/09/59/25/566095925.db2.gz HIAGHSKINUYQMN-BBRMVZONSA-N 0 3 389.359 3.108 10 0 GGAEHN C[C@H](C(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1)N(C)CC(F)(F)F ZINC000249158032 566098199 /nfs/dbraw/zinc/09/81/99/566098199.db2.gz XPWXTVMAYSDLHP-VNHYZAJKSA-N 0 3 377.476 3.130 10 0 GGAEHN C[C@@H]1CN(C(=O)c2c(Cl)cc(F)cc2Cl)CC[C@@H]1N1CCN(C)CC1 ZINC000365397275 566098862 /nfs/dbraw/zinc/09/88/62/566098862.db2.gz VGZXNDMAKUBEMD-WBMJQRKESA-N 0 3 388.314 3.231 10 0 GGAEHN CC[C@H](CN(C)C[C@@H](O)CN1CCCC1=O)Oc1ccc(Cl)c(Cl)c1 ZINC000249284326 566100747 /nfs/dbraw/zinc/10/07/47/566100747.db2.gz LINMJVSKQWFXLO-ZIAGYGMSSA-N 0 3 389.323 3.066 10 0 GGAEHN COCc1nc2n(n1)C[C@H](N[C@@H](C)c1ccc(Br)c(C)c1)CC2 ZINC000180940109 566101425 /nfs/dbraw/zinc/10/14/25/566101425.db2.gz CGUNUODRRCZRGM-GXTWGEPZSA-N 0 3 379.302 3.161 10 0 GGAEHN COCc1nc2n(n1)C[C@@H](N[C@@H](C)c1ccc(Br)c(C)c1)CC2 ZINC000180940149 566101568 /nfs/dbraw/zinc/10/15/68/566101568.db2.gz CGUNUODRRCZRGM-JSGCOSHPSA-N 0 3 379.302 3.161 10 0 GGAEHN COc1cc(Br)ccc1CN[C@H]1CCCN(c2cccnn2)C1 ZINC000180934784 566101607 /nfs/dbraw/zinc/10/16/07/566101607.db2.gz CLAVMGVQMVIJGC-HNNXBMFYSA-N 0 3 377.286 3.006 10 0 GGAEHN CC[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc(CC(F)(F)F)cc1 ZINC000249395451 566101814 /nfs/dbraw/zinc/10/18/14/566101814.db2.gz GUAAHRZCNRELMQ-GJZGRUSLSA-N 0 3 376.444 3.039 10 0 GGAEHN Cc1ccc(Cl)c(OC[C@H](O)CN2C[C@@H](c3ccsc3)[C@H](CO)C2)c1 ZINC000249564582 566104461 /nfs/dbraw/zinc/10/44/61/566104461.db2.gz MSROSZSBXRUKDP-BBWFWOEESA-N 0 3 381.925 3.158 10 0 GGAEHN CCN1CCC[C@H](NC(=O)N2CCO[C@@H](c3cccc(Br)c3)C2)C1 ZINC000249725585 566106408 /nfs/dbraw/zinc/10/64/08/566106408.db2.gz LTOKFVNRXGYZDJ-DLBZAZTESA-N 0 3 396.329 3.016 10 0 GGAEHN O=C(NCc1ccc(Cl)cn1)NCC1(N2CCSCC2)CCCCC1 ZINC000181025513 566107401 /nfs/dbraw/zinc/10/74/01/566107401.db2.gz QIIVGCSDKJKLHA-UHFFFAOYSA-N 0 3 382.961 3.286 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)NC[C@@]2(C)CCCS2)C1 ZINC000251716811 566111815 /nfs/dbraw/zinc/11/18/15/566111815.db2.gz LCAKCMNAPNYERY-MAUKXSAKSA-N 0 3 382.599 3.201 10 0 GGAEHN O[C@@H](CNc1nccc(-c2sccc2Br)n1)CN1CCCCC1 ZINC000252499275 566114051 /nfs/dbraw/zinc/11/40/51/566114051.db2.gz RYCHSEUNOVPNPB-LBPRGKRZSA-N 0 3 397.342 3.226 10 0 GGAEHN CN1CC[C@H]2CCN(C(=O)CCCOc3ccccc3Br)[C@H]2C1 ZINC000252513172 566114153 /nfs/dbraw/zinc/11/41/53/566114153.db2.gz XUVWVRZVZAWBGP-HOCLYGCPSA-N 0 3 381.314 3.161 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)N2CCO[C@@H](c3ccc(Br)cc3)C2)C1 ZINC000253358396 566118322 /nfs/dbraw/zinc/11/83/22/566118322.db2.gz ORCSKBHTXUBZPH-IAGOWNOFSA-N 0 3 396.329 3.016 10 0 GGAEHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000253544310 566119378 /nfs/dbraw/zinc/11/93/78/566119378.db2.gz QHPCTXIBWXRKAA-BDJLRTHQSA-N 0 3 392.297 3.115 10 0 GGAEHN CCN1CCC[C@H]1CN(Cc1c(Br)cnn1C)Cc1ccncc1 ZINC000289373969 566119859 /nfs/dbraw/zinc/11/98/59/566119859.db2.gz BOINRHNUKOXKLB-INIZCTEOSA-N 0 3 392.345 3.064 10 0 GGAEHN C[C@H]1CN(C)CC[C@H]1N(C)C(=O)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000253544311 566119790 /nfs/dbraw/zinc/11/97/90/566119790.db2.gz QHPCTXIBWXRKAA-MEDUHNTESA-N 0 3 392.297 3.115 10 0 GGAEHN O[C@H](CSc1ncccc1Br)CN1CCc2ccccc2C1 ZINC000181153097 566120731 /nfs/dbraw/zinc/12/07/31/566120731.db2.gz KBVPMKGLCWEJPN-HNNXBMFYSA-N 0 3 379.323 3.355 10 0 GGAEHN CN(Cc1ccccc1)C[C@@H](O)CN(C)Cc1ccccc1Br ZINC000261406991 566123899 /nfs/dbraw/zinc/12/38/99/566123899.db2.gz LVQOROAVPPDHTL-GOSISDBHSA-N 0 3 377.326 3.374 10 0 GGAEHN CN(C)C[C@H]1CN(C(=O)Nc2cccc(Cl)c2SCC(F)F)CCO1 ZINC000181213826 566124773 /nfs/dbraw/zinc/12/47/73/566124773.db2.gz KWSVFGWYRFBYKI-NSHDSACASA-N 0 3 393.887 3.492 10 0 GGAEHN C[C@H](NC(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C)c1ccccc1Br ZINC000261644741 566128125 /nfs/dbraw/zinc/12/81/25/566128125.db2.gz FFIWZLGWGPELPR-KSBHJAGGSA-N 0 3 381.314 3.159 10 0 GGAEHN CC(C)c1cc(Br)ccc1NC(=O)N1CCO[C@H](CN(C)C)C1 ZINC000181285306 566129802 /nfs/dbraw/zinc/12/98/02/566129802.db2.gz XPLQTRWTYPQXJV-CQSZACIVSA-N 0 3 384.318 3.367 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)[C@](C)(N)c1ccc(Br)cc1 ZINC000261702336 566130698 /nfs/dbraw/zinc/13/06/98/566130698.db2.gz IOFLMCLZTWJKTR-QWQRMKEZSA-N 0 3 382.346 3.002 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)[C@@](C)(N)c1ccc(Br)cc1 ZINC000261702330 566130905 /nfs/dbraw/zinc/13/09/05/566130905.db2.gz IOFLMCLZTWJKTR-IYOUNJFTSA-N 0 3 382.346 3.002 10 0 GGAEHN CCNC(=O)N1CC[C@@H](N[C@H]2CCCOc3ccc(Br)cc32)C1 ZINC000181329436 566132072 /nfs/dbraw/zinc/13/20/72/566132072.db2.gz FBAGAHCBUSOUNR-HIFRSBDPSA-N 0 3 382.302 3.056 10 0 GGAEHN N[C@@H](C(=O)Nc1cc(Br)cc(C(F)(F)F)c1)C1CCOCC1 ZINC000261760264 566133094 /nfs/dbraw/zinc/13/30/94/566133094.db2.gz LTBFGGZVTGXKEN-GFCCVEGCSA-N 0 3 381.192 3.160 10 0 GGAEHN Cc1nc(NC(=O)[C@H](N)C2CCOCC2)sc1Cc1cccc(Cl)c1 ZINC000261760245 566133557 /nfs/dbraw/zinc/13/35/57/566133557.db2.gz LSVJBZWMFQWZDN-MRXNPFEDSA-N 0 3 379.913 3.388 10 0 GGAEHN CCNC(=O)N1CC[C@H](N[C@@H](CCCOC)c2ccc(Br)cc2)C1 ZINC000181330909 566133638 /nfs/dbraw/zinc/13/36/38/566133638.db2.gz XMJRLJJGOCRDJP-IRXDYDNUSA-N 0 3 398.345 3.310 10 0 GGAEHN CCNC(=O)N1CC[C@H](N[C@H]2CCSc3ccc(Br)cc32)C1 ZINC000181335262 566133952 /nfs/dbraw/zinc/13/39/52/566133952.db2.gz YBVXGEOSGREYFO-JSGCOSHPSA-N 0 3 384.343 3.379 10 0 GGAEHN COc1cc(Br)c(CN2CCNC[C@H]2c2cccnc2)cc1OC ZINC000261794902 566134616 /nfs/dbraw/zinc/13/46/16/566134616.db2.gz QKTNYCUTKRIPAX-INIZCTEOSA-N 0 3 392.297 3.008 10 0 GGAEHN Brc1ccc(-c2c[nH]c(CN3CCNC[C@H]3c3cccnc3)n2)cc1 ZINC000261787511 566135094 /nfs/dbraw/zinc/13/50/94/566135094.db2.gz UOVGAZOVCKVHHO-SFHVURJKSA-N 0 3 398.308 3.381 10 0 GGAEHN Cc1sc([C@H](C)NC(=O)C2(N)CCOCC2)nc1-c1ccc(Cl)cc1 ZINC000261862057 566137347 /nfs/dbraw/zinc/13/73/47/566137347.db2.gz NHPOYQUHNHPCOT-NSHDSACASA-N 0 3 379.913 3.457 10 0 GGAEHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)C1(N)CCOCC1 ZINC000261915059 566140644 /nfs/dbraw/zinc/14/06/44/566140644.db2.gz UHAJTQBAYRSAHC-LBPRGKRZSA-N 0 3 379.913 3.457 10 0 GGAEHN CSC1(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCC1 ZINC000366206000 566141873 /nfs/dbraw/zinc/14/18/73/566141873.db2.gz WGONNSFGNZOOLR-UHFFFAOYSA-N 0 3 379.492 3.377 10 0 GGAEHN CC1(C)CN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)CCS1 ZINC000366229474 566142684 /nfs/dbraw/zinc/14/26/84/566142684.db2.gz IVYVVKLAYCXDDO-UHFFFAOYSA-N 0 3 379.492 3.329 10 0 GGAEHN C[C@H](NC(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C)c1ccc(Br)cc1 ZINC000261970150 566143357 /nfs/dbraw/zinc/14/33/57/566143357.db2.gz YWPWHFDKUYMFFQ-FGVQXAILSA-N 0 3 381.314 3.159 10 0 GGAEHN CCS(=O)(=O)c1c(Cl)cccc1CN(CCN)CCc1ccccc1 ZINC000262089343 566145168 /nfs/dbraw/zinc/14/51/68/566145168.db2.gz URFSSWIFUZHZLV-UHFFFAOYSA-N 0 3 380.941 3.137 10 0 GGAEHN O=C(NCCSC(F)(F)F)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000366306342 566146545 /nfs/dbraw/zinc/14/65/45/566146545.db2.gz UNFNOVLHXFSCRZ-UHFFFAOYSA-N 0 3 393.397 3.344 10 0 GGAEHN C[C@@H](NCCOc1cc(Cl)ccc1Cl)c1ccc(S(N)(=O)=O)cc1 ZINC000181563935 566149007 /nfs/dbraw/zinc/14/90/07/566149007.db2.gz BZGVJDXNCFSQQE-LLVKDONJSA-N 0 3 389.304 3.370 10 0 GGAEHN O=C(CCN1CCNC[C@@H]1c1cccnc1)Nc1cc(Cl)ccc1Cl ZINC000262314038 566149738 /nfs/dbraw/zinc/14/97/38/566149738.db2.gz ZJRTUWREZDJYFY-QGZVFWFLSA-N 0 3 379.291 3.364 10 0 GGAEHN CN(Cc1cc(Br)cs1)C(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C ZINC000262401696 566152120 /nfs/dbraw/zinc/15/21/20/566152120.db2.gz CHGFFOQJBAQSSY-HEHGZKQESA-N 0 3 387.343 3.002 10 0 GGAEHN O=S(=O)(Cc1ccc(Cl)cc1Cl)N1CC[C@@H](CN2CCCC2)C1 ZINC000181658264 566155957 /nfs/dbraw/zinc/15/59/57/566155957.db2.gz XFNNMHUCCOPHIW-ZDUSSCGKSA-N 0 3 377.337 3.241 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)Cc2ccc(Cl)cc2Cl)[C@H](C)C1 ZINC000181664681 566156178 /nfs/dbraw/zinc/15/61/78/566156178.db2.gz RQJQZDCGVPQCOO-WBMJQRKESA-N 0 3 379.353 3.485 10 0 GGAEHN COC[C@@H](NC[C@H](O)COc1ccc(Br)cc1)c1ccccc1 ZINC000181683162 566158306 /nfs/dbraw/zinc/15/83/06/566158306.db2.gz YTOMWUHFQLPLGY-FUHWJXTLSA-N 0 3 380.282 3.166 10 0 GGAEHN C[C@H](CN1CCN(C)CC1)N[C@H](C)c1cc2cc(Br)ccc2o1 ZINC000181720960 566162119 /nfs/dbraw/zinc/16/21/19/566162119.db2.gz WYBAZQOCXCZFGR-ZIAGYGMSSA-N 0 3 380.330 3.482 10 0 GGAEHN CC[C@H]1CN(CCCc2ccc(Br)cc2OC)CCN1CCOC ZINC000181818972 566167084 /nfs/dbraw/zinc/16/70/84/566167084.db2.gz LRFYUOWEHNEXKV-SFHVURJKSA-N 0 3 399.373 3.433 10 0 GGAEHN COc1cc(Br)ccc1CCCN1CCC[C@@H](n2cncn2)C1 ZINC000181853409 566169483 /nfs/dbraw/zinc/16/94/83/566169483.db2.gz IQKZSTAABDNAJH-MRXNPFEDSA-N 0 3 379.302 3.319 10 0 GGAEHN N[C@@H](CNC(=O)NCC1(c2cccc(Br)c2)CC1)c1ccccc1 ZINC000417656268 566169596 /nfs/dbraw/zinc/16/95/96/566169596.db2.gz GGEPMBSDKIICDR-KRWDZBQOSA-N 0 3 388.309 3.480 10 0 GGAEHN N[C@H](CNC(=O)NCC1(c2cccc(Br)c2)CC1)c1ccccc1 ZINC000417656269 566170000 /nfs/dbraw/zinc/17/00/00/566170000.db2.gz GGEPMBSDKIICDR-QGZVFWFLSA-N 0 3 388.309 3.480 10 0 GGAEHN Cn1ncc(Br)c1CN(Cc1ccccc1)C1CCN(C)CC1 ZINC000290432467 566172512 /nfs/dbraw/zinc/17/25/12/566172512.db2.gz LKSNQFOKONPNKE-UHFFFAOYSA-N 0 3 377.330 3.279 10 0 GGAEHN C[C@@H](CNC(=O)NC[C@H](N)c1ccccc1)Oc1ccc(Br)cc1 ZINC000417774026 566176114 /nfs/dbraw/zinc/17/61/14/566176114.db2.gz KHAXEMYLVMJMQO-GUYCJALGSA-N 0 3 392.297 3.216 10 0 GGAEHN C[C@@H](Cc1ccccc1Br)NC(=O)NC[C@H](N)c1ccccc1 ZINC000417895852 566179205 /nfs/dbraw/zinc/17/92/05/566179205.db2.gz QHFBSTQYLBQCGB-GUYCJALGSA-N 0 3 376.298 3.379 10 0 GGAEHN CN(C)C(=O)c1ccccc1CNCCOc1ccc(Br)cc1 ZINC000417905846 566180183 /nfs/dbraw/zinc/18/01/83/566180183.db2.gz ARQKEPZLXSUHAQ-UHFFFAOYSA-N 0 3 377.282 3.320 10 0 GGAEHN C[C@@H](N[C@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccccc1Br ZINC000182070844 566180638 /nfs/dbraw/zinc/18/06/38/566180638.db2.gz AVWIWAYXZYQPKT-MLGOLLRUSA-N 0 3 396.329 3.190 10 0 GGAEHN OC[C@H](CNCc1ccc(F)cc1I)c1ccccc1 ZINC000417921688 566181344 /nfs/dbraw/zinc/18/13/44/566181344.db2.gz BLFPAHMAWGSHLK-AWEZNQCLSA-N 0 3 385.220 3.296 10 0 GGAEHN COc1cccc(CCNCc2ccc(F)cc2I)n1 ZINC000417939529 566182930 /nfs/dbraw/zinc/18/29/30/566182930.db2.gz WFXIXUZWIKOVJP-UHFFFAOYSA-N 0 3 386.208 3.166 10 0 GGAEHN CCCOC[C@@H](Cc1cccc(Br)c1)NCc1cnnn1CC ZINC000418018377 566190038 /nfs/dbraw/zinc/19/00/38/566190038.db2.gz ZXAXOECKMUQWDZ-MRXNPFEDSA-N 0 3 381.318 3.188 10 0 GGAEHN Cc1cccc(CNC(=O)NCCCNCc2cccnc2)c1Br ZINC000418054546 566193579 /nfs/dbraw/zinc/19/35/79/566193579.db2.gz GTJIALGTRDAWSV-UHFFFAOYSA-N 0 3 391.313 3.132 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)CSc1nnc(-c2ccc(Cl)cc2)o1 ZINC000263900769 566199698 /nfs/dbraw/zinc/19/96/98/566199698.db2.gz DIVWAUYNRKZVGS-CQSZACIVSA-N 0 3 380.901 3.035 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)CSc1nnc(-c2ccc(Cl)cc2)o1 ZINC000263900765 566199850 /nfs/dbraw/zinc/19/98/50/566199850.db2.gz DIVWAUYNRKZVGS-AWEZNQCLSA-N 0 3 380.901 3.035 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)COc1ccc(C2SCCCS2)cc1 ZINC000263913553 566199964 /nfs/dbraw/zinc/19/99/64/566199964.db2.gz NFSRKQKBGMKVPM-INIZCTEOSA-N 0 3 380.579 3.487 10 0 GGAEHN CC[C@@H](N[C@@H]1CCN(C2CCOCC2)C1=O)c1cccc(Br)c1 ZINC000367412546 566200588 /nfs/dbraw/zinc/20/05/88/566200588.db2.gz KHAGRUXFYDPLRO-IAGOWNOFSA-N 0 3 381.314 3.270 10 0 GGAEHN CN1CC[C@H]2[C@H](CCCN2C(=O)NCc2cc(F)cc(Br)c2)C1 ZINC000182435110 566204380 /nfs/dbraw/zinc/20/43/80/566204380.db2.gz LBFNIXOOXPCOHW-CJNGLKHVSA-N 0 3 384.293 3.214 10 0 GGAEHN Cc1ccc(Br)cc1NC(=O)CCN[C@@H]1CCCc2n[nH]cc21 ZINC000367525053 566205407 /nfs/dbraw/zinc/20/54/07/566205407.db2.gz DLMDCAKEPKBCFT-CQSZACIVSA-N 0 3 377.286 3.476 10 0 GGAEHN CN(Cc1csc(Br)c1)C(=O)NCCCNCc1cccnc1 ZINC000418334963 566210296 /nfs/dbraw/zinc/21/02/96/566210296.db2.gz YGCMTDZTNUQZFZ-UHFFFAOYSA-N 0 3 397.342 3.227 10 0 GGAEHN N[C@@H](CNC(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000418426301 566213446 /nfs/dbraw/zinc/21/34/46/566213446.db2.gz JIVQFYHCJOYTGP-KRWDZBQOSA-N 0 3 382.291 3.197 10 0 GGAEHN CCOc1cc(C[NH2+][C@@H]2CCN(c3ccccn3)C2)cc(Br)c1[O-] ZINC000291382859 566217814 /nfs/dbraw/zinc/21/78/14/566217814.db2.gz BHKBUVUGKQZKSN-CQSZACIVSA-N 0 3 392.297 3.317 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)Nc1ccc(Br)c(C(=O)OC)c1 ZINC000182640916 566217927 /nfs/dbraw/zinc/21/79/27/566217927.db2.gz DQJXAMDHGUJFEI-CYBMUJFWSA-N 0 3 398.301 3.184 10 0 GGAEHN COC(=O)c1cc(NC(=O)N[C@H]2CN(C(C)C)C[C@H]2C)ccc1Br ZINC000182642612 566218035 /nfs/dbraw/zinc/21/80/35/566218035.db2.gz PXUXTBHAKDSGET-ABAIWWIYSA-N 0 3 398.301 3.086 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)N1CCC[C@H]1c1cccc(Br)c1 ZINC000418741400 566222052 /nfs/dbraw/zinc/22/20/52/566222052.db2.gz ATPLGCZOSAUPIN-KBPBESRZSA-N 0 3 388.256 3.293 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)N1CCC[C@H]1c1ccc(Br)cc1 ZINC000418747188 566222173 /nfs/dbraw/zinc/22/21/73/566222173.db2.gz AFAWJKSUEYPNND-UONOGXRCSA-N 0 3 388.256 3.293 10 0 GGAEHN CCCN(Cc1ccccc1Br)C(=O)N[C@@H]1CNCCC1(F)F ZINC000418747275 566222191 /nfs/dbraw/zinc/22/21/91/566222191.db2.gz JGNFKDGARTYVQH-CQSZACIVSA-N 0 3 390.272 3.368 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)N1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000418745072 566222203 /nfs/dbraw/zinc/22/22/03/566222203.db2.gz GCTRSSOKOMDKFC-KBPBESRZSA-N 0 3 375.872 3.137 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)N1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000418751421 566222215 /nfs/dbraw/zinc/22/22/15/566222215.db2.gz RALATCBACCUUEU-ZIAGYGMSSA-N 0 3 375.872 3.213 10 0 GGAEHN OC[C@H](CN[C@@H]1CCCOc2c(Br)cccc21)c1cccnc1 ZINC000367905529 566222596 /nfs/dbraw/zinc/22/25/96/566222596.db2.gz XJPHSWSSFHARKO-WMLDXEAASA-N 0 3 377.282 3.424 10 0 GGAEHN C[C@H](c1ccccc1Br)N(C)C(=O)N[C@@H]1CNCCC1(F)F ZINC000418775932 566223244 /nfs/dbraw/zinc/22/32/44/566223244.db2.gz WQVBSRZDBUIUNQ-ZWNOBZJWSA-N 0 3 376.245 3.149 10 0 GGAEHN C[C@H](NCCOc1cc(Cl)cc(Cl)c1)c1ccc(S(N)(=O)=O)cc1 ZINC000182854338 566226524 /nfs/dbraw/zinc/22/65/24/566226524.db2.gz MIKMQBHKAMIHJQ-NSHDSACASA-N 0 3 389.304 3.370 10 0 GGAEHN C[C@@H](NCc1ccc(Cl)c2cccnc12)c1ccc(S(N)(=O)=O)cc1 ZINC000182858635 566226699 /nfs/dbraw/zinc/22/66/99/566226699.db2.gz MQLZGSKVKUTCPE-GFCCVEGCSA-N 0 3 375.881 3.386 10 0 GGAEHN CN1CC[C@H](NCc2cnc(C3OCCO3)s2)[C@H]1c1ccc(Cl)cc1 ZINC000368031504 566227711 /nfs/dbraw/zinc/22/77/11/566227711.db2.gz UJWQUDQEDIKNIA-JKSUJKDBSA-N 0 3 379.913 3.377 10 0 GGAEHN CN1CC[C@H](NCc2cnc(C3OCCO3)s2)[C@@H]1c1ccc(Cl)cc1 ZINC000368031502 566228131 /nfs/dbraw/zinc/22/81/31/566228131.db2.gz UJWQUDQEDIKNIA-HOTGVXAUSA-N 0 3 379.913 3.377 10 0 GGAEHN CN1CC[C@@H](NCC(=O)Nc2cccnc2Cl)[C@@H]1c1ccc(Cl)cc1 ZINC000368064152 566229021 /nfs/dbraw/zinc/22/90/21/566229021.db2.gz OWOIRDPZZXWSEN-PBHICJAKSA-N 0 3 379.291 3.362 10 0 GGAEHN O=C(CCN1CCC(c2ncc[nH]2)CC1)Nc1ccccc1Br ZINC000265468039 566237519 /nfs/dbraw/zinc/23/75/19/566237519.db2.gz HIRBEBWOVWTQCH-UHFFFAOYSA-N 0 3 377.286 3.380 10 0 GGAEHN O=C1C[C@@H]([C@@H]2CCCCN2Cc2nc3cc(Br)ccc3o2)CN1 ZINC000368505075 566240650 /nfs/dbraw/zinc/24/06/50/566240650.db2.gz UHHRCSIOCVUENL-RISCZKNCSA-N 0 3 378.270 3.081 10 0 GGAEHN CN1CCC[C@@H](NCc2ccc(S(N)(=O)=O)c(Cl)c2)c2ccccc21 ZINC000419705266 566242195 /nfs/dbraw/zinc/24/21/95/566242195.db2.gz AEAMCYRCJGDEGP-MRXNPFEDSA-N 0 3 379.913 3.048 10 0 GGAEHN NS(=O)(=O)c1ccc(CNC[C@H]2CCCCC2(F)F)cc1Br ZINC000419741193 566243582 /nfs/dbraw/zinc/24/35/82/566243582.db2.gz CBGKCQHSSZSUIA-LLVKDONJSA-N 0 3 397.285 3.012 10 0 GGAEHN CCN1CC[C@H](CNC(=O)[C@@H](C)CC(=O)c2cccc(Br)c2)C1 ZINC000265942783 566243929 /nfs/dbraw/zinc/24/39/29/566243929.db2.gz JRQZBGUJBYHXFS-UONOGXRCSA-N 0 3 381.314 3.116 10 0 GGAEHN CN1CCC[C@@H](CNC(=O)N2CCc3ncsc3C2)[C@@H]1c1cccs1 ZINC000368680287 566244287 /nfs/dbraw/zinc/24/42/87/566244287.db2.gz KYGPBDNJRFHOIB-SUMWQHHRSA-N 0 3 376.551 3.355 10 0 GGAEHN Cc1ccccc1[C@H](CC(F)(F)F)NC[C@H]1CCCN(S(C)(=O)=O)C1 ZINC000444784785 566251580 /nfs/dbraw/zinc/25/15/80/566251580.db2.gz OULNECMEDCQHCI-ZBFHGGJFSA-N 0 3 378.460 3.250 10 0 GGAEHN Brc1cncc(Br)c1CN1CC[C@@H]2COC[C@@H]2C1 ZINC000668704668 566257634 /nfs/dbraw/zinc/25/76/34/566257634.db2.gz BWXZIUACVRONRJ-ZJUUUORDSA-N 0 3 376.092 3.075 10 0 GGAEHN Cc1ccccc1[C@@H](CC(F)(F)F)NC[C@H]1CCCN(S(C)(=O)=O)C1 ZINC000444784779 566251822 /nfs/dbraw/zinc/25/18/22/566251822.db2.gz OULNECMEDCQHCI-GDBMZVCRSA-N 0 3 378.460 3.250 10 0 GGAEHN Cn1c(-c2ccc(Br)cc2)nnc1N1CC[C@H](N2CCCCC2)C1 ZINC000508960987 566252090 /nfs/dbraw/zinc/25/20/90/566252090.db2.gz LSLHEKLJSHFMJK-INIZCTEOSA-N 0 3 390.329 3.309 10 0 GGAEHN CN1CC[C@H](NC(=O)COc2ccc(Br)cc2)[C@@H]1c1ccccc1 ZINC000534756646 566253368 /nfs/dbraw/zinc/25/33/68/566253368.db2.gz XPHICRXUYLLOLZ-HKUYNNGSSA-N 0 3 389.293 3.390 10 0 GGAEHN CN1CC[C@@H](NC(=O)COc2ccc(Br)cc2)[C@@H]1c1ccccc1 ZINC000534756648 566253383 /nfs/dbraw/zinc/25/33/83/566253383.db2.gz XPHICRXUYLLOLZ-MJGOQNOKSA-N 0 3 389.293 3.390 10 0 GGAEHN OC[C@@H](CNCc1cnc(-c2ccc(Br)cc2)s1)[C@H]1CCOC1 ZINC000481811486 566253942 /nfs/dbraw/zinc/25/39/42/566253942.db2.gz BMHZLKLZYJCUIW-UONOGXRCSA-N 0 3 397.338 3.307 10 0 GGAEHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)c1[nH]nc2ccc(Br)cc21 ZINC000599352005 566254227 /nfs/dbraw/zinc/25/42/27/566254227.db2.gz HXAPGNYLYOWFOZ-VXGBXAGGSA-N 0 3 379.302 3.176 10 0 GGAEHN Cc1c2cc(Br)cc(C)c2oc1C(=O)NC[C@](C)(O)CCN(C)C ZINC000419971941 566256203 /nfs/dbraw/zinc/25/62/03/566256203.db2.gz FWTLKHXMFYWSNO-GOSISDBHSA-N 0 3 397.313 3.245 10 0 GGAEHN Cc1c2cc(Br)cc(C)c2oc1C(=O)NC[C@@](C)(O)CCN(C)C ZINC000419971942 566256304 /nfs/dbraw/zinc/25/63/04/566256304.db2.gz FWTLKHXMFYWSNO-SFHVURJKSA-N 0 3 397.313 3.245 10 0 GGAEHN OCC1(CO)CCN(Cc2ccc(-c3ccc(Br)cc3)s2)C1 ZINC000668665715 566256512 /nfs/dbraw/zinc/25/65/12/566256512.db2.gz BUXOWEDHTDATIC-UHFFFAOYSA-N 0 3 382.323 3.354 10 0 GGAEHN CCOCCOc1ccc(Br)cc1CN1CC[C@@H]2COC[C@@H]2C1 ZINC000668706254 566258103 /nfs/dbraw/zinc/25/81/03/566258103.db2.gz REWORSKVBBDEAO-ZBFHGGJFSA-N 0 3 384.314 3.333 10 0 GGAEHN CCOC(=O)C[C@H](O)CN[C@H](CC1CC1)c1cc(F)cc(Br)c1 ZINC000599377056 566258440 /nfs/dbraw/zinc/25/84/40/566258440.db2.gz GSNCBXDLHWSIHT-JKSUJKDBSA-N 0 3 388.277 3.333 10 0 GGAEHN CCOCCOc1ccc(Br)cc1CN1CC[C@H]2COC[C@@H]2C1 ZINC000668706253 566259282 /nfs/dbraw/zinc/25/92/82/566259282.db2.gz REWORSKVBBDEAO-HOCLYGCPSA-N 0 3 384.314 3.333 10 0 GGAEHN COc1cc(Br)c(CNCC2(CC(N)=O)CCCCC2)cc1O ZINC000668754568 566265778 /nfs/dbraw/zinc/26/57/78/566265778.db2.gz KHOHFXWHMVFPCC-UHFFFAOYSA-N 0 3 385.302 3.079 10 0 GGAEHN CCO[C@@H]1C[C@@H](N[C@H]2CCc3cc(Br)ccc3NC2=O)[C@@H]1SC ZINC000599451994 566266117 /nfs/dbraw/zinc/26/61/17/566266117.db2.gz LBOHPJIDLKFQSW-JJXSEGSLSA-N 0 3 399.354 3.201 10 0 GGAEHN C[C@H]1CN(CCCOc2cccc(I)c2)CCCO1 ZINC000556064726 566268421 /nfs/dbraw/zinc/26/84/21/566268421.db2.gz AVKLLEVCQOVMHR-ZDUSSCGKSA-N 0 3 375.250 3.171 10 0 GGAEHN C[NH+](C)[C@@H]1CCC[C@H]([N-]S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000509168832 566269183 /nfs/dbraw/zinc/26/91/83/566269183.db2.gz WLMKBDXWMWGVIF-WDEREUQCSA-N 0 3 395.750 3.254 10 0 GGAEHN COc1ccc(CCC(=O)N(C)C[C@H]2CCCN(C)C2)c(Br)c1 ZINC000668800226 566269836 /nfs/dbraw/zinc/26/98/36/566269836.db2.gz ZCQRENAIAKUOHD-AWEZNQCLSA-N 0 3 383.330 3.191 10 0 GGAEHN CSC[C@@H](C)NC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1nccs1 ZINC000599535892 566272394 /nfs/dbraw/zinc/27/23/94/566272394.db2.gz RVFPMTZTSKWKQG-DJIMGWMZSA-N 0 3 375.563 3.226 10 0 GGAEHN CN(C)Cc1ccc(S(=O)(=O)N(C)[C@H]2CCCC[C@H]2C(F)(F)F)cc1 ZINC000462285214 566275201 /nfs/dbraw/zinc/27/52/01/566275201.db2.gz GNGVNFNEEYNJJY-CVEARBPZSA-N 0 3 378.460 3.490 10 0 GGAEHN O=C(NC[C@H](c1cccs1)N1CCCC1)c1cc[nH]c(=O)c1Br ZINC000445250976 566276856 /nfs/dbraw/zinc/27/68/56/566276856.db2.gz PHWRZMZUNVHEQT-GFCCVEGCSA-N 0 3 396.310 3.178 10 0 GGAEHN CN1CC[C@@]2(CCN(C(=O)c3cc4c(cncc4Br)s3)C2)C1 ZINC000648400364 566278044 /nfs/dbraw/zinc/27/80/44/566278044.db2.gz PBMDMQGQMBLYFS-MRXNPFEDSA-N 0 3 380.311 3.227 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc3c(c(Cl)c2)O[C@@H](C)C3)[C@H](C)C1 ZINC000462302208 566278534 /nfs/dbraw/zinc/27/85/34/566278534.db2.gz MDWINGRGUDPXNX-IGCXYCKISA-N 0 3 386.945 3.014 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc3c(c(Cl)c2)O[C@H](C)C3)[C@@H](C)C1 ZINC000462302206 566278826 /nfs/dbraw/zinc/27/88/26/566278826.db2.gz MDWINGRGUDPXNX-AHIWAGSCSA-N 0 3 386.945 3.014 10 0 GGAEHN CCN1CCC(N(C)C(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)CC1 ZINC000625131995 566279069 /nfs/dbraw/zinc/27/90/69/566279069.db2.gz DYTFYQFIZRAGIX-CGTJXYLNSA-N 0 3 377.326 3.278 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(OC)c(Cl)c2Cl)[C@@H](C)C1 ZINC000462310472 566280332 /nfs/dbraw/zinc/28/03/32/566280332.db2.gz CSMBGMZHOJSUCK-NWDGAFQWSA-N 0 3 395.352 3.353 10 0 GGAEHN COC(=O)c1cc(Cl)cc(Cl)c1NC(=O)CN[C@H]1[C@@H](C)[C@H](C)O[C@H]1C ZINC000599625243 566280856 /nfs/dbraw/zinc/28/08/56/566280856.db2.gz HTDHGWANZUEGBQ-WSHGPQCASA-N 0 3 389.279 3.120 10 0 GGAEHN O=C([C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)N1CC[C@H](N2CCCC2)C1 ZINC000625135831 566281503 /nfs/dbraw/zinc/28/15/03/566281503.db2.gz GORVCBXZRGBWIE-LGRHPFTQSA-N 0 3 375.310 3.032 10 0 GGAEHN CN(CCCN1CCCC1)S(=O)(=O)c1c(Cl)cccc1Br ZINC000509262637 566283948 /nfs/dbraw/zinc/28/39/48/566283948.db2.gz IAOAASDDTPADMW-UHFFFAOYSA-N 0 3 395.750 3.209 10 0 GGAEHN CCN1CC[C@H](N(C)C(=O)c2nn(C(C)(C)C)cc2Br)[C@@H](C)C1 ZINC000669126235 566286025 /nfs/dbraw/zinc/28/60/25/566286025.db2.gz VGAWDLVDJANINC-JSGCOSHPSA-N 0 3 385.350 3.203 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000669118318 566286278 /nfs/dbraw/zinc/28/62/78/566286278.db2.gz LJVAQTOUEAOZAM-KDOFPFPSSA-N 0 3 394.357 3.462 10 0 GGAEHN COc1ccc(CCC(=O)N(C)[C@@H]2CCN(C)C[C@H]2C)c(Br)c1 ZINC000669119718 566286678 /nfs/dbraw/zinc/28/66/78/566286678.db2.gz GDAZMIGFSJDDPO-CXAGYDPISA-N 0 3 383.330 3.189 10 0 GGAEHN CN(C)[C@]1(CNCc2cn(-c3ccc(Cl)cc3Cl)nn2)CCSC1 ZINC000535200073 566287306 /nfs/dbraw/zinc/28/73/06/566287306.db2.gz IDLMIBGCFWLLAI-INIZCTEOSA-N 0 3 386.352 3.101 10 0 GGAEHN COC(=O)C1C[C@@H](C)N(CCC(=O)Nc2ccccc2Br)[C@H](C)C1 ZINC000599695409 566287647 /nfs/dbraw/zinc/28/76/47/566287647.db2.gz LWCPHLZJINIBRV-CHWSQXEVSA-N 0 3 397.313 3.440 10 0 GGAEHN COC(=O)[C@@H]1C[C@@H](C)N(CCC(=O)Nc2cccc(Br)c2)[C@@H](C)C1 ZINC000599699716 566287983 /nfs/dbraw/zinc/28/79/83/566287983.db2.gz YMUXWDWHPZPYCT-BTTYYORXSA-N 0 3 397.313 3.440 10 0 GGAEHN CN(C(=O)c1cc(Br)cc(N2CCCC2)c1)[C@H]1CCCN(C)C1 ZINC000669179106 566288477 /nfs/dbraw/zinc/28/84/77/566288477.db2.gz RGLHPFSJSRYIOE-INIZCTEOSA-N 0 3 380.330 3.216 10 0 GGAEHN COC(=O)C1C[C@@H](C)N(CCC(=O)Nc2ccc(Br)cc2)[C@H](C)C1 ZINC000599703486 566288666 /nfs/dbraw/zinc/28/86/66/566288666.db2.gz BNKILHCKJWVVAH-CHWSQXEVSA-N 0 3 397.313 3.440 10 0 GGAEHN COC(=O)C1C[C@H](C)N(C[C@@H](O)COc2ccc(Cl)cc2Cl)[C@@H](C)C1 ZINC000599710364 566289967 /nfs/dbraw/zinc/28/99/67/566289967.db2.gz QTJWHXQYOWBYKM-SLEUVZQESA-N 0 3 390.307 3.395 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2csc(N(C)c3ccccc3)n2)C[C@H]1N(C)C ZINC000599721739 566289980 /nfs/dbraw/zinc/28/99/80/566289980.db2.gz QZGLKHKEDKDRFA-HZPDHXFCSA-N 0 3 376.551 3.029 10 0 GGAEHN CN(CC1CCN(C)CC1)S(=O)(=O)c1cccc(Br)c1Cl ZINC000556364668 566290235 /nfs/dbraw/zinc/29/02/35/566290235.db2.gz HUQULIXTBMITQL-UHFFFAOYSA-N 0 3 395.750 3.065 10 0 GGAEHN CN(C(=O)Cc1c[nH]c2cc(Br)ccc12)[C@H]1CN2CCC1CC2 ZINC000482178386 566290300 /nfs/dbraw/zinc/29/03/00/566290300.db2.gz MQBHJCKRTRPPGU-KRWDZBQOSA-N 0 3 376.298 3.026 10 0 GGAEHN C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)N(C)[C@H]1CN2CCC1CC2 ZINC000482181314 566290792 /nfs/dbraw/zinc/29/07/92/566290792.db2.gz QYEDNGNRIXOLEV-SJCJKPOMSA-N 0 3 383.305 3.319 10 0 GGAEHN Cc1nc2ccc(Br)cc2c(NCC(=O)NCC(F)(F)F)c1C ZINC000462377620 566292280 /nfs/dbraw/zinc/29/22/80/566292280.db2.gz BQEKIQNANGDOLF-UHFFFAOYSA-N 0 3 390.203 3.126 10 0 GGAEHN CS[C@@H]1CN(C(=O)[C@@H]2[C@@H]3Cc4cc(Cl)ccc4[C@@H]32)C[C@@H]1N1CCCC1 ZINC000599763281 566294566 /nfs/dbraw/zinc/29/45/66/566294566.db2.gz SHOHCFDGMUGJNY-MTHXSQLBSA-N 0 3 376.953 3.264 10 0 GGAEHN COCCN1CCC[C@H]1CN[C@H]1CCCOc2ccc(Br)cc21 ZINC000482247089 566295554 /nfs/dbraw/zinc/29/55/54/566295554.db2.gz RIEHRKBHRZXAIF-RDJZCZTQSA-N 0 3 383.330 3.363 10 0 GGAEHN COCCN1CCC[C@H]1CN[C@H](C)c1ccccc1I ZINC000482241773 566295846 /nfs/dbraw/zinc/29/58/46/566295846.db2.gz JFVGFAURTGPOAA-KGLIPLIRSA-N 0 3 388.293 3.053 10 0 GGAEHN CN(C)C[C@@H]1CCCCN1C(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000625243892 566295989 /nfs/dbraw/zinc/29/59/89/566295989.db2.gz HHIDXDZFLDVTTC-PWUKJLEFSA-N 0 3 377.326 3.278 10 0 GGAEHN CC[NH+]1CCC(CC[N-]S(=O)(=O)c2cc(Cl)ccc2OC(F)F)CC1 ZINC000420677639 566298307 /nfs/dbraw/zinc/29/83/07/566298307.db2.gz RXBBUZBILPPBRS-UHFFFAOYSA-N 0 3 396.887 3.342 10 0 GGAEHN O=C(COc1ccccc1)N1CC[C@@H](NCc2cccc(Br)c2)C1 ZINC000509427893 566303491 /nfs/dbraw/zinc/30/34/91/566303491.db2.gz AGJFJHJAGNPEOV-QGZVFWFLSA-N 0 3 389.293 3.219 10 0 GGAEHN Brc1cccc(OC2CCN(CCOC3CCOCC3)CC2)c1 ZINC000625324215 566305128 /nfs/dbraw/zinc/30/51/28/566305128.db2.gz HYTYOYQJVHICRN-UHFFFAOYSA-N 0 3 384.314 3.488 10 0 GGAEHN CSC1(CNC(=O)c2cc(C)cc(Br)c2F)CCN(C)CC1 ZINC000599961068 566306476 /nfs/dbraw/zinc/30/64/76/566306476.db2.gz UNOPFKYGCIFKQI-UHFFFAOYSA-N 0 3 389.334 3.454 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)c1c2ccc(Br)cc2nn1C ZINC000648751233 566307009 /nfs/dbraw/zinc/30/70/09/566307009.db2.gz YYLRVHPPSIUSDC-ZDUSSCGKSA-N 0 3 381.318 3.042 10 0 GGAEHN O=C(CSCc1cccc(Cl)c1)N1CCC(N2CCCOCC2)CC1 ZINC000600007070 566309127 /nfs/dbraw/zinc/30/91/27/566309127.db2.gz ORRKBSPRRSNWJC-UHFFFAOYSA-N 0 3 382.957 3.287 10 0 GGAEHN CN(C)Cc1ccc(S(=O)(=O)N2CCc3c2cccc3Br)cc1 ZINC000420724143 566309946 /nfs/dbraw/zinc/30/99/46/566309946.db2.gz KRLFWEPZAFQSEO-UHFFFAOYSA-N 0 3 395.322 3.262 10 0 GGAEHN O[C@@H](CN[C@H](c1cccnc1)C1CC1)COc1ccc(Br)cc1 ZINC000445766362 566311961 /nfs/dbraw/zinc/31/19/61/566311961.db2.gz IWZISIULQWVFLJ-WMZOPIPTSA-N 0 3 377.282 3.325 10 0 GGAEHN Brc1ccc(-c2ncc(CNCCN3CCCOCC3)s2)cc1 ZINC000576074823 566313412 /nfs/dbraw/zinc/31/34/12/566313412.db2.gz XDAJXLJWRKTQRB-UHFFFAOYSA-N 0 3 396.354 3.385 10 0 GGAEHN O=C1CC[C@H](N2CCN(Cc3c(Cl)ccc(Cl)c3Cl)CC2)CCN1 ZINC000648819246 566317080 /nfs/dbraw/zinc/31/70/80/566317080.db2.gz YPTFNMBGNMPCMW-LBPRGKRZSA-N 0 3 390.742 3.433 10 0 GGAEHN CC1(C)CN(CCN[C@@H]2CCCOc3ccc(Br)cc32)CCO1 ZINC000482556223 566317666 /nfs/dbraw/zinc/31/76/66/566317666.db2.gz IRQPQVOWCNKSOE-MRXNPFEDSA-N 0 3 383.330 3.363 10 0 GGAEHN O=C(Cc1c(F)ccc(Br)c1F)N1CCN(c2ccncc2)CC1 ZINC000669687137 566320969 /nfs/dbraw/zinc/32/09/69/566320969.db2.gz NIYBANOULCFEKE-UHFFFAOYSA-N 0 3 396.235 3.014 10 0 GGAEHN C[C@@H](NC(=O)c1cc2c(cncc2Br)s1)C1=CCN(C)CC1 ZINC000648856943 566321571 /nfs/dbraw/zinc/32/15/71/566321571.db2.gz GLXVVIHMWYVTCR-SNVBAGLBSA-N 0 3 380.311 3.439 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)N1CCc2c(Cl)cc(Cl)cc2C1 ZINC000482623924 566323226 /nfs/dbraw/zinc/32/32/26/566323226.db2.gz RSHFITBVGCQSHJ-OAHLLOKOSA-N 0 3 386.323 3.172 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)c1[nH]nc2ccc(Br)cc21 ZINC000600200637 566323453 /nfs/dbraw/zinc/32/34/53/566323453.db2.gz WFSLNWPUGAZUFX-TXEJJXNPSA-N 0 3 379.302 3.318 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)c1[nH]nc2ccc(Br)cc21 ZINC000600200635 566323636 /nfs/dbraw/zinc/32/36/36/566323636.db2.gz WFSLNWPUGAZUFX-RYUDHWBXSA-N 0 3 379.302 3.318 10 0 GGAEHN CN1Cc2ccccc2[C@@H](NC(=O)c2cc(Br)cc3nc[nH]c32)C1 ZINC000669713302 566324481 /nfs/dbraw/zinc/32/44/81/566324481.db2.gz PHRYPJHDFBDQMF-INIZCTEOSA-N 0 3 385.265 3.242 10 0 GGAEHN O=C1Nc2ccc(Br)cc2CC[C@H]1N1CCC[C@]2(CCOC2)C1 ZINC000625461666 566325376 /nfs/dbraw/zinc/32/53/76/566325376.db2.gz KZOLYNOZBDBBMD-AEFFLSMTSA-N 0 3 379.298 3.205 10 0 GGAEHN CC[C@H](CN1CCCC1)NC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000669766277 566326235 /nfs/dbraw/zinc/32/62/35/566326235.db2.gz PUGNKXOPUFJZBR-CJNGLKHVSA-N 0 3 396.329 3.446 10 0 GGAEHN CC[C@H](CN1CCCC1)NC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000669766278 566326488 /nfs/dbraw/zinc/32/64/88/566326488.db2.gz PUGNKXOPUFJZBR-CZUORRHYSA-N 0 3 396.329 3.446 10 0 GGAEHN COc1c(Br)ccc(F)c1C(=O)NC1CC(N2CCCCC2)C1 ZINC000648889022 566327575 /nfs/dbraw/zinc/32/75/75/566327575.db2.gz CWEXSPDQVKJQHS-UHFFFAOYSA-N 0 3 385.277 3.344 10 0 GGAEHN CN1CCC[C@@]2(CCN(C(=O)[C@@H]3CCc4cc(Br)ccc43)C2)C1 ZINC000648914750 566328689 /nfs/dbraw/zinc/32/86/89/566328689.db2.gz UJJDDIRMIYVVQK-IEBWSBKVSA-N 0 3 377.326 3.423 10 0 GGAEHN CN(C)CCN(CC1CCCCC1)C(=O)c1cc[nH]c(=O)c1Br ZINC000446103447 566331167 /nfs/dbraw/zinc/33/11/67/566331167.db2.gz DHASXMFLJJBEDY-UHFFFAOYSA-N 0 3 384.318 3.134 10 0 GGAEHN Cc1ccc(NC(=O)c2cc[nH]c(=O)c2Br)c(OCCN(C)C)c1 ZINC000446156609 566333337 /nfs/dbraw/zinc/33/33/37/566333337.db2.gz CZKIDXQETDHOLF-UHFFFAOYSA-N 0 3 394.269 3.051 10 0 GGAEHN C[C@@]12COC[C@]1(C)CN([C@@H]1CCc3cc(Br)ccc3NC1=O)C2 ZINC000625537972 566334481 /nfs/dbraw/zinc/33/44/81/566334481.db2.gz UNVQFZDHDIQPRM-NXHRZFHOSA-N 0 3 379.298 3.061 10 0 GGAEHN CCCN(C(=O)Cc1noc2ccc(Br)cc21)[C@H]1CCN(C)C1 ZINC000648994857 566336969 /nfs/dbraw/zinc/33/69/69/566336969.db2.gz GKMWDAVJFRCKLB-ZDUSSCGKSA-N 0 3 380.286 3.076 10 0 GGAEHN COc1ccc([C@H](CN(C)C)NC(=O)Cc2cscc2Br)cc1 ZINC000556867370 566339369 /nfs/dbraw/zinc/33/93/69/566339369.db2.gz ANOPTQFFQUWYOB-INIZCTEOSA-N 0 3 397.338 3.481 10 0 GGAEHN CCN(CC)[C@H]1CCN(S(=O)(=O)c2c(C)cc(Br)cc2C)C1 ZINC000462684984 566340035 /nfs/dbraw/zinc/34/00/35/566340035.db2.gz VWGMYFQSRYDAQE-HNNXBMFYSA-N 0 3 389.359 3.171 10 0 GGAEHN Brc1cc(CNCCc2cnc(C3CC3)nc2)cc2c1OCO2 ZINC000535943918 566340632 /nfs/dbraw/zinc/34/06/32/566340632.db2.gz UKZDSTWSOLKDPF-UHFFFAOYSA-N 0 3 376.254 3.178 10 0 GGAEHN CN(C(=O)COc1ccc(Br)cc1Cl)[C@H]1CN2CCC1CC2 ZINC000600516754 566342981 /nfs/dbraw/zinc/34/29/81/566342981.db2.gz NPTBMSNMUXHJDZ-AWEZNQCLSA-N 0 3 387.705 3.034 10 0 GGAEHN COc1ccc([C@H](C)N[C@H](C)C2(S(C)(=O)=O)CC2)cc1Br ZINC000556920563 566344337 /nfs/dbraw/zinc/34/43/37/566344337.db2.gz JWDGMBZOPBDABA-WDEREUQCSA-N 0 3 376.316 3.074 10 0 GGAEHN Cc1ccc(Br)c(C)c1C(=O)N1CCOC2(CCN(C)CC2)C1 ZINC000649128975 566346161 /nfs/dbraw/zinc/34/61/61/566346161.db2.gz GVDNUWLYOBEYQI-UHFFFAOYSA-N 0 3 381.314 3.003 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)CCCc1cccc(Br)c1)CCO2 ZINC000649131646 566347035 /nfs/dbraw/zinc/34/70/35/566347035.db2.gz VTPAEBAEKNUCGY-UHFFFAOYSA-N 0 3 395.341 3.095 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)Cc1csc3ccc(Cl)cc13)CCO2 ZINC000649131258 566347576 /nfs/dbraw/zinc/34/75/76/566347576.db2.gz FIAUUYVTBANCLN-UHFFFAOYSA-N 0 3 378.925 3.420 10 0 GGAEHN CN(C[C@H]1CCCN(C)C1)C(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000625644784 566347543 /nfs/dbraw/zinc/34/75/43/566347543.db2.gz ILQUGHPREHCSRT-LGRHPFTQSA-N 0 3 377.326 3.135 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)[C@H]1COc2ccc(Br)cc21 ZINC000576467117 566348120 /nfs/dbraw/zinc/34/81/20/566348120.db2.gz ZVFFEBDGDITPAJ-DLBZAZTESA-N 0 3 387.277 3.010 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)[C@H]1COc2ccc(Br)cc21 ZINC000576467119 566348161 /nfs/dbraw/zinc/34/81/61/566348161.db2.gz ZVFFEBDGDITPAJ-IRXDYDNUSA-N 0 3 387.277 3.010 10 0 GGAEHN CN(C)CCn1ccc(NC(=O)Nc2cc(Cl)c(Cl)c(Cl)c2)n1 ZINC000576469417 566349615 /nfs/dbraw/zinc/34/96/15/566349615.db2.gz PFRMDBMMCMFABU-UHFFFAOYSA-N 0 3 376.675 3.471 10 0 GGAEHN COC(=O)[C@@H](NC[C@H]1CCN1C1CCCC1)c1cccc(Br)c1 ZINC000600612978 566350803 /nfs/dbraw/zinc/35/08/03/566350803.db2.gz DGMMBWSINCVYBZ-SJORKVTESA-N 0 3 381.314 3.270 10 0 GGAEHN COC(=O)[C@@H](NC[C@@H]1CCN1C1CCCC1)c1ccccc1Br ZINC000600614150 566351014 /nfs/dbraw/zinc/35/10/14/566351014.db2.gz MCGLDPJNJBBIQZ-YOEHRIQHSA-N 0 3 381.314 3.270 10 0 GGAEHN C[C@@H]1CN(CCCOc2cccc(I)c2)C[C@H](C)N1C ZINC000576533374 566356222 /nfs/dbraw/zinc/35/62/22/566356222.db2.gz PCJZQHSWGIYEEW-OKILXGFUSA-N 0 3 388.293 3.085 10 0 GGAEHN O=C(COc1ccccc1)N1CC[C@@H](NCc2csc(Br)c2)C1 ZINC000510010241 566356840 /nfs/dbraw/zinc/35/68/40/566356840.db2.gz OXSCIZLNKSPTHC-CQSZACIVSA-N 0 3 395.322 3.280 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000625779971 566358135 /nfs/dbraw/zinc/35/81/35/566358135.db2.gz IAOQEEMSKXTTNX-IERSGTSRSA-N 0 3 377.326 3.133 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000625779980 566358147 /nfs/dbraw/zinc/35/81/47/566358147.db2.gz IAOQEEMSKXTTNX-QMUUJGJKSA-N 0 3 377.326 3.133 10 0 GGAEHN CCc1nc(C)c(CN[C@]2(CO)CCc3cc(Br)ccc3C2)o1 ZINC000625796095 566358760 /nfs/dbraw/zinc/35/87/60/566358760.db2.gz FEVBDXDIONXNDV-GOSISDBHSA-N 0 3 379.298 3.318 10 0 GGAEHN CN(C)C[C@@]1(O)CCCN(C(=O)C2(c3ccc(Cl)c(Cl)c3)CCC2)C1 ZINC000670378039 566359967 /nfs/dbraw/zinc/35/99/67/566359967.db2.gz MMJPXSKOIPFCNG-SFHVURJKSA-N 0 3 385.335 3.330 10 0 GGAEHN CCc1noc(C)c1CN[C@@]1(CO)CCc2cc(Br)ccc2C1 ZINC000625794558 566359993 /nfs/dbraw/zinc/35/99/93/566359993.db2.gz KJJMYAVMXAONFH-SFHVURJKSA-N 0 3 379.298 3.318 10 0 GGAEHN Cc1ccc(CN[C@]2(CO)CCc3cc(Br)ccc3C2)c(C)n1 ZINC000625797140 566360586 /nfs/dbraw/zinc/36/05/86/566360586.db2.gz QMFXADLAYBGUSL-LJQANCHMSA-N 0 3 375.310 3.471 10 0 GGAEHN OC[C@]1(NCc2cnc3ccccc3n2)CCc2cc(Br)ccc2C1 ZINC000625796133 566360947 /nfs/dbraw/zinc/36/09/47/566360947.db2.gz GGDTYTQRFLZUAZ-FQEVSTJZSA-N 0 3 398.304 3.402 10 0 GGAEHN Cc1ccc(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)c(C)n1 ZINC000625797139 566361235 /nfs/dbraw/zinc/36/12/35/566361235.db2.gz QMFXADLAYBGUSL-IBGZPJMESA-N 0 3 375.310 3.471 10 0 GGAEHN COc1ccc(Br)cc1[C@H]1CCCN1C(=O)CN1CC[C@@H](C)C1 ZINC000576595849 566361263 /nfs/dbraw/zinc/36/12/63/566361263.db2.gz PZSBDDYPPIBNET-CZUORRHYSA-N 0 3 381.314 3.463 10 0 GGAEHN CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)Nc1cc(Cl)ccc1Cl ZINC000510129762 566365170 /nfs/dbraw/zinc/36/51/70/566365170.db2.gz FWGUXRQNWVLEMW-HNNXBMFYSA-N 0 3 387.311 3.058 10 0 GGAEHN O=C(NCc1ccc(Br)c(F)c1F)Nc1cnc2c(c1)CNCC2 ZINC000625896060 566367216 /nfs/dbraw/zinc/36/72/16/566367216.db2.gz QBWXQURWWZNZGI-UHFFFAOYSA-N 0 3 397.223 3.090 10 0 GGAEHN CN(C[C@@H]1CCCN(C)C1)S(=O)(=O)c1c(Cl)cccc1Br ZINC000510148011 566367277 /nfs/dbraw/zinc/36/72/77/566367277.db2.gz VMXGQWZAILXMKR-LLVKDONJSA-N 0 3 395.750 3.065 10 0 GGAEHN CN(C[C@H]1CCCN(C)C1)S(=O)(=O)c1c(Cl)cccc1Br ZINC000510148012 566367682 /nfs/dbraw/zinc/36/76/82/566367682.db2.gz VMXGQWZAILXMKR-NSHDSACASA-N 0 3 395.750 3.065 10 0 GGAEHN CC[C@@H]1C[C@H](NCc2cc(Br)ccc2O[C@@H](C)C(=O)NC)CCO1 ZINC000421373847 566368782 /nfs/dbraw/zinc/36/87/82/566368782.db2.gz DZNAUNIWFNLHOI-APHBMKBZSA-N 0 3 399.329 3.010 10 0 GGAEHN C[C@@H](NCCC1CCS(=O)(=O)CC1)c1ccc(Br)cc1F ZINC000446939773 566371622 /nfs/dbraw/zinc/37/16/22/566371622.db2.gz BNHBWRCBCHRTCH-LLVKDONJSA-N 0 3 378.307 3.454 10 0 GGAEHN CN(C)C[C@H](NCC[C@H]1CCS(=O)(=O)C1)c1ccc(Cl)c(Cl)c1 ZINC000625983599 566371906 /nfs/dbraw/zinc/37/19/06/566371906.db2.gz UWAHBHVIVOHHCT-LRDDRELGSA-N 0 3 379.353 3.011 10 0 GGAEHN CC(C)N(Cc1cnc(-c2ccc(Br)cc2)s1)C[C@@H](O)CO ZINC000421408059 566372909 /nfs/dbraw/zinc/37/29/09/566372909.db2.gz JYGOBZHJFSNDNV-CQSZACIVSA-N 0 3 385.327 3.136 10 0 GGAEHN CCOc1cc(C[NH2+][C@@H](C)C2(OC)CCOCC2)cc(Br)c1[O-] ZINC000421407898 566372917 /nfs/dbraw/zinc/37/29/17/566372917.db2.gz WTQGTLDTZQZZEQ-LBPRGKRZSA-N 0 3 388.302 3.227 10 0 GGAEHN C[C@H](CN1CCC(CNS(C)(=O)=O)CC1)c1ccc(C(F)(F)F)cc1 ZINC000510262206 566373000 /nfs/dbraw/zinc/37/30/00/566373000.db2.gz ZQEFYCIIOORNCS-CYBMUJFWSA-N 0 3 378.460 3.070 10 0 GGAEHN COCC[C@H](N[C@@H](C)Cn1cc(Br)ccc1=O)c1ccc(C)o1 ZINC000576731495 566372897 /nfs/dbraw/zinc/37/28/97/566372897.db2.gz DQKYPRRHBSOFJP-WFASDCNBSA-N 0 3 383.286 3.268 10 0 GGAEHN COCC[C@@H](N[C@H](C)Cn1cc(Br)ccc1=O)c1ccc(C)o1 ZINC000576731493 566373123 /nfs/dbraw/zinc/37/31/23/566373123.db2.gz DQKYPRRHBSOFJP-IUODEOHRSA-N 0 3 383.286 3.268 10 0 GGAEHN O=S(=O)(NC1CC1)c1ccc(CN(CCC(F)(F)F)CC2CC2)cc1 ZINC000649549958 566373447 /nfs/dbraw/zinc/37/34/47/566373447.db2.gz YDCLGDSEPBZKPZ-UHFFFAOYSA-N 0 3 376.444 3.292 10 0 GGAEHN Cc1cc(Br)ccc1[C@H]1CCCN1CCC(=O)N1CCOCC1 ZINC000626009499 566374069 /nfs/dbraw/zinc/37/40/69/566374069.db2.gz KJFNPQODGOSVSG-QGZVFWFLSA-N 0 3 381.314 3.143 10 0 GGAEHN C[C@H]1C[C@@H](c2ccc(Br)cc2)CN1Cc1cc(=O)n2nccc2[nH]1 ZINC000626040726 566377864 /nfs/dbraw/zinc/37/78/64/566377864.db2.gz KVLCFIYLSAWGGT-GXTWGEPZSA-N 0 3 387.281 3.163 10 0 GGAEHN CS[C@H]1CN(C(=O)c2ccc(F)cc2C(F)(F)F)C[C@@H]1N1CCCC1 ZINC000483387592 566379156 /nfs/dbraw/zinc/37/91/56/566379156.db2.gz CBRCNOXIIJGBLF-GJZGRUSLSA-N 0 3 376.419 3.496 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cccc(C)c2Br)C[C@H]1N1CCCC1 ZINC000483400137 566379355 /nfs/dbraw/zinc/37/93/55/566379355.db2.gz CSJJGPNBQADFMI-HUUCEWRRSA-N 0 3 383.355 3.409 10 0 GGAEHN C[C@@H]1C[C@@H](c2ccc(Br)cc2)CN1C[C@H]1CCCS(=O)(=O)C1 ZINC000626041334 566380408 /nfs/dbraw/zinc/38/04/08/566380408.db2.gz VRIPBHBCYSMMSY-IIAWOOMASA-N 0 3 386.355 3.452 10 0 GGAEHN CNC(=O)C[C@@H](NCCOc1cc(F)cc(Br)c1)c1ccccc1 ZINC000483404199 566381179 /nfs/dbraw/zinc/38/11/79/566381179.db2.gz IXEWOEGIGKZGDL-QGZVFWFLSA-N 0 3 395.272 3.434 10 0 GGAEHN CNC(=O)C[C@@H](NCCOc1cccc(Br)c1)c1ccccc1 ZINC000483420188 566381967 /nfs/dbraw/zinc/38/19/67/566381967.db2.gz KLJDXXINNADZPF-QGZVFWFLSA-N 0 3 377.282 3.295 10 0 GGAEHN CCC1(N2CCOCC2)CCN(CCOc2ccccc2Br)CC1 ZINC000626089066 566384545 /nfs/dbraw/zinc/38/45/45/566384545.db2.gz ZDFUFQBUSDSTAL-UHFFFAOYSA-N 0 3 397.357 3.405 10 0 GGAEHN C[C@H]1C[C@@H](N2CCCC2)CN1S(=O)(=O)Cc1ccc(Cl)cc1Cl ZINC000510483478 566386431 /nfs/dbraw/zinc/38/64/31/566386431.db2.gz AIPVQWNJBYJHMJ-SWLSCSKDSA-N 0 3 377.337 3.382 10 0 GGAEHN C[C@@H]1C[C@H](CO)CCN1Cc1ccnc(-c2ccc(Br)cc2)n1 ZINC000626120270 566386539 /nfs/dbraw/zinc/38/65/39/566386539.db2.gz YFIYSBDTFOSAJY-ZIAGYGMSSA-N 0 3 376.298 3.499 10 0 GGAEHN C[C@H](NC(=O)N[C@@H]1CCc2cc(Br)ccc21)C1=CCN(C)CC1 ZINC000510498553 566387784 /nfs/dbraw/zinc/38/77/84/566387784.db2.gz CBESGUVJGJFLCP-YVEFUNNKSA-N 0 3 378.314 3.386 10 0 GGAEHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1nscc1Br ZINC000649725745 566389089 /nfs/dbraw/zinc/38/90/89/566389089.db2.gz ASBIHFLPJBVIET-UHFFFAOYSA-N 0 3 386.290 3.249 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)c1ccc(F)c(Br)c1 ZINC000463193985 566389217 /nfs/dbraw/zinc/38/92/17/566389217.db2.gz XFWHWSXFYNEEFE-HNNXBMFYSA-N 0 3 379.273 3.491 10 0 GGAEHN Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(C[C@@H]1CCCO1)C(F)(F)F ZINC000649730487 566389597 /nfs/dbraw/zinc/38/95/97/566389597.db2.gz SCZAQLACSWXMPG-AAEUAGOBSA-N 0 3 379.400 3.085 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)[C@@H]2CCOc3ccc(Br)cc32)CCN1C ZINC000649765567 566390474 /nfs/dbraw/zinc/39/04/74/566390474.db2.gz ZTGZDRLMPPVUIZ-VHDGCEQUSA-N 0 3 381.314 3.256 10 0 GGAEHN Cc1ccc(NC(=O)c2nscc2Br)c(OCCN(C)C)c1 ZINC000649754763 566391399 /nfs/dbraw/zinc/39/13/99/566391399.db2.gz UTWSKTJDMSLVQM-UHFFFAOYSA-N 0 3 384.299 3.407 10 0 GGAEHN O=C(Cc1csc(-c2ccc(Cl)s2)n1)N[C@H]1CNCCC1(F)F ZINC000576941638 566391895 /nfs/dbraw/zinc/39/18/95/566391895.db2.gz GIRJIIJQSJFGDB-JTQLQIEISA-N 0 3 377.869 3.181 10 0 GGAEHN CC(C)N(C[C@@H](O)COc1ccc(Cl)cc1Br)[C@@H]1CCOC1 ZINC000463228593 566394474 /nfs/dbraw/zinc/39/44/74/566394474.db2.gz CULMLHBCWRYSLM-ZIAGYGMSSA-N 0 3 392.721 3.342 10 0 GGAEHN CC[C@@H]1C[C@H](C)CC[C@H]1NCc1ccc(S(=O)(=O)N2CCOCC2)s1 ZINC000536700395 566394374 /nfs/dbraw/zinc/39/43/74/566394374.db2.gz SVHIWTZTIOZEMJ-BFYDXBDKSA-N 0 3 386.583 3.073 10 0 GGAEHN C[C@@H](Cc1cccc(Br)c1)NC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000601281127 566398705 /nfs/dbraw/zinc/39/87/05/566398705.db2.gz ZKAGXCWFQQVFOH-GUYCJALGSA-N 0 3 380.330 3.258 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@@H](C)c1ccc2c(c1)OCCO2 ZINC000671117088 566400701 /nfs/dbraw/zinc/40/07/01/566400701.db2.gz MQYCMPJHHXXINP-OLZOCXBDSA-N 0 3 393.281 3.121 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@H](C)c1ccc2c(c1)OCCO2 ZINC000671117087 566401241 /nfs/dbraw/zinc/40/12/41/566401241.db2.gz MQYCMPJHHXXINP-CHWSQXEVSA-N 0 3 393.281 3.121 10 0 GGAEHN CN(C(=O)c1ccn(-c2ccc(Cl)cc2Cl)n1)[C@H]1CCN(C2CC2)C1 ZINC000536782634 566401470 /nfs/dbraw/zinc/40/14/70/566401470.db2.gz FBZXHDJKWFNYGB-AWEZNQCLSA-N 0 3 379.291 3.488 10 0 GGAEHN CN1CCC2(CCCN2C(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)CC1 ZINC000626332440 566403180 /nfs/dbraw/zinc/40/31/80/566403180.db2.gz RKZDDSALDYPASQ-CGTJXYLNSA-N 0 3 389.337 3.422 10 0 GGAEHN CN1CCN(C(=O)CCN2CCC(c3cccc(Cl)c3Cl)CC2)CC1 ZINC000463368281 566403681 /nfs/dbraw/zinc/40/36/81/566403681.db2.gz OVVGZIIHMVSGAP-UHFFFAOYSA-N 0 3 384.351 3.337 10 0 GGAEHN CS(=O)(=O)N1CC[C@@H](CN2CCC(c3cccc(Cl)c3Cl)CC2)C1 ZINC000463364418 566403986 /nfs/dbraw/zinc/40/39/86/566403986.db2.gz ACFZEDNFWWYVMC-ZDUSSCGKSA-N 0 3 391.364 3.454 10 0 GGAEHN Cc1cnn(CCN[C@@H](C)c2ccc(Br)cc2OCCCO)c1 ZINC000463363891 566404156 /nfs/dbraw/zinc/40/41/56/566404156.db2.gz BATMNEBOBOBERG-AWEZNQCLSA-N 0 3 382.302 3.066 10 0 GGAEHN C[C@H](NCCC1CCS(=O)(=O)CC1)c1cc(Br)ccc1F ZINC000536842476 566404266 /nfs/dbraw/zinc/40/42/66/566404266.db2.gz XMDKUXLUADZVIN-NSHDSACASA-N 0 3 378.307 3.454 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2C[C@@H](N3CCCC3)C[C@H]2C)c1 ZINC000557640573 566404320 /nfs/dbraw/zinc/40/43/20/566404320.db2.gz KNVVRRWQILFNBI-KGLIPLIRSA-N 0 3 398.288 3.298 10 0 GGAEHN CCn1nccc1CCN[C@@H](C)c1ccc(Br)cc1OCCCO ZINC000463373654 566405429 /nfs/dbraw/zinc/40/54/29/566405429.db2.gz DAPPPEIKAYINOF-AWEZNQCLSA-N 0 3 396.329 3.320 10 0 GGAEHN Cc1nccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)c1Br ZINC000649949055 566408192 /nfs/dbraw/zinc/40/81/92/566408192.db2.gz NGOGUNXFVHWTCJ-VHSXEESVSA-N 0 3 381.192 3.261 10 0 GGAEHN CN(C)C1(CN(C)C(=O)[C@@H]2CCOc3ccc(Br)cc32)CCC1 ZINC000649949272 566408342 /nfs/dbraw/zinc/40/83/42/566408342.db2.gz VDCTXSNDLCLYIH-CQSZACIVSA-N 0 3 381.314 3.258 10 0 GGAEHN C[C@@H](NC[C@H]1CC[C@H](C(N)=O)CC1)c1ccccc1I ZINC000421851278 566411539 /nfs/dbraw/zinc/41/15/39/566411539.db2.gz FPZCKZGQQZLPHO-JHJVBQTASA-N 0 3 386.277 3.234 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)c1ccc(Br)c(C(F)(F)F)c1 ZINC000577181519 566412587 /nfs/dbraw/zinc/41/25/87/566412587.db2.gz FLYOIHQHOALJRA-SNVBAGLBSA-N 0 3 387.146 3.195 10 0 GGAEHN CCNC(=O)C[C@@H]1CCCCN1C[C@@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000671248955 566412476 /nfs/dbraw/zinc/41/24/76/566412476.db2.gz SGMZDNVMEHUFOH-UONOGXRCSA-N 0 3 389.323 3.114 10 0 GGAEHN C[C@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CC[C@@]2(C1)CCCOC2 ZINC000671254311 566413197 /nfs/dbraw/zinc/41/31/97/566413197.db2.gz BMSGNNADCWDKIQ-DNVCBOLYSA-N 0 3 395.341 3.299 10 0 GGAEHN CCO[C@@H]1C[C@H](NC[C@H](O)COc2c(Cl)cccc2Cl)[C@@]12CCCO2 ZINC000577172762 566413265 /nfs/dbraw/zinc/41/32/65/566413265.db2.gz CQFBEXQZSMUBGQ-PTOXDTDZSA-N 0 3 390.307 3.049 10 0 GGAEHN C[C@H](NC(=O)CN1CCCCC[C@H]1CCO)c1ccc(Br)cc1 ZINC000671248372 566413309 /nfs/dbraw/zinc/41/33/09/566413309.db2.gz RKLQMUOKHVXCBX-YOEHRIQHSA-N 0 3 383.330 3.253 10 0 GGAEHN CN1CCN([C@H]2CC[C@@H](NC(=O)Cc3cc(Cl)cc(Cl)c3)CC2)CC1 ZINC000626458194 566413342 /nfs/dbraw/zinc/41/33/42/566413342.db2.gz SVPYIAKQOGJZPI-HDICACEKSA-N 0 3 384.351 3.211 10 0 GGAEHN C[C@@H](NC(=O)c1cc(=O)[nH]c2ccc(Br)cc21)C1=CCN(C)CC1 ZINC000510795805 566414167 /nfs/dbraw/zinc/41/41/67/566414167.db2.gz SEFSAQZWOZJPMR-LLVKDONJSA-N 0 3 390.281 3.083 10 0 GGAEHN O=C(N[C@H]1C[C@H](c2ccc(Br)cc2)C1)N1CCN2CCC1CC2 ZINC000463521709 566414979 /nfs/dbraw/zinc/41/49/79/566414979.db2.gz VUEZRPDFGQHGLF-KOMQPUFPSA-N 0 3 378.314 3.185 10 0 GGAEHN Cc1ccc(I)c(C(=O)NCCN2CCCC[C@H]2C)c1 ZINC000510834158 566415211 /nfs/dbraw/zinc/41/52/11/566415211.db2.gz BCKQPAGOMOCTTJ-CYBMUJFWSA-N 0 3 386.277 3.204 10 0 GGAEHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000650024280 566415266 /nfs/dbraw/zinc/41/52/66/566415266.db2.gz GQGXXBBTGFVFLN-BMFZPTHFSA-N 0 3 393.325 3.400 10 0 GGAEHN CCc1n[nH]c(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)c1Br ZINC000447565047 566415321 /nfs/dbraw/zinc/41/53/21/566415321.db2.gz IHTNRTYIAQTFMQ-CQSZACIVSA-N 0 3 391.313 3.081 10 0 GGAEHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000650024281 566416047 /nfs/dbraw/zinc/41/60/47/566416047.db2.gz GQGXXBBTGFVFLN-FVQBIDKESA-N 0 3 393.325 3.400 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1cc(F)ccc1I ZINC000510844279 566416790 /nfs/dbraw/zinc/41/67/90/566416790.db2.gz PWNDPYYGSMFUAW-LLVKDONJSA-N 0 3 390.240 3.035 10 0 GGAEHN C[C@@H](NCCOCC(F)(F)C(F)F)c1ccc(-n2cncn2)cc1Cl ZINC000447602366 566417768 /nfs/dbraw/zinc/41/77/68/566417768.db2.gz UJZRRRWJYSREFN-SNVBAGLBSA-N 0 3 380.773 3.488 10 0 GGAEHN CN(Cc1ccc(F)cc1Br)C(=O)CCN(C)c1ccncc1 ZINC000577322689 566424057 /nfs/dbraw/zinc/42/40/57/566424057.db2.gz MHSWNXMOMMIICH-UHFFFAOYSA-N 0 3 380.261 3.468 10 0 GGAEHN O=C(Nc1ccc2c(c1)CNC2)N(CCO)Cc1cc(Br)cs1 ZINC000577364639 566429316 /nfs/dbraw/zinc/42/93/16/566429316.db2.gz PQCZFGGKRDHBLS-UHFFFAOYSA-N 0 3 396.310 3.140 10 0 GGAEHN COc1cc(NC(=O)NC[C@@H]2CCCN2C)c(Cl)cc1Br ZINC000626615218 566430022 /nfs/dbraw/zinc/43/00/22/566430022.db2.gz WWVANIOTHXUCGM-VIFPVBQESA-N 0 3 376.682 3.327 10 0 GGAEHN CCSc1ccc(CC(=O)N2CCN3CCC2CC3)c(Br)c1 ZINC000626626369 566431717 /nfs/dbraw/zinc/43/17/17/566431717.db2.gz IBSXHFZWSFEJQT-UHFFFAOYSA-N 0 3 383.355 3.410 10 0 GGAEHN CN(C[C@H]1CCCN1C)C(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000422163866 566436727 /nfs/dbraw/zinc/43/67/27/566436727.db2.gz UQICKODUQYYCPA-HIFRSBDPSA-N 0 3 382.302 3.008 10 0 GGAEHN CN(CCN1CCCCC1)C(=O)Nc1cnc2c(Br)cccn12 ZINC000650203868 566437944 /nfs/dbraw/zinc/43/79/44/566437944.db2.gz SMFUTLCKZYFNPG-UHFFFAOYSA-N 0 3 380.290 3.046 10 0 GGAEHN CN(C)CCn1cc(NC(=O)c2cc(F)c(Br)c(Cl)c2)cn1 ZINC000671681880 566438303 /nfs/dbraw/zinc/43/83/03/566438303.db2.gz UWHIHTHSVWQMEU-UHFFFAOYSA-N 0 3 389.656 3.252 10 0 GGAEHN COC(=O)[C@H](c1c(F)cccc1Cl)N1C[C@@H](SC)[C@@H](N2CCCC2)C1 ZINC000484609446 566440151 /nfs/dbraw/zinc/44/01/51/566440151.db2.gz APOHTXLDLUBQCP-UXLLHSPISA-N 0 3 386.920 3.205 10 0 GGAEHN COC(=O)[C@H](c1c(F)cccc1Cl)N1C[C@H](SC)[C@@H](N2CCCC2)C1 ZINC000484609448 566440503 /nfs/dbraw/zinc/44/05/03/566440503.db2.gz APOHTXLDLUBQCP-ZOBUZTSGSA-N 0 3 386.920 3.205 10 0 GGAEHN Cc1cc(Br)c(F)c(C(=O)NCCCN2CCCO[C@@H](C)C2)c1 ZINC000626667004 566440659 /nfs/dbraw/zinc/44/06/59/566440659.db2.gz HUZFOLZPZSGGQF-ZDUSSCGKSA-N 0 3 387.293 3.127 10 0 GGAEHN CN(CCN(C)C1CCCCC1)C(=O)C(=O)c1ccc(Br)cc1 ZINC000511130577 566440964 /nfs/dbraw/zinc/44/09/64/566440964.db2.gz MVGMFVYBYHBBEW-UHFFFAOYSA-N 0 3 381.314 3.355 10 0 GGAEHN CS[C@@H]1CN([C@H](C)C(=O)Nc2cc(Cl)ccc2F)C[C@@H]1N1CCCC1 ZINC000484631201 566441480 /nfs/dbraw/zinc/44/14/80/566441480.db2.gz HZEWAECZTPFLMO-OAUYIBNBSA-N 0 3 385.936 3.318 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000484699267 566447613 /nfs/dbraw/zinc/44/76/13/566447613.db2.gz ZPQXEQAQUUVCED-YOEHRIQHSA-N 0 3 393.325 3.173 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000484699267 566447619 /nfs/dbraw/zinc/44/76/19/566447619.db2.gz ZPQXEQAQUUVCED-YOEHRIQHSA-N 0 3 393.325 3.173 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000484699265 566447656 /nfs/dbraw/zinc/44/76/56/566447656.db2.gz ZPQXEQAQUUVCED-RHSMWYFYSA-N 0 3 393.325 3.173 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000484699265 566447657 /nfs/dbraw/zinc/44/76/57/566447657.db2.gz ZPQXEQAQUUVCED-RHSMWYFYSA-N 0 3 393.325 3.173 10 0 GGAEHN CCOC(=O)CC(C)(C)CCN1CCN(c2ccc(Br)cn2)CC1 ZINC000558086686 566449121 /nfs/dbraw/zinc/44/91/21/566449121.db2.gz BXRVICDWGGXNHG-UHFFFAOYSA-N 0 3 398.345 3.336 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1F)NC[C@@](C)(O)C(=O)OC(C)(C)C ZINC000484733944 566450279 /nfs/dbraw/zinc/45/02/79/566450279.db2.gz CCZYOSMGLBXNPG-APPDUMDISA-N 0 3 390.293 3.202 10 0 GGAEHN Cc1nc([C@@H]2CCCN(C[C@@H](O)COc3c(Cl)cccc3Cl)C2)n[nH]1 ZINC000537562217 566452480 /nfs/dbraw/zinc/45/24/80/566452480.db2.gz MARYLLDHMGKWCZ-CHWSQXEVSA-N 0 3 385.295 3.039 10 0 GGAEHN Cc1n[nH]c([C@@H]2CCCN(C[C@@H](O)COc3c(Cl)cccc3Cl)C2)n1 ZINC000537562217 566452483 /nfs/dbraw/zinc/45/24/83/566452483.db2.gz MARYLLDHMGKWCZ-CHWSQXEVSA-N 0 3 385.295 3.039 10 0 GGAEHN Cc1nnc([C@@H]2CCCN(C[C@@H](O)COc3c(Cl)cccc3Cl)C2)[nH]1 ZINC000537562217 566452486 /nfs/dbraw/zinc/45/24/86/566452486.db2.gz MARYLLDHMGKWCZ-CHWSQXEVSA-N 0 3 385.295 3.039 10 0 GGAEHN COc1ccc(Br)c2[nH]c(C(=O)N(C)[C@@H]3CN4CCC3CC4)cc21 ZINC000558200997 566458578 /nfs/dbraw/zinc/45/85/78/566458578.db2.gz SRACIFHPOSUZJK-OAHLLOKOSA-N 0 3 392.297 3.105 10 0 GGAEHN C[C@H](NCCC1(F)CCC1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000558259492 566461314 /nfs/dbraw/zinc/46/13/14/566461314.db2.gz SEZMMIHTUSBAPK-JTQLQIEISA-N 0 3 379.295 3.029 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1ccc2cc(Br)ccc2c1 ZINC000448246720 566466316 /nfs/dbraw/zinc/46/63/16/566466316.db2.gz FPRQUYUMNDOVQF-SFHVURJKSA-N 0 3 391.309 3.443 10 0 GGAEHN Cc1nc(CN)ccc1[C@@H](C)NCc1cc(Br)c2c(c1)OCCO2 ZINC000422932180 566467180 /nfs/dbraw/zinc/46/71/80/566467180.db2.gz DXXMZEORFDOFIV-LLVKDONJSA-N 0 3 392.297 3.233 10 0 GGAEHN Cc1ccc(Br)cc1NC(=O)CCN[C@@H](C)c1cnccc1N ZINC000422955651 566467211 /nfs/dbraw/zinc/46/72/11/566467211.db2.gz MTZXDJVOBAAKCP-LBPRGKRZSA-N 0 3 377.286 3.244 10 0 GGAEHN FC(F)(F)c1cc(Br)ccc1CN[C@H](C1CC1)[C@@H]1CNCCO1 ZINC000423020662 566468955 /nfs/dbraw/zinc/46/89/55/566468955.db2.gz CMWHWLLVDVIQRX-LSDHHAIUSA-N 0 3 393.247 3.325 10 0 GGAEHN Cc1ccc(S(=O)(=O)C[C@@H](C)NC[C@@H]2CSc3ccccc3O2)cc1 ZINC000577849855 566470971 /nfs/dbraw/zinc/47/09/71/566470971.db2.gz JQIUGIXIJGSGSG-HZPDHXFCSA-N 0 3 377.531 3.300 10 0 GGAEHN C[C@@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)C(=O)c1ccc(Br)cc1 ZINC000511554928 566471424 /nfs/dbraw/zinc/47/14/24/566471424.db2.gz ASWKALLKGXNEHN-MJBXVCDLSA-N 0 3 381.314 3.114 10 0 GGAEHN C[C@@](CO)(NCCOCCOc1ccccc1)c1ccc(Br)cc1 ZINC000511568254 566473450 /nfs/dbraw/zinc/47/34/50/566473450.db2.gz SYGSXJUIRNTKQE-IBGZPJMESA-N 0 3 394.309 3.342 10 0 GGAEHN C[C@](CO)(NCCOCCOc1ccccc1)c1ccc(Br)cc1 ZINC000511568255 566473598 /nfs/dbraw/zinc/47/35/98/566473598.db2.gz SYGSXJUIRNTKQE-LJQANCHMSA-N 0 3 394.309 3.342 10 0 GGAEHN CC1(C)CCCN[C@H]1C(=O)N1CCO[C@@H](c2cccc(Br)c2)C1 ZINC000423112969 566476806 /nfs/dbraw/zinc/47/68/06/566476806.db2.gz XUSSHGRUOPFVEU-CVEARBPZSA-N 0 3 381.314 3.127 10 0 GGAEHN C[C@@](CO)(NCC[S@@](=O)c1ccccc1)c1ccc(Br)cc1 ZINC000511612790 566477569 /nfs/dbraw/zinc/47/75/69/566477569.db2.gz VQQOVTWDFXJBGB-HTAPYJJXSA-N 0 3 382.323 3.054 10 0 GGAEHN Cc1ccc(C[C@@H](CO)CN[C@H](C)c2cnccc2N)cc1Br ZINC000423161647 566480728 /nfs/dbraw/zinc/48/07/28/566480728.db2.gz NYBKYQCQIMTFQJ-UKRRQHHQSA-N 0 3 378.314 3.067 10 0 GGAEHN C[C@H](NCCN1CCN(C(=O)C2CCC2)CC1)c1ccccc1Br ZINC000537977079 566481739 /nfs/dbraw/zinc/48/17/39/566481739.db2.gz TZMMDWUJWDWWHV-HNNXBMFYSA-N 0 3 394.357 3.044 10 0 GGAEHN O=C(Cc1sccc1Br)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000448608262 566482065 /nfs/dbraw/zinc/48/20/65/566482065.db2.gz RMYZXVMXPBDTJU-AWEZNQCLSA-N 0 3 379.323 3.444 10 0 GGAEHN C[C@@H](NCCN1CCN(C(=O)C2CCC2)CC1)c1ccccc1Br ZINC000537977080 566482522 /nfs/dbraw/zinc/48/25/22/566482522.db2.gz TZMMDWUJWDWWHV-OAHLLOKOSA-N 0 3 394.357 3.044 10 0 GGAEHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)CCOC1CNC1 ZINC000578005800 566482679 /nfs/dbraw/zinc/48/26/79/566482679.db2.gz VXRQEIRLYISWAS-NSHDSACASA-N 0 3 379.913 3.328 10 0 GGAEHN Fc1ccc(Br)c2c1CC[C@H]2Nc1ccc(N2CCNCC2)cn1 ZINC000423233091 566482636 /nfs/dbraw/zinc/48/26/36/566482636.db2.gz NWYOPXGKLXSJHH-MRXNPFEDSA-N 0 3 391.288 3.492 10 0 GGAEHN O=S1(=O)CCC(CCN[C@@H]2CCc3c2c(Br)ccc3F)CC1 ZINC000537959556 566482689 /nfs/dbraw/zinc/48/26/89/566482689.db2.gz MBYYRSGGWZFBMU-OAHLLOKOSA-N 0 3 390.318 3.380 10 0 GGAEHN Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)CCOC1CNC1 ZINC000578005799 566482731 /nfs/dbraw/zinc/48/27/31/566482731.db2.gz VXRQEIRLYISWAS-LLVKDONJSA-N 0 3 379.913 3.328 10 0 GGAEHN C[C@H](N[C@@H]1CN(C2CC2)C[C@@H]1C)c1cc2c(cc1Br)OCCO2 ZINC000537989446 566483687 /nfs/dbraw/zinc/48/36/87/566483687.db2.gz BKUQYDGFTKSDFM-MQIPJXDCSA-N 0 3 381.314 3.354 10 0 GGAEHN CN(CCNS(=O)(=O)Cc1cccc(Br)c1)C1CCCCC1 ZINC000672380573 566483908 /nfs/dbraw/zinc/48/39/08/566483908.db2.gz QAJMHMZYTZXRQO-UHFFFAOYSA-N 0 3 389.359 3.133 10 0 GGAEHN CCOc1cc(C[NH2+][C@@H](CO)Cc2ccccc2)cc(Br)c1[O-] ZINC000485238987 566486118 /nfs/dbraw/zinc/48/61/18/566486118.db2.gz KXHFJKKOGFDRQP-OAHLLOKOSA-N 0 3 380.282 3.247 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3c(C)cc(C)c(Br)c3C)[C@H]2C1 ZINC000627531851 566486863 /nfs/dbraw/zinc/48/68/63/566486863.db2.gz KWLICQSBLULQMC-JKSUJKDBSA-N 0 3 395.341 3.310 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NCc1cccc2c1CCCN2 ZINC000423413848 566488390 /nfs/dbraw/zinc/48/83/90/566488390.db2.gz LHICKSVNVGHIFD-ZDUSSCGKSA-N 0 3 376.298 3.147 10 0 GGAEHN C[C@@]1(F)CNCCN(CC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000578070729 566489898 /nfs/dbraw/zinc/48/98/98/566489898.db2.gz DLGOYVUIYOVODM-FUHWJXTLSA-N 0 3 388.314 3.290 10 0 GGAEHN C[C@@]1(F)CNCCN(CC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000578070730 566490042 /nfs/dbraw/zinc/49/00/42/566490042.db2.gz DLGOYVUIYOVODM-SJLPKXTDSA-N 0 3 388.314 3.290 10 0 GGAEHN C[C@H](N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1)C(=O)Nc1nccs1 ZINC000578101724 566491143 /nfs/dbraw/zinc/49/11/43/566491143.db2.gz WEMVIRVTJZSYQX-NZVBXONLSA-N 0 3 382.892 3.298 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNCc1ncc(I)s1 ZINC000512003782 566504121 /nfs/dbraw/zinc/50/41/21/566504121.db2.gz ANHVLCWVVANGTN-PHIMTYICSA-N 0 3 379.311 3.100 10 0 GGAEHN COC(=O)[C@](C)(O)CN(Cc1ccccc1)Cc1ccc(Br)cc1 ZINC000578095979 566491851 /nfs/dbraw/zinc/49/18/51/566491851.db2.gz OXGPCUZFEJNGNU-LJQANCHMSA-N 0 3 392.293 3.375 10 0 GGAEHN CCN(C(=O)Cc1c(F)ccc(Br)c1F)C1CCN(C)CC1 ZINC000627616158 566492328 /nfs/dbraw/zinc/49/23/28/566492328.db2.gz DLDYTSAQUJXBJP-UHFFFAOYSA-N 0 3 375.257 3.213 10 0 GGAEHN CC(C)(C)NS(=O)(=O)CCN[C@H](c1ccc(Br)cc1)C1CC1 ZINC000538116455 566493513 /nfs/dbraw/zinc/49/35/13/566493513.db2.gz KZXUISUMCZLBMD-HNNXBMFYSA-N 0 3 389.359 3.208 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)N[C@H]1C[C@H](C)N(C3CC3)C1)CC2 ZINC000538126628 566494223 /nfs/dbraw/zinc/49/42/23/566494223.db2.gz NEYQJCQQRFNXNP-BBRMVZONSA-N 0 3 392.341 3.450 10 0 GGAEHN CC1(C)CCCN1CCNC(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000627697504 566499199 /nfs/dbraw/zinc/49/91/99/566499199.db2.gz CNFWKCCYKGYSMD-HYVNUMGLSA-N 0 3 377.326 3.325 10 0 GGAEHN OC[C@H](CN[C@H](c1ccc(Br)cc1)[C@H]1CCCO1)c1cccnc1 ZINC000672618411 566499346 /nfs/dbraw/zinc/49/93/46/566499346.db2.gz CIOXBKBCHZNYFQ-QXAKKESOSA-N 0 3 391.309 3.430 10 0 GGAEHN OC[C@H](CN[C@@H](c1ccc(Br)cc1)[C@@H]1CCCO1)c1cccnc1 ZINC000672618413 566499521 /nfs/dbraw/zinc/49/95/21/566499521.db2.gz CIOXBKBCHZNYFQ-WDSOQIARSA-N 0 3 391.309 3.430 10 0 GGAEHN CCc1ccccc1[C@H](N)CNC(=O)c1ccc(Br)cc1OC ZINC000423982077 566500725 /nfs/dbraw/zinc/50/07/25/566500725.db2.gz RFTHZQCMQGNLLH-MRXNPFEDSA-N 0 3 377.282 3.450 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(F)cc1Br ZINC000485470378 566501177 /nfs/dbraw/zinc/50/11/77/566501177.db2.gz QPNZZKLUBURCJY-QGZVFWFLSA-N 0 3 393.300 3.420 10 0 GGAEHN CN(C)CCOc1ccccc1C(=O)NCc1ccsc1Br ZINC000511975400 566501293 /nfs/dbraw/zinc/50/12/93/566501293.db2.gz CTKBXFUZCIIINL-UHFFFAOYSA-N 0 3 383.311 3.381 10 0 GGAEHN Cn1cc([C@@H](NC[C@H](O)COc2ccc(Br)cc2)C(C)(C)C)cn1 ZINC000538277032 566502853 /nfs/dbraw/zinc/50/28/53/566502853.db2.gz MEZJIBXNXGHZRJ-DOTOQJQBSA-N 0 3 396.329 3.299 10 0 GGAEHN Cc1csc(C(=O)N2CCC(N3CCCOCC3)CC2)c1Br ZINC000627741830 566502834 /nfs/dbraw/zinc/50/28/34/566502834.db2.gz WWWPBBIBBHCOAF-UHFFFAOYSA-N 0 3 387.343 3.146 10 0 GGAEHN CN(Cc1cccc(Br)c1)C[C@@H](O)COc1ccc2c(c1)OCO2 ZINC000511987182 566502860 /nfs/dbraw/zinc/50/28/60/566502860.db2.gz FRBRYCPRXUDKIE-OAHLLOKOSA-N 0 3 394.265 3.050 10 0 GGAEHN Cc1c(Br)ccc(C(=O)N2CCC(N3CCCOCC3)CC2)c1F ZINC000627741661 566502946 /nfs/dbraw/zinc/50/29/46/566502946.db2.gz QOIGQAIMIDXCSF-UHFFFAOYSA-N 0 3 399.304 3.224 10 0 GGAEHN Cc1cccc(C(=O)N2CCC(N3CCCOCC3)CC2)c1Br ZINC000627740998 566503289 /nfs/dbraw/zinc/50/32/89/566503289.db2.gz NFAFJXAVPNXJCC-UHFFFAOYSA-N 0 3 381.314 3.084 10 0 GGAEHN Cc1ccc(Br)c(C(=O)N2CCC(N3CCCOCC3)CC2)c1 ZINC000627740652 566503340 /nfs/dbraw/zinc/50/33/40/566503340.db2.gz ZRHOPHYFWBLKKE-UHFFFAOYSA-N 0 3 381.314 3.084 10 0 GGAEHN O=C(COc1c(Cl)cccc1Cl)N1CCC(N2CCCOCC2)CC1 ZINC000627737605 566503405 /nfs/dbraw/zinc/50/34/05/566503405.db2.gz DUBZPKVCTPXOSW-UHFFFAOYSA-N 0 3 387.307 3.086 10 0 GGAEHN Cn1cc([C@H](NC[C@@H](O)COc2ccc(Br)cc2)C(C)(C)C)cn1 ZINC000538277036 566503478 /nfs/dbraw/zinc/50/34/78/566503478.db2.gz MEZJIBXNXGHZRJ-WBVHZDCISA-N 0 3 396.329 3.299 10 0 GGAEHN Cc1ccc(CC(=O)N2CCC(N3CCCOCC3)CC2)cc1Br ZINC000627741300 566503577 /nfs/dbraw/zinc/50/35/77/566503577.db2.gz AOOLLPVHBRPOAX-UHFFFAOYSA-N 0 3 395.341 3.013 10 0 GGAEHN Cc1c(F)c(Br)ccc1C(=O)N1CCC(N2CCCOCC2)CC1 ZINC000627742698 566503864 /nfs/dbraw/zinc/50/38/64/566503864.db2.gz INOJQSIQIIVIOM-UHFFFAOYSA-N 0 3 399.304 3.224 10 0 GGAEHN O=C([C@@H]1CCOc2ccc(Br)cc21)N1CC[C@H](N2CCCC2)C1 ZINC000651235965 566504027 /nfs/dbraw/zinc/50/40/27/566504027.db2.gz QDFYSKLJFRDYSD-LSDHHAIUSA-N 0 3 379.298 3.012 10 0 GGAEHN CS(=O)(=O)N1CC[C@@H](CNC2(c3cc(C(F)(F)F)ccc3Cl)CC2)C1 ZINC000558740723 566504103 /nfs/dbraw/zinc/50/41/03/566504103.db2.gz CRTMVVLCJRCACH-NSHDSACASA-N 0 3 396.862 3.219 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1ccc(Br)c(OC(C)C)c1 ZINC000651261483 566505668 /nfs/dbraw/zinc/50/56/68/566505668.db2.gz JNPMCAKNWMFMQO-HNNXBMFYSA-N 0 3 399.329 3.077 10 0 GGAEHN C[C@H]1CC[C@H](C)N(CC(=O)N2CCN(c3ncc(Cl)cc3Cl)CC2)C1 ZINC000464825411 566506584 /nfs/dbraw/zinc/50/65/84/566506584.db2.gz WZYHHWPLESMKQI-KBPBESRZSA-N 0 3 385.339 3.157 10 0 GGAEHN O=C([C@@H]1CCOc2ccc(Br)cc21)N1CC[C@@H](N2CCCCC2)C1 ZINC000651290014 566507234 /nfs/dbraw/zinc/50/72/34/566507234.db2.gz GVCREGAPPJSOEG-HZPDHXFCSA-N 0 3 393.325 3.402 10 0 GGAEHN CCN1CCCC[C@@H]1CNC(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651305608 566509116 /nfs/dbraw/zinc/50/91/16/566509116.db2.gz PVGNATCGWCHVBE-HUUCEWRRSA-N 0 3 381.314 3.306 10 0 GGAEHN COCC[C@@H](Cc1cccc(Br)c1)C(=O)N1CCC[C@H]1CN(C)C ZINC000464930702 566509889 /nfs/dbraw/zinc/50/98/89/566509889.db2.gz FBAFZTHLUMOHSR-WMZOPIPTSA-N 0 3 397.357 3.197 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)CSCc1ccc(Br)cc1F ZINC000464925458 566509989 /nfs/dbraw/zinc/50/99/89/566509989.db2.gz DMGCXMNNRQTPOU-CQSZACIVSA-N 0 3 389.334 3.374 10 0 GGAEHN Cc1sc2ncnc(SCCC(=O)N3CCC[C@H]3CN(C)C)c2c1C ZINC000464927256 566510445 /nfs/dbraw/zinc/51/04/45/566510445.db2.gz RORWHNMVHYKXMZ-AWEZNQCLSA-N 0 3 378.567 3.343 10 0 GGAEHN Cc1[nH]c2ccc(Br)cc2c1CC(=O)N1CCC[C@H]1CN(C)C ZINC000464939282 566511897 /nfs/dbraw/zinc/51/18/97/566511897.db2.gz WPIDMXZXFCJMOZ-AWEZNQCLSA-N 0 3 378.314 3.334 10 0 GGAEHN CC[C@H](CO)N1CCN(c2ncc(Br)c3ccc(F)cc32)CC1 ZINC000651322595 566512098 /nfs/dbraw/zinc/51/20/98/566512098.db2.gz XROPOIVDWIRINE-CYBMUJFWSA-N 0 3 382.277 3.029 10 0 GGAEHN CC1(C)NC(=O)CC[C@@H]1NCc1ccc(I)c(Cl)c1 ZINC000558860180 566512247 /nfs/dbraw/zinc/51/22/47/566512247.db2.gz OCXMCRWDSGVSJL-LBPRGKRZSA-N 0 3 392.668 3.091 10 0 GGAEHN C[C@@H](O)CN1CCN(c2ncc(Br)c3ccc(F)cc32)[C@@H](C)C1 ZINC000651342835 566514236 /nfs/dbraw/zinc/51/42/36/566514236.db2.gz QKRGVIRWEWZASD-NWDGAFQWSA-N 0 3 382.277 3.028 10 0 GGAEHN CN(C[C@H]1CCCN(C)C1)C(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651347173 566515655 /nfs/dbraw/zinc/51/56/55/566515655.db2.gz ZYADSNWTGRDTIK-DZGCQCFKSA-N 0 3 381.314 3.115 10 0 GGAEHN COc1ccc(Br)cc1C[C@H](CO)CNCc1cncn1C(C)C ZINC000424170661 566517394 /nfs/dbraw/zinc/51/73/94/566517394.db2.gz IPRRNNKMRURTBL-AWEZNQCLSA-N 0 3 396.329 3.176 10 0 GGAEHN CC(C)CN(C)CCCNc1c(Br)cccc1S(C)(=O)=O ZINC000651363208 566518470 /nfs/dbraw/zinc/51/84/70/566518470.db2.gz QUGVGAZQPQPNJX-UHFFFAOYSA-N 0 3 377.348 3.242 10 0 GGAEHN COc1ccc(Br)cc1C[C@@H](CO)CNCc1cncn1C(C)C ZINC000424170664 566518522 /nfs/dbraw/zinc/51/85/22/566518522.db2.gz IPRRNNKMRURTBL-CQSZACIVSA-N 0 3 396.329 3.176 10 0 GGAEHN OCCN1CCCC[C@@H]1CN[C@@H](c1ccc(Br)cc1)[C@@H]1CCCO1 ZINC000651379975 566519899 /nfs/dbraw/zinc/51/98/99/566519899.db2.gz IUJRJOGDMIKJPY-QYZOEREBSA-N 0 3 397.357 3.106 10 0 GGAEHN O=C(NC[C@H]1CCCCN1CCO)N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000578417623 566520925 /nfs/dbraw/zinc/52/09/25/566520925.db2.gz LFQMEFXSXGTGRZ-GDBMZVCRSA-N 0 3 383.945 3.023 10 0 GGAEHN CN(CCN1CCCCC1)C(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000628010787 566522576 /nfs/dbraw/zinc/52/25/76/566522576.db2.gz APKWOQYLPASZKU-BPQIPLTHSA-N 0 3 377.326 3.279 10 0 GGAEHN CN(C)[C@]1(CNC(=O)c2cnc(-c3c(F)cccc3F)s2)CCSC1 ZINC000651434768 566522890 /nfs/dbraw/zinc/52/28/90/566522890.db2.gz LGZSQNITDRRHNQ-KRWDZBQOSA-N 0 3 383.489 3.255 10 0 GGAEHN O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1nscc1Br ZINC000651452562 566523468 /nfs/dbraw/zinc/52/34/68/566523468.db2.gz PVHTWYMVOYEACR-UHFFFAOYSA-N 0 3 396.310 3.115 10 0 GGAEHN O=C1C[C@@H]([C@H]2CCCCN2Cc2ccnc3c(Br)cccc23)CN1 ZINC000449040154 566525976 /nfs/dbraw/zinc/52/59/76/566525976.db2.gz GUXFJAKZXOEZGP-RHSMWYFYSA-N 0 3 388.309 3.488 10 0 GGAEHN CS(=O)(=O)CCCCN[C@H]1CCCOc2ccc(Br)cc21 ZINC000424308776 566527570 /nfs/dbraw/zinc/52/75/70/566527570.db2.gz PDDJIXFUNLYRIQ-AWEZNQCLSA-N 0 3 376.316 3.077 10 0 GGAEHN C[C@H](NCc1ccc(S(=O)(=O)N(C)C)cc1)c1ccc2ncsc2c1 ZINC000485823296 566528947 /nfs/dbraw/zinc/52/89/47/566528947.db2.gz PBQCAZJKJWSWAZ-ZDUSSCGKSA-N 0 3 375.519 3.397 10 0 GGAEHN C[C@H](NCc1ccc(S(=O)(=O)N2CCOCC2)s1)[C@@H]1CCCC[C@H]1C ZINC000449128781 566531413 /nfs/dbraw/zinc/53/14/13/566531413.db2.gz ARCXFIWBBKNDCI-HLLBOEOZSA-N 0 3 386.583 3.073 10 0 GGAEHN COc1ccccc1/C=C\CNCCNC(=O)c1cccc(Br)c1 ZINC000603518243 566531823 /nfs/dbraw/zinc/53/18/23/566531823.db2.gz JCZFMYVMGMUWLI-YVMONPNESA-N 0 3 389.293 3.491 10 0 GGAEHN Cc1nccc(NC(=O)N[C@H](C)CN(C)Cc2ccccc2)c1Br ZINC000578552365 566533619 /nfs/dbraw/zinc/53/36/19/566533619.db2.gz JYOUPBUKLRQXHN-CYBMUJFWSA-N 0 3 391.313 3.216 10 0 GGAEHN O=S(=O)(C[C@H](O)CN[C@H]1CC[C@H](c2ccc(Cl)cc2)C1)c1cccs1 ZINC000449195742 566535862 /nfs/dbraw/zinc/53/58/62/566535862.db2.gz VQGXOUUJCGNZJL-BHYGNILZSA-N 0 3 399.965 3.462 10 0 GGAEHN O=S(=O)(C[C@H](O)CN[C@@H]1CC[C@H](c2ccc(Cl)cc2)C1)c1cccs1 ZINC000449195745 566535966 /nfs/dbraw/zinc/53/59/66/566535966.db2.gz VQGXOUUJCGNZJL-USXIJHARSA-N 0 3 399.965 3.462 10 0 GGAEHN NC(=O)N[C@H]1CCN(Cc2ccc(-c3ccccc3Br)s2)C1 ZINC000538795780 566536613 /nfs/dbraw/zinc/53/66/13/566536613.db2.gz VYDRYFHYROGSGL-NSHDSACASA-N 0 3 380.311 3.420 10 0 GGAEHN CN1CC[C@@H](NCc2cccc(S(C)(=O)=O)c2)[C@H]1c1ccc(Cl)cc1 ZINC000449212994 566537058 /nfs/dbraw/zinc/53/70/58/566537058.db2.gz JSGZONPRYDVRGI-RTBURBONSA-N 0 3 378.925 3.279 10 0 GGAEHN CNC(=O)[C@@H](C)Oc1ccc(Br)cc1CNC[C@@H]1CCC(C)(C)O1 ZINC000449259666 566542511 /nfs/dbraw/zinc/54/25/11/566542511.db2.gz RYPVSCQFZNKPDU-DOMZBBRYSA-N 0 3 399.329 3.010 10 0 GGAEHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)Cc1noc2ccc(Br)cc21 ZINC000424604058 566544960 /nfs/dbraw/zinc/54/49/60/566544960.db2.gz GVEINKNFYFYXTP-QWHCGFSZSA-N 0 3 394.313 3.369 10 0 GGAEHN OC[C@H](CNCc1cc(Br)ccc1OC(F)F)c1cccnc1 ZINC000673616361 566546560 /nfs/dbraw/zinc/54/65/60/566546560.db2.gz SDHSGQZDBBHQAU-ZDUSSCGKSA-N 0 3 387.224 3.311 10 0 GGAEHN COc1ncc(C(=O)N(CCN(C)C)c2ccccc2)cc1Br ZINC000424619000 566546602 /nfs/dbraw/zinc/54/66/02/566546602.db2.gz AUDLYAZVZYBPAN-UHFFFAOYSA-N 0 3 378.270 3.061 10 0 GGAEHN Cc1cc(Br)cc(C)c1CNC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000465806747 566546519 /nfs/dbraw/zinc/54/65/19/566546519.db2.gz GUJOPEIUSJNORU-INIZCTEOSA-N 0 3 378.314 3.222 10 0 GGAEHN O=C(Cc1noc2ccc(Br)cc21)N1CCC[C@@H]1CN1CCCC1 ZINC000424622639 566548308 /nfs/dbraw/zinc/54/83/08/566548308.db2.gz GRWOZVYPQZYNSV-CQSZACIVSA-N 0 3 392.297 3.220 10 0 GGAEHN CC(C)(C)[C@H](O)C[C@@H](CO)NCc1ccnc2c(Br)cccc12 ZINC000449309701 566548268 /nfs/dbraw/zinc/54/82/68/566548268.db2.gz FDQCXWYBNUPVDG-XJKSGUPXSA-N 0 3 381.314 3.245 10 0 GGAEHN COc1ncc(C(=O)N(CCN(C)C)Cc2ccccc2)cc1Br ZINC000424623391 566548548 /nfs/dbraw/zinc/54/85/48/566548548.db2.gz ZLZROTLVUPTUAQ-UHFFFAOYSA-N 0 3 392.297 3.057 10 0 GGAEHN CN(C(=O)C1(c2cc(F)cc(Br)c2)CC1)[C@@H]1CCN(C2CC2)C1 ZINC000512676428 566549505 /nfs/dbraw/zinc/54/95/05/566549505.db2.gz BKGFCAGHZQMOGN-MRXNPFEDSA-N 0 3 381.289 3.315 10 0 GGAEHN Cc1oc(Br)cc1C(=O)NCc1ccc(OCCN(C)C)cc1 ZINC000424635750 566550669 /nfs/dbraw/zinc/55/06/69/566550669.db2.gz GLLRADXGTWJCSV-UHFFFAOYSA-N 0 3 381.270 3.221 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)NCCc1nc(C(F)(F)F)cs1 ZINC000465907531 566551223 /nfs/dbraw/zinc/55/12/23/566551223.db2.gz SUVFLVURYPRUJY-VXGBXAGGSA-N 0 3 378.464 3.267 10 0 GGAEHN Cc1ccc(CNC[C@@H]2CS(=O)(=O)c3ccccc32)cc1Br ZINC000449357301 566551758 /nfs/dbraw/zinc/55/17/58/566551758.db2.gz KWIROWKOWCORFN-CQSZACIVSA-N 0 3 380.307 3.418 10 0 GGAEHN Cc1cc(Br)ccc1CNC[C@@H]1CS(=O)(=O)c2ccccc21 ZINC000449361152 566552064 /nfs/dbraw/zinc/55/20/64/566552064.db2.gz WVDQUJFPOMLEHS-CQSZACIVSA-N 0 3 380.307 3.418 10 0 GGAEHN CC(C)CN(CCN(C)C)C(=O)Cc1noc2ccc(Br)cc21 ZINC000424650340 566552426 /nfs/dbraw/zinc/55/24/26/566552426.db2.gz UIEGJABROBNNLI-UHFFFAOYSA-N 0 3 382.302 3.179 10 0 GGAEHN C[C@@H]1[C@@H](N2CCCC2)CCN1S(=O)(=O)Cc1cc(Cl)sc1Cl ZINC000651705029 566553395 /nfs/dbraw/zinc/55/33/95/566553395.db2.gz DTBRPXSSNRORAU-PWSUYJOCSA-N 0 3 383.366 3.443 10 0 GGAEHN OC[C@@]1(NCc2ccc3c(n2)CCC3)CCc2cc(Br)ccc2C1 ZINC000628423775 566553624 /nfs/dbraw/zinc/55/36/24/566553624.db2.gz KDENUDLCHSJPMR-HXUWFJFHSA-N 0 3 387.321 3.342 10 0 GGAEHN OC[C@]1(NCc2ccc3c(n2)CCC3)CCc2cc(Br)ccc2C1 ZINC000628423774 566553825 /nfs/dbraw/zinc/55/38/25/566553825.db2.gz KDENUDLCHSJPMR-FQEVSTJZSA-N 0 3 387.321 3.342 10 0 GGAEHN COc1ncc(C(=O)N(CC(C)C)C2CCN(C)CC2)cc1Br ZINC000424654273 566553655 /nfs/dbraw/zinc/55/36/55/566553655.db2.gz IDMDUBQNMVHRSX-UHFFFAOYSA-N 0 3 384.318 3.045 10 0 GGAEHN CN(Cc1cc(Br)cc(C(F)(F)F)c1)[C@H]1CCN2CCO[C@H]1C2 ZINC000449365975 566554280 /nfs/dbraw/zinc/55/42/80/566554280.db2.gz VEBLDMYNWXFHNL-GJZGRUSLSA-N 0 3 393.247 3.373 10 0 GGAEHN CN(Cc1ccc(Br)cc1C(F)(F)F)[C@@H]1CCN2CCO[C@H]1C2 ZINC000449367184 566554653 /nfs/dbraw/zinc/55/46/53/566554653.db2.gz ZXXDYYTVDIFRIY-CABCVRRESA-N 0 3 393.247 3.373 10 0 GGAEHN CN(Cc1ccc(Br)cc1C(F)(F)F)[C@H]1CCN2CCO[C@H]1C2 ZINC000449367185 566554744 /nfs/dbraw/zinc/55/47/44/566554744.db2.gz ZXXDYYTVDIFRIY-GJZGRUSLSA-N 0 3 393.247 3.373 10 0 GGAEHN CN1CCC[C@]2(CCN(S(=O)(=O)Cc3cc(Cl)sc3Cl)C2)C1 ZINC000651717776 566555237 /nfs/dbraw/zinc/55/52/37/566555237.db2.gz RVTDXNBICRYQSK-AWEZNQCLSA-N 0 3 383.366 3.302 10 0 GGAEHN COC[C@](C)(O)CCNCc1cnc(-c2ccc(Br)cc2)s1 ZINC000449384061 566555623 /nfs/dbraw/zinc/55/56/23/566555623.db2.gz MADHONBOVHDBMN-MRXNPFEDSA-N 0 3 385.327 3.450 10 0 GGAEHN COC[C@@](C)(O)CCNCc1cc(Br)cc(C)c1OC(F)F ZINC000449383190 566555885 /nfs/dbraw/zinc/55/58/85/566555885.db2.gz FOXIFQDULSOEEH-HNNXBMFYSA-N 0 3 382.245 3.236 10 0 GGAEHN COC[C@](C)(O)CCNCc1cc(Br)cc(C)c1OC(F)F ZINC000449383191 566556209 /nfs/dbraw/zinc/55/62/09/566556209.db2.gz FOXIFQDULSOEEH-OAHLLOKOSA-N 0 3 382.245 3.236 10 0 GGAEHN Cc1cnc(CN2CC[C@H](Cc3cccc(I)c3)C2)cn1 ZINC000449388747 566556420 /nfs/dbraw/zinc/55/64/20/566556420.db2.gz BBNUJZNIFNQYJX-OAHLLOKOSA-N 0 3 393.272 3.454 10 0 GGAEHN Cc1c[nH]nc1CN1CC[C@@H](Cc2cccc(I)c2)C1 ZINC000449391090 566556622 /nfs/dbraw/zinc/55/66/22/566556622.db2.gz HRAOWAVATVAXFW-AWEZNQCLSA-N 0 3 381.261 3.387 10 0 GGAEHN COc1cc(OC)c([C@H](C)NCCC2CCS(=O)(=O)CC2)cc1Cl ZINC000539048719 566556716 /nfs/dbraw/zinc/55/67/16/566556716.db2.gz SJYOUEIHGTVYLY-LBPRGKRZSA-N 0 3 375.918 3.223 10 0 GGAEHN COC[C@](C)(O)CCNCc1ccc(OC(F)(F)F)c(Br)c1 ZINC000449388316 566556776 /nfs/dbraw/zinc/55/67/76/566556776.db2.gz ZJKIOTUSXCTYLB-CYBMUJFWSA-N 0 3 386.208 3.225 10 0 GGAEHN Cc1ccc(I)c(C(=O)N(CCN(C)C)CC(C)C)c1 ZINC000512785404 566557604 /nfs/dbraw/zinc/55/76/04/566557604.db2.gz IJILMRKJUQRHDA-UHFFFAOYSA-N 0 3 388.293 3.259 10 0 GGAEHN OC[C@]12CCC[C@H]1CN(Cc1c[nH]nc1-c1ccc(Br)s1)C2 ZINC000628461458 566557698 /nfs/dbraw/zinc/55/76/98/566557698.db2.gz ANRQWFKBDFZTGS-BLLLJJGKSA-N 0 3 382.327 3.495 10 0 GGAEHN COc1cc(CNCC2=CCOCC2)cc(Br)c1OC(F)F ZINC000449401694 566558197 /nfs/dbraw/zinc/55/81/97/566558197.db2.gz IFBRPBODJYNLSX-UHFFFAOYSA-N 0 3 378.213 3.495 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)Cc2noc3ccc(Br)cc32)CCN1C ZINC000424688240 566558320 /nfs/dbraw/zinc/55/83/20/566558320.db2.gz NUVTYYFRXTYQTO-AAEUAGOBSA-N 0 3 380.286 3.074 10 0 GGAEHN Cc1nc(CNC2CCN(Cc3ccncc3)CC2)sc1Br ZINC000449402239 566559008 /nfs/dbraw/zinc/55/90/08/566559008.db2.gz QFGFVUYMAQDXEQ-UHFFFAOYSA-N 0 3 381.343 3.363 10 0 GGAEHN Cc1cc(Br)c(S(=O)(=O)[N-]CCC[N@@H+](C)CC(C)C)s1 ZINC000651769177 566559741 /nfs/dbraw/zinc/55/97/41/566559741.db2.gz VEFYSECLWICLPW-UHFFFAOYSA-N 0 3 383.377 3.075 10 0 GGAEHN Cc1cc(Br)c(S(=O)(=O)[N-]CCC[N@H+](C)CC(C)C)s1 ZINC000651769177 566559745 /nfs/dbraw/zinc/55/97/45/566559745.db2.gz VEFYSECLWICLPW-UHFFFAOYSA-N 0 3 383.377 3.075 10 0 GGAEHN CN(C)C[C@@H](CNS(=O)(=O)C[C@@H]1CCCC1(F)F)c1ccc(Cl)cc1 ZINC000651764836 566559955 /nfs/dbraw/zinc/55/99/55/566559955.db2.gz QIHAOZCAWNOYEM-CABCVRRESA-N 0 3 394.915 3.340 10 0 GGAEHN CCOc1cc(CN[C@@H](CC)[C@@H](O)C(F)F)cc(Br)c1OC ZINC000449426531 566559986 /nfs/dbraw/zinc/55/99/86/566559986.db2.gz VEDKVQJWQCGOPX-WCQYABFASA-N 0 3 382.245 3.351 10 0 GGAEHN CC[C@H](NCc1cc(Br)c2c(c1)OCCCO2)[C@H](O)C(F)F ZINC000449429446 566562260 /nfs/dbraw/zinc/56/22/60/566562260.db2.gz ZZZUHACFMFKTIZ-AAEUAGOBSA-N 0 3 380.229 3.105 10 0 GGAEHN CNS(=O)(=O)C[C@@H]1CCCN(Cc2ccc(-c3ccccc3F)s2)C1 ZINC000628496576 566562677 /nfs/dbraw/zinc/56/26/77/566562677.db2.gz UNSIUHSKKVQEBP-CQSZACIVSA-N 0 3 382.526 3.315 10 0 GGAEHN CN(C)CCn1cc(NC(=O)N(C)Cc2cc(Br)ccc2F)cn1 ZINC000673867642 566564110 /nfs/dbraw/zinc/56/41/10/566564110.db2.gz PZKOXYXQIUCFEX-UHFFFAOYSA-N 0 3 398.280 3.010 10 0 GGAEHN CN1CC[C@H]2[C@H](CCCN2C(=O)Cc2noc3ccc(Br)cc32)C1 ZINC000424737960 566564500 /nfs/dbraw/zinc/56/45/00/566564500.db2.gz LZBFAIZVVNINIP-WBMJQRKESA-N 0 3 392.297 3.076 10 0 GGAEHN C[C@@H](NCc1ccc(Br)c2cccnc12)C1(S(C)(=O)=O)CC1 ZINC000512879343 566565905 /nfs/dbraw/zinc/56/59/05/566565905.db2.gz CJQMGLVKRNUOQO-LLVKDONJSA-N 0 3 383.311 3.053 10 0 GGAEHN COc1ncc(C(=O)Nc2cc(C)cc(CN(C)C)c2)cc1Br ZINC000424750655 566566307 /nfs/dbraw/zinc/56/63/07/566566307.db2.gz LLKXSFHPALNWKS-UHFFFAOYSA-N 0 3 378.270 3.475 10 0 GGAEHN C[C@H](C1CCN(C)CC1)N(C)C(=O)Cc1noc2ccc(Br)cc21 ZINC000424745419 566566784 /nfs/dbraw/zinc/56/67/84/566566784.db2.gz KCGNNHLCXDSAAY-GFCCVEGCSA-N 0 3 394.313 3.322 10 0 GGAEHN C[C@@H]1OCC[C@H]1N(CCO)Cc1ccc(Br)c(Br)c1 ZINC000449676929 566589360 /nfs/dbraw/zinc/58/93/60/566589360.db2.gz KLKHDOSCXRLMRP-IINYFYTJSA-N 0 3 393.119 3.183 10 0 GGAEHN CC[C@@H]1C[C@H](C[NH2+]CC[N-]S(=O)(=O)c2cccc(Cl)c2Cl)CCO1 ZINC000512903528 566568244 /nfs/dbraw/zinc/56/82/44/566568244.db2.gz AIWWCSQJYSRSRO-CHWSQXEVSA-N 0 3 395.352 3.067 10 0 GGAEHN CCN1CCC(NC(=O)N2CCc3cc(Br)cc(C)c3C2)CC1 ZINC000539226040 566568632 /nfs/dbraw/zinc/56/86/32/566568632.db2.gz KUXACTWDBDVPGM-UHFFFAOYSA-N 0 3 380.330 3.310 10 0 GGAEHN CC(C)N1CCC[C@@H](NC(=O)Cc2noc3ccc(Br)cc32)C1 ZINC000424775070 566568809 /nfs/dbraw/zinc/56/88/09/566568809.db2.gz HVAFCFHEHLMFBB-CYBMUJFWSA-N 0 3 380.286 3.122 10 0 GGAEHN C[C@H](CNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1)Oc1ccc(Br)cc1 ZINC000466369703 566570340 /nfs/dbraw/zinc/57/03/40/566570340.db2.gz ZQCMGONMCADHEO-SQWLQELKSA-N 0 3 398.345 3.341 10 0 GGAEHN FC(F)(F)COc1ccccc1CNCCn1cc(Br)cn1 ZINC000512977384 566570492 /nfs/dbraw/zinc/57/04/92/566570492.db2.gz KWPGJAAKQLDMGK-UHFFFAOYSA-N 0 3 378.192 3.377 10 0 GGAEHN CC(C)N1CC[C@H](NC(=O)[C@@H](N)CC(F)F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000578985803 566570504 /nfs/dbraw/zinc/57/05/04/566570504.db2.gz VSWICSRNCHJGCF-DZKIICNBSA-N 0 3 377.838 3.102 10 0 GGAEHN C[C@H](CNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1)Oc1ccc(Br)cc1 ZINC000466369701 566570802 /nfs/dbraw/zinc/57/08/02/566570802.db2.gz ZQCMGONMCADHEO-IIAWOOMASA-N 0 3 398.345 3.341 10 0 GGAEHN C[C@H](CNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1)Oc1ccc(Br)cc1 ZINC000466369702 566570918 /nfs/dbraw/zinc/57/09/18/566570918.db2.gz ZQCMGONMCADHEO-LZWOXQAQSA-N 0 3 398.345 3.341 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)N[C@@H]1CN(C3CC3)C[C@@H]1C)CC2 ZINC000539285385 566571955 /nfs/dbraw/zinc/57/19/55/566571955.db2.gz PJHWKYIDYIYIRG-SCLBCKFNSA-N 0 3 392.341 3.308 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@H]1CNCc1ccc(Br)c(Cl)c1 ZINC000512988006 566572067 /nfs/dbraw/zinc/57/20/67/566572067.db2.gz FLHAJNRIAJAMBR-LBPRGKRZSA-N 0 3 395.750 3.006 10 0 GGAEHN CN(C)C1(CN(C)C(=O)Cc2noc3ccc(Br)cc32)CCC1 ZINC000424798736 566572086 /nfs/dbraw/zinc/57/20/86/566572086.db2.gz JHCJHNKPSYTJGW-UHFFFAOYSA-N 0 3 380.286 3.076 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@@H]1CNCc1ccc(-c2cccc(F)c2)s1 ZINC000512992606 566572248 /nfs/dbraw/zinc/57/22/48/566572248.db2.gz MINPGSPQYLWNCK-MRXNPFEDSA-N 0 3 382.526 3.458 10 0 GGAEHN OC[C@]1(CNCc2cnc3ccc(Br)cn23)CCc2ccccc21 ZINC000651884531 566572803 /nfs/dbraw/zinc/57/28/03/566572803.db2.gz KKMXFSNSRWFULA-LJQANCHMSA-N 0 3 386.293 3.063 10 0 GGAEHN COc1cc(Br)ccc1[C@@H]1CCCN1C(=O)C1CCN(C)CC1 ZINC000628675535 566573879 /nfs/dbraw/zinc/57/38/79/566573879.db2.gz DACZFBRGQIMXSN-INIZCTEOSA-N 0 3 381.314 3.463 10 0 GGAEHN C/C(=C\c1ccc(Cl)cc1)CNCCS(=O)(=O)NCc1ccccc1 ZINC000513019496 566574587 /nfs/dbraw/zinc/57/45/87/566574587.db2.gz DKHBYAUTYVSCNH-DTQAZKPQSA-N 0 3 378.925 3.453 10 0 GGAEHN COC[C@@](C)(CO)NCc1ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc1 ZINC000674067498 566575075 /nfs/dbraw/zinc/57/50/75/566575075.db2.gz KETZQIGENWJJLP-QWHCGFSZSA-N 0 3 375.309 3.046 10 0 GGAEHN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN[C@H]1C[C@@H](C(N)=O)C1 ZINC000651939818 566577981 /nfs/dbraw/zinc/57/79/81/566577981.db2.gz RRLDUQZVWQVFSN-JNSHFYNHSA-N 0 3 391.313 3.112 10 0 GGAEHN OC[C@@H](CNCc1cnn2ccccc12)Cc1cc(Br)ccc1F ZINC000449597865 566578821 /nfs/dbraw/zinc/57/88/21/566578821.db2.gz GRIRNAMXOXEYRQ-CYBMUJFWSA-N 0 3 392.272 3.177 10 0 GGAEHN OC[C@H](CNCc1cnn2ccccc12)Cc1cc(Br)ccc1F ZINC000449597871 566579037 /nfs/dbraw/zinc/57/90/37/566579037.db2.gz GRIRNAMXOXEYRQ-ZDUSSCGKSA-N 0 3 392.272 3.177 10 0 GGAEHN Cc1ccc([O-])c(C[NH2+]C[C@@H](CO)Cc2ccc(C)c(Br)c2)n1 ZINC000449596415 566579135 /nfs/dbraw/zinc/57/91/35/566579135.db2.gz AZEKDZREAXDQRZ-HNNXBMFYSA-N 0 3 379.298 3.107 10 0 GGAEHN COc1ccc(C[C@@H](CO)CNCc2cnccc2C)cc1Br ZINC000449597519 566579160 /nfs/dbraw/zinc/57/91/60/566579160.db2.gz FIUUQSQDOYLAMM-OAHLLOKOSA-N 0 3 379.298 3.102 10 0 GGAEHN C[C@@H]1CN(C(=O)Cc2noc3ccc(Br)cc32)CCN(C2CC2)C1 ZINC000424857657 566580125 /nfs/dbraw/zinc/58/01/25/566580125.db2.gz XHZDZHVEFFLUHX-LBPRGKRZSA-N 0 3 392.297 3.076 10 0 GGAEHN C[C@H]1CN(C(=O)Cc2noc3ccc(Br)cc32)CCN(C2CC2)C1 ZINC000424857654 566580431 /nfs/dbraw/zinc/58/04/31/566580431.db2.gz XHZDZHVEFFLUHX-GFCCVEGCSA-N 0 3 392.297 3.076 10 0 GGAEHN COc1cc(C)nc(CNC[C@H](CO)Cc2cc(Br)ccc2F)c1 ZINC000449599805 566580910 /nfs/dbraw/zinc/58/09/10/566580910.db2.gz MCJGUWAPTCULGI-CYBMUJFWSA-N 0 3 397.288 3.241 10 0 GGAEHN COC(=O)C[C@](C)(NCCN1CCCCC1)c1ccc(Br)cc1 ZINC000513116327 566581984 /nfs/dbraw/zinc/58/19/84/566581984.db2.gz CQYBLNBAMOATJL-SFHVURJKSA-N 0 3 383.330 3.303 10 0 GGAEHN COC(=O)C[C@](C)(NCCOCC(F)(F)F)c1ccc(Br)cc1 ZINC000513143188 566582513 /nfs/dbraw/zinc/58/25/13/566582513.db2.gz ANDMLYBISIGXFM-AWEZNQCLSA-N 0 3 398.219 3.396 10 0 GGAEHN CC(=O)N1CCN(CCN[C@H](C)c2cc3cc(Br)ccc3o2)CC1 ZINC000539500208 566584778 /nfs/dbraw/zinc/58/47/78/566584778.db2.gz UGWZTIUUPDHZLY-CYBMUJFWSA-N 0 3 394.313 3.010 10 0 GGAEHN COC(=O)C[C@](C)(NCC1(CC(=O)OC)CC1)c1ccc(Br)cc1 ZINC000513149955 566584803 /nfs/dbraw/zinc/58/48/03/566584803.db2.gz NOFOFCBUGVNOBN-KRWDZBQOSA-N 0 3 398.297 3.160 10 0 GGAEHN COC(=O)C[C@](C)(NC[C@H](O)CC(F)(F)F)c1ccc(Br)cc1 ZINC000513168736 566585071 /nfs/dbraw/zinc/58/50/71/566585071.db2.gz VYKBXCNPUBCEPT-OCCSQVGLSA-N 0 3 398.219 3.130 10 0 GGAEHN CCOc1cc(CNC[C@H](CO)c2cccnc2)cc(Br)c1OC ZINC000579156595 566585226 /nfs/dbraw/zinc/58/52/26/566585226.db2.gz FELYXQNAMHGHPG-OAHLLOKOSA-N 0 3 395.297 3.117 10 0 GGAEHN Cn1c(=O)ccc2c1CCC[C@@H]2NCc1cc2c(c(Br)c1)OCO2 ZINC000652044996 566585525 /nfs/dbraw/zinc/58/55/25/566585525.db2.gz XNNRABJFNGFYET-AWEZNQCLSA-N 0 3 391.265 3.044 10 0 GGAEHN C[C@H](NC(=O)c1cccc(CN2CCCC2)c1)c1ncc(Br)cn1 ZINC000486411870 566586084 /nfs/dbraw/zinc/58/60/84/566586084.db2.gz XQLCHWGAXKPPDR-ZDUSSCGKSA-N 0 3 389.297 3.326 10 0 GGAEHN OC1CCN(CCNCc2cnc(-c3ccc(Br)cc3)s2)CC1 ZINC000449644834 566586601 /nfs/dbraw/zinc/58/66/01/566586601.db2.gz GQYDOGDXKCWNET-UHFFFAOYSA-N 0 3 396.354 3.119 10 0 GGAEHN C[C@@H]1OCC[C@@H]1N(CCO)Cc1ccc(OC(F)F)c(Br)c1 ZINC000449677315 566589490 /nfs/dbraw/zinc/58/94/90/566589490.db2.gz MHTKWIKAWBWECF-GWCFXTLKSA-N 0 3 380.229 3.022 10 0 GGAEHN C[C@@H]1OCC[C@H]1N(CCO)Cc1cc(Br)cc(Br)c1 ZINC000449677124 566589561 /nfs/dbraw/zinc/58/95/61/566589561.db2.gz LQHJFYAHYDBHBU-IINYFYTJSA-N 0 3 393.119 3.183 10 0 GGAEHN C[C@@H]1OCC[C@@H]1N(CCO)Cc1ccc(Br)c(Br)c1 ZINC000449676928 566589568 /nfs/dbraw/zinc/58/95/68/566589568.db2.gz KLKHDOSCXRLMRP-HZMBPMFUSA-N 0 3 393.119 3.183 10 0 GGAEHN COC[C@@](C)(CCO)NCc1cc(Br)cc(Br)c1 ZINC000579220587 566589759 /nfs/dbraw/zinc/58/97/59/566589759.db2.gz FRGAQHMRMVGJMG-CYBMUJFWSA-N 0 3 381.108 3.089 10 0 GGAEHN OC[C@@H](CNCc1cnn2ccccc12)Cc1ccc(F)c(Br)c1 ZINC000449681133 566590990 /nfs/dbraw/zinc/59/09/90/566590990.db2.gz LGYBBIHWPLDPGV-CQSZACIVSA-N 0 3 392.272 3.177 10 0 GGAEHN C[C@H]1OCC[C@@H]1N(CCO)Cc1ccc(Br)cc1C(F)(F)F ZINC000449684270 566591138 /nfs/dbraw/zinc/59/11/38/566591138.db2.gz ZVVSHFLGDFKFBS-YGRLFVJLSA-N 0 3 382.220 3.440 10 0 GGAEHN CC[C@H](NC(=O)N(C)[C@@H]1CCN(C2CC2)C1)c1nc(C(F)(F)F)cs1 ZINC000466696605 566592200 /nfs/dbraw/zinc/59/22/00/566592200.db2.gz OHBKFJCBAOINIS-NEPJUHHUSA-N 0 3 376.448 3.491 10 0 GGAEHN CCCN1CCC[C@H]1CNC(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000652140529 566593347 /nfs/dbraw/zinc/59/33/47/566593347.db2.gz SQTDEWFIFPCGIM-GJZGRUSLSA-N 0 3 381.314 3.306 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)c2cc(Br)cnc2OCC2CC2)CCN1C ZINC000513299047 566594122 /nfs/dbraw/zinc/59/41/22/566594122.db2.gz ROVKPLVRKTVCAU-IUODEOHRSA-N 0 3 396.329 3.188 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)c2cc(Br)cnc2OCC2CC2)CCN1C ZINC000513299048 566594152 /nfs/dbraw/zinc/59/41/52/566594152.db2.gz ROVKPLVRKTVCAU-SWLSCSKDSA-N 0 3 396.329 3.188 10 0 GGAEHN Cc1cc(S(=O)(=O)[N-]Cc2ccc(CC[NH+](C)C)cc2)c(Cl)cc1F ZINC000466730411 566594580 /nfs/dbraw/zinc/59/45/80/566594580.db2.gz FDIPPNZMYQNFSN-UHFFFAOYSA-N 0 3 384.904 3.370 10 0 GGAEHN COc1ncc(C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)cc1Cl ZINC000560103332 566598242 /nfs/dbraw/zinc/59/82/42/566598242.db2.gz QKKYCEGBIKWDOI-ZDUSSCGKSA-N 0 3 379.913 3.447 10 0 GGAEHN Cc1cc(NC(=O)NC2CCN(C)CC2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000539730257 566598526 /nfs/dbraw/zinc/59/85/26/566598526.db2.gz IXJADNFFEWJUFN-UHFFFAOYSA-N 0 3 382.295 3.125 10 0 GGAEHN C[C@H](CCc1ccc(Br)cc1)NC(=O)N1CCN2CCC1CC2 ZINC000560098272 566598588 /nfs/dbraw/zinc/59/85/88/566598588.db2.gz YQLOSPUFPHNGFK-CQSZACIVSA-N 0 3 380.330 3.260 10 0 GGAEHN COc1c(Br)ccc(F)c1C(=O)NC[C@H]1CCN1C1CCCC1 ZINC000628966349 566598709 /nfs/dbraw/zinc/59/87/09/566598709.db2.gz PQJHYDCEYABRDR-GFCCVEGCSA-N 0 3 385.277 3.344 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCC1)[C@@H]1CCOc2ccc(Br)cc21 ZINC000628966375 566598751 /nfs/dbraw/zinc/59/87/51/566598751.db2.gz QZXCFJMYBHSSJO-HZPDHXFCSA-N 0 3 393.325 3.448 10 0 GGAEHN CC(C)(C)n1cc(Br)c(C(=O)NC[C@H]2CCN2C2CCCC2)n1 ZINC000628965993 566599010 /nfs/dbraw/zinc/59/90/10/566599010.db2.gz GNFRDPOLOUCCMX-CYBMUJFWSA-N 0 3 383.334 3.147 10 0 GGAEHN O=C(CCOc1ccccc1Br)NC[C@H]1CCN1C1CCCC1 ZINC000628966712 566599357 /nfs/dbraw/zinc/59/93/57/566599357.db2.gz MJDPCJYWUGIGSQ-OAHLLOKOSA-N 0 3 381.314 3.351 10 0 GGAEHN CN(C)CCn1cc(NC(=O)N2CCc3cc(Cl)cc(Cl)c3C2)cn1 ZINC000674572484 566599791 /nfs/dbraw/zinc/59/97/91/566599791.db2.gz OISKGZBVJREWSD-UHFFFAOYSA-N 0 3 382.295 3.342 10 0 GGAEHN CN(C[C@H](O)COc1ccc(Cl)cc1Br)C[C@@H]1CCCCO1 ZINC000513414427 566599931 /nfs/dbraw/zinc/59/99/31/566599931.db2.gz DKKDGDGQMATNEB-KBPBESRZSA-N 0 3 392.721 3.343 10 0 GGAEHN C[C@@H](C(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1)N1CCSCC1 ZINC000628969145 566600288 /nfs/dbraw/zinc/60/02/88/566600288.db2.gz OJTNCJSGYRLUOV-BLLLJJGKSA-N 0 3 390.380 3.150 10 0 GGAEHN COc1cc(Br)ccc1CN[C@H]1CCO[C@@H](c2nccn2C)C1 ZINC000449773329 566600726 /nfs/dbraw/zinc/60/07/26/566600726.db2.gz MSZYQUYIEXASJP-GOEBONIOSA-N 0 3 380.286 3.201 10 0 GGAEHN C[C@H](C(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1)N1CCSCC1 ZINC000628969151 566601127 /nfs/dbraw/zinc/60/11/27/566601127.db2.gz OJTNCJSGYRLUOV-MLGOLLRUSA-N 0 3 390.380 3.150 10 0 GGAEHN O=C(NCCNc1ccncc1)N[C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000466852944 566602196 /nfs/dbraw/zinc/60/21/96/566602196.db2.gz LADCHKOPCALVRO-CTYIDZIISA-N 0 3 379.291 3.468 10 0 GGAEHN CCc1ccc(S(=O)(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)s1 ZINC000486602514 566602365 /nfs/dbraw/zinc/60/23/65/566602365.db2.gz YLKVHKVFFPWKDK-DOTOQJQBSA-N 0 3 378.563 3.499 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)C1(c2cccc(Br)c2)CCCC1 ZINC000579355590 566602914 /nfs/dbraw/zinc/60/29/14/566602914.db2.gz MFLWPGPCPQCONR-CQSZACIVSA-N 0 3 387.268 3.374 10 0 GGAEHN COCCN1CCC(NC(=O)c2c(Cl)cc(F)cc2Br)CC1 ZINC000449803942 566603002 /nfs/dbraw/zinc/60/30/02/566603002.db2.gz LDAQCPGNJIJHIZ-UHFFFAOYSA-N 0 3 393.684 3.082 10 0 GGAEHN CN(C)CCN(C)c1ccc(Br)cc1NC(=O)[C@@H]1CCCOCC1 ZINC000425095243 566603004 /nfs/dbraw/zinc/60/30/04/566603004.db2.gz ASPUCPOESABHBB-CQSZACIVSA-N 0 3 398.345 3.202 10 0 GGAEHN CN(C)CCOc1ccc(CNC(=O)c2ccsc2Br)cc1 ZINC000449808913 566604416 /nfs/dbraw/zinc/60/44/16/566604416.db2.gz DBENXOAZXTZGQT-UHFFFAOYSA-N 0 3 383.311 3.381 10 0 GGAEHN CN1CCC[C@]2(CCN(C(=O)[C@H]3CCOc4ccc(Br)cc43)C2)C1 ZINC000652362145 566605074 /nfs/dbraw/zinc/60/50/74/566605074.db2.gz ZBGJHAYOICLENF-KXBFYZLASA-N 0 3 393.325 3.260 10 0 GGAEHN Cc1cccc(Br)c1C(=O)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000486624716 566605345 /nfs/dbraw/zinc/60/53/45/566605345.db2.gz FDNPXHRTDDGGQR-INIZCTEOSA-N 0 3 395.341 3.475 10 0 GGAEHN C[C@H]1CN(C(=O)[C@@H]2CCOc3ccc(Br)cc32)CCN(C2CC2)C1 ZINC000652372757 566606719 /nfs/dbraw/zinc/60/67/19/566606719.db2.gz LAEKXYJNEHVAKA-CZUORRHYSA-N 0 3 393.325 3.258 10 0 GGAEHN C[C@@H]1CN(C(=O)[C@@H]2CCOc3ccc(Br)cc32)CCN(C2CC2)C1 ZINC000652372758 566607271 /nfs/dbraw/zinc/60/72/71/566607271.db2.gz LAEKXYJNEHVAKA-XJKSGUPXSA-N 0 3 393.325 3.258 10 0 GGAEHN C/C(=C\c1ccc(Cl)cc1)CNC[C@@H](O)CS(=O)(=O)c1cccs1 ZINC000513539975 566608474 /nfs/dbraw/zinc/60/84/74/566608474.db2.gz TXTFFEAESUFVGX-LRFDDAOPSA-N 0 3 385.938 3.229 10 0 GGAEHN CN(C)c1nc(CNc2cc(Cl)ccc2OC2CCN(C)CC2)ns1 ZINC000579437748 566609408 /nfs/dbraw/zinc/60/94/08/566609408.db2.gz ZUCJTZCVMZIKEB-UHFFFAOYSA-N 0 3 381.933 3.343 10 0 GGAEHN CN(C[C@@H]1CCCN(C)C1)C(=O)c1cc2c(Br)cccc2cn1 ZINC000449867335 566610644 /nfs/dbraw/zinc/61/06/44/566610644.db2.gz HBZLASHFZVJQLC-CYBMUJFWSA-N 0 3 376.298 3.411 10 0 GGAEHN COC(=O)c1ccc(CNCC2(CO)CC3(CCC3)C2)c(Br)c1 ZINC000560274565 566613852 /nfs/dbraw/zinc/61/38/52/566613852.db2.gz KOHTYVTZQZHQST-UHFFFAOYSA-N 0 3 382.298 3.268 10 0 GGAEHN O=C(NCCN[C@@H]1CCN(c2ccccc2)C1)c1cccc(Br)c1 ZINC000674882339 566614676 /nfs/dbraw/zinc/61/46/76/566614676.db2.gz IUDCGQQHBJPSHE-QGZVFWFLSA-N 0 3 388.309 3.047 10 0 GGAEHN O=C(NCCN[C@H]1CCN(c2ccccc2)C1)c1ccc(Br)cc1 ZINC000674879196 566614814 /nfs/dbraw/zinc/61/48/14/566614814.db2.gz BGBBWJVKYHJCLC-KRWDZBQOSA-N 0 3 388.309 3.047 10 0 GGAEHN CN(C)C1(CNC(=O)c2ccsc2Br)Cc2ccccc2C1 ZINC000449934204 566618000 /nfs/dbraw/zinc/61/80/00/566618000.db2.gz IFEIBNREQWAIGY-UHFFFAOYSA-N 0 3 379.323 3.340 10 0 GGAEHN O=C(N[C@@H]1CCN(CC2CC2)C1)N1CCc2cccc(Br)c2C1 ZINC000605882988 566620667 /nfs/dbraw/zinc/62/06/67/566620667.db2.gz OKKUHRGWVLXRKU-OAHLLOKOSA-N 0 3 378.314 3.001 10 0 GGAEHN C[C@@H](NC(=O)Nc1cnn(CCN(C)C)c1)c1ccc(F)c(Br)c1 ZINC000652631441 566622471 /nfs/dbraw/zinc/62/24/71/566622471.db2.gz RMFANODHODXXJI-LLVKDONJSA-N 0 3 398.280 3.229 10 0 GGAEHN CC1(C)NC(=O)CC[C@H]1NCc1cc(Br)ccc1OC(F)F ZINC000579619414 566624706 /nfs/dbraw/zinc/62/47/06/566624706.db2.gz MDOSCEVXNUKOAN-GFCCVEGCSA-N 0 3 377.229 3.197 10 0 GGAEHN CC[C@H](Cc1ccccc1Br)C(=O)NC[C@H]1CCCN1CCOC ZINC000467097932 566625144 /nfs/dbraw/zinc/62/51/44/566625144.db2.gz TVDRZCKZKPTQEE-NVXWUHKLSA-N 0 3 397.357 3.245 10 0 GGAEHN CCOc1cc(CNCC[C@H](O)C(F)(F)F)cc(Br)c1OC ZINC000579647389 566627882 /nfs/dbraw/zinc/62/78/82/566627882.db2.gz LFUXKMRTNTTXOR-LBPRGKRZSA-N 0 3 386.208 3.259 10 0 GGAEHN CS(=O)(=O)N1CC[C@@H](CN(Cc2ccc(Cl)c(Cl)c2)C2CC2)C1 ZINC000513879764 566630971 /nfs/dbraw/zinc/63/09/71/566630971.db2.gz KAQZBYVBFYPGIU-ZDUSSCGKSA-N 0 3 377.337 3.239 10 0 GGAEHN C[C@@H](CC(=O)N1CCCCCC1)N[C@@H](CO)c1ccc(Br)cc1 ZINC000540160422 566632912 /nfs/dbraw/zinc/63/29/12/566632912.db2.gz FNFVMIYFTQZEBK-YOEHRIQHSA-N 0 3 383.330 3.253 10 0 GGAEHN CS[C@H]1CC[C@@H]1NCc1ccccc1CS(=O)(=O)N1CCC(C)CC1 ZINC000425344084 566634012 /nfs/dbraw/zinc/63/40/12/566634012.db2.gz ISVNPWBILLSJAF-OALUTQOASA-N 0 3 382.595 3.232 10 0 GGAEHN COc1ccc([C@H](CNCc2c(Br)cnn2C)N2CCCC2)cc1 ZINC000486934647 566636409 /nfs/dbraw/zinc/63/64/09/566636409.db2.gz ZAFOEPTXPSRCIP-KRWDZBQOSA-N 0 3 393.329 3.118 10 0 GGAEHN Cn1ncc(Br)c1CNCCc1ccc(OC(F)(F)F)cc1 ZINC000486932283 566636504 /nfs/dbraw/zinc/63/65/04/566636504.db2.gz GVAPXGMGEFBCJK-UHFFFAOYSA-N 0 3 378.192 3.414 10 0 GGAEHN O[C@H](CN(Cc1cccc(Br)c1)C1CCOCC1)C(F)(F)F ZINC000467296819 566638111 /nfs/dbraw/zinc/63/81/11/566638111.db2.gz AJEGXTKTMPHKPT-CQSZACIVSA-N 0 3 382.220 3.353 10 0 GGAEHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)c1c(Cl)cc(F)cc1Br ZINC000450151179 566640031 /nfs/dbraw/zinc/64/00/31/566640031.db2.gz GGRNDDWEAUAFDP-ISVAXAHUSA-N 0 3 375.669 3.454 10 0 GGAEHN Cn1ncc(Br)c1CNC1CCN(Cc2ccc(F)cc2)CC1 ZINC000486987259 566641751 /nfs/dbraw/zinc/64/17/51/566641751.db2.gz LRNYIVGSBJLRRG-UHFFFAOYSA-N 0 3 381.293 3.076 10 0 GGAEHN CN(CCN1CCCCC1)C(=O)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000652989748 566643457 /nfs/dbraw/zinc/64/34/57/566643457.db2.gz SLMWVYSZKQYINB-UHFFFAOYSA-N 0 3 392.297 3.261 10 0 GGAEHN CN(CCN1CCCCC1)C(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000652992875 566644272 /nfs/dbraw/zinc/64/42/72/566644272.db2.gz JOIZXRISZMKPSI-HNNXBMFYSA-N 0 3 381.314 3.260 10 0 GGAEHN CC[C@@H](NC(=O)NCCNc1ccncc1)c1cc(F)cc(Br)c1 ZINC000487053492 566644726 /nfs/dbraw/zinc/64/47/26/566644726.db2.gz LAIMUSWQNZGFED-MRXNPFEDSA-N 0 3 395.276 3.268 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)NCCOc1ccc(Br)cc1 ZINC000514220627 566646692 /nfs/dbraw/zinc/64/66/92/566646692.db2.gz ZRVJDBVNCZYGNY-CQSZACIVSA-N 0 3 384.318 3.002 10 0 GGAEHN CS(=O)(=O)N1CC[C@H](CN2CC=C(c3ccc(Cl)c(Cl)c3)CC2)C1 ZINC000514229420 566647162 /nfs/dbraw/zinc/64/71/62/566647162.db2.gz PZEBDRRNCBMDHW-CYBMUJFWSA-N 0 3 389.348 3.364 10 0 GGAEHN CS[C@H]1CN(C(=O)c2c(C)cccc2Br)C[C@H]1N1CCCC1 ZINC000487092528 566647664 /nfs/dbraw/zinc/64/76/64/566647664.db2.gz AYFAGOVNDIUNPJ-CABCVRRESA-N 0 3 383.355 3.409 10 0 GGAEHN CN1CC[C@H]2[C@@H](CCCN2C(=O)CCc2cccc(F)c2Br)C1 ZINC000450234966 566648284 /nfs/dbraw/zinc/64/82/84/566648284.db2.gz TTWJVTKBQBMJDD-HOCLYGCPSA-N 0 3 383.305 3.464 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)NC[C@H](C)N(C)C1CC1)CC2 ZINC000540383993 566648627 /nfs/dbraw/zinc/64/86/27/566648627.db2.gz PSIKFKOMAJBWGO-ZDUSSCGKSA-N 0 3 380.330 3.308 10 0 GGAEHN CN(C)C[C@@H]1CN(C(=O)c2csc(Br)c2)c2ccccc2O1 ZINC000675490003 566649356 /nfs/dbraw/zinc/64/93/56/566649356.db2.gz FBELATDPEGPBIN-GFCCVEGCSA-N 0 3 381.295 3.480 10 0 GGAEHN CS[C@H]1CN(C(=O)Cc2ccc(Br)s2)C[C@H]1N1CCCC1 ZINC000487113619 566649900 /nfs/dbraw/zinc/64/99/00/566649900.db2.gz PFIOOOOFWRFEQD-OLZOCXBDSA-N 0 3 389.384 3.091 10 0 GGAEHN COc1cc(Br)ccc1CNCC(C)(C)N1CCC(OC)CC1 ZINC000514249481 566650072 /nfs/dbraw/zinc/65/00/72/566650072.db2.gz GQQVVIBEIIHLAT-UHFFFAOYSA-N 0 3 385.346 3.437 10 0 GGAEHN CS[C@H]1CN(C(=O)CCc2cccc(F)c2Br)C[C@@H]1N(C)C ZINC000450267749 566650818 /nfs/dbraw/zinc/65/08/18/566650818.db2.gz XYXDHIADKSLPLX-KBPBESRZSA-N 0 3 389.334 3.025 10 0 GGAEHN O[C@@H](CNc1ncc(Br)cc1C(F)(F)F)CN1CCCCC1 ZINC000450259547 566651534 /nfs/dbraw/zinc/65/15/34/566651534.db2.gz XCUNNQGQRACXCQ-NSHDSACASA-N 0 3 382.224 3.122 10 0 GGAEHN Cn1ncc(Br)c1CNC[C@@]1(Cc2ccc(F)cc2)CCC[C@H]1O ZINC000487162272 566652616 /nfs/dbraw/zinc/65/26/16/566652616.db2.gz SEURCHBYNNYJPT-MSOLQXFVSA-N 0 3 396.304 3.185 10 0 GGAEHN CCN1CC[C@H](NCC2(CS(C)(=O)=O)CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000579932114 566652737 /nfs/dbraw/zinc/65/27/37/566652737.db2.gz PCPNRDMRISZABS-IRXDYDNUSA-N 0 3 388.936 3.029 10 0 GGAEHN COC(=O)c1ccc(CN[C@H](C)Cc2c(C)nn(C)c2C)c(Br)c1 ZINC000579934372 566652936 /nfs/dbraw/zinc/65/29/36/566652936.db2.gz GTEJEZAOKCZWAC-LLVKDONJSA-N 0 3 394.313 3.307 10 0 GGAEHN N[C@H]1Cc2ccccc2N(C(=O)[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000653165014 566653587 /nfs/dbraw/zinc/65/35/87/566653587.db2.gz CMMLLSYYFOVKBQ-GJZGRUSLSA-N 0 3 387.277 3.232 10 0 GGAEHN N[C@@H]1Cc2ccccc2N(C(=O)[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000653165013 566654474 /nfs/dbraw/zinc/65/44/74/566654474.db2.gz CMMLLSYYFOVKBQ-CABCVRRESA-N 0 3 387.277 3.232 10 0 GGAEHN COCCOc1ccc(Br)cc1NC(=O)CC1CCN(C)CC1 ZINC000487222367 566656558 /nfs/dbraw/zinc/65/65/58/566656558.db2.gz QUGIHMDFINWDCE-UHFFFAOYSA-N 0 3 385.302 3.145 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N[C@H]1CN(C2CC2)C[C@H]1C ZINC000467716920 566659670 /nfs/dbraw/zinc/65/96/70/566659670.db2.gz ZVTOGLCZTRQATA-WBMJQRKESA-N 0 3 390.325 3.311 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N[C@H]1CN(C2CC2)C[C@@H]1C ZINC000467716918 566659845 /nfs/dbraw/zinc/65/98/45/566659845.db2.gz ZVTOGLCZTRQATA-LRDDRELGSA-N 0 3 390.325 3.311 10 0 GGAEHN CN(C)CCOC1CCN(c2ncc(Br)cc2C(F)(F)F)CC1 ZINC000450334391 566659825 /nfs/dbraw/zinc/65/98/25/566659825.db2.gz ZWCMTOCMVXHYRN-UHFFFAOYSA-N 0 3 396.251 3.410 10 0 GGAEHN CCOc1cc(CCCNCc2c(Br)cnn2C)ccc1OC ZINC000487270204 566660372 /nfs/dbraw/zinc/66/03/72/566660372.db2.gz JOKIKLIOFNOITA-UHFFFAOYSA-N 0 3 382.302 3.312 10 0 GGAEHN Cn1ncc(Br)c1CNC[C@@H]1CCCN(C)[C@H]1c1cccs1 ZINC000487264046 566660526 /nfs/dbraw/zinc/66/05/26/566660526.db2.gz FZWFONJQNMMPFF-BLLLJJGKSA-N 0 3 383.359 3.417 10 0 GGAEHN Cn1ncc(Br)c1CNCC1(N2CCSCC2)CCCCC1 ZINC000487276256 566660638 /nfs/dbraw/zinc/66/06/38/566660638.db2.gz WSEWJJIHWMLCRU-UHFFFAOYSA-N 0 3 387.391 3.024 10 0 GGAEHN Cn1ncc(Br)c1CNC[C@@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000487264049 566660692 /nfs/dbraw/zinc/66/06/92/566660692.db2.gz FZWFONJQNMMPFF-LRDDRELGSA-N 0 3 383.359 3.417 10 0 GGAEHN O=C1N[C@@H](c2ccccc2Br)C(=O)N1C[C@H]1CCN1C1CCCC1 ZINC000629488283 566661812 /nfs/dbraw/zinc/66/18/12/566661812.db2.gz YWYZEVYFXCVHNN-CJNGLKHVSA-N 0 3 392.297 3.059 10 0 GGAEHN CN(C)C(=O)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1 ZINC000560829429 566663004 /nfs/dbraw/zinc/66/30/04/566663004.db2.gz AEJCAXWJLSHBAA-UHFFFAOYSA-N 0 3 381.314 3.212 10 0 GGAEHN Cc1c([C@H](C)N[C@@H]2CCCN(C)C2)nnn1-c1cccc(Br)c1 ZINC000675767781 566664427 /nfs/dbraw/zinc/66/44/27/566664427.db2.gz UMNIGTNJQZJLQY-SWLSCSKDSA-N 0 3 378.318 3.083 10 0 GGAEHN CN1C[C@@H]2CCCN(C(=O)N[C@@H]3CCc4cc(Br)ccc43)[C@@H]2C1 ZINC000425659930 566664491 /nfs/dbraw/zinc/66/44/91/566664491.db2.gz LILHNCGJLIPGKB-IAOVAPTHSA-N 0 3 378.314 3.172 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)Nc2cnc3c(Br)cccn23)CCN1C ZINC000425669870 566664515 /nfs/dbraw/zinc/66/45/15/566664515.db2.gz DGEHWDYBXQYGHB-RYUDHWBXSA-N 0 3 380.290 3.043 10 0 GGAEHN Cc1c([C@H](C)N[C@H]2CCCN(C)C2)nnn1-c1cccc(Br)c1 ZINC000675767784 566664679 /nfs/dbraw/zinc/66/46/79/566664679.db2.gz UMNIGTNJQZJLQY-WFASDCNBSA-N 0 3 378.318 3.083 10 0 GGAEHN O[C@H](CN[C@H]1CCN(c2ccccc2)C1)COc1ccccc1Br ZINC000675762985 566664687 /nfs/dbraw/zinc/66/46/87/566664687.db2.gz AMZMSNPNBKDKGB-DOTOQJQBSA-N 0 3 391.309 3.057 10 0 GGAEHN Cc1cccc(Cl)c1S(=O)(=O)N1CC[C@H](c2ccc(F)cc2)[C@@H](N)C1 ZINC000580097094 566664983 /nfs/dbraw/zinc/66/49/83/566664983.db2.gz ZZEZNMANCFJPPD-WBVHZDCISA-N 0 3 382.888 3.293 10 0 GGAEHN COc1cc(Br)ccc1[C@@H]1CCCN1C[C@H]1CCC2(CNC2)O1 ZINC000629558181 566666138 /nfs/dbraw/zinc/66/61/38/566666138.db2.gz CJVOWLHEWQRJNM-ZBFHGGJFSA-N 0 3 381.314 3.116 10 0 GGAEHN CS[C@H]1CN(c2ncc(Br)cc2C(F)(F)F)C[C@H]1N(C)C ZINC000450399505 566667385 /nfs/dbraw/zinc/66/73/85/566667385.db2.gz DHTXEYLJGBLVLO-MNOVXSKESA-N 0 3 384.265 3.345 10 0 GGAEHN CCN1CCC[C@H](NC(=O)[C@@H](CCOC)Cc2cccc(Br)c2)C1 ZINC000607339220 566667787 /nfs/dbraw/zinc/66/77/87/566667787.db2.gz APGCMNKATMOJMM-WMZOPIPTSA-N 0 3 397.357 3.245 10 0 GGAEHN O[C@H](CNC[C@H](n1cccn1)C(F)(F)F)COc1c(Cl)cccc1Cl ZINC000629600803 566671182 /nfs/dbraw/zinc/67/11/82/566671182.db2.gz QZMIUXUDZPFQAG-MFKMUULPSA-N 0 3 398.212 3.323 10 0 GGAEHN O[C@H](CNC[C@@H](n1cccn1)C(F)(F)F)COc1ccc(Cl)cc1Cl ZINC000629596156 566671377 /nfs/dbraw/zinc/67/13/77/566671377.db2.gz DVQUVRTXTIQDQC-BXUZGUMPSA-N 0 3 398.212 3.323 10 0 GGAEHN O[C@@H](CNC[C@@H](n1cccn1)C(F)(F)F)COc1ccc(Cl)c(Cl)c1 ZINC000629599093 566671487 /nfs/dbraw/zinc/67/14/87/566671487.db2.gz NBDCTYVDXXEJLB-IINYFYTJSA-N 0 3 398.212 3.323 10 0 GGAEHN O[C@@H](CNC[C@@H](n1cccn1)C(F)(F)F)COc1cc(Cl)ccc1Cl ZINC000629601766 566672718 /nfs/dbraw/zinc/67/27/18/566672718.db2.gz VAEMTLCERWCTMT-SMDDNHRTSA-N 0 3 398.212 3.323 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CCC[C@H]2CN(C)C[C@H]21 ZINC000425748317 566674853 /nfs/dbraw/zinc/67/48/53/566674853.db2.gz WCBCTXXHXYMVGE-HEHGZKQESA-N 0 3 396.329 3.254 10 0 GGAEHN CCCN1CCC[C@@H]1C(=O)NCCOc1ncc(C(F)(F)F)cc1Cl ZINC000607671936 566677525 /nfs/dbraw/zinc/67/75/25/566677525.db2.gz OGODYOGDAWQTEQ-CYBMUJFWSA-N 0 3 379.810 3.123 10 0 GGAEHN O=C(NCc1ccccc1CN1CC[C@@H](O)C1)c1ccsc1Br ZINC000450516094 566680362 /nfs/dbraw/zinc/68/03/62/566680362.db2.gz ATMRRHTUNJWXQZ-CQSZACIVSA-N 0 3 395.322 3.007 10 0 GGAEHN C[C@@H](CNC(=O)CCN(C)c1ccncc1)Oc1ccc(Br)cc1 ZINC000540926096 566681011 /nfs/dbraw/zinc/68/10/11/566681011.db2.gz MWZWDOHWUOITDA-AWEZNQCLSA-N 0 3 392.297 3.254 10 0 GGAEHN CC(C)(NCC(=O)NC1CCN(C2CC2)CC1)c1ccccc1Br ZINC000561199286 566684657 /nfs/dbraw/zinc/68/46/57/566684657.db2.gz KSXKIRYEUDTSJE-UHFFFAOYSA-N 0 3 394.357 3.017 10 0 GGAEHN CN(CCC(=O)OC(C)(C)C)C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000468137775 566684793 /nfs/dbraw/zinc/68/47/93/566684793.db2.gz ZDVYQNCOSBYXTI-GFCCVEGCSA-N 0 3 378.296 3.397 10 0 GGAEHN CS[C@H]1CN(C(=O)c2ccsc2Br)C[C@H]1N1CCCC1 ZINC000450576482 566685887 /nfs/dbraw/zinc/68/58/87/566685887.db2.gz CHEYDRPRSHCGKU-NEPJUHHUSA-N 0 3 375.357 3.162 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2ccsc2Br)C[C@@H]1N1CCCC1 ZINC000450576486 566686505 /nfs/dbraw/zinc/68/65/05/566686505.db2.gz CHEYDRPRSHCGKU-NWDGAFQWSA-N 0 3 375.357 3.162 10 0 GGAEHN CCN1C(=O)N=NC1C1CCN(CCOc2ccc(Br)cc2)CC1 ZINC000676353767 566686860 /nfs/dbraw/zinc/68/68/60/566686860.db2.gz JHTMQIJETSDVEY-UHFFFAOYSA-N 0 3 395.301 3.025 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)NC23CCC(C(F)(F)F)(CC2)CC3)CCSC1 ZINC000426030070 566687242 /nfs/dbraw/zinc/68/72/42/566687242.db2.gz NFJUZBAZYDVMGH-UYSNPLJNSA-N 0 3 379.492 3.378 10 0 GGAEHN CS(=O)(=O)CC1(CN[C@H](Cc2cccnc2)c2cccc(Cl)c2)CC1 ZINC000426059018 566689463 /nfs/dbraw/zinc/68/94/63/566689463.db2.gz GQKOPQYDYMJPTM-GOSISDBHSA-N 0 3 378.925 3.433 10 0 GGAEHN CC[C@H](Cn1cncn1)NCc1ccc(I)c(Cl)c1 ZINC000561283561 566690467 /nfs/dbraw/zinc/69/04/67/566690467.db2.gz KJHKASBTMPYBFN-LLVKDONJSA-N 0 3 390.656 3.105 10 0 GGAEHN CN(Cc1ccccc1)C[C@@H](O)CN1CCc2sc(Br)cc2C1 ZINC000676411447 566691223 /nfs/dbraw/zinc/69/12/23/566691223.db2.gz XXWRFUATVOEVRS-MRXNPFEDSA-N 0 3 395.366 3.362 10 0 GGAEHN CN(Cc1ccccc1)C[C@H](O)CN1CCc2sc(Br)cc2C1 ZINC000676411446 566691572 /nfs/dbraw/zinc/69/15/72/566691572.db2.gz XXWRFUATVOEVRS-INIZCTEOSA-N 0 3 395.366 3.362 10 0 GGAEHN CCc1n[n-]c(C(=O)NCc2ccc(C[NH+]3CCCC3)cc2)c1Br ZINC000468258361 566693965 /nfs/dbraw/zinc/69/39/65/566693965.db2.gz CWRSCCWVJYTSBP-UHFFFAOYSA-N 0 3 391.313 3.260 10 0 GGAEHN C[C@H](Nc1ncc(I)cn1)[C@H](c1ccccc1)N(C)C ZINC000561324867 566695832 /nfs/dbraw/zinc/69/58/32/566695832.db2.gz LMIVWTCIWUFYKO-SMDDNHRTSA-N 0 3 382.249 3.185 10 0 GGAEHN CCN(Cc1c(Br)cnn1C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000426147989 566695764 /nfs/dbraw/zinc/69/57/64/566695764.db2.gz GDBKUICCARAUCD-MRXNPFEDSA-N 0 3 377.330 3.279 10 0 GGAEHN CN1CCC(CCO)(NC(=O)c2ccc3scc(Br)c3c2)CC1 ZINC000450667628 566696603 /nfs/dbraw/zinc/69/66/03/566696603.db2.gz LYJDVFANPQOYJU-UHFFFAOYSA-N 0 3 397.338 3.240 10 0 GGAEHN CC(C)N1CCN(CCCN2CCOc3cccc(Br)c3C2)CC1 ZINC000653835115 566697216 /nfs/dbraw/zinc/69/72/16/566697216.db2.gz FSJSETYCJWQHMH-UHFFFAOYSA-N 0 3 396.373 3.060 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)NCCN1CCCCC1 ZINC000468447109 566700851 /nfs/dbraw/zinc/70/08/51/566700851.db2.gz XGFIXKSOTXEGNS-CYBMUJFWSA-N 0 3 384.318 3.304 10 0 GGAEHN C[C@@H](CO)[C@H](C)NCC(=O)Nc1ccc(Br)c(C(F)(F)F)c1 ZINC000450725102 566701322 /nfs/dbraw/zinc/70/13/22/566701322.db2.gz BRSHNARLEKQCPT-IUCAKERBSA-N 0 3 383.208 3.013 10 0 GGAEHN C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(Br)c(C(F)(F)F)c1 ZINC000450725100 566701775 /nfs/dbraw/zinc/70/17/75/566701775.db2.gz BRSHNARLEKQCPT-BDAKNGLRSA-N 0 3 383.208 3.013 10 0 GGAEHN O=C1NCC[C@@H]1CCN1CCN(c2cc(Cl)c(Cl)c(Cl)c2)CC1 ZINC000653882594 566701689 /nfs/dbraw/zinc/70/16/89/566701689.db2.gz MHDFVYLLIAZETN-LLVKDONJSA-N 0 3 376.715 3.295 10 0 GGAEHN CC[C@H](NCCS(=O)(=O)c1ccc(Br)cc1)[C@H]1CCCCO1 ZINC000653881963 566701751 /nfs/dbraw/zinc/70/17/51/566701751.db2.gz WYZNXBMBOOUMDR-JKSUJKDBSA-N 0 3 390.343 3.160 10 0 GGAEHN CC[C@H](NCC(=O)N(C)Cc1cc(Br)cs1)[C@@H]1CCCCO1 ZINC000653876865 566701823 /nfs/dbraw/zinc/70/18/23/566701823.db2.gz JAAHMEZRKXIZFS-GJZGRUSLSA-N 0 3 389.359 3.406 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NC[C@H]1N(C)CCCC1(C)C ZINC000468471002 566702821 /nfs/dbraw/zinc/70/28/21/566702821.db2.gz TUFNIRJAPHUHJR-MRXNPFEDSA-N 0 3 383.330 3.237 10 0 GGAEHN Cc1cc(S(=O)(=O)NCCNC2CC(c3ccccc3F)C2)c(C)s1 ZINC000541215395 566704993 /nfs/dbraw/zinc/70/49/93/566704993.db2.gz ZJJCPLOPQBVLDA-UHFFFAOYSA-N 0 3 382.526 3.318 10 0 GGAEHN CN1CC[C@]2(CCN(C(=O)N[C@@H]3CCOc4ccc(Br)cc43)C2)C1 ZINC000488074570 566705643 /nfs/dbraw/zinc/70/56/43/566705643.db2.gz NLOLLEUXRBRLMW-QAPCUYQASA-N 0 3 394.313 3.010 10 0 GGAEHN Cc1cc(Cl)cc2c1OCCC[C@@H]2NC[C@H]1CCCCN1S(C)(=O)=O ZINC000580588198 566705760 /nfs/dbraw/zinc/70/57/60/566705760.db2.gz CDVPYLKQJRMVNG-WBVHZDCISA-N 0 3 386.945 3.266 10 0 GGAEHN CCC(=O)N[C@@H]1CCCN(CCCc2ccc(Br)cc2OC)C1 ZINC000541274439 566708851 /nfs/dbraw/zinc/70/88/51/566708851.db2.gz XMYLFZSDOMCCJN-MRXNPFEDSA-N 0 3 383.330 3.381 10 0 GGAEHN Cn1cc(Br)c(C(=O)NCc2ccccc2CN2CCCCC2)n1 ZINC000580613074 566708828 /nfs/dbraw/zinc/70/88/28/566708828.db2.gz FPNLALIHDPGRBW-UHFFFAOYSA-N 0 3 391.313 3.099 10 0 GGAEHN Brc1ccc2[nH]c(CN[C@H]3CCCC[C@H]3N3CCOCC3)nc2c1 ZINC000580615908 566708890 /nfs/dbraw/zinc/70/88/90/566708890.db2.gz TXCQLWNRKJGPQK-DOTOQJQBSA-N 0 3 393.329 3.058 10 0 GGAEHN Brc1ccc2nc(CN[C@H]3CCCC[C@H]3N3CCOCC3)[nH]c2c1 ZINC000580615908 566708896 /nfs/dbraw/zinc/70/88/96/566708896.db2.gz TXCQLWNRKJGPQK-DOTOQJQBSA-N 0 3 393.329 3.058 10 0 GGAEHN Brc1ccc2[nH]c(CN[C@@H]3CCCC[C@H]3N3CCOCC3)nc2c1 ZINC000580615909 566708922 /nfs/dbraw/zinc/70/89/22/566708922.db2.gz TXCQLWNRKJGPQK-NVXWUHKLSA-N 0 3 393.329 3.058 10 0 GGAEHN Brc1ccc2nc(CN[C@@H]3CCCC[C@H]3N3CCOCC3)[nH]c2c1 ZINC000580615909 566708927 /nfs/dbraw/zinc/70/89/27/566708927.db2.gz TXCQLWNRKJGPQK-NVXWUHKLSA-N 0 3 393.329 3.058 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)c1ccc(Cl)c(I)c1 ZINC000609030501 566747997 /nfs/dbraw/zinc/74/79/97/566747997.db2.gz SWJQUWQRYIDPFW-NSHDSACASA-N 0 3 392.668 3.111 10 0 GGAEHN CS[C@H]1CN(C(=O)Cc2sccc2Br)C[C@H]1N1CCCC1 ZINC000450837334 566711152 /nfs/dbraw/zinc/71/11/52/566711152.db2.gz CDTWMYQTBMTFMU-OCCSQVGLSA-N 0 3 389.384 3.091 10 0 GGAEHN CN(C)CCn1cc(NC(=O)Nc2c(F)cc(Br)cc2F)cn1 ZINC000608331276 566713880 /nfs/dbraw/zinc/71/38/80/566713880.db2.gz NHFVWCOOLOGSQW-UHFFFAOYSA-N 0 3 388.216 3.129 10 0 GGAEHN O=C(Nc1cnc2c(Br)cccn12)N[C@H]1CCCN2CCCC[C@H]12 ZINC000654084443 566715130 /nfs/dbraw/zinc/71/51/30/566715130.db2.gz SNYCUTABIPPAGO-UONOGXRCSA-N 0 3 392.301 3.235 10 0 GGAEHN COCCN1CC[C@H](NCc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000676902233 566715476 /nfs/dbraw/zinc/71/54/76/566715476.db2.gz NPFQRVHYWYNQAJ-HNNXBMFYSA-N 0 3 396.354 3.383 10 0 GGAEHN C[C@H]1CN(C2CCOCC2)CCN1C(=O)COc1ccc(Cl)c(Cl)c1 ZINC000488248983 566717687 /nfs/dbraw/zinc/71/76/87/566717687.db2.gz IGAVXHCOGSAWRC-ZDUSSCGKSA-N 0 3 387.307 3.084 10 0 GGAEHN C[C@@H]1[C@@H](N2CCCC2)CCN1S(=O)(=O)Cc1ccc(Cl)cc1Cl ZINC000561552179 566718775 /nfs/dbraw/zinc/71/87/75/566718775.db2.gz GMPQMAGSTSNCRP-WBMJQRKESA-N 0 3 377.337 3.382 10 0 GGAEHN CCN1C(=O)N=NC1C1CCN(CCOc2cccc(Br)c2)CC1 ZINC000677046218 566722242 /nfs/dbraw/zinc/72/22/42/566722242.db2.gz HKTOTRGKECSILX-UHFFFAOYSA-N 0 3 395.301 3.025 10 0 GGAEHN CCOC(=O)CC(C(F)(F)F)S(=O)(=O)N(Cc1ccccc1)C(C)C ZINC000450964858 566725275 /nfs/dbraw/zinc/72/52/75/566725275.db2.gz CSSUCQJAZIXIHU-AWEZNQCLSA-N 0 3 381.416 3.111 10 0 GGAEHN O=C(NC1CCN(Cc2ccccc2)CC1)c1c(F)cncc1Br ZINC000630412511 566726142 /nfs/dbraw/zinc/72/61/42/566726142.db2.gz VBJMUBQLOHVMEN-UHFFFAOYSA-N 0 3 392.272 3.378 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000654312055 566726816 /nfs/dbraw/zinc/72/68/16/566726816.db2.gz MQCQLDIKBSEEDU-HOTGVXAUSA-N 0 3 381.314 3.133 10 0 GGAEHN Cc1csc(CCNC(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)n1 ZINC000608638884 566726674 /nfs/dbraw/zinc/72/66/74/566726674.db2.gz HLEFUJRQLYRWBC-YOEHRIQHSA-N 0 3 378.567 3.438 10 0 GGAEHN CC(C)[C@@H]1C[C@@H](NCc2ccccc2CS(=O)(=O)N2CCCC2)CS1 ZINC000488432116 566727209 /nfs/dbraw/zinc/72/72/09/566727209.db2.gz GPVDLIGEPGQYIO-MOPGFXCFSA-N 0 3 382.595 3.232 10 0 GGAEHN CC(C)[C@H]1C[C@H](NCc2ccccc2CS(=O)(=O)N2CCCC2)CS1 ZINC000488432136 566727381 /nfs/dbraw/zinc/72/73/81/566727381.db2.gz GPVDLIGEPGQYIO-RBUKOAKNSA-N 0 3 382.595 3.232 10 0 GGAEHN C[C@H](c1ccccc1)[C@@H](O)CN[C@](C)(CO)c1ccc(Br)cc1 ZINC000450977980 566728805 /nfs/dbraw/zinc/72/88/05/566728805.db2.gz CJZOVAOXRVBOEJ-MDASCCDHSA-N 0 3 378.310 3.411 10 0 GGAEHN C[C@H](c1ccccc1)[C@H](O)CN[C@](C)(CO)c1ccc(Br)cc1 ZINC000450977981 566729018 /nfs/dbraw/zinc/72/90/18/566729018.db2.gz CJZOVAOXRVBOEJ-NIKGAXFTSA-N 0 3 378.310 3.411 10 0 GGAEHN CCN1CCCC[C@H]1CNC(=O)NCc1ccc(Br)cc1OC ZINC000488520985 566732358 /nfs/dbraw/zinc/73/23/58/566732358.db2.gz WZZOMBZLVSBXGC-HNNXBMFYSA-N 0 3 384.318 3.131 10 0 GGAEHN Cc1c([C@@H](C)NCC[C@H]2CCOC2)nnn1-c1cccc(Br)c1 ZINC000541559159 566733703 /nfs/dbraw/zinc/73/37/03/566733703.db2.gz WGRPFNHTVFLLEM-OCCSQVGLSA-N 0 3 379.302 3.415 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)NCCc1ccc(F)c(Br)c1 ZINC000515827797 566734138 /nfs/dbraw/zinc/73/41/38/566734138.db2.gz AOLAAGHRNZPBQE-CYBMUJFWSA-N 0 3 386.309 3.304 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CC[C@@H](N3CCCC3)[C@H]2C)c1 ZINC000561755822 566735561 /nfs/dbraw/zinc/73/55/61/566735561.db2.gz VOOOOLZPBFVRKV-CZUORRHYSA-N 0 3 398.288 3.298 10 0 GGAEHN CN(C(=O)N[C@H]1CSc2ccc(Br)cc21)[C@@H]1CCN(C2CC2)C1 ZINC000426857233 566735877 /nfs/dbraw/zinc/73/58/77/566735877.db2.gz GQJHFVVCKIQJKZ-HIFRSBDPSA-N 0 3 396.354 3.474 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@@H]1CCOC[C@@H]1C)c1ccc(Br)cn1 ZINC000515852326 566735999 /nfs/dbraw/zinc/73/59/99/566735999.db2.gz XTUHZJITQVYZAT-GOEBONIOSA-N 0 3 398.345 3.192 10 0 GGAEHN Cc1c(Br)ccc(C(=O)NCCCN2CCCO[C@@H](C)C2)c1F ZINC000468831407 566736307 /nfs/dbraw/zinc/73/63/07/566736307.db2.gz FITONXYKRNXGKP-LBPRGKRZSA-N 0 3 387.293 3.127 10 0 GGAEHN C[S@@](=O)C[C@H](NCCCc1nc(-c2cccs2)no1)c1ccccc1 ZINC000541608344 566738070 /nfs/dbraw/zinc/73/80/70/566738070.db2.gz PEFDRWDKRVVSIU-ODCWNRFASA-N 0 3 375.519 3.440 10 0 GGAEHN C[S@@](=O)C[C@@H](NCCCc1nc(-c2cccs2)no1)c1ccccc1 ZINC000541608345 566738626 /nfs/dbraw/zinc/73/86/26/566738626.db2.gz PEFDRWDKRVVSIU-SGANQWHYSA-N 0 3 375.519 3.440 10 0 GGAEHN COCCCN1CCC(NC(=O)[C@H]2CCc3cc(Br)ccc32)CC1 ZINC000581014518 566742544 /nfs/dbraw/zinc/74/25/44/566742544.db2.gz NEDOOOBMUBHFNV-SFHVURJKSA-N 0 3 395.341 3.096 10 0 GGAEHN COCCN(CCN(C)C)C(=O)c1oc2c(cc(Br)cc2C)c1C ZINC000427088170 566746111 /nfs/dbraw/zinc/74/61/11/566746111.db2.gz RIAOCEDLNLDMOV-UHFFFAOYSA-N 0 3 397.313 3.462 10 0 GGAEHN CC1(C)CN(CCC(=O)Nc2cccc(Br)c2)C[C@]2(CCOC2)O1 ZINC000581106898 566749154 /nfs/dbraw/zinc/74/91/54/566749154.db2.gz SIBBOBMWZJMQRA-SFHVURJKSA-N 0 3 397.313 3.048 10 0 GGAEHN NC(=O)C1CCN(Cc2cccc(NC(=O)c3cscc3Cl)c2)CC1 ZINC000630766087 566749417 /nfs/dbraw/zinc/74/94/17/566749417.db2.gz PALXXZLLIBOEEL-UHFFFAOYSA-N 0 3 377.897 3.351 10 0 GGAEHN Cc1ccc(Br)cc1C(=O)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000427149422 566750450 /nfs/dbraw/zinc/75/04/50/566750450.db2.gz GMZNSCLITGXEHT-KRWDZBQOSA-N 0 3 395.341 3.475 10 0 GGAEHN CCN1CCCN(C(=O)N[C@@H](C)c2ccc(Br)cc2OC)CC1 ZINC000469006351 566751679 /nfs/dbraw/zinc/75/16/79/566751679.db2.gz OQMMCKSETFDAOI-ZDUSSCGKSA-N 0 3 384.318 3.256 10 0 GGAEHN O=C(c1cc(Br)cs1)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000427160380 566752001 /nfs/dbraw/zinc/75/20/01/566752001.db2.gz AVRCQUHRZLHGSF-CQSZACIVSA-N 0 3 387.343 3.228 10 0 GGAEHN O=C(c1ccc(F)c(Br)c1)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000427149849 566752136 /nfs/dbraw/zinc/75/21/36/566752136.db2.gz KHNQDCRNFKPXHZ-OAHLLOKOSA-N 0 3 399.304 3.305 10 0 GGAEHN CCOc1c(Br)cc(CN(C)[C@@H](C)CO)cc1Br ZINC000561981156 566753644 /nfs/dbraw/zinc/75/36/44/566753644.db2.gz ZXWLYXLMDOKPMT-VIFPVBQESA-N 0 3 381.108 3.423 10 0 GGAEHN C[C@H]1CSCCN1CCCOc1cccc(I)c1 ZINC000561983694 566753726 /nfs/dbraw/zinc/75/37/26/566753726.db2.gz ROTZDZIZSZRUGY-LBPRGKRZSA-N 0 3 377.291 3.497 10 0 GGAEHN CS[C@H]1CN(C(=O)c2c(F)cccc2Br)C[C@@H]1N1CCCC1 ZINC000541840511 566754145 /nfs/dbraw/zinc/75/41/45/566754145.db2.gz DIIXBWNUSQEHMG-KBPBESRZSA-N 0 3 387.318 3.240 10 0 GGAEHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)Cc1csc(CCC(F)(F)F)n1 ZINC000630811202 566754120 /nfs/dbraw/zinc/75/41/20/566754120.db2.gz MHVWUYLTVLWCMG-STQMWFEESA-N 0 3 377.476 3.417 10 0 GGAEHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)Cc1csc(CCC(F)(F)F)n1 ZINC000630811200 566754615 /nfs/dbraw/zinc/75/46/15/566754615.db2.gz MHVWUYLTVLWCMG-QWHCGFSZSA-N 0 3 377.476 3.417 10 0 GGAEHN COc1ccc(Br)c(C(=O)N2C[C@H](SC)[C@@H](N3CCCC3)C2)c1 ZINC000541840107 566754927 /nfs/dbraw/zinc/75/49/27/566754927.db2.gz CGYWWXQHUXXENY-HOTGVXAUSA-N 0 3 399.354 3.110 10 0 GGAEHN C[C@@H](CNC(=O)Cc1csc(CCC(F)(F)F)n1)N1CCC(C)CC1 ZINC000630839642 566756537 /nfs/dbraw/zinc/75/65/37/566756537.db2.gz RKMHWRYRXSEARB-ZDUSSCGKSA-N 0 3 377.476 3.417 10 0 GGAEHN Cc1ccc([C@H](CNC(=O)c2c(F)cncc2Br)N(C)C)cc1 ZINC000630838974 566756815 /nfs/dbraw/zinc/75/68/15/566756815.db2.gz LXPSHFROXBJSRU-HNNXBMFYSA-N 0 3 380.261 3.324 10 0 GGAEHN COC(=O)c1ccc(CNC2(c3ccc(Br)cc3)CCOCC2)[nH]1 ZINC000541919697 566759688 /nfs/dbraw/zinc/75/96/88/566759688.db2.gz SZCWZMZRSWRDAQ-UHFFFAOYSA-N 0 3 393.281 3.359 10 0 GGAEHN COCCCN1CCC(NC(=O)c2scc(Br)c2C)CC1 ZINC000630897021 566761194 /nfs/dbraw/zinc/76/11/94/566761194.db2.gz GTJUJVRHRCQBSC-UHFFFAOYSA-N 0 3 375.332 3.050 10 0 GGAEHN O[C@H](COc1ccc(Cl)cc1Br)CN1CC[C@@H](C(F)F)C1 ZINC000677732231 566762035 /nfs/dbraw/zinc/76/20/35/566762035.db2.gz MRQGXGSSIBQQLW-KOLCDFICSA-N 0 3 384.648 3.429 10 0 GGAEHN CC(C)N1CCCN(C(=O)[C@H]2[C@@H]3c4ccc(Br)cc4C[C@H]23)CC1 ZINC000630913855 566762973 /nfs/dbraw/zinc/76/29/73/566762973.db2.gz YQQULLQDEGOJOQ-RCCFBDPRSA-N 0 3 377.326 3.278 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)[C@H]1[C@@H]2c3ccc(Br)cc3C[C@H]12 ZINC000630925785 566764264 /nfs/dbraw/zinc/76/42/64/566764264.db2.gz PMSUVDBEZLHMNM-RCCFBDPRSA-N 0 3 377.326 3.135 10 0 GGAEHN CNS(=O)(=O)CCCNC(C)(C)c1nc(-c2ccccc2F)c(C)s1 ZINC000451164671 566768570 /nfs/dbraw/zinc/76/85/70/566768570.db2.gz HTAAOTYVGLGMQH-UHFFFAOYSA-N 0 3 385.530 3.022 10 0 GGAEHN Cc1nc2ccc(S(=O)(=O)NCc3cccc(CN(C)C)c3)cc2s1 ZINC000489119217 566772769 /nfs/dbraw/zinc/77/27/69/566772769.db2.gz QJUJNVISUAVOEF-UHFFFAOYSA-N 0 3 375.519 3.145 10 0 GGAEHN Nc1ncccc1CN1CC[C@@H](Cc2cccc(I)c2)C1 ZINC000451191115 566774201 /nfs/dbraw/zinc/77/42/01/566774201.db2.gz MDAJJOYPWMSGCD-AWEZNQCLSA-N 0 3 393.272 3.333 10 0 GGAEHN COc1cc(Br)ccc1CCC(=O)NCCN1CCCC[C@@H]1C ZINC000542098713 566775140 /nfs/dbraw/zinc/77/51/40/566775140.db2.gz MVRWWMMOTIYSKY-AWEZNQCLSA-N 0 3 383.330 3.381 10 0 GGAEHN CN(C)CCn1ccc(C(=O)N2CC(C)(C)c3cc(Br)ccc32)n1 ZINC000655071670 566776207 /nfs/dbraw/zinc/77/62/07/566776207.db2.gz ZKGSLOQIEMUSDF-UHFFFAOYSA-N 0 3 391.313 3.145 10 0 GGAEHN CC(C)OCCN1CCC(NCc2ncc(Br)cc2Cl)CC1 ZINC000631083804 566777521 /nfs/dbraw/zinc/77/75/21/566777521.db2.gz RJKQWURJSUWVPC-UHFFFAOYSA-N 0 3 390.753 3.477 10 0 GGAEHN CCC(CC)Nc1ccncc1NC(=O)c1cc[nH]c(=O)c1Br ZINC000655098634 566777605 /nfs/dbraw/zinc/77/76/05/566777605.db2.gz FMAKIXFXNSETQP-UHFFFAOYSA-N 0 3 379.258 3.219 10 0 GGAEHN C[C@H](CO)CN1CCN(c2ccc(Br)cc2C(F)(F)F)CC1 ZINC000678044450 566777925 /nfs/dbraw/zinc/77/79/25/566777925.db2.gz BLUCTAOVZDQGIF-NSHDSACASA-N 0 3 381.236 3.218 10 0 GGAEHN C[C@@H](CO)CN1CCN(c2ccc(Br)cc2C(F)(F)F)CC1 ZINC000678044449 566778844 /nfs/dbraw/zinc/77/88/44/566778844.db2.gz BLUCTAOVZDQGIF-LLVKDONJSA-N 0 3 381.236 3.218 10 0 GGAEHN COC(=O)[C@@H]1CCCCC[C@@H]1N[C@H](C)C(=O)Nc1ccccc1Br ZINC000451234940 566780679 /nfs/dbraw/zinc/78/06/79/566780679.db2.gz MPTBMEXSHZNFCA-NFAWXSAZSA-N 0 3 397.313 3.488 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cccc3c(Cl)ccnc32)[C@H](C)C1 ZINC000451245778 566781992 /nfs/dbraw/zinc/78/19/92/566781992.db2.gz UGCRGRVKKSZHGI-CJNGLKHVSA-N 0 3 381.929 3.239 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cccc3c(Cl)ccnc32)[C@@H](C)C1 ZINC000451245780 566782057 /nfs/dbraw/zinc/78/20/57/566782057.db2.gz UGCRGRVKKSZHGI-XJKSGUPXSA-N 0 3 381.929 3.239 10 0 GGAEHN C[NH+](C)[C@H]1CCC[C@H]([N-]S(=O)(=O)c2cccc(Br)c2Cl)C1 ZINC000516792251 566783973 /nfs/dbraw/zinc/78/39/73/566783973.db2.gz QQPZTBYNDWEONU-QWRGUYRKSA-N 0 3 395.750 3.254 10 0 GGAEHN Cn1ccnc1[C@H]1C[C@@H](NCc2ncc(Br)cc2Cl)CCO1 ZINC000631154141 566785811 /nfs/dbraw/zinc/78/58/11/566785811.db2.gz FHZVCQDEUAYZHL-SMDDNHRTSA-N 0 3 385.693 3.241 10 0 GGAEHN CC[C@@H](Cc1ccc(Br)cc1)NCc1cn(C[C@@H]2CCOC2)nn1 ZINC000631176851 566786989 /nfs/dbraw/zinc/78/69/89/566786989.db2.gz HWXBCHPPDSUQKN-RDJZCZTQSA-N 0 3 393.329 3.188 10 0 GGAEHN COc1cc(CN[C@H](CO)[C@@H]2CCC[C@@H](OC)C2)c(F)cc1Br ZINC000631171845 566787109 /nfs/dbraw/zinc/78/71/09/566787109.db2.gz IQUKPAASJNFWGY-AXAPSJFSSA-N 0 3 390.293 3.253 10 0 GGAEHN COc1cc(CN[C@H](CO)[C@H]2CCC[C@@H](OC)C2)c(F)cc1Br ZINC000631171852 566787424 /nfs/dbraw/zinc/78/74/24/566787424.db2.gz IQUKPAASJNFWGY-NORZTCDRSA-N 0 3 390.293 3.253 10 0 GGAEHN CC[C@@H](N[C@@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)C(=O)NC ZINC000451281518 566788024 /nfs/dbraw/zinc/78/80/24/566788024.db2.gz JSFICCCBNQDSKS-JOYOIKCWSA-N 0 3 379.810 3.190 10 0 GGAEHN C[C@@H](NC[C@H]1CSc2ccccc2O1)c1cccc(NS(C)(=O)=O)c1 ZINC000516866571 566788425 /nfs/dbraw/zinc/78/84/25/566788425.db2.gz FENAYCZDSNFGSE-CJNGLKHVSA-N 0 3 378.519 3.262 10 0 GGAEHN C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)C(=O)Nc1cc(Cl)c(Cl)c(Cl)c1 ZINC000581552847 566788927 /nfs/dbraw/zinc/78/89/27/566788927.db2.gz QRJMTNAPKJLWSW-ZANVPECISA-N 0 3 392.714 3.384 10 0 GGAEHN Cc1nn(C)c2ncc(CN[C@@H]3[C@H]4Cc5c(cccc5Br)[C@@H]34)cc12 ZINC000631190930 566789412 /nfs/dbraw/zinc/78/94/12/566789412.db2.gz FBUJMEOQHGFYIJ-CGTJXYLNSA-N 0 3 383.293 3.467 10 0 GGAEHN C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(Br)c2c1OCCC2 ZINC000469437813 566789929 /nfs/dbraw/zinc/78/99/29/566789929.db2.gz CQUVLUVRIRUTIZ-QWHCGFSZSA-N 0 3 379.298 3.083 10 0 GGAEHN CCn1nc2c(cc1=O)CN(C[C@H](C)c1cccc(Br)c1)CC2 ZINC000678284284 566790848 /nfs/dbraw/zinc/79/08/48/566790848.db2.gz QNJCGGKATFNGMK-ZDUSSCGKSA-N 0 3 376.298 3.188 10 0 GGAEHN CCn1nc2c(cc1=O)CN(C[C@@H](C)c1cccc(Br)c1)CC2 ZINC000678284282 566791134 /nfs/dbraw/zinc/79/11/34/566791134.db2.gz QNJCGGKATFNGMK-CYBMUJFWSA-N 0 3 376.298 3.188 10 0 GGAEHN O[C@@H]1C[C@H]([C@H]2CCCOC2)N(Cc2cc(Br)cc3cccnc32)C1 ZINC000451295088 566791145 /nfs/dbraw/zinc/79/11/45/566791145.db2.gz CWBURJFIOGMQKN-BMGDILEWSA-N 0 3 391.309 3.359 10 0 GGAEHN Cc1cc(Br)cn2c(CNCCc3cnc(C4CC4)nc3)cnc12 ZINC000542309205 566792144 /nfs/dbraw/zinc/79/21/44/566792144.db2.gz ASRMPJDUBHKSSU-UHFFFAOYSA-N 0 3 386.297 3.405 10 0 GGAEHN CCC(CC)(C(=O)N1CCN2C[C@H](O)C[C@H]2C1)c1ccc(Cl)c(Cl)c1 ZINC000655299243 566792327 /nfs/dbraw/zinc/79/23/27/566792327.db2.gz XLMPNPIWXJTMCD-LSDHHAIUSA-N 0 3 385.335 3.329 10 0 GGAEHN C[C@H](Cc1ccc(F)cc1Br)[NH2+]Cc1nnc(C2CCOCC2)[n-]1 ZINC000631214747 566792383 /nfs/dbraw/zinc/79/23/83/566792383.db2.gz XNEMQNHWKMEGNL-LLVKDONJSA-N 0 3 397.292 3.321 10 0 GGAEHN COc1cc(CNCC[C@H](O)C(F)F)cc(Br)c1OC(F)F ZINC000631215933 566792479 /nfs/dbraw/zinc/79/24/79/566792479.db2.gz CGVOYLGQKLSJMD-VIFPVBQESA-N 0 3 390.171 3.165 10 0 GGAEHN OC1(CCNCc2ccc(Br)cn2)CCN(c2ccccc2)CC1 ZINC000631218552 566793494 /nfs/dbraw/zinc/79/34/94/566793494.db2.gz NRIAJNMPIYFBHM-UHFFFAOYSA-N 0 3 390.325 3.355 10 0 GGAEHN CCN(CC)CCN(C(=O)c1oc(C)nc1C)c1ccc(Br)cn1 ZINC000562451222 566793578 /nfs/dbraw/zinc/79/35/78/566793578.db2.gz LRGCCCBBYAMJIN-UHFFFAOYSA-N 0 3 395.301 3.438 10 0 GGAEHN O=C(N[C@@H]1CCCN2CCCC[C@@H]12)c1cc(Br)cc2[nH]cnc21 ZINC000655347813 566795282 /nfs/dbraw/zinc/79/52/82/566795282.db2.gz CJVBTMQZJIDOFH-HIFRSBDPSA-N 0 3 377.286 3.072 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)N1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000581657174 566796855 /nfs/dbraw/zinc/79/68/55/566796855.db2.gz JEPPARNQRDCUMU-ZIAGYGMSSA-N 0 3 394.249 3.074 10 0 GGAEHN O=C(N[C@H]1CCCN2CCCC[C@H]12)c1[nH]nc2ccc(Br)cc21 ZINC000655349304 566797085 /nfs/dbraw/zinc/79/70/85/566797085.db2.gz FRABAWRHCVWOKJ-LSDHHAIUSA-N 0 3 377.286 3.072 10 0 GGAEHN CSc1cc(Br)ccc1C(=O)NCCCNCc1cccnc1 ZINC000655412049 566798223 /nfs/dbraw/zinc/79/82/23/566798223.db2.gz MJAZWHFCHYOYGK-UHFFFAOYSA-N 0 3 394.338 3.476 10 0 GGAEHN CCSc1cc(CN[C@@H](C)Cn2cc(Br)ccc2=O)ccn1 ZINC000581681576 566798433 /nfs/dbraw/zinc/79/84/33/566798433.db2.gz WNOPEVKEKBGZII-LBPRGKRZSA-N 0 3 382.327 3.296 10 0 GGAEHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1c(F)cncc1Br ZINC000631314065 566798672 /nfs/dbraw/zinc/79/86/72/566798672.db2.gz WXQRNERTRRTWIW-AWEZNQCLSA-N 0 3 392.272 3.378 10 0 GGAEHN CN(C)CCOc1ccc(NC(=O)c2n[nH]cc2C(F)(F)F)cc1Cl ZINC000631338707 566800461 /nfs/dbraw/zinc/80/04/61/566800461.db2.gz SFFZHTNGHAZRST-UHFFFAOYSA-N 0 3 376.766 3.275 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)[C@H]1[C@@H]2c3ccc(Br)cc3C[C@H]12 ZINC000631464722 566804412 /nfs/dbraw/zinc/80/44/12/566804412.db2.gz IWDZRCLKFIQMHO-QBFPWWHVSA-N 0 3 377.326 3.133 10 0 GGAEHN CO[C@@H](C(=O)N1CCc2ccccc2[C@@H]1CN)c1ccccc1Br ZINC000655483763 566804667 /nfs/dbraw/zinc/80/46/67/566804667.db2.gz LLKOFJDKIWYVJD-ZWKOTPCHSA-N 0 3 389.293 3.221 10 0 GGAEHN N[C@@H](CC(=O)N1CCOc2cccc(Br)c2C1)c1ccccc1 ZINC000655503475 566805184 /nfs/dbraw/zinc/80/51/84/566805184.db2.gz GZURHIHVUUOZJU-INIZCTEOSA-N 0 3 375.266 3.260 10 0 GGAEHN O=C1[C@@H](N[C@@H]2CCCc3ccc(Br)cc32)CCN1C1CCOCC1 ZINC000678595662 566805329 /nfs/dbraw/zinc/80/53/29/566805329.db2.gz WYYQRGUABHNGSA-MSOLQXFVSA-N 0 3 393.325 3.196 10 0 GGAEHN C[C@@H](NCCCN1CCCS1(=O)=O)c1cc(Cl)ccc1OC(F)F ZINC000678582211 566805872 /nfs/dbraw/zinc/80/58/72/566805872.db2.gz HCCPYVHOGJDAKV-LLVKDONJSA-N 0 3 382.860 3.018 10 0 GGAEHN COc1ccc(Cl)cc1[C@H](CC(C)C)NCCCN1CCCS1(=O)=O ZINC000678582263 566805907 /nfs/dbraw/zinc/80/59/07/566805907.db2.gz HYYKFHBVJSIXAT-KRWDZBQOSA-N 0 3 388.961 3.451 10 0 GGAEHN COc1cc(C(=O)N[C@H](CN)C(F)(F)F)cc(Cl)c1OCCC(C)C ZINC000655506494 566806169 /nfs/dbraw/zinc/80/61/69/566806169.db2.gz AGMGYSJGGFVIMX-CYBMUJFWSA-N 0 3 382.810 3.393 10 0 GGAEHN Cc1cc(SCC(=O)N[C@H](CN)C(F)(F)F)c(C)cc1Br ZINC000655504555 566806875 /nfs/dbraw/zinc/80/68/75/566806875.db2.gz FILHMUYIADDRTI-LLVKDONJSA-N 0 3 385.249 3.164 10 0 GGAEHN Cc1cc(C(=O)N[C@H](CN)C(F)(F)F)nn1-c1ccc(Cl)c(Cl)c1 ZINC000655515998 566807114 /nfs/dbraw/zinc/80/71/14/566807114.db2.gz TXXKCLDHXCQNIY-GFCCVEGCSA-N 0 3 381.185 3.107 10 0 GGAEHN NC[C@@H](NC(=O)C1(c2ccc(Br)cc2)CCCC1)C(F)(F)F ZINC000655509389 566807167 /nfs/dbraw/zinc/80/71/67/566807167.db2.gz LTPQBISRAXZYSU-GFCCVEGCSA-N 0 3 379.220 3.267 10 0 GGAEHN Cc1cccc(C[C@H](CO)NC[C@H](O)COc2c(Cl)cccc2Cl)c1 ZINC000581824240 566807398 /nfs/dbraw/zinc/80/73/98/566807398.db2.gz CRCYEWLYFIKLTD-CVEARBPZSA-N 0 3 384.303 3.235 10 0 GGAEHN OCCC1(CN[C@@H]2CCCOc3ccc(I)cc32)CC1 ZINC000427973747 566807721 /nfs/dbraw/zinc/80/77/21/566807721.db2.gz ABNFEMCRPKYIMK-CQSZACIVSA-N 0 3 387.261 3.257 10 0 GGAEHN Cc1cc(Br)ccc1NC(=O)CN1CCc2ccccc2[C@H]1CN ZINC000517146723 566808124 /nfs/dbraw/zinc/80/81/24/566808124.db2.gz LMEGHLLRYCUMMK-GOSISDBHSA-N 0 3 388.309 3.254 10 0 GGAEHN CC[C@@H](NC[C@H](O)COc1ccc(Br)cc1)c1c(C)nn(C)c1C ZINC000542522140 566808452 /nfs/dbraw/zinc/80/84/52/566808452.db2.gz KJHARDXPEHYTNX-DOTOQJQBSA-N 0 3 396.329 3.280 10 0 GGAEHN CC[C@H](NC[C@@H](O)COc1ccc(Br)cc1)c1c(C)nn(C)c1C ZINC000542522146 566808582 /nfs/dbraw/zinc/80/85/82/566808582.db2.gz KJHARDXPEHYTNX-WBVHZDCISA-N 0 3 396.329 3.280 10 0 GGAEHN CC[C@H](NC[C@H](O)COc1ccc(Br)cc1)c1c(C)nn(C)c1C ZINC000542522144 566809014 /nfs/dbraw/zinc/80/90/14/566809014.db2.gz KJHARDXPEHYTNX-RDJZCZTQSA-N 0 3 396.329 3.280 10 0 GGAEHN O=S1(=O)CCC(CCNCc2cnc(-c3c(F)cccc3F)s2)CC1 ZINC000562654376 566810705 /nfs/dbraw/zinc/81/07/05/566810705.db2.gz DITKNVNQKXOGBG-UHFFFAOYSA-N 0 3 386.489 3.393 10 0 GGAEHN CC(C)(C)[C@@H]1CCN(C[C@@H](O)COc2cc(Cl)ccc2Cl)C[C@H]1O ZINC000542547033 566810703 /nfs/dbraw/zinc/81/07/03/566810703.db2.gz SYOVKYNZYMLWPH-IIAWOOMASA-N 0 3 376.324 3.462 10 0 GGAEHN COc1ccc(-c2nc([C@@H](N)CC(C)C)no2)c(I)c1 ZINC000581883912 566811767 /nfs/dbraw/zinc/81/17/67/566811767.db2.gz ISCYTGZXIRVRKJ-LBPRGKRZSA-N 0 3 387.221 3.396 10 0 GGAEHN COc1ccc([C@@H](C)NC(=O)N2C[C@H]3CCC[C@@H](C2)N3)cc1Br ZINC000581873715 566812176 /nfs/dbraw/zinc/81/21/76/566812176.db2.gz YLDZJFJTFMPBJM-BNOWGMLFSA-N 0 3 382.302 3.055 10 0 GGAEHN CN1CCC[C@H](CNC(=O)c2ccc([S@@](C)=O)cc2)[C@@H]1c1cccs1 ZINC000610200282 566815232 /nfs/dbraw/zinc/81/52/32/566815232.db2.gz WZCGYANDERJUIQ-LNJIKXCHSA-N 0 3 376.547 3.298 10 0 GGAEHN CN1CCC[C@H](CNC(=O)c2ccc([S@@](C)=O)cc2)[C@H]1c1cccs1 ZINC000610200280 566815273 /nfs/dbraw/zinc/81/52/73/566815273.db2.gz WZCGYANDERJUIQ-HYGPGOAJSA-N 0 3 376.547 3.298 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)NCc1cc(Br)ccc1F ZINC000581942182 566816892 /nfs/dbraw/zinc/81/68/92/566816892.db2.gz BEMSBFVTDOWCPM-KRWDZBQOSA-N 0 3 392.272 3.356 10 0 GGAEHN CSCC[C@H](N[C@H](C)Cc1ccc(Br)cc1F)C(=O)N(C)C ZINC000489910767 566817564 /nfs/dbraw/zinc/81/75/64/566817564.db2.gz XYKVWNNMYSWIGI-ABAIWWIYSA-N 0 3 391.350 3.319 10 0 GGAEHN Cc1ccsc1[C@H](CO)NC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000489917550 566817766 /nfs/dbraw/zinc/81/77/66/566817766.db2.gz XNVAOLOYJISPNM-GJZGRUSLSA-N 0 3 379.551 3.288 10 0 GGAEHN C[NH+](C)[C@H]1C[C@@H](C[N-]S(=O)(=O)c2cc(Cl)ccc2OCC2CCC2)C1 ZINC000655632772 566824246 /nfs/dbraw/zinc/82/42/46/566824246.db2.gz RGZWIVOBOXQUTA-FZNQNYSPSA-N 0 3 386.945 3.137 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@H](CCCO)c1ccccc1 ZINC000428215996 566824781 /nfs/dbraw/zinc/82/47/81/566824781.db2.gz BBNJXIUULNMLGD-WMLDXEAASA-N 0 3 379.298 3.103 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cccc(Br)c2C)C[C@@H]1N1CCCC1 ZINC000542772670 566825134 /nfs/dbraw/zinc/82/51/34/566825134.db2.gz AGVLZSCACAHPPJ-JKSUJKDBSA-N 0 3 383.355 3.409 10 0 GGAEHN C[C@@H]1CC[C@@H](C)N1[C@H]1CCCN(S(=O)(=O)c2onc(C3CC3)c2Cl)C1 ZINC000631785160 566825822 /nfs/dbraw/zinc/82/58/22/566825822.db2.gz MFAPHMIUXZLUJK-BZPMIXESSA-N 0 3 387.933 3.231 10 0 GGAEHN C[C@@H](CNC(=O)N[C@@H](CO)c1cccc(Br)c1)N1CCCC[C@H]1C ZINC000490031764 566826183 /nfs/dbraw/zinc/82/61/83/566826183.db2.gz PHBZWYIFGZZLFI-KEYYUXOJSA-N 0 3 398.345 3.045 10 0 GGAEHN CN(CCC(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1)c1ccncc1 ZINC000542786234 566827278 /nfs/dbraw/zinc/82/72/78/566827278.db2.gz PPKGBXRPSKGLCC-UHFFFAOYSA-N 0 3 382.291 3.236 10 0 GGAEHN CN(CCc1ccc(Br)cc1)C(=O)CCN(C)c1ccncc1 ZINC000542784132 566827818 /nfs/dbraw/zinc/82/78/18/566827818.db2.gz KYXGJYYUXJKRNR-UHFFFAOYSA-N 0 3 376.298 3.372 10 0 GGAEHN O=C(Cc1ccc(Br)cc1)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000469922486 566827902 /nfs/dbraw/zinc/82/79/02/566827902.db2.gz AYPGTOUCEBGVCR-GOSISDBHSA-N 0 3 395.341 3.095 10 0 GGAEHN O=C(c1cccc(Br)c1)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000469927349 566828043 /nfs/dbraw/zinc/82/80/43/566828043.db2.gz XXOWSHANTWJVSN-QGZVFWFLSA-N 0 3 381.314 3.166 10 0 GGAEHN O=C(c1cc(F)ccc1Br)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000469932292 566828769 /nfs/dbraw/zinc/82/87/69/566828769.db2.gz GZBQTPZFTQBVHG-OAHLLOKOSA-N 0 3 399.304 3.305 10 0 GGAEHN O=C([C@H]1SCCc2sccc21)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000469943747 566829429 /nfs/dbraw/zinc/82/94/29/566829429.db2.gz ITOSTPUUVULWEZ-YJBOKZPZSA-N 0 3 380.579 3.182 10 0 GGAEHN CC[C@@H](C)N(C)CCNS(=O)(=O)c1c(C)cc(Br)cc1C ZINC000517528293 566831400 /nfs/dbraw/zinc/83/14/00/566831400.db2.gz XZCSQOUUMBEVSI-CYBMUJFWSA-N 0 3 377.348 3.075 10 0 GGAEHN Cc1nc(C(F)(F)F)c(CN2CCC(CCN3CCOCC3)CC2)s1 ZINC000562910070 566833439 /nfs/dbraw/zinc/83/34/39/566833439.db2.gz XIAVXHBKJIDIMX-UHFFFAOYSA-N 0 3 377.476 3.405 10 0 GGAEHN CCS(=O)(=O)NCCCN1CCC(F)(Cc2ccc(Cl)cc2)CC1 ZINC000451535416 566833851 /nfs/dbraw/zinc/83/38/51/566833851.db2.gz ZTUNFPAVSRXFHV-UHFFFAOYSA-N 0 3 376.925 3.016 10 0 GGAEHN C[C@H](Cc1ccc(F)cc1Br)N[C@H](C)C1(S(C)(=O)=O)CC1 ZINC000582144552 566835132 /nfs/dbraw/zinc/83/51/32/566835132.db2.gz QDNHDQBTNMOFGF-GHMZBOCLSA-N 0 3 378.307 3.075 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CC[C@]2(CCN(C)C2)C1 ZINC000490223491 566837161 /nfs/dbraw/zinc/83/71/61/566837161.db2.gz OJNQNQBSAJNUQY-ACJLOTCBSA-N 0 3 396.329 3.256 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CNCCCN1CCCC1=O ZINC000655712234 566838354 /nfs/dbraw/zinc/83/83/54/566838354.db2.gz HMLSTDJORSNKTL-UHFFFAOYSA-N 0 3 391.313 3.045 10 0 GGAEHN C[C@@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)N1CCC[C@H](C)C1 ZINC000517643360 566838506 /nfs/dbraw/zinc/83/85/06/566838506.db2.gz WXBZEPXPCSBTFQ-RYUDHWBXSA-N 0 3 379.302 3.176 10 0 GGAEHN CN(C(=O)CCCOc1ccccc1Br)[C@@H]1CN2CCC1CC2 ZINC000517699671 566840940 /nfs/dbraw/zinc/84/09/40/566840940.db2.gz SPPPTIIJNLNUOV-MRXNPFEDSA-N 0 3 381.314 3.161 10 0 GGAEHN C[C@@H]1CN(CCCNC(=O)C2(c3ccccc3Br)CC2)CCCO1 ZINC000470078006 566843407 /nfs/dbraw/zinc/84/34/07/566843407.db2.gz CVAAXKVEDPKWSB-OAHLLOKOSA-N 0 3 395.341 3.098 10 0 GGAEHN CN1CCN(CCNC(=O)N[C@@H]2CCCc3sc(Cl)cc32)CC1(C)C ZINC000490323190 566844334 /nfs/dbraw/zinc/84/43/34/566844334.db2.gz RGJUOKMGFWJUJO-CQSZACIVSA-N 0 3 384.977 3.104 10 0 GGAEHN COc1cccc2c1CC[C@@H]2N[C@@H](C)Cn1cc(Br)ccc1=O ZINC000428450808 566844457 /nfs/dbraw/zinc/84/44/57/566844457.db2.gz YPATWTXYGQGERH-LRDDRELGSA-N 0 3 377.282 3.285 10 0 GGAEHN COc1cccc2c1CC[C@H]2N[C@@H](C)Cn1cc(Br)ccc1=O ZINC000428450807 566844637 /nfs/dbraw/zinc/84/46/37/566844637.db2.gz YPATWTXYGQGERH-BLLLJJGKSA-N 0 3 377.282 3.285 10 0 GGAEHN COC(=O)[C@@H]1CCCC[C@@H]1NCc1ccc(OC)c(OC)c1Br ZINC000451588071 566844879 /nfs/dbraw/zinc/84/48/79/566844879.db2.gz ODNABWCPNCLUKW-OLZOCXBDSA-N 0 3 386.286 3.288 10 0 GGAEHN C[C@@H]1CC[C@@H]([NH2+]CC[N-]S(=O)(=O)c2cccc(Cl)c2Cl)CS1 ZINC000655766269 566845268 /nfs/dbraw/zinc/84/52/68/566845268.db2.gz CCEOGSMKWVMVPP-GHMZBOCLSA-N 0 3 383.366 3.145 10 0 GGAEHN C[C@H](N[C@H]([C@H](CO)C1CC1)C1CC1)C(=O)Nc1ccccc1Br ZINC000451585361 566845236 /nfs/dbraw/zinc/84/52/36/566845236.db2.gz DFCDAUGWQIAHPJ-KHIZAZIESA-N 0 3 381.314 3.163 10 0 GGAEHN COCC[C@H](COC)NCc1cn(-c2ccccc2Br)nc1C ZINC000655777880 566846532 /nfs/dbraw/zinc/84/65/32/566846532.db2.gz YNIGDGFVUBVESK-OAHLLOKOSA-N 0 3 382.302 3.084 10 0 GGAEHN COC(=O)[C@@H]1CCCC[C@@H]1N[C@@H](C)C(=O)Nc1cccc(Br)c1 ZINC000451590530 566846733 /nfs/dbraw/zinc/84/67/33/566846733.db2.gz YQEOJKWUCAIVSB-GLQYFDAESA-N 0 3 383.286 3.098 10 0 GGAEHN COCC[C@@H](COC)NCc1cn(-c2ccccc2Br)nc1C ZINC000655777879 566847905 /nfs/dbraw/zinc/84/79/05/566847905.db2.gz YNIGDGFVUBVESK-HNNXBMFYSA-N 0 3 382.302 3.084 10 0 GGAEHN CC[C@@H](NCc1cn(-c2ccccc2Br)nc1C)[C@H](O)C(F)F ZINC000655778406 566848124 /nfs/dbraw/zinc/84/81/24/566848124.db2.gz KHRXQCRZJVDFGV-HIFRSBDPSA-N 0 3 388.256 3.437 10 0 GGAEHN COC(=O)[C@@H]1CCCC[C@@H]1N[C@@H](C)C(=O)Nc1ccccc1Br ZINC000451598867 566848115 /nfs/dbraw/zinc/84/81/15/566848115.db2.gz PKUYQVPABJQRMU-SCRDCRAPSA-N 0 3 383.286 3.098 10 0 GGAEHN OC[C@@H](CNCc1cc2n(n1)CCCC2)Cc1ccc(F)c(Br)c1 ZINC000655780298 566848769 /nfs/dbraw/zinc/84/87/69/566848769.db2.gz XFYVQDOQVFGZDU-CQSZACIVSA-N 0 3 396.304 3.062 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@@H]1CCO[C@H](C)C1)c1ccc(Br)cn1 ZINC000517804253 566849099 /nfs/dbraw/zinc/84/90/99/566849099.db2.gz LDNCUWSUYLNIHN-HUUCEWRRSA-N 0 3 398.345 3.334 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1F)[NH2+]Cc1nnc([C@H]2CCCO2)[n-]1 ZINC000655795854 566849990 /nfs/dbraw/zinc/84/99/90/566849990.db2.gz DFKMMHIYCCAAQR-IINYFYTJSA-N 0 3 383.265 3.279 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1F)NCc1nc([C@H]2CCCO2)n[nH]1 ZINC000655795854 566849996 /nfs/dbraw/zinc/84/99/96/566849996.db2.gz DFKMMHIYCCAAQR-IINYFYTJSA-N 0 3 383.265 3.279 10 0 GGAEHN COCCN1CCC[C@@H]1CN[C@H](c1ccc(Br)cc1)[C@H]1CCCO1 ZINC000679336584 566850038 /nfs/dbraw/zinc/85/00/38/566850038.db2.gz AJVGPDLZGZBUMA-GUDVDZBRSA-N 0 3 397.357 3.370 10 0 GGAEHN Cn1nnnc1CCN[C@H](c1cccc(F)c1)c1cccc(Br)c1 ZINC000679351626 566851169 /nfs/dbraw/zinc/85/11/69/566851169.db2.gz MDGNANSWRMUPBI-KRWDZBQOSA-N 0 3 390.260 3.033 10 0 GGAEHN OCC[C@]1(CN[C@H](c2ccc(Br)cc2)[C@@H]2CCCO2)CCOC1 ZINC000679349026 566851257 /nfs/dbraw/zinc/85/12/57/566851257.db2.gz JAWWAAMGKYJWIF-RCCFBDPRSA-N 0 3 384.314 3.048 10 0 GGAEHN O=S1(=O)CCCN1CCCN[C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000679354364 566851800 /nfs/dbraw/zinc/85/18/00/566851800.db2.gz ZHOBQGBJZYROAV-IBGZPJMESA-N 0 3 378.925 3.445 10 0 GGAEHN O=C(NC[C@H]1CCCCN1C1CC1)c1[nH]nc2ccc(Br)cc21 ZINC000470165800 566852857 /nfs/dbraw/zinc/85/28/57/566852857.db2.gz OQFQLCZJXGZAES-CYBMUJFWSA-N 0 3 377.286 3.072 10 0 GGAEHN CN(CCC(=O)N1CCc2c(F)cc(Br)cc2C1)c1ccncc1 ZINC000679410148 566854819 /nfs/dbraw/zinc/85/48/19/566854819.db2.gz RCDLZELPQQKPNA-UHFFFAOYSA-N 0 3 392.272 3.394 10 0 GGAEHN COc1cc(C)nc(CNC[C@@H](CO)Cc2ccccc2Br)c1 ZINC000428546672 566855995 /nfs/dbraw/zinc/85/59/95/566855995.db2.gz MJYWKGGCPRYOES-AWEZNQCLSA-N 0 3 379.298 3.102 10 0 GGAEHN COc1ccc(OC)c(CNC[C@H](CO)Cc2ccc(Br)cc2)c1 ZINC000428544189 566856555 /nfs/dbraw/zinc/85/65/55/566856555.db2.gz UAIADZLLIOHJCM-OAHLLOKOSA-N 0 3 394.309 3.407 10 0 GGAEHN NC[C@@H](NC(=O)N1CCC[C@@H]1c1ccc(Br)cc1)C(F)(F)F ZINC000655910958 566858387 /nfs/dbraw/zinc/85/83/87/566858387.db2.gz FPWUSTPMTCLONA-VXGBXAGGSA-N 0 3 380.208 3.185 10 0 GGAEHN NC[C@H](NC(=O)N1CCC[C@H](COc2ccccc2Cl)C1)C(F)(F)F ZINC000655919443 566858909 /nfs/dbraw/zinc/85/89/09/566858909.db2.gz CORXNFLSAUHPJO-FZMZJTMJSA-N 0 3 379.810 3.030 10 0 GGAEHN NC[C@@H](NC(=O)N[C@H](c1ccc(Br)cc1)C1CCC1)C(F)(F)F ZINC000655910748 566859022 /nfs/dbraw/zinc/85/90/22/566859022.db2.gz BMGVKQOEBYKOOD-OLZOCXBDSA-N 0 3 394.235 3.479 10 0 GGAEHN NC[C@@H](NC(=O)N1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1)C(F)(F)F ZINC000655921647 566859031 /nfs/dbraw/zinc/85/90/31/566859031.db2.gz PQSWECKVFAFAFD-JOYOIKCWSA-N 0 3 386.201 3.046 10 0 GGAEHN CCN(Cc1cc(Br)ccc1F)C(=O)N[C@H](CN)C(F)(F)F ZINC000655916436 566859046 /nfs/dbraw/zinc/85/90/46/566859046.db2.gz YEVRHKBOQKELKN-LLVKDONJSA-N 0 3 386.187 3.009 10 0 GGAEHN CC(C)N(Cc1ccc(Br)cc1)C(=O)N[C@H](CN)C(F)(F)F ZINC000655916251 566859062 /nfs/dbraw/zinc/85/90/62/566859062.db2.gz UHYLLYDKFSQTKA-GFCCVEGCSA-N 0 3 382.224 3.259 10 0 GGAEHN CC[C@@H](NC(=O)N[C@@H](CN)C(F)(F)F)c1cc(F)cc(Br)c1 ZINC000655923638 566859230 /nfs/dbraw/zinc/85/92/30/566859230.db2.gz ATDXGBCWSVWMCU-MNOVXSKESA-N 0 3 386.187 3.228 10 0 GGAEHN CC[C@H](NC(=O)N[C@H](CN)C(F)(F)F)c1cc(F)cc(Br)c1 ZINC000655923641 566859331 /nfs/dbraw/zinc/85/93/31/566859331.db2.gz ATDXGBCWSVWMCU-WDEREUQCSA-N 0 3 386.187 3.228 10 0 GGAEHN NC[C@H](NC(=O)N(Cc1cccc(Br)c1)C1CC1)C(F)(F)F ZINC000655912566 566859397 /nfs/dbraw/zinc/85/93/97/566859397.db2.gz ACPUDEZZHXVFMM-LBPRGKRZSA-N 0 3 380.208 3.013 10 0 GGAEHN CC(C)N(Cc1cccc(Br)c1)C(=O)N[C@H](CN)C(F)(F)F ZINC000655913817 566859697 /nfs/dbraw/zinc/85/96/97/566859697.db2.gz JTZDCSZUFJAKKT-GFCCVEGCSA-N 0 3 382.224 3.259 10 0 GGAEHN NC[C@@H](NC(=O)N1CCC[C@@H]1c1cc(F)cc(Br)c1)C(F)(F)F ZINC000655924825 566860874 /nfs/dbraw/zinc/86/08/74/566860874.db2.gz QZRQLHDOICKEBP-VXGBXAGGSA-N 0 3 398.198 3.324 10 0 GGAEHN NC[C@H](NC(=O)N1CCC[C@H]1c1ccc(Br)c(F)c1)C(F)(F)F ZINC000655928543 566860887 /nfs/dbraw/zinc/86/08/87/566860887.db2.gz OILZLYDQPVIUAR-RYUDHWBXSA-N 0 3 398.198 3.324 10 0 GGAEHN O=C(CN(c1ccc(Br)cc1)C1CC1)NC1CCN(C2CC2)CC1 ZINC000451668565 566861038 /nfs/dbraw/zinc/86/10/38/566861038.db2.gz LPKDFSBCFMFRAL-UHFFFAOYSA-N 0 3 392.341 3.161 10 0 GGAEHN NC[C@H](NC(=O)N1CCC(c2ccc(Br)cc2)CC1)C(F)(F)F ZINC000655926833 566861119 /nfs/dbraw/zinc/86/11/19/566861119.db2.gz GPKDYLWPWWZYNT-ZDUSSCGKSA-N 0 3 394.235 3.228 10 0 GGAEHN NC[C@H](NC(=O)N1CCC[C@H]1c1ccc(Br)s1)C(F)(F)F ZINC000655925281 566861302 /nfs/dbraw/zinc/86/13/02/566861302.db2.gz ZPDXCRGPGVIJKT-CBAPKCEASA-N 0 3 386.237 3.247 10 0 GGAEHN NC[C@H](NC(=O)N[C@H]1C[C@H](c2ccc(F)c(Br)c2)C1)C(F)(F)F ZINC000655926393 566861649 /nfs/dbraw/zinc/86/16/49/566861649.db2.gz FAOHRYDHBYBFSF-AUTRQRHGSA-N 0 3 398.198 3.023 10 0 GGAEHN NC[C@H](NC(=O)N1CCC[C@H]1c1cc(F)cc(Br)c1)C(F)(F)F ZINC000655924824 566861318 /nfs/dbraw/zinc/86/13/18/566861318.db2.gz QZRQLHDOICKEBP-RYUDHWBXSA-N 0 3 398.198 3.324 10 0 GGAEHN C[C@H](CN(C)C(=O)N[C@@H](CN)C(F)(F)F)Oc1ccc(Cl)c(Cl)c1 ZINC000655927950 566861477 /nfs/dbraw/zinc/86/14/77/566861477.db2.gz JVWFXHNITTWUTE-PELKAZGASA-N 0 3 388.217 3.292 10 0 GGAEHN NC[C@@H](NC(=O)N1CCC(c2ccc(Br)cc2)CC1)C(F)(F)F ZINC000655926832 566861522 /nfs/dbraw/zinc/86/15/22/566861522.db2.gz GPKDYLWPWWZYNT-CYBMUJFWSA-N 0 3 394.235 3.228 10 0 GGAEHN N[C@H](CNC(=O)N1CCOc2cccc(Br)c2C1)c1ccccc1 ZINC000655962904 566862641 /nfs/dbraw/zinc/86/26/41/566862641.db2.gz HWKFMISUIDGPRZ-MRXNPFEDSA-N 0 3 390.281 3.053 10 0 GGAEHN COC(=O)[C@@H](c1cc(Cl)cc(Cl)c1)N1CCN(c2ccncc2)CC1 ZINC000610787569 566864245 /nfs/dbraw/zinc/86/42/45/566864245.db2.gz XNIYADPQGTZIIC-QGZVFWFLSA-N 0 3 380.275 3.425 10 0 GGAEHN CN1CCC[C@@H](N[C@H]2CCCOc3ccc(I)cc32)C1 ZINC000610804147 566864804 /nfs/dbraw/zinc/86/48/04/566864804.db2.gz BGADAFGGPXHOEV-HIFRSBDPSA-N 0 3 386.277 3.189 10 0 GGAEHN Cc1ccc(C(=O)N2CC[C@H](N3CCCCC3)C2)cc1I ZINC000518080622 566864759 /nfs/dbraw/zinc/86/47/59/566864759.db2.gz HKLMJQCJURJAMH-HNNXBMFYSA-N 0 3 398.288 3.300 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNS(=O)(=O)Cc1cccc(C(F)(F)F)c1 ZINC000518088755 566865208 /nfs/dbraw/zinc/86/52/08/566865208.db2.gz ATPDFQVWHZJLOD-ZIAGYGMSSA-N 0 3 378.460 3.388 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)c1ccc(I)cc1 ZINC000518085038 566865263 /nfs/dbraw/zinc/86/52/63/566865263.db2.gz JTETVWRLLQKJQH-CHWSQXEVSA-N 0 3 386.277 3.284 10 0 GGAEHN CCN(CC)CCN(C(=O)c1cncs1)c1ccc(Br)cn1 ZINC000563218928 566865664 /nfs/dbraw/zinc/86/56/64/566865664.db2.gz WECIPOYFHUARHU-UHFFFAOYSA-N 0 3 383.315 3.289 10 0 GGAEHN O=C(CCN1CCC[C@@H](OC(F)F)C1)Nc1cccc(Br)c1 ZINC000679678123 566865822 /nfs/dbraw/zinc/86/58/22/566865822.db2.gz JNSFGYAOJZBWAS-CYBMUJFWSA-N 0 3 377.229 3.481 10 0 GGAEHN CCCN1CCC[C@@H]1C(=O)NCc1cnn(-c2ccc(Br)cc2)c1 ZINC000470346629 566866119 /nfs/dbraw/zinc/86/61/19/566866119.db2.gz RKWDWXGAPDYISS-QGZVFWFLSA-N 0 3 391.313 3.125 10 0 GGAEHN CCCN1CCC[C@H]1C(=O)NCc1cnn(-c2ccc(Br)cc2)c1 ZINC000470346628 566866540 /nfs/dbraw/zinc/86/65/40/566866540.db2.gz RKWDWXGAPDYISS-KRWDZBQOSA-N 0 3 391.313 3.125 10 0 GGAEHN O=C(CCN1CCC[C@H](OC(F)F)C1)Nc1ccccc1Br ZINC000679677516 566866682 /nfs/dbraw/zinc/86/66/82/566866682.db2.gz AZRULIKSSWIZEI-NSHDSACASA-N 0 3 377.229 3.481 10 0 GGAEHN O=S(=O)(c1ccc(Br)cc1)N1CCCC[C@H](N2CCCC2)C1 ZINC000518089960 566867189 /nfs/dbraw/zinc/86/71/89/566867189.db2.gz OJEJASIUBSRYDB-HNNXBMFYSA-N 0 3 387.343 3.088 10 0 GGAEHN O=C(NCCN1CCCC1)c1ccc(NCc2ccc(Br)o2)cc1 ZINC000518142883 566868617 /nfs/dbraw/zinc/86/86/17/566868617.db2.gz XEIINXJRNVIVSR-UHFFFAOYSA-N 0 3 392.297 3.480 10 0 GGAEHN CCCN1CCC[C@@H]1C(=O)NCCCc1ccc(Br)cc1OC ZINC000543348484 566872293 /nfs/dbraw/zinc/87/22/93/566872293.db2.gz DFFKIFMSCFSOHM-MRXNPFEDSA-N 0 3 383.330 3.381 10 0 GGAEHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1c(F)cncc1Br ZINC000632307413 566872586 /nfs/dbraw/zinc/87/25/86/566872586.db2.gz CNSOTJRPFNXRRC-GFCCVEGCSA-N 0 3 380.261 3.234 10 0 GGAEHN C[C@]12CCN(C[C@H](O)COc3ccc(Br)cc3)C[C@H]1C2(F)F ZINC000428714826 566872811 /nfs/dbraw/zinc/87/28/11/566872811.db2.gz WLCCNCGPCDIQKQ-CFVMTHIKSA-N 0 3 376.241 3.166 10 0 GGAEHN COc1cc(Br)ccc1CN1CCCN(C[C@@H]2CCCO2)CC1 ZINC000679770798 566873399 /nfs/dbraw/zinc/87/33/99/566873399.db2.gz QAGPCDQQDCZTEF-KRWDZBQOSA-N 0 3 383.330 3.144 10 0 GGAEHN CCCN1CCC[C@H]1C(=O)N[C@@H]1CCN(c2cccc(Br)c2)C1 ZINC000470443524 566874259 /nfs/dbraw/zinc/87/42/59/566874259.db2.gz IHPAYFHLVVYOEQ-WBVHZDCISA-N 0 3 380.330 3.018 10 0 GGAEHN CCN(CCCC(=O)Nc1c(C)cc(Br)cc1C)CC(=O)N(C)C ZINC000679817387 566875239 /nfs/dbraw/zinc/87/52/39/566875239.db2.gz PQWKAVUMARQHQQ-UHFFFAOYSA-N 0 3 398.345 3.195 10 0 GGAEHN Cc1c(Br)cccc1CNC[C@H](O)COc1ccc2c(c1)OCO2 ZINC000656153882 566875503 /nfs/dbraw/zinc/87/55/03/566875503.db2.gz DVWUFCGXSLKVDP-AWEZNQCLSA-N 0 3 394.265 3.016 10 0 GGAEHN CC(C)C[C@H](CN(C)C)NC(=O)c1cccc(F)c1I ZINC000611001978 566881229 /nfs/dbraw/zinc/88/12/29/566881229.db2.gz RRXFBJQVYGOSNU-LLVKDONJSA-N 0 3 392.256 3.136 10 0 GGAEHN CN(C)CCN(Cc1nc2cc(Br)ccc2[nH]1)Cc1ccccn1 ZINC000563366811 566880174 /nfs/dbraw/zinc/88/01/74/566880174.db2.gz XNVJQEXHWOTZOA-UHFFFAOYSA-N 0 3 388.313 3.284 10 0 GGAEHN CN(C(=O)c1[nH]nc(-c2ccccc2)c1Br)[C@H]1CCN(C2CC2)C1 ZINC000518431460 566882116 /nfs/dbraw/zinc/88/21/16/566882116.db2.gz BUXILNVLAIKBIK-AWEZNQCLSA-N 0 3 389.297 3.148 10 0 GGAEHN Cc1nc2ccc(Br)cc2c(N2CCN3CCOC[C@H]3C2)c1C ZINC000543451827 566884824 /nfs/dbraw/zinc/88/48/24/566884824.db2.gz KFXGYDYOWCBPRB-OAHLLOKOSA-N 0 3 376.298 3.135 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)NCc1ccc(Br)cc1 ZINC000518520063 566887214 /nfs/dbraw/zinc/88/72/14/566887214.db2.gz RWKFEEZOMYCIHH-SFHVURJKSA-N 0 3 390.325 3.421 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1C[C@H](C(N)=O)CC[C@@H]1C ZINC000656249793 566888384 /nfs/dbraw/zinc/88/83/84/566888384.db2.gz CKEVQMODSOUKQF-GXTWGEPZSA-N 0 3 391.313 3.029 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1C[C@H](C(N)=O)CC[C@H]1C ZINC000656250622 566889929 /nfs/dbraw/zinc/88/99/29/566889929.db2.gz WLJMKJQBFBIXFN-TZMCWYRMSA-N 0 3 391.313 3.029 10 0 GGAEHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1c(F)cncc1Br ZINC000632482647 566890292 /nfs/dbraw/zinc/89/02/92/566890292.db2.gz HLMSKHRNBIIIAY-MLGOLLRUSA-N 0 3 392.272 3.234 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1CC[C@@H]2CN(C)C[C@@H]21 ZINC000656260053 566892313 /nfs/dbraw/zinc/89/23/13/566892313.db2.gz IHLWLLPJHPTWLX-KDOFPFPSSA-N 0 3 375.314 3.079 10 0 GGAEHN C[C@H](NCc1cc(Cl)cc(S(N)(=O)=O)c1)[C@H]1Oc2ccccc2[C@H]1C ZINC000563539782 566892658 /nfs/dbraw/zinc/89/26/58/566892658.db2.gz WSUPNFREJCPKMW-SOZUMNATSA-N 0 3 380.897 3.030 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)c1ccccc1I ZINC000518597499 566893166 /nfs/dbraw/zinc/89/31/66/566893166.db2.gz HKHLAURBGFZWFQ-BETUJISGSA-N 0 3 386.277 3.284 10 0 GGAEHN COc1cc(S(=O)(=O)N[C@@H](C)[C@H]2CCCN(C3CCC3)C2)ccc1Cl ZINC000563539928 566893135 /nfs/dbraw/zinc/89/31/35/566893135.db2.gz DWNLYWMQUKIKBI-KBPBESRZSA-N 0 3 386.945 3.280 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)COc1ccc(F)cc1Br ZINC000518596671 566893260 /nfs/dbraw/zinc/89/32/60/566893260.db2.gz JAWHOTCWSVRJOY-BETUJISGSA-N 0 3 387.293 3.346 10 0 GGAEHN CN1CC[C@H](NC(=O)Cc2ccc(Br)cc2O)[C@@H]1c1ccccc1 ZINC000491119289 566893368 /nfs/dbraw/zinc/89/33/68/566893368.db2.gz VPHGBKXBHVTKQR-LPHOPBHVSA-N 0 3 389.293 3.259 10 0 GGAEHN CN1CC[C@@H](NC(=O)Cc2ccc(Br)cc2O)[C@@H]1c1ccccc1 ZINC000491119288 566893554 /nfs/dbraw/zinc/89/35/54/566893554.db2.gz VPHGBKXBHVTKQR-APWZRJJASA-N 0 3 389.293 3.259 10 0 GGAEHN CSC1(CNC(=O)Cc2ccc(C)cc2Br)CCN(C)CC1 ZINC000451856249 566895276 /nfs/dbraw/zinc/89/52/76/566895276.db2.gz SNPGXQGWXZMWAS-UHFFFAOYSA-N 0 3 385.371 3.244 10 0 GGAEHN CCCCN(C)CCNC(=O)Nc1ccc2nccnc2c1Br ZINC000491216355 566897666 /nfs/dbraw/zinc/89/76/66/566897666.db2.gz IOTPOTSYWLOOFS-UHFFFAOYSA-N 0 3 380.290 3.246 10 0 GGAEHN C[C@H]1CN(CCC(=O)Nc2ccc(Cl)cc2)CCN(CC(F)(F)F)C1 ZINC000451877364 566899353 /nfs/dbraw/zinc/89/93/53/566899353.db2.gz CPGOSIWUQXTJBI-ZDUSSCGKSA-N 0 3 377.838 3.485 10 0 GGAEHN O=C(COc1cc(C(F)(F)F)ccc1Cl)NC1CCN(C2CC2)CC1 ZINC000518730314 566900345 /nfs/dbraw/zinc/90/03/45/566900345.db2.gz OUFXEWCLKOAIAJ-UHFFFAOYSA-N 0 3 376.806 3.481 10 0 GGAEHN COc1cc(C(=O)N2CCc3ccccc3[C@H]2CN)sc1Br ZINC000563626783 566901652 /nfs/dbraw/zinc/90/16/52/566901652.db2.gz VSRRCCUOQOUOBD-GFCCVEGCSA-N 0 3 381.295 3.218 10 0 GGAEHN O=C(CCN1CC[C@H]([C@H](O)C(F)(F)F)C1)Nc1cccc(Br)c1 ZINC000451891945 566903335 /nfs/dbraw/zinc/90/33/35/566903335.db2.gz OXLKSBCLAIZGAR-HZMBPMFUSA-N 0 3 395.219 3.023 10 0 GGAEHN COc1ccc(S[C@H](C)C(=O)N2C[C@H](SC)[C@@H](N3CCCC3)C2)cc1 ZINC000543701162 566903596 /nfs/dbraw/zinc/90/35/96/566903596.db2.gz AKXJCGRMFTXUOF-JLSDUUJJSA-N 0 3 380.579 3.214 10 0 GGAEHN COc1ccc(S[C@H](C)C(=O)N2C[C@@H](SC)[C@H](N3CCCC3)C2)cc1 ZINC000543701164 566904008 /nfs/dbraw/zinc/90/40/08/566904008.db2.gz AKXJCGRMFTXUOF-ZTFGCOKTSA-N 0 3 380.579 3.214 10 0 GGAEHN COc1cc(Br)ccc1CN1CCC(CCN2CCOCC2)CC1 ZINC000582896526 566904317 /nfs/dbraw/zinc/90/43/17/566904317.db2.gz DCLOOWLERUBHAO-UHFFFAOYSA-N 0 3 397.357 3.392 10 0 GGAEHN C[C@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CCC[C@@]2(CCOC2)C1 ZINC000451902670 566904551 /nfs/dbraw/zinc/90/45/51/566904551.db2.gz OPEYTWZBTLMFPH-DNVCBOLYSA-N 0 3 395.341 3.299 10 0 GGAEHN C[C@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CCC[C@]2(CCOC2)C1 ZINC000451902669 566904822 /nfs/dbraw/zinc/90/48/22/566904822.db2.gz OPEYTWZBTLMFPH-BEFAXECRSA-N 0 3 395.341 3.299 10 0 GGAEHN O=C(CCN1CC[C@@H]([C@H](O)C(F)(F)F)C1)Nc1ccc(Br)cc1 ZINC000451915413 566905973 /nfs/dbraw/zinc/90/59/73/566905973.db2.gz VKYDOGOXCXUDGH-YGRLFVJLSA-N 0 3 395.219 3.023 10 0 GGAEHN O[C@H]([C@@H]1CCN(CCc2nc(-c3cccc(Cl)c3)no2)C1)C(F)(F)F ZINC000451915564 566906694 /nfs/dbraw/zinc/90/66/94/566906694.db2.gz VRCPXQRXMJKKTG-BXUZGUMPSA-N 0 3 375.778 3.178 10 0 GGAEHN O=C1CC[C@@H](N2CCN(CCCSc3ccccc3Cl)CC2)CCN1 ZINC000451919994 566908002 /nfs/dbraw/zinc/90/80/02/566908002.db2.gz VFBLDBSJULUAAA-MRXNPFEDSA-N 0 3 381.973 3.109 10 0 GGAEHN CC[C@@H](c1ccc(Br)cc1)N1CCN([C@@H]2CCNC(=O)CC2)CC1 ZINC000451919629 566908169 /nfs/dbraw/zinc/90/81/69/566908169.db2.gz SOYASTSIDXRLOC-ROUUACIJSA-N 0 3 394.357 3.187 10 0 GGAEHN CC[C@H](c1ccc(Br)cc1)N1CCN([C@H]2CCNC(=O)CC2)CC1 ZINC000451919628 566908438 /nfs/dbraw/zinc/90/84/38/566908438.db2.gz SOYASTSIDXRLOC-QZTJIDSGSA-N 0 3 394.357 3.187 10 0 GGAEHN CS(=O)(=O)N1CCC[C@@H](CN2CC[C@H](Sc3cccc(Cl)c3)C2)C1 ZINC000429126982 566909641 /nfs/dbraw/zinc/90/96/41/566909641.db2.gz ATVPZZZVEQUZER-YOEHRIQHSA-N 0 3 388.986 3.178 10 0 GGAEHN CCCCOc1c(Cl)cc(C(=O)N[C@@H]2CNCCC2(F)F)cc1OC ZINC000563713330 566911089 /nfs/dbraw/zinc/91/10/89/566911089.db2.gz MARQPNKLMCCGIC-CQSZACIVSA-N 0 3 376.831 3.255 10 0 GGAEHN CC(C(=O)NCCc1ccc(F)cc1)S(=O)(=O)Cc1ccsc1Cl ZINC000656533825 566912137 /nfs/dbraw/zinc/91/21/37/566912137.db2.gz BVZJOBRJIGDXGJ-NSHDSACASA-N 0 3 389.901 3.203 10 0 GGAEHN CC(C(=O)NCc1ccc(F)cc1)S(=O)(=O)Cc1ccsc1Cl ZINC000656533142 566912196 /nfs/dbraw/zinc/91/21/96/566912196.db2.gz PGBVZMLUQDIOFE-JTQLQIEISA-N 0 3 375.874 3.160 10 0 GGAEHN CC(C(=O)NCc1ccc(F)cc1)S(=O)(=O)Cc1ccsc1Cl ZINC000656533143 566912272 /nfs/dbraw/zinc/91/22/72/566912272.db2.gz PGBVZMLUQDIOFE-SNVBAGLBSA-N 0 3 375.874 3.160 10 0 GGAEHN COc1cccc(CNC(=O)C(C)S(=O)(=O)Cc2ccsc2Cl)c1 ZINC000656533330 566912783 /nfs/dbraw/zinc/91/27/83/566912783.db2.gz VKMNPYJYDFSAQW-NSHDSACASA-N 0 3 387.910 3.030 10 0 GGAEHN O=C(Cc1csc(CCC(F)(F)F)n1)NC[C@H]1CCCCN1C1CC1 ZINC000632767147 566912921 /nfs/dbraw/zinc/91/29/21/566912921.db2.gz KMEZXTWCJLXYOO-CQSZACIVSA-N 0 3 375.460 3.314 10 0 GGAEHN CC1(C)CCCN(CCNC(=O)Cc2csc(CCC(F)(F)F)n2)C1 ZINC000632773151 566913086 /nfs/dbraw/zinc/91/30/86/566913086.db2.gz SRUMRYCAWYDFHQ-UHFFFAOYSA-N 0 3 377.476 3.419 10 0 GGAEHN Cc1ccsc1[C@@H](CO)NC[C@H](O)COc1cc(Cl)ccc1Cl ZINC000563764788 566914008 /nfs/dbraw/zinc/91/40/08/566914008.db2.gz MTNSITMUWXCMKU-GXTWGEPZSA-N 0 3 376.305 3.426 10 0 GGAEHN N[C@@H]1CCCc2cn(Cc3cc4c(cc3Br)OCCCO4)nc21 ZINC000583019390 566914616 /nfs/dbraw/zinc/91/46/16/566914616.db2.gz ACSXUOQHUDLKRC-CQSZACIVSA-N 0 3 378.270 3.191 10 0 GGAEHN Cc1ccsc1[C@@H](CO)NC[C@@H](O)COc1cc(Cl)ccc1Cl ZINC000563764810 566915041 /nfs/dbraw/zinc/91/50/41/566915041.db2.gz MTNSITMUWXCMKU-TZMCWYRMSA-N 0 3 376.305 3.426 10 0 GGAEHN CN1CC[C@@]2(CCN(C(=O)c3cc(F)c(Br)cc3Cl)C2)C1 ZINC000583016259 566915623 /nfs/dbraw/zinc/91/56/23/566915623.db2.gz RPYTYNPEBSLUPL-OAHLLOKOSA-N 0 3 375.669 3.409 10 0 GGAEHN COCc1sccc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000632808888 566916405 /nfs/dbraw/zinc/91/64/05/566916405.db2.gz ZUEMNMADJKHNPD-UHFFFAOYSA-N 0 3 376.444 3.430 10 0 GGAEHN C[C@@H]1[C@H](C(F)(F)F)CCN1C[C@H](O)COc1ccc(Br)cc1 ZINC000470948897 566916976 /nfs/dbraw/zinc/91/69/76/566916976.db2.gz MIIPZBXMJMJYFN-SCDSUCTJSA-N 0 3 382.220 3.462 10 0 GGAEHN C[C@@H]1[C@@H](C(F)(F)F)CCN1CCC(=O)Nc1ccc(C(N)=O)c(Cl)c1 ZINC000470938930 566917018 /nfs/dbraw/zinc/91/70/18/566917018.db2.gz AORMPROHTSRQKR-SKDRFNHKSA-N 0 3 377.794 3.040 10 0 GGAEHN CC[C@@H]1CN(C)CCCN1C(=O)[C@H]1[C@@H]2c3ccc(Br)cc3C[C@H]12 ZINC000632822109 566917786 /nfs/dbraw/zinc/91/77/86/566917786.db2.gz VTIMRBPBOJFWCI-BZZMCLGOSA-N 0 3 377.326 3.278 10 0 GGAEHN COc1cc(Br)ccc1CCC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1 ZINC000543858691 566918094 /nfs/dbraw/zinc/91/80/94/566918094.db2.gz ROMPBGVMNSRVJZ-CJNGLKHVSA-N 0 3 383.330 3.331 10 0 GGAEHN C[C@H](N[C@H]1Cc2cccc(O)c2C1)C(=O)Nc1ccccc1Br ZINC000429304559 566922014 /nfs/dbraw/zinc/92/20/14/566922014.db2.gz GZMXPEIVILTWRA-AAEUAGOBSA-N 0 3 375.266 3.239 10 0 GGAEHN CC(C)n1ccc(C[C@H](C)NCC(=O)Nc2ccc(Br)cc2)n1 ZINC000544007518 566927997 /nfs/dbraw/zinc/92/79/97/566927997.db2.gz GOCWIKIEJUNGCJ-ZDUSSCGKSA-N 0 3 379.302 3.386 10 0 GGAEHN CNC(=O)[C@H](C)Oc1ccc(Br)cc1CN[C@@H]1CC12CCCC2 ZINC000583184698 566928657 /nfs/dbraw/zinc/92/86/57/566928657.db2.gz MXHKXJJMCBSBTL-BLLLJJGKSA-N 0 3 381.314 3.385 10 0 GGAEHN CNC(=O)[C@@H](C)Oc1ccc(Br)cc1CN[C@@H]1CC12CCCC2 ZINC000583184700 566929128 /nfs/dbraw/zinc/92/91/28/566929128.db2.gz MXHKXJJMCBSBTL-MLGOLLRUSA-N 0 3 381.314 3.385 10 0 GGAEHN CCN(CC)CCN(C(=O)CC[C@H]1CCOC1)c1ccc(Br)cn1 ZINC000563932500 566930643 /nfs/dbraw/zinc/93/06/43/566930643.db2.gz QWJMTPRJDKWSGL-HNNXBMFYSA-N 0 3 398.345 3.336 10 0 GGAEHN COCCN1CCC(NC(=O)c2cc(Br)cc3ccccc32)CC1 ZINC000519298422 566930969 /nfs/dbraw/zinc/93/09/69/566930969.db2.gz PQCMGVQQYOVLCD-UHFFFAOYSA-N 0 3 391.309 3.443 10 0 GGAEHN COC[C@H](N[C@H](C)C(=O)Nc1ccc(Br)c(C)c1)C1CCOCC1 ZINC000656677900 566931681 /nfs/dbraw/zinc/93/16/81/566931681.db2.gz IGLPXHGIKVPWKG-DYVFJYSZSA-N 0 3 399.329 3.116 10 0 GGAEHN COC[C@@H](N[C@H](C)C(=O)Nc1ccc(Br)c(C)c1)C1CCOCC1 ZINC000656677898 566931996 /nfs/dbraw/zinc/93/19/96/566931996.db2.gz IGLPXHGIKVPWKG-CXAGYDPISA-N 0 3 399.329 3.116 10 0 GGAEHN CSC[C@H](NCCCN1CCCS1(=O)=O)c1ccc(C(F)(F)F)cc1 ZINC000611622053 566932602 /nfs/dbraw/zinc/93/26/02/566932602.db2.gz OFZJTUKLALFRBY-HNNXBMFYSA-N 0 3 396.500 3.125 10 0 GGAEHN COC[C@H]1CCCN(CC(=O)N[C@@H](C)c2ccc(Br)cc2)CC1 ZINC000452088707 566933190 /nfs/dbraw/zinc/93/31/90/566933190.db2.gz OZKFQRDAJRELSH-GJZGRUSLSA-N 0 3 383.330 3.375 10 0 GGAEHN COC[C@H]1CCCN(CC(=O)N(C)Cc2ccccc2Br)CC1 ZINC000452089957 566933386 /nfs/dbraw/zinc/93/33/86/566933386.db2.gz QJCBNYZPNYSFOA-HNNXBMFYSA-N 0 3 383.330 3.156 10 0 GGAEHN CC[C@@H](c1ccc(Br)cc1)N1CCN(C[C@]2(O)CCCOC2)CC1 ZINC000656696689 566933430 /nfs/dbraw/zinc/93/34/30/566933430.db2.gz JRKDSKOJQKWCGP-RBUKOAKNSA-N 0 3 397.357 3.059 10 0 GGAEHN CC[C@@H](c1ccc(Br)cc1)N1CCN(C[C@@]2(O)CCCOC2)CC1 ZINC000656696688 566934056 /nfs/dbraw/zinc/93/40/56/566934056.db2.gz JRKDSKOJQKWCGP-OALUTQOASA-N 0 3 397.357 3.059 10 0 GGAEHN COC[C@@H](N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)C1CCOCC1 ZINC000656680625 566934396 /nfs/dbraw/zinc/93/43/96/566934396.db2.gz YXZZFTMHEFTZCK-JKSUJKDBSA-N 0 3 387.307 3.130 10 0 GGAEHN CN1CCN([C@H]2CC[C@@H](NC(=O)c3cc(F)c(Cl)cc3Cl)CC2)CC1 ZINC000680840655 566934451 /nfs/dbraw/zinc/93/44/51/566934451.db2.gz BQIJIDJBRXMOIT-BETUJISGSA-N 0 3 388.314 3.421 10 0 GGAEHN CN(CCc1nnnn1-c1ccccc1)CCc1ccc(Br)cc1 ZINC000519341567 566934454 /nfs/dbraw/zinc/93/44/54/566934454.db2.gz CGGJGZZDILJOCR-UHFFFAOYSA-N 0 3 386.297 3.142 10 0 GGAEHN COC[C@H](N[C@@H](C)C(=O)Nc1cccc(Cl)c1Cl)C1CCOCC1 ZINC000656680672 566934477 /nfs/dbraw/zinc/93/44/77/566934477.db2.gz SHLVIONHGISLNV-NHYWBVRUSA-N 0 3 375.296 3.352 10 0 GGAEHN Cc1c(Br)cccc1C(=O)N[C@H]1CC[C@@H](N2CCN(C)CC2)CC1 ZINC000680841790 566934597 /nfs/dbraw/zinc/93/45/97/566934597.db2.gz LLCWZELSKBMLKN-IYBDPMFKSA-N 0 3 394.357 3.046 10 0 GGAEHN CC(C)(CN1CCCC1)NCc1nc(Cc2cccc(Br)c2)no1 ZINC000452095455 566934664 /nfs/dbraw/zinc/93/46/64/566934664.db2.gz KUKZIZBUCFOPGP-UHFFFAOYSA-N 0 3 393.329 3.387 10 0 GGAEHN CSc1cc(C(=O)N2CCN(CCN(C)C)CC2)c(Cl)cc1Cl ZINC000471175899 566934797 /nfs/dbraw/zinc/93/47/97/566934797.db2.gz ITWQJQZKRZUECS-UHFFFAOYSA-N 0 3 376.353 3.035 10 0 GGAEHN C[C@]1(CCNCCS(=O)(=O)c2cccc(Br)c2)CC1(F)F ZINC000656714987 566935016 /nfs/dbraw/zinc/93/50/16/566935016.db2.gz POEGZGQWDDTMOV-ZDUSSCGKSA-N 0 3 382.270 3.248 10 0 GGAEHN C[C@@H]1CCN(CCNC(=O)c2cc(Br)cc(N3CCCC3)c2)C1 ZINC000611749132 566935320 /nfs/dbraw/zinc/93/53/20/566935320.db2.gz IWPYCXDTRCKCMH-CQSZACIVSA-N 0 3 380.330 3.121 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)NCCNc1ncc(Cl)cc1Cl ZINC000519372838 566936297 /nfs/dbraw/zinc/93/62/97/566936297.db2.gz HIQQLNSXWMLRPT-BETUJISGSA-N 0 3 388.343 3.362 10 0 GGAEHN Cc1cc(Br)c(CNC[C@H](O)CN(C)Cc2ccccc2)s1 ZINC000656716250 566936912 /nfs/dbraw/zinc/93/69/12/566936912.db2.gz UHIQJNUTDASVLH-HNNXBMFYSA-N 0 3 383.355 3.402 10 0 GGAEHN COC[C@@H]1CCCN([C@H]2CCN(c3cccc(Br)c3)C2=O)CC1 ZINC000452103089 566937028 /nfs/dbraw/zinc/93/70/28/566937028.db2.gz LROWTHWCZAGFQM-PBHICJAKSA-N 0 3 381.314 3.303 10 0 GGAEHN C[C@@H]1CCN(CCNC(=O)c2c(F)c(F)c(Br)c(F)c2F)C1 ZINC000611750991 566938177 /nfs/dbraw/zinc/93/81/77/566938177.db2.gz SYPXQUGHBJSTIY-SSDOTTSWSA-N 0 3 383.183 3.077 10 0 GGAEHN CO[C@@H]1CCC[C@@H](N[C@@H]2CCN(c3ccc(Br)c(C)c3)C2=O)C1 ZINC000680882083 566938469 /nfs/dbraw/zinc/93/84/69/566938469.db2.gz MYWJIEXZRFFWOE-FRFSOERESA-N 0 3 381.314 3.410 10 0 GGAEHN C[C@H](NC(=O)N[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)C1=CCN(C)CC1 ZINC000633158798 566938848 /nfs/dbraw/zinc/93/88/48/566938848.db2.gz YJRZVTBZMSIOHR-PHTTXTFCSA-N 0 3 390.325 3.037 10 0 GGAEHN Cc1c(I)cccc1C(=O)NCCN1CCCC[C@H]1C ZINC000471237910 566939373 /nfs/dbraw/zinc/93/93/73/566939373.db2.gz FWWMYJOKNRTQIH-GFCCVEGCSA-N 0 3 386.277 3.204 10 0 GGAEHN CN1CC[C@]2(CCN(C(=O)[C@H]3C[C@]3(C)c3cccc(Br)c3)C2)C1 ZINC000633186434 566940089 /nfs/dbraw/zinc/94/00/89/566940089.db2.gz SGWULSCKJREXDH-QRQLOZEOSA-N 0 3 377.326 3.281 10 0 GGAEHN CN1CC[C@]2(CCN(C(=O)[C@@H]3C[C@@]3(C)c3cccc(Br)c3)C2)C1 ZINC000633186436 566940312 /nfs/dbraw/zinc/94/03/12/566940312.db2.gz SGWULSCKJREXDH-WDSOQIARSA-N 0 3 377.326 3.281 10 0 GGAEHN O[C@H](COc1ccc(Br)cc1)CN1CC[C@@H](Cc2ccncc2)C1 ZINC000680888940 566940324 /nfs/dbraw/zinc/94/03/24/566940324.db2.gz MCMFURXNXYPIQS-WMZOPIPTSA-N 0 3 391.309 3.148 10 0 GGAEHN CC[C@H](C)N[C@@H](CNC(=O)c1cc[nH]c(=O)c1Br)c1ccco1 ZINC000519458900 566941652 /nfs/dbraw/zinc/94/16/52/566941652.db2.gz XTQOZXUWNAYOIF-JQWIXIFHSA-N 0 3 382.258 3.002 10 0 GGAEHN COc1cc(C)c(Br)cc1NC(=O)Nc1cnn(CCN(C)C)c1 ZINC000680926662 566942161 /nfs/dbraw/zinc/94/21/61/566942161.db2.gz MUCBAKUBEDWHMA-UHFFFAOYSA-N 0 3 396.289 3.168 10 0 GGAEHN C[C@@H](NC(=O)CN1CCCC[C@@H]1C1(O)CC1)c1ccc(Br)cc1 ZINC000519525159 566944682 /nfs/dbraw/zinc/94/46/82/566944682.db2.gz JPZLEAFHTFITER-CZUORRHYSA-N 0 3 381.314 3.006 10 0 GGAEHN C[C@@H]1CN(C(=O)Cc2c(F)ccc(Br)c2F)CCN(C2CC2)C1 ZINC000452171647 566947495 /nfs/dbraw/zinc/94/74/95/566947495.db2.gz KXBAHQZNJLRIOF-NSHDSACASA-N 0 3 387.268 3.213 10 0 GGAEHN COc1cc(Br)c(CNc2ccc([C@H]3CNCCO3)cc2)cc1O ZINC000656794396 566950766 /nfs/dbraw/zinc/95/07/66/566950766.db2.gz ZRJSZJOTZKQCPE-GOSISDBHSA-N 0 3 393.281 3.436 10 0 GGAEHN Brc1ccc2ncc(CNc3ccc([C@@H]4CNCCO4)cc3)n2c1 ZINC000656792025 566950830 /nfs/dbraw/zinc/95/08/30/566950830.db2.gz IHLAEOGHRUGIHV-KRWDZBQOSA-N 0 3 387.281 3.370 10 0 GGAEHN COc1ccc([C@@H]2CC[NH2+]C[C@@H]2NCc2cccc([O-])c2Br)cc1 ZINC000656789918 566950966 /nfs/dbraw/zinc/95/09/66/566950966.db2.gz DDEKYBZVCHQGHX-IRXDYDNUSA-N 0 3 391.309 3.399 10 0 GGAEHN COc1ccc(Br)c2[nH]c(C(=O)N3CCC[C@@H]3CN(C)C)cc21 ZINC000519616546 566952271 /nfs/dbraw/zinc/95/22/71/566952271.db2.gz XXHNIBJNKQTZQT-LLVKDONJSA-N 0 3 380.286 3.105 10 0 GGAEHN O=C(c1cccc(Br)c1F)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000429818377 566952306 /nfs/dbraw/zinc/95/23/06/566952306.db2.gz CWHKCKWQJXGMTB-CQSZACIVSA-N 0 3 399.304 3.305 10 0 GGAEHN O=C(c1cccc(Br)c1F)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000429818373 566952544 /nfs/dbraw/zinc/95/25/44/566952544.db2.gz CWHKCKWQJXGMTB-AWEZNQCLSA-N 0 3 399.304 3.305 10 0 GGAEHN C[C@H]1C[C@H](NC(=O)c2cc(Br)cc(N3CCCC3)c2)CN1C1CC1 ZINC000612107403 566953300 /nfs/dbraw/zinc/95/33/00/566953300.db2.gz UOOXAYNDJLHDPZ-BBRMVZONSA-N 0 3 392.341 3.404 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CN1C(=O)N[C@@H](Cc2cc(Cl)cc(Cl)c2)C1=O ZINC000656820179 566953934 /nfs/dbraw/zinc/95/39/34/566953934.db2.gz BJORCPLZDOWSFY-CABCVRRESA-N 0 3 384.307 3.329 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)N[C@@H]1[C@H]2Cc3c(cccc3Br)[C@@H]12 ZINC000633395899 566955796 /nfs/dbraw/zinc/95/57/96/566955796.db2.gz JGPSIIXLCCPQMS-CGTJXYLNSA-N 0 3 392.341 3.070 10 0 GGAEHN Cc1c(Br)csc1C(=O)N1CCC(N2CCCOCC2)CC1 ZINC000633410066 566957352 /nfs/dbraw/zinc/95/73/52/566957352.db2.gz BZLMDDGHFUHBEV-UHFFFAOYSA-N 0 3 387.343 3.146 10 0 GGAEHN O=C(Nc1nc2c(cccc2Cl)[nH]1)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000612190985 566958572 /nfs/dbraw/zinc/95/85/72/566958572.db2.gz ORAADFILDAUXPY-RKDXNWHRSA-N 0 3 377.750 3.139 10 0 GGAEHN C[C@H](Cc1ccccc1Br)NC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000471561250 566960904 /nfs/dbraw/zinc/96/09/04/566960904.db2.gz XCYVENDMPGRSMX-CZUORRHYSA-N 0 3 380.330 3.258 10 0 GGAEHN O=C(CN[C@H]1CC[C@@H]1C1CCC1)Nc1ccc(I)cc1 ZINC000583571275 566963118 /nfs/dbraw/zinc/96/31/18/566963118.db2.gz NBQIASCCYFJHCO-CABCVRRESA-N 0 3 384.261 3.398 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)N1CCc2c(Cl)cc(Cl)cc2C1 ZINC000583563097 566963277 /nfs/dbraw/zinc/96/32/77/566963277.db2.gz CIIPSZYQFMOPPE-OGWOLHLISA-N 0 3 383.319 3.411 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)N1CCc2c(Cl)cc(Cl)cc2C1 ZINC000583563096 566963434 /nfs/dbraw/zinc/96/34/34/566963434.db2.gz CIIPSZYQFMOPPE-IDHHARJASA-N 0 3 383.319 3.411 10 0 GGAEHN COc1ccc(N(C)C(=O)C(C[C@H]2COCCO2)C(F)(F)F)cc1Cl ZINC000612301561 566963652 /nfs/dbraw/zinc/96/36/52/566963652.db2.gz RWNLFVIVFYNZFZ-NWDGAFQWSA-N 0 3 381.778 3.295 10 0 GGAEHN CN1CC[C@]2(CCN(C(=O)c3c(Cl)cc(F)cc3Br)C2)C1 ZINC000452340478 566965030 /nfs/dbraw/zinc/96/50/30/566965030.db2.gz AKHPQMYETWORGN-HNNXBMFYSA-N 0 3 375.669 3.409 10 0 GGAEHN O=C(NC[C@@H]1CCCN1CCCO)c1cc(Br)cc2ccccc21 ZINC000452354260 566965988 /nfs/dbraw/zinc/96/59/88/566965988.db2.gz VJNHTKZBYMPUSZ-INIZCTEOSA-N 0 3 391.309 3.179 10 0 GGAEHN COC(=O)C[C@@H](NC(=O)CN1[C@@H](C)CC[C@@H]1C)c1cccc(Br)c1 ZINC000612342836 566967678 /nfs/dbraw/zinc/96/76/78/566967678.db2.gz CAHGGILYQNDQTD-HEHGZKQESA-N 0 3 397.313 3.042 10 0 GGAEHN CS(=O)(=O)N1CC[C@H](CN[C@@H](c2c(Cl)cccc2Cl)C2CC2)C1 ZINC000564379025 566968508 /nfs/dbraw/zinc/96/85/08/566968508.db2.gz MDFOOTKPPZWKJV-BDJLRTHQSA-N 0 3 377.337 3.316 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N1C[C@@H](CN(C)C)Oc2ccccc21 ZINC000612400718 566971122 /nfs/dbraw/zinc/97/11/22/566971122.db2.gz PVBWBKKGAVEOCT-CYBMUJFWSA-N 0 3 390.281 3.122 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)c1oc3ccccc3c1Br)CCO2 ZINC000633561797 566971197 /nfs/dbraw/zinc/97/11/97/566971197.db2.gz XQSIVVABXOJVQC-UHFFFAOYSA-N 0 3 393.281 3.132 10 0 GGAEHN C[C@H](CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21)c1ccncc1 ZINC000681391412 566971843 /nfs/dbraw/zinc/97/18/43/566971843.db2.gz FWVQFGLONNIOIO-WBMJQRKESA-N 0 3 395.322 3.456 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000612433436 566972597 /nfs/dbraw/zinc/97/25/97/566972597.db2.gz XLCOITFGCYBHEW-MRXNPFEDSA-N 0 3 388.309 3.499 10 0 GGAEHN CC1(C2CC2)CCN(Cc2cc(=O)n3cc(Br)ccc3n2)CC1 ZINC000564397373 566972911 /nfs/dbraw/zinc/97/29/11/566972911.db2.gz LIGFDIKUOPABQD-UHFFFAOYSA-N 0 3 376.298 3.469 10 0 GGAEHN O=C(N[C@@H]1CCCN(CCCO)C1)c1ccc2scc(Br)c2c1 ZINC000452386753 566973622 /nfs/dbraw/zinc/97/36/22/566973622.db2.gz OEKZCHKHTCLMBN-CYBMUJFWSA-N 0 3 397.338 3.240 10 0 GGAEHN O=C(Cc1csc(-c2ccc(Cl)s2)n1)NC[C@H]1CCCCN1CCO ZINC000452395979 566974516 /nfs/dbraw/zinc/97/45/16/566974516.db2.gz XOFZWVWYWNKTFB-CYBMUJFWSA-N 0 3 399.969 3.031 10 0 GGAEHN CC(C)(C)OCCNC[C@@H](O)COc1ccc(Cl)cc1Br ZINC000583688688 566974752 /nfs/dbraw/zinc/97/47/52/566974752.db2.gz VTPAJQBSEPCSFF-GFCCVEGCSA-N 0 3 380.710 3.247 10 0 GGAEHN CN1C(=O)C[C@H](NCC[S@](=O)c2ccccc2)[C@@H]1c1ccc(Cl)cc1 ZINC000494271617 566980994 /nfs/dbraw/zinc/98/09/94/566980994.db2.gz RODVAFVKYJFDCO-KMEZTADASA-N 0 3 376.909 3.009 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2ccc(F)cc2Br)C[C@H]1N1CCCC1 ZINC000544689560 566981405 /nfs/dbraw/zinc/98/14/05/566981405.db2.gz BUVSHVWNCPUHKU-HUUCEWRRSA-N 0 3 387.318 3.240 10 0 GGAEHN OCCN(Cc1cc(Br)cs1)C[C@H](O)CCc1ccccc1 ZINC000494278049 566981743 /nfs/dbraw/zinc/98/17/43/566981743.db2.gz WSSWDRNNGDDDLG-MRXNPFEDSA-N 0 3 384.339 3.299 10 0 GGAEHN CS[C@H]1CN(C(=O)c2ccc(F)cc2Br)C[C@@H]1N1CCCC1 ZINC000544689559 566981877 /nfs/dbraw/zinc/98/18/77/566981877.db2.gz BUVSHVWNCPUHKU-GJZGRUSLSA-N 0 3 387.318 3.240 10 0 GGAEHN O=C(NC[C@@H]1CCCCN1CCO)c1ccc2scc(Br)c2c1 ZINC000583794212 566982967 /nfs/dbraw/zinc/98/29/67/566982967.db2.gz QWUCXNRWXNJWPF-ZDUSSCGKSA-N 0 3 397.338 3.240 10 0 GGAEHN O=C(NCC1CCSCC1)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000471904044 566985429 /nfs/dbraw/zinc/98/54/29/566985429.db2.gz ZHFXLLWWUPPEPK-UHFFFAOYSA-N 0 3 379.492 3.234 10 0 GGAEHN CN(CCC(=O)Nc1nnc(C(F)(F)C(F)(F)F)s1)c1ccncc1 ZINC000633730142 566985428 /nfs/dbraw/zinc/98/54/28/566985428.db2.gz ZHZMYMKRMZXQMH-UHFFFAOYSA-N 0 3 381.330 3.052 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N(CCN(C)C)Cc1cccc(O)c1 ZINC000612623497 566985930 /nfs/dbraw/zinc/98/59/30/566985930.db2.gz MOUXEMGAAVIFNA-UHFFFAOYSA-N 0 3 392.297 3.062 10 0 GGAEHN COc1ccc(CCC(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)c(Br)c1 ZINC000612648802 566986146 /nfs/dbraw/zinc/98/61/46/566986146.db2.gz IWWUERDRDNEEML-QAPCUYQASA-N 0 3 395.341 3.333 10 0 GGAEHN C[C@H](NC(=O)[C@H](C)N1CCNC[C@@](C)(F)C1)c1ccc(Cl)cc1Cl ZINC000583872617 566990340 /nfs/dbraw/zinc/99/03/40/566990340.db2.gz VZKAOLOCJHPVOB-NVGCLXPQSA-N 0 3 376.303 3.193 10 0 GGAEHN O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@@H](C1CC1)N1CCCC1 ZINC000544820889 566997513 /nfs/dbraw/zinc/99/75/13/566997513.db2.gz FRODUIPPBMKKDW-GOSISDBHSA-N 0 3 390.325 3.464 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N(C)[C@@H](C)C1CCN(C)CC1 ZINC000430277399 567004214 /nfs/dbraw/zinc/00/42/14/567004214.db2.gz YVLPQXGIQVRFQK-ZDUSSCGKSA-N 0 3 398.345 3.329 10 0 GGAEHN Cc1c(Br)cccc1CS(=O)(=O)N[C@@H]1CCN(C(C)(C)C)C1 ZINC000657061523 567008456 /nfs/dbraw/zinc/00/84/56/567008456.db2.gz WCHCRRONJJQXNJ-CQSZACIVSA-N 0 3 389.359 3.050 10 0 GGAEHN Cc1nccc(NC(=O)C2CCN(Cc3ccccc3)CC2)c1Br ZINC000520492228 567009191 /nfs/dbraw/zinc/00/91/91/567009191.db2.gz QOLUZSSAHMVXEP-UHFFFAOYSA-N 0 3 388.309 3.425 10 0 GGAEHN Cc1cc(Br)cc(C(=O)Nc2ccc(=O)n(CCN(C)C)c2)c1C ZINC000612993827 567009417 /nfs/dbraw/zinc/00/94/17/567009417.db2.gz GKZMRKAWVZKUPI-UHFFFAOYSA-N 0 3 392.297 3.042 10 0 GGAEHN CC(C)C[C@H](N[C@H](C)c1cc(Br)cs1)C(=O)NCCN(C)C ZINC000494649684 567015184 /nfs/dbraw/zinc/01/51/84/567015184.db2.gz RGAYGQOCIDPNSX-OCCSQVGLSA-N 0 3 390.391 3.254 10 0 GGAEHN CN1CCC(n2cc(NC(=O)CCc3ccc(Br)cc3)cn2)CC1 ZINC000634091494 567016275 /nfs/dbraw/zinc/01/62/75/567016275.db2.gz JAJHUVIGEYBGTO-UHFFFAOYSA-N 0 3 391.313 3.484 10 0 GGAEHN CN1CCC(n2cc(NC(=O)c3cccc(Br)c3F)cn2)CC1 ZINC000634095680 567016483 /nfs/dbraw/zinc/01/64/83/567016483.db2.gz OUXOAXMDSKYZRW-UHFFFAOYSA-N 0 3 381.249 3.304 10 0 GGAEHN COc1ccc(C(=O)Nc2cnn(C3CCN(C)CC3)c2)c(Br)c1 ZINC000634089355 567016749 /nfs/dbraw/zinc/01/67/49/567016749.db2.gz HEEPOTBTKRRZBU-UHFFFAOYSA-N 0 3 393.285 3.173 10 0 GGAEHN Cc1cc(Br)ccc1C(=O)Nc1cnn(C2CCN(C)CC2)c1 ZINC000634091651 567016894 /nfs/dbraw/zinc/01/68/94/567016894.db2.gz VOJJHCYZKXBHAP-UHFFFAOYSA-N 0 3 377.286 3.473 10 0 GGAEHN Cc1ccsc1[C@H](CO)NC[C@@H](O)COc1c(Cl)cccc1Cl ZINC000494675099 567016847 /nfs/dbraw/zinc/01/68/47/567016847.db2.gz YSQIVOZRPIDNBT-RISCZKNCSA-N 0 3 376.305 3.426 10 0 GGAEHN CN1CCC(n2cc(NC(=O)Cc3ccc(F)cc3Br)cn2)CC1 ZINC000634096764 567016990 /nfs/dbraw/zinc/01/69/90/567016990.db2.gz ZAPMJDQIWYFDFC-UHFFFAOYSA-N 0 3 395.276 3.233 10 0 GGAEHN COc1ccc(CCC(=O)N2CCCC23CCN(C)CC3)c(Br)c1 ZINC000613191624 567019898 /nfs/dbraw/zinc/01/98/98/567019898.db2.gz SNSYZAPODDARHR-UHFFFAOYSA-N 0 3 395.341 3.477 10 0 GGAEHN CN(C(=O)c1cn(-c2ccc(Cl)c(Cl)c2)cn1)[C@@H]1CCN(C2CC2)C1 ZINC000430582469 567022410 /nfs/dbraw/zinc/02/24/10/567022410.db2.gz KQOPLFXKGAXPQZ-CQSZACIVSA-N 0 3 379.291 3.488 10 0 GGAEHN Cc1c(Br)cncc1C(=O)NCC1CCN(c2ccncc2)CC1 ZINC000613241596 567023120 /nfs/dbraw/zinc/02/31/20/567023120.db2.gz RJQIVVDSJVQKCD-UHFFFAOYSA-N 0 3 389.297 3.194 10 0 GGAEHN O=C(CSc1cccc(Br)c1)NCCCNCc1cccnc1 ZINC000584230911 567023577 /nfs/dbraw/zinc/02/35/77/567023577.db2.gz IUIFWQRGGWYDLJ-UHFFFAOYSA-N 0 3 394.338 3.232 10 0 GGAEHN C[C@H]1CN(C2CC2)C[C@@H]1Nc1ncnc2cccc(I)c21 ZINC000545164833 567024572 /nfs/dbraw/zinc/02/45/72/567024572.db2.gz YSIGKAIFLOHPOP-HZMBPMFUSA-N 0 3 394.260 3.129 10 0 GGAEHN CCc1cccc(OC[C@H](O)CN[C@@H](CO)c2cccc(Br)c2)c1 ZINC000520783226 567024987 /nfs/dbraw/zinc/02/49/87/567024987.db2.gz WFPRAXYJJANZGG-MJGOQNOKSA-N 0 3 394.309 3.074 10 0 GGAEHN COc1ccc(Br)c(CC(=O)NCCN2[C@H](C)CCC[C@@H]2C)c1 ZINC000494817894 567025295 /nfs/dbraw/zinc/02/52/95/567025295.db2.gz HSGPPGNABHTSHO-OKILXGFUSA-N 0 3 383.330 3.379 10 0 GGAEHN CN(CCC(F)(F)F)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000472443947 567026655 /nfs/dbraw/zinc/02/66/55/567026655.db2.gz MZVQPQCHBBYABS-UHFFFAOYSA-N 0 3 375.357 3.386 10 0 GGAEHN CN1CC[C@@H]2[C@H](CCCN2C(=O)[C@@H]2CCc3cc(Br)ccc32)C1 ZINC000564998479 567029972 /nfs/dbraw/zinc/02/99/72/567029972.db2.gz NOOYHUYRCCJGJQ-ZTFGCOKTSA-N 0 3 377.326 3.422 10 0 GGAEHN C[C@@H]1C[C@@H](Nc2cc(Br)cnc2C(N)=O)CN1Cc1ccccc1 ZINC000472500575 567031795 /nfs/dbraw/zinc/03/17/95/567031795.db2.gz NIZMJKHFHWNDCG-IUODEOHRSA-N 0 3 389.297 3.018 10 0 GGAEHN C[C@H]1CN(CCCNC(=O)[C@@H]2CCc3cc(Br)ccc32)CCCO1 ZINC000565022551 567031887 /nfs/dbraw/zinc/03/18/87/567031887.db2.gz GHFRYJIINJEKAE-KBXCAEBGSA-N 0 3 395.341 3.096 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1cc(C)c(Br)c(C)c1 ZINC000494878216 567031979 /nfs/dbraw/zinc/03/19/79/567031979.db2.gz MYQAFEFQDRQMKA-HNNXBMFYSA-N 0 3 384.318 3.298 10 0 GGAEHN CCN(CC)CCN(C(=O)COC1CCCC1)c1ccc(Br)cn1 ZINC000565049185 567033507 /nfs/dbraw/zinc/03/35/07/567033507.db2.gz UEINPTJGGPMCNM-UHFFFAOYSA-N 0 3 398.345 3.478 10 0 GGAEHN CN(C(=O)N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1)[C@@H]1CCN(C2CC2)C1 ZINC000472527339 567034208 /nfs/dbraw/zinc/03/42/08/567034208.db2.gz HLHBYCOVDARLJK-JKIFEVAISA-N 0 3 396.304 3.322 10 0 GGAEHN O=C(N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1)N1CC[C@@H](N2CC=CC2)C1 ZINC000472529779 567034523 /nfs/dbraw/zinc/03/45/23/567034523.db2.gz QJUCPILRTZYOCX-JKIFEVAISA-N 0 3 394.288 3.100 10 0 GGAEHN COc1ccc(CCC(=O)N[C@@H](C)C2=CCN(C)CC2)c(Br)c1 ZINC000613377076 567034677 /nfs/dbraw/zinc/03/46/77/567034677.db2.gz YYVQIAGFMHTNIS-ZDUSSCGKSA-N 0 3 381.314 3.157 10 0 GGAEHN COc1ccc(CCC(=O)N[C@H](C)C2=CCN(C)CC2)c(Br)c1 ZINC000613377075 567034925 /nfs/dbraw/zinc/03/49/25/567034925.db2.gz YYVQIAGFMHTNIS-CYBMUJFWSA-N 0 3 381.314 3.157 10 0 GGAEHN COC(=O)CC1(NCc2cc(Br)c(OC(F)F)c(OC)c2)CC1 ZINC000521055116 567037739 /nfs/dbraw/zinc/03/77/39/567037739.db2.gz WMVFOMOIZAVZBG-UHFFFAOYSA-N 0 3 394.212 3.244 10 0 GGAEHN C[C@@H](Oc1ccc(F)cc1Br)C(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000521081972 567040042 /nfs/dbraw/zinc/04/00/42/567040042.db2.gz FTSLAZZPQGIEHS-RISCZKNCSA-N 0 3 385.277 3.051 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N(C)[C@@H]2CCN(C3CC3)C2)cc1OC ZINC000521082194 567040100 /nfs/dbraw/zinc/04/01/00/567040100.db2.gz PVWUJVKWNFLIHF-CQSZACIVSA-N 0 3 397.313 3.165 10 0 GGAEHN CC(C)(C)OC(=O)[C@@H]1CCN(C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000495056774 567042388 /nfs/dbraw/zinc/04/23/88/567042388.db2.gz DRCYRKRMRQIQMD-OCCSQVGLSA-N 0 3 390.307 3.397 10 0 GGAEHN CC(C)(C)OC(=O)[C@H]1CCN(CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000495060641 567043375 /nfs/dbraw/zinc/04/33/75/567043375.db2.gz AJFNXPSYEKLSSI-ZDUSSCGKSA-N 0 3 397.313 3.441 10 0 GGAEHN CC(C)(C)OC(=O)[C@@H]1CCN(CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000495060640 567043648 /nfs/dbraw/zinc/04/36/48/567043648.db2.gz AJFNXPSYEKLSSI-CYBMUJFWSA-N 0 3 397.313 3.441 10 0 GGAEHN CCN1CCC(CNS(=O)(=O)c2c(C)cc(Br)cc2C)CC1 ZINC000521166699 567045278 /nfs/dbraw/zinc/04/52/78/567045278.db2.gz CGUFTTBNKPRRNY-UHFFFAOYSA-N 0 3 389.359 3.076 10 0 GGAEHN CN(C)CCOc1ccc(CNCc2c(F)cncc2Br)cc1 ZINC000657315934 567046557 /nfs/dbraw/zinc/04/65/57/567046557.db2.gz UZMWNSRXFCLENC-UHFFFAOYSA-N 0 3 382.277 3.213 10 0 GGAEHN C[C@H]1CCN(CC(=O)N(Cc2cccc(Br)c2)C2CCOCC2)C1 ZINC000565191418 567047139 /nfs/dbraw/zinc/04/71/39/567047139.db2.gz JXQBAPWUMDPCAT-HNNXBMFYSA-N 0 3 395.341 3.299 10 0 GGAEHN Brc1ccc(N2CC[C@@H](CNCc3cnn4c3CCC4)C2)cc1 ZINC000657325170 567047714 /nfs/dbraw/zinc/04/77/14/567047714.db2.gz BUEZVNCQXPLJQX-AWEZNQCLSA-N 0 3 375.314 3.208 10 0 GGAEHN O=S1(=O)CC(CCNCc2csc(-c3ccc(C(F)(F)F)cc3)n2)C1 ZINC000682474465 567047887 /nfs/dbraw/zinc/04/78/87/567047887.db2.gz JLUILNVFBUTRLH-UHFFFAOYSA-N 0 3 390.452 3.353 10 0 GGAEHN CN(Cc1c(Br)cnn1C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000495137328 567048009 /nfs/dbraw/zinc/04/80/09/567048009.db2.gz GNOHXHXBVAWXIP-INIZCTEOSA-N 0 3 377.330 3.279 10 0 GGAEHN Cn1nnnc1CCNCc1ccc(Oc2cccc(Br)c2)cc1 ZINC000682474077 567048199 /nfs/dbraw/zinc/04/81/99/567048199.db2.gz PAQSMJSWJXZLMF-UHFFFAOYSA-N 0 3 388.269 3.097 10 0 GGAEHN Brc1cccc(C2(NCc3cnn4c3CCC4)CCOCC2)c1 ZINC000657355410 567048419 /nfs/dbraw/zinc/04/84/19/567048419.db2.gz MRXXDSQNFNORSE-UHFFFAOYSA-N 0 3 376.298 3.387 10 0 GGAEHN Cn1ncc(C(F)(F)F)c1CNCCOc1ccc(Br)cc1 ZINC000657348848 567048779 /nfs/dbraw/zinc/04/87/79/567048779.db2.gz JWGCGDSXJLRNLV-UHFFFAOYSA-N 0 3 378.192 3.370 10 0 GGAEHN Brc1ccc(C2(CNCc3cc4n(n3)CCC4)CCOCC2)cc1 ZINC000657341552 567048981 /nfs/dbraw/zinc/04/89/81/567048981.db2.gz ZKWRBQGZKRLSIW-UHFFFAOYSA-N 0 3 390.325 3.430 10 0 GGAEHN CN(C)CCOc1ccccc1CNCc1c(F)cncc1Br ZINC000657337193 567049414 /nfs/dbraw/zinc/04/94/14/567049414.db2.gz LTXTZXDYAFSPAZ-UHFFFAOYSA-N 0 3 382.277 3.213 10 0 GGAEHN C[C@@H](Cn1ncc2ccccc2c1=O)N[C@@H](C)c1cncc(Br)c1 ZINC000565241929 567049450 /nfs/dbraw/zinc/04/94/50/567049450.db2.gz AMDNTKWNXVSYTE-STQMWFEESA-N 0 3 387.281 3.293 10 0 GGAEHN CC[C@H](c1ccc(Br)cc1)N1CCC[C@H](C(=O)N2CCOCC2)C1 ZINC000472775442 567050819 /nfs/dbraw/zinc/05/08/19/567050819.db2.gz UUAXJJKZNYPUJG-FUHWJXTLSA-N 0 3 395.341 3.471 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)[C@H](N)Cc1ccccc1 ZINC000584524584 567051035 /nfs/dbraw/zinc/05/10/35/567051035.db2.gz RQBAEWDMXZBVPO-BLLLJJGKSA-N 0 3 377.282 3.205 10 0 GGAEHN Brc1ccccc1N1CC[C@H](NCc2ccnn2-c2ccncc2)C1 ZINC000657357132 567051108 /nfs/dbraw/zinc/05/11/08/567051108.db2.gz RBTSHWAUKQPLCD-HNNXBMFYSA-N 0 3 398.308 3.398 10 0 GGAEHN CC[C@H](c1ccc(Br)cc1)N1CCC[C@@H](C(=O)N2CCOCC2)C1 ZINC000472775443 567051515 /nfs/dbraw/zinc/05/15/15/567051515.db2.gz UUAXJJKZNYPUJG-SJLPKXTDSA-N 0 3 395.341 3.471 10 0 GGAEHN CC[C@@H]1C[C@H](NCC(C)(C)S(=O)(=O)c2ccc(Br)cc2)CO1 ZINC000657365284 567051499 /nfs/dbraw/zinc/05/14/99/567051499.db2.gz ZLKACVXRSWXCLJ-UONOGXRCSA-N 0 3 390.343 3.159 10 0 GGAEHN CN(C)C1(CNCc2c(F)cncc2Br)Cc2ccccc2C1 ZINC000657374262 567052004 /nfs/dbraw/zinc/05/20/04/567052004.db2.gz HDNMYUKSOBEUHP-UHFFFAOYSA-N 0 3 378.289 3.172 10 0 GGAEHN CO[C@H](c1ccccc1Cl)[C@@H](C)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000545459453 567052908 /nfs/dbraw/zinc/05/29/08/567052908.db2.gz YAITYBBGGFYLAK-JCGVRSQUSA-N 0 3 382.913 3.414 10 0 GGAEHN C[C@@](O)(C[C@@H](O)CNCc1cc(Br)ccc1OC(F)F)C1CC1 ZINC000634703067 567054769 /nfs/dbraw/zinc/05/47/69/567054769.db2.gz PBNOECUSVAJMGD-CZUORRHYSA-N 0 3 394.256 3.052 10 0 GGAEHN CCCOC[C@@H](Cc1cccc(Br)c1)NC[C@@H](O)C(F)(F)F ZINC000565300383 567055370 /nfs/dbraw/zinc/05/53/70/567055370.db2.gz WRALGTYAMSYOKS-ZIAGYGMSSA-N 0 3 384.236 3.300 10 0 GGAEHN CO[C@H](c1ccc(Br)cc1)[C@H](C)NC[C@@H](O)C[C@@](C)(O)C1CC1 ZINC000634710003 567055997 /nfs/dbraw/zinc/05/59/97/567055997.db2.gz QXOKLBVUKFLFGR-GYIHYUDTSA-N 0 3 386.330 3.027 10 0 GGAEHN Fc1cncc(Br)c1CNCC1CCN(CC(F)(F)F)CC1 ZINC000657442427 567056873 /nfs/dbraw/zinc/05/68/73/567056873.db2.gz LFSJXAGIBHBHDY-UHFFFAOYSA-N 0 3 384.215 3.347 10 0 GGAEHN O=C(NCC1CCN(Cc2cccs2)CC1)N[C@H](CO)c1ccsc1 ZINC000472949360 567057011 /nfs/dbraw/zinc/05/70/11/567057011.db2.gz INZRPKBHDCRUGZ-QGZVFWFLSA-N 0 3 379.551 3.054 10 0 GGAEHN COc1cc(Br)ccc1CCCNCc1cn(C2CCC2)nn1 ZINC000657433564 567057192 /nfs/dbraw/zinc/05/71/92/567057192.db2.gz VGQMLLWYKFIPQI-UHFFFAOYSA-N 0 3 379.302 3.497 10 0 GGAEHN O=C(NCC1CCN(Cc2cccs2)CC1)N[C@@H](CO)c1ccsc1 ZINC000472949359 567057398 /nfs/dbraw/zinc/05/73/98/567057398.db2.gz INZRPKBHDCRUGZ-KRWDZBQOSA-N 0 3 379.551 3.054 10 0 GGAEHN C[C@H](NCC[C@H](C)[S@](C)=O)c1ccc(F)c(I)c1 ZINC000453167858 567059236 /nfs/dbraw/zinc/05/92/36/567059236.db2.gz UKJWBGRJGXAZTK-RAALSFIWSA-N 0 3 383.270 3.238 10 0 GGAEHN O=C(CCN1CCO[C@@H](C(F)F)CC1)Nc1ccccc1Br ZINC000634755933 567058590 /nfs/dbraw/zinc/05/85/90/567058590.db2.gz KMHAOXZZYZTHNB-CYBMUJFWSA-N 0 3 377.229 3.134 10 0 GGAEHN O=C(NC[C@@H]1CCCN(Cc2cccs2)C1)N[C@@H](CO)c1ccsc1 ZINC000472962485 567058751 /nfs/dbraw/zinc/05/87/51/567058751.db2.gz WHYMJVXYZWHUIT-YOEHRIQHSA-N 0 3 379.551 3.054 10 0 GGAEHN Cn1ncc(C2CCC2)c1CNC[C@H](CO)Cc1ccc(Br)cc1 ZINC000657449279 567058987 /nfs/dbraw/zinc/05/89/87/567058987.db2.gz SQOXCEIATACPOM-OAHLLOKOSA-N 0 3 392.341 3.391 10 0 GGAEHN Cn1ncc(C2CCC2)c1CNC[C@@H](CO)Cc1ccc(Br)cc1 ZINC000657449278 567059055 /nfs/dbraw/zinc/05/90/55/567059055.db2.gz SQOXCEIATACPOM-HNNXBMFYSA-N 0 3 392.341 3.391 10 0 GGAEHN COc1ccc2c(c1)C[C@@H](N[C@@H](CO)c1cccc(Br)c1)CO2 ZINC000453158007 567059421 /nfs/dbraw/zinc/05/94/21/567059421.db2.gz IAVMRKPENAZEFY-WBVHZDCISA-N 0 3 378.266 3.084 10 0 GGAEHN COc1ccc2c(c1)C[C@H](N[C@@H](CO)c1cccc(Br)c1)CO2 ZINC000453158006 567059594 /nfs/dbraw/zinc/05/95/94/567059594.db2.gz IAVMRKPENAZEFY-RDJZCZTQSA-N 0 3 378.266 3.084 10 0 GGAEHN O[C@@H]1CCN(Cc2cccc(NCc3c(F)cncc3Br)c2)C1 ZINC000657471885 567061400 /nfs/dbraw/zinc/06/14/00/567061400.db2.gz CSSFLUDAJLSBJY-CQSZACIVSA-N 0 3 380.261 3.162 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)c1cc(C)n(-c2ccc(Br)cc2)n1 ZINC000431166489 567061578 /nfs/dbraw/zinc/06/15/78/567061578.db2.gz KQJFFXGEVLCWNL-MRXNPFEDSA-N 0 3 391.313 3.157 10 0 GGAEHN CCN1CCC(NC(=O)c2cc(C)n(-c3ccc(Br)cc3)n2)CC1 ZINC000431167525 567062218 /nfs/dbraw/zinc/06/22/18/567062218.db2.gz OIQFKOJWRBERLP-UHFFFAOYSA-N 0 3 391.313 3.157 10 0 GGAEHN CS[C@@H]1CN(C(=O)CSc2cccc(C(F)(F)F)c2)C[C@@H]1N(C)C ZINC000495566652 567063027 /nfs/dbraw/zinc/06/30/27/567063027.db2.gz XUVDJYIGRHIVRS-UONOGXRCSA-N 0 3 378.485 3.302 10 0 GGAEHN Brc1cccc(CN2CCC(NCc3cc4n(n3)CCC4)CC2)c1 ZINC000657493807 567063653 /nfs/dbraw/zinc/06/36/53/567063653.db2.gz IASNEVDMHDVHHV-UHFFFAOYSA-N 0 3 389.341 3.346 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2c[nH]c3cccc(Br)c23)C[C@@H]1N(C)C ZINC000495695602 567064428 /nfs/dbraw/zinc/06/44/28/567064428.db2.gz FBINCPOYKDJDPD-UONOGXRCSA-N 0 3 382.327 3.048 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cc3c(cccc3Br)[nH]2)C[C@H]1N(C)C ZINC000495608377 567064431 /nfs/dbraw/zinc/06/44/31/567064431.db2.gz RLZQJXUPKJJWSC-HUUCEWRRSA-N 0 3 382.327 3.048 10 0 GGAEHN CS[C@H]1CN(C(=O)CSCc2cc(-c3cccs3)on2)C[C@H]1N(C)C ZINC000495635110 567064722 /nfs/dbraw/zinc/06/47/22/567064722.db2.gz JEBRCJSWNURNJA-CJNGLKHVSA-N 0 3 397.591 3.140 10 0 GGAEHN COc1cc2c(cc1F)CC[C@@H]2NCCn1cc(Br)ccc1=O ZINC000453238638 567065056 /nfs/dbraw/zinc/06/50/56/567065056.db2.gz AARBLBVODQLNMP-HNNXBMFYSA-N 0 3 381.245 3.036 10 0 GGAEHN CS[C@@H]1CN(C(=O)C[C@H](C)c2ccc(Br)cc2)C[C@@H]1N(C)C ZINC000495712224 567066262 /nfs/dbraw/zinc/06/62/62/567066262.db2.gz JJPVLURBDUYDKS-VBNZEHGJSA-N 0 3 385.371 3.447 10 0 GGAEHN CS[C@@H]1CN(C(=O)C[C@@H](C)c2ccc(Br)cc2)C[C@@H]1N(C)C ZINC000495712223 567066434 /nfs/dbraw/zinc/06/64/34/567066434.db2.gz JJPVLURBDUYDKS-UHOFOFEASA-N 0 3 385.371 3.447 10 0 GGAEHN CO[C@@H](CNCc1cc(OC(F)F)ccc1Br)[C@H]1CCOC1 ZINC000657543192 567066857 /nfs/dbraw/zinc/06/68/57/567066857.db2.gz RVTAUFIIKJOZKH-HZMBPMFUSA-N 0 3 380.229 3.192 10 0 GGAEHN CO[C@@H](CNCc1ccc(OC(F)(F)F)c(Br)c1)[C@H]1CCOC1 ZINC000657540586 567067242 /nfs/dbraw/zinc/06/72/42/567067242.db2.gz IOENGEINUANVRR-FZMZJTMJSA-N 0 3 398.219 3.489 10 0 GGAEHN CO[C@H](CNCc1cc(Br)cc(Br)c1)[C@@H]1CCOC1 ZINC000657542203 567067375 /nfs/dbraw/zinc/06/73/75/567067375.db2.gz OVJGUBWLUZXKRX-BXUZGUMPSA-N 0 3 393.119 3.353 10 0 GGAEHN CO[C@@H](CNCc1cccc(Br)c1OC(F)F)[C@H]1CCOC1 ZINC000657541456 567067454 /nfs/dbraw/zinc/06/74/54/567067454.db2.gz KTIHCXTVLFAKAM-AAEUAGOBSA-N 0 3 380.229 3.192 10 0 GGAEHN CO[C@H](CNCc1cccc(Br)c1OC(F)F)[C@@H]1CCOC1 ZINC000657541460 567068033 /nfs/dbraw/zinc/06/80/33/567068033.db2.gz KTIHCXTVLFAKAM-DGCLKSJQSA-N 0 3 380.229 3.192 10 0 GGAEHN OCCCN1CCC[C@H]1CN[C@@H]1CCCOc2ccc(Br)cc21 ZINC000453266978 567068724 /nfs/dbraw/zinc/06/87/24/567068724.db2.gz OVHCDUNOUIZAEM-DOTOQJQBSA-N 0 3 383.330 3.099 10 0 GGAEHN CS(=O)(=O)CC1(CCNCc2cc(Br)ccc2Cl)CC1 ZINC000657547105 567069181 /nfs/dbraw/zinc/06/91/81/567069181.db2.gz CVONXYSXTONAON-UHFFFAOYSA-N 0 3 380.735 3.407 10 0 GGAEHN Cc1nn(-c2ccccc2Cl)cc1CNCCC1(CS(C)(=O)=O)CC1 ZINC000657547596 567069412 /nfs/dbraw/zinc/06/94/12/567069412.db2.gz UPCKARFDIRXYLR-UHFFFAOYSA-N 0 3 381.929 3.139 10 0 GGAEHN COc1c(Br)cc(Br)cc1CN[C@@H](CO)C1CCC1 ZINC000657557223 567069454 /nfs/dbraw/zinc/06/94/54/567069454.db2.gz KEIRJBHSEDVYHP-ZDUSSCGKSA-N 0 3 393.119 3.471 10 0 GGAEHN COC[C@@H](CCNCc1cn(-c2ccc(Br)cc2)nc1C)OC ZINC000657555407 567069502 /nfs/dbraw/zinc/06/95/02/567069502.db2.gz UTJUONHNXCCMDQ-QGZVFWFLSA-N 0 3 382.302 3.084 10 0 GGAEHN CS(=O)(=O)CC1(CCNCc2cc3cc(Br)ccc3o2)CC1 ZINC000657547316 567069693 /nfs/dbraw/zinc/06/96/93/567069693.db2.gz PFFXTKJDYWUVQP-UHFFFAOYSA-N 0 3 386.311 3.500 10 0 GGAEHN CC[C@H](N[C@@H](C)c1ccc(F)c(I)c1)[C@H](O)C(F)F ZINC000453268002 567070823 /nfs/dbraw/zinc/07/08/23/567070823.db2.gz JDRRSYWUYHDKQL-QILRFPOHSA-N 0 3 387.183 3.486 10 0 GGAEHN Cc1cc(F)c(Br)cc1NC(=O)Nc1cnn(CCN(C)C)c1 ZINC000682765305 567071104 /nfs/dbraw/zinc/07/11/04/567071104.db2.gz ADTABCMBMRSHOK-UHFFFAOYSA-N 0 3 384.253 3.299 10 0 GGAEHN O=S1(=O)CC[C@H](CCN(Cc2cccc(Br)c2)CC2CC2)C1 ZINC000682776889 567071418 /nfs/dbraw/zinc/07/14/18/567071418.db2.gz ADVDRMVONNDSEJ-HNNXBMFYSA-N 0 3 386.355 3.486 10 0 GGAEHN CC[C@H](N[C@H](C)c1ccc(F)c(I)c1)[C@@H](O)C(F)F ZINC000453268003 567071492 /nfs/dbraw/zinc/07/14/92/567071492.db2.gz JDRRSYWUYHDKQL-VSYUYLJXSA-N 0 3 387.183 3.486 10 0 GGAEHN OCCN1CCCC[C@H]1CN[C@@H]1CCCOc2ccc(Br)cc21 ZINC000453270774 567071604 /nfs/dbraw/zinc/07/16/04/567071604.db2.gz SPEVSIAIPCVHHM-DOTOQJQBSA-N 0 3 383.330 3.099 10 0 GGAEHN OCCN1CCCC[C@@H]1CN[C@H]1CCCOc2cc(Br)ccc21 ZINC000453267755 567071673 /nfs/dbraw/zinc/07/16/73/567071673.db2.gz PQOPGQGLUMCLQM-WBVHZDCISA-N 0 3 383.330 3.099 10 0 GGAEHN CO[C@@H]1CCC[C@@H]([C@H](CO)NCc2cnc3c(C)cc(Br)cn23)C1 ZINC000657577078 567073107 /nfs/dbraw/zinc/07/31/07/567073107.db2.gz OKXCFHTUWLRGGA-XYPHTWIQSA-N 0 3 396.329 3.061 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)c1cc(Br)c2c(c1)OCCO2 ZINC000521683520 567073825 /nfs/dbraw/zinc/07/38/25/567073825.db2.gz HGIPLMXYFPGOGP-CHWSQXEVSA-N 0 3 397.313 3.213 10 0 GGAEHN O[C@H]1CCN(Cc2ccc(CNCc3cccc(F)c3Br)cc2)C1 ZINC000657595722 567073801 /nfs/dbraw/zinc/07/38/01/567073801.db2.gz JOBWLMCOELPYAQ-KRWDZBQOSA-N 0 3 393.300 3.445 10 0 GGAEHN CCCN(CCN(C)C)C(=O)c1cc(C)n(-c2ccc(Br)cc2)n1 ZINC000496246275 567074581 /nfs/dbraw/zinc/07/45/81/567074581.db2.gz RTBFRZYZAPLJDC-UHFFFAOYSA-N 0 3 393.329 3.357 10 0 GGAEHN Cc1cc(C(=O)N[C@@H]2CCN(C)[C@@H](C)C2)nn1-c1ccc(Br)cc1 ZINC000431324244 567074733 /nfs/dbraw/zinc/07/47/33/567074733.db2.gz VHHDPVMYIOXUCO-SWLSCSKDSA-N 0 3 391.313 3.156 10 0 GGAEHN O[C@H]1CCN(Cc2ccc(CNCc3ccc(Br)cc3F)cc2)C1 ZINC000657593994 567074885 /nfs/dbraw/zinc/07/48/85/567074885.db2.gz GAUSMLYKXUNWBW-SFHVURJKSA-N 0 3 393.300 3.445 10 0 GGAEHN C[C@H](NCC1(CF)CCOCC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000453306867 567074986 /nfs/dbraw/zinc/07/49/86/567074986.db2.gz JSOQIMILTZPJCO-JTQLQIEISA-N 0 3 399.315 3.058 10 0 GGAEHN C[C@@H](NC[C@H]1CCCC1(F)F)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000453326536 567075035 /nfs/dbraw/zinc/07/50/35/567075035.db2.gz YDPCPLLJKAUCCH-MWLCHTKSSA-N 0 3 397.285 3.183 10 0 GGAEHN O[C@H]1CCN(Cc2ccc(CNCc3sccc3Br)cc2)C1 ZINC000657594848 567075125 /nfs/dbraw/zinc/07/51/25/567075125.db2.gz DICOFROCIUOMKM-HNNXBMFYSA-N 0 3 381.339 3.367 10 0 GGAEHN O[C@H]1CCN(Cc2ccc(CNCc3ccc(F)cc3Br)cc2)C1 ZINC000657596988 567075270 /nfs/dbraw/zinc/07/52/70/567075270.db2.gz PZAAUVJUKRJRQK-SFHVURJKSA-N 0 3 393.300 3.445 10 0 GGAEHN Oc1ccc(Br)c(CNCc2ccc(CN3CC[C@@H](O)C3)cc2)c1 ZINC000657596431 567075291 /nfs/dbraw/zinc/07/52/91/567075291.db2.gz NFMSHOIAWZKZCL-GOSISDBHSA-N 0 3 391.309 3.011 10 0 GGAEHN Cc1cc(C(=O)N[C@@H]2CCN(C)[C@H](C)C2)nn1-c1ccc(Br)cc1 ZINC000431324243 567075341 /nfs/dbraw/zinc/07/53/41/567075341.db2.gz VHHDPVMYIOXUCO-IUODEOHRSA-N 0 3 391.313 3.156 10 0 GGAEHN [O-]c1cccc(CNCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c1Br ZINC000657597301 567075308 /nfs/dbraw/zinc/07/53/08/567075308.db2.gz SPAYTBYUXZBRAE-QGZVFWFLSA-N 0 3 391.309 3.011 10 0 GGAEHN [O-]c1cccc(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c1Br ZINC000657597301 567075311 /nfs/dbraw/zinc/07/53/11/567075311.db2.gz SPAYTBYUXZBRAE-QGZVFWFLSA-N 0 3 391.309 3.011 10 0 GGAEHN CCOc1cc(CNCCO[C@@H]2CC2(F)F)cc(Br)c1OC ZINC000657618449 567077088 /nfs/dbraw/zinc/07/70/88/567077088.db2.gz UIHCWFBOQILBGG-CYBMUJFWSA-N 0 3 380.229 3.370 10 0 GGAEHN C[C@@H]1CC[C@@H](NCc2ccc(Br)c3cccnc23)CS1(=O)=O ZINC000657636145 567078957 /nfs/dbraw/zinc/07/89/57/567078957.db2.gz DPWJADAQOKFLIW-DGCLKSJQSA-N 0 3 383.311 3.053 10 0 GGAEHN CN(C)C(=O)N1CCC(N[C@@H]2CSCc3ccc(Br)cc32)CC1 ZINC000657642200 567080520 /nfs/dbraw/zinc/08/05/20/567080520.db2.gz WQXAOWLGOANEFL-MRXNPFEDSA-N 0 3 398.370 3.473 10 0 GGAEHN Cc1cc(Br)cc2c(C(=O)N3CCC[C@@](O)(CN(C)C)C3)coc21 ZINC000614064517 567080596 /nfs/dbraw/zinc/08/05/96/567080596.db2.gz GPROIZPCGNWXAQ-GOSISDBHSA-N 0 3 395.297 3.032 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)Nc2ccccc2Br)CC1 ZINC000431433744 567081419 /nfs/dbraw/zinc/08/14/19/567081419.db2.gz VLSVXXVSBDSBOO-UHFFFAOYSA-N 0 3 391.269 3.207 10 0 GGAEHN C[C@@H]1CCC[C@H](CNCc2ccc(Br)cc2N2CCOCC2)O1 ZINC000657662522 567081995 /nfs/dbraw/zinc/08/19/95/567081995.db2.gz ADKHWLABOZQNNC-RHSMWYFYSA-N 0 3 383.330 3.333 10 0 GGAEHN COc1cc(SC)ccc1NC(=O)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000614081858 567082084 /nfs/dbraw/zinc/08/20/84/567082084.db2.gz MYPQPCAPNFOOKT-ZYHUDNBSSA-N 0 3 379.400 3.340 10 0 GGAEHN COc1cc(SC)ccc1NC(=O)C(C[C@H]1COCCO1)C(F)(F)F ZINC000614081852 567082461 /nfs/dbraw/zinc/08/24/61/567082461.db2.gz MYPQPCAPNFOOKT-CMPLNLGQSA-N 0 3 379.400 3.340 10 0 GGAEHN CNC(=O)[C@H](C)Oc1ccc(Br)cc1CNC[C@H]1CCC[C@@H](C)O1 ZINC000657670294 567083042 /nfs/dbraw/zinc/08/30/42/567083042.db2.gz SQCUNHUPZSEYBB-DVOMOZLQSA-N 0 3 399.329 3.010 10 0 GGAEHN CCOCCOc1ccc(Br)cc1CN[C@H]1C[C@@H](O)C12CCC2 ZINC000657702842 567085943 /nfs/dbraw/zinc/08/59/43/567085943.db2.gz JRSGVOPQJNKWBI-DLBZAZTESA-N 0 3 384.314 3.258 10 0 GGAEHN CC(C)(C)O[C@H]1C[C@H](NCc2ccc(S(N)(=O)=O)c(Cl)c2)C12CCC2 ZINC000657703137 567085959 /nfs/dbraw/zinc/08/59/59/567085959.db2.gz UTDMJUBTMKRSQF-HOTGVXAUSA-N 0 3 386.945 3.203 10 0 GGAEHN COc1cc(C[NH2+][C@H]2CCC[C@@H]2Cc2cnn(C)c2)cc(Br)c1[O-] ZINC000657689884 567086274 /nfs/dbraw/zinc/08/62/74/567086274.db2.gz ZLCFQFVBGYBUJH-ZBFHGGJFSA-N 0 3 394.313 3.398 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN[C@H]1C[C@@H](O)C12CCC2 ZINC000657710624 567087553 /nfs/dbraw/zinc/08/75/53/567087553.db2.gz XIEPEJKVKPNJGI-DLBZAZTESA-N 0 3 376.298 3.336 10 0 GGAEHN O=C1CC[C@@H](CNCc2cc(Br)ccc2OCc2ccccc2)N1 ZINC000657709141 567087746 /nfs/dbraw/zinc/08/77/46/567087746.db2.gz JPAHVWGKRVSZBO-KRWDZBQOSA-N 0 3 389.293 3.396 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN[C@H]1C[C@H](O)C12CCC2 ZINC000657705332 567087882 /nfs/dbraw/zinc/08/78/82/567087882.db2.gz KEIHTGUPXOJPKW-IRXDYDNUSA-N 0 3 376.298 3.336 10 0 GGAEHN CN(C(=O)CSCc1cc(-c2cccs2)on1)[C@H]1CCN(C2CC2)C1 ZINC000521931239 567088053 /nfs/dbraw/zinc/08/80/53/567088053.db2.gz XMQWDCACFYQXNJ-HNNXBMFYSA-N 0 3 377.535 3.331 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN[C@H]1C[C@H](O)C12CCC2 ZINC000657710626 567088267 /nfs/dbraw/zinc/08/82/67/567088267.db2.gz XIEPEJKVKPNJGI-IRXDYDNUSA-N 0 3 376.298 3.336 10 0 GGAEHN CC[C@@H](C)N1CCN(c2nnc(-c3ccccc3Br)n2C)CC1 ZINC000453436670 567088963 /nfs/dbraw/zinc/08/89/63/567088963.db2.gz ZOQGAJVJLUCOGQ-CYBMUJFWSA-N 0 3 378.318 3.165 10 0 GGAEHN CN(C)[C@@H](CNC(=O)c1n[nH]c2ccc(Br)cc21)c1ccsc1 ZINC000521967850 567089902 /nfs/dbraw/zinc/08/99/02/567089902.db2.gz GUTPTWJYCZEOHY-AWEZNQCLSA-N 0 3 393.310 3.420 10 0 GGAEHN Cc1cc(Br)c(CNC[C@H](O)CN2CCc3ccccc3C2)s1 ZINC000453566926 567090614 /nfs/dbraw/zinc/09/06/14/567090614.db2.gz GFNCGAWEOWFJGV-INIZCTEOSA-N 0 3 395.366 3.328 10 0 GGAEHN COc1ccc(CN[C@@H]2C[C@@H](N3CCOCC3)C23CCC3)cc1Br ZINC000657746339 567091365 /nfs/dbraw/zinc/09/13/65/567091365.db2.gz BMDGPUJOJLMCOH-QZTJIDSGSA-N 0 3 395.341 3.191 10 0 GGAEHN COc1c(Br)cccc1CN[C@@H]1C[C@@H](N2CCOCC2)C12CCC2 ZINC000657747136 567091852 /nfs/dbraw/zinc/09/18/52/567091852.db2.gz LMALVGRQQRXOLV-IAGOWNOFSA-N 0 3 395.341 3.191 10 0 GGAEHN Fc1cc(Br)cc(CN[C@@H]2C[C@@H](N3CCOCC3)C23CCC3)c1 ZINC000657748654 567092801 /nfs/dbraw/zinc/09/28/01/567092801.db2.gz KQAFFWIWQFJUJK-IAGOWNOFSA-N 0 3 383.305 3.321 10 0 GGAEHN CN(Cc1ccccc1)C[C@H](O)CN1CCc2cc(Br)ccc2C1 ZINC000683028070 567093005 /nfs/dbraw/zinc/09/30/05/567093005.db2.gz PBHFQONMVRUWTN-FQEVSTJZSA-N 0 3 389.337 3.300 10 0 GGAEHN CN(Cc1ccccc1)C[C@@H](O)CN1CCc2cc(Br)ccc2C1 ZINC000683028071 567093269 /nfs/dbraw/zinc/09/32/69/567093269.db2.gz PBHFQONMVRUWTN-HXUWFJFHSA-N 0 3 389.337 3.300 10 0 GGAEHN NC(=O)[C@H](N[C@@H]1CCC[C@@H]([C@@H]2CCOC2)C1)c1cccc(Br)c1 ZINC000545983435 567094330 /nfs/dbraw/zinc/09/43/30/567094330.db2.gz IIDCENIDXUNYCO-ODVANORSSA-N 0 3 381.314 3.160 10 0 GGAEHN Cc1[nH]c2ccc(Br)cc2c1CC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000522037497 567095349 /nfs/dbraw/zinc/09/53/49/567095349.db2.gz LDCRECDXUKNESQ-HNNXBMFYSA-N 0 3 390.325 3.476 10 0 GGAEHN COc1cc(C[NH2+]CC2(CC(N)=O)CCCCC2)cc(Br)c1[O-] ZINC000657797280 567096392 /nfs/dbraw/zinc/09/63/92/567096392.db2.gz KJPYPQZOCCOLCC-UHFFFAOYSA-N 0 3 385.302 3.079 10 0 GGAEHN C[C@@H](CO)CN1CCC(c2nc(-c3ccccc3Br)no2)CC1 ZINC000683103787 567096419 /nfs/dbraw/zinc/09/64/19/567096419.db2.gz NHCIMCGYUFMLAM-GFCCVEGCSA-N 0 3 380.286 3.307 10 0 GGAEHN Cc1c(Br)cncc1C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1 ZINC000614238138 567096811 /nfs/dbraw/zinc/09/68/11/567096811.db2.gz RKLHYORHLBXFLU-INIZCTEOSA-N 0 3 388.309 3.404 10 0 GGAEHN CN(C)CCn1cc(NC(=O)N(C)Cc2ccc(Br)c(F)c2)cn1 ZINC000683150533 567097867 /nfs/dbraw/zinc/09/78/67/567097867.db2.gz TXJAVKPWUGITSA-UHFFFAOYSA-N 0 3 398.280 3.010 10 0 GGAEHN CCOc1c(Br)cc(Br)cc1CNC1CC(CO)C1 ZINC000657808553 567097906 /nfs/dbraw/zinc/09/79/06/567097906.db2.gz KXOCXSOJDTUVMJ-UHFFFAOYSA-N 0 3 393.119 3.471 10 0 GGAEHN Cc1csc([C@@H](C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)n1 ZINC000614248624 567098144 /nfs/dbraw/zinc/09/81/44/567098144.db2.gz RBWWNBRMZJNVSZ-XGNXJENSSA-N 0 3 375.460 3.477 10 0 GGAEHN COCc1csc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 ZINC000614248459 567098657 /nfs/dbraw/zinc/09/86/57/567098657.db2.gz NPABERNOXVKCTE-UHFFFAOYSA-N 0 3 376.444 3.430 10 0 GGAEHN CN(C)CCOCCNC(=O)Nc1ccc(C(F)(F)F)cc1Br ZINC000473752879 567099676 /nfs/dbraw/zinc/09/96/76/567099676.db2.gz SXWZEJQFIHCPNX-UHFFFAOYSA-N 0 3 398.223 3.168 10 0 GGAEHN COc1cc(C[NH2+][C@@H](CO)Cc2ccc(C)c(C)c2)cc(Br)c1[O-] ZINC000453639807 567100026 /nfs/dbraw/zinc/10/00/26/567100026.db2.gz WWDABGGBEPGHIP-MRXNPFEDSA-N 0 3 394.309 3.473 10 0 GGAEHN COC[C@@H](CC1CCOCC1)NCC(=O)Nc1ccc(Br)cc1C ZINC000657909264 567103211 /nfs/dbraw/zinc/10/32/11/567103211.db2.gz MAJGPDMASNPBLI-MRXNPFEDSA-N 0 3 399.329 3.117 10 0 GGAEHN CC[C@@H]1CN(C)CCCN1C(=O)Cc1c(F)ccc(Br)c1F ZINC000614340744 567103957 /nfs/dbraw/zinc/10/39/57/567103957.db2.gz DHUNCAOZYOZSNW-LLVKDONJSA-N 0 3 375.257 3.213 10 0 GGAEHN CC[C@@H]1CN(C)CCCN1C(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000614332947 567104039 /nfs/dbraw/zinc/10/40/39/567104039.db2.gz WSRDEDRDYTZYKS-CABCVRRESA-N 0 3 381.314 3.258 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1S(=O)(=O)c1c(Cl)cc(F)cc1Cl ZINC000565833256 567104958 /nfs/dbraw/zinc/10/49/58/567104958.db2.gz VQAUOCLXJDKPTM-HNNXBMFYSA-N 0 3 389.279 3.379 10 0 GGAEHN OC[C@@H](CNCc1cn2cccc(F)c2n1)Cc1ccccc1Br ZINC000683206027 567106268 /nfs/dbraw/zinc/10/62/68/567106268.db2.gz LUWIZKWIQYXFCS-CYBMUJFWSA-N 0 3 392.272 3.177 10 0 GGAEHN COC[C@H](CC1CCOCC1)N[C@H](CCO)c1ccccc1Br ZINC000657969584 567110030 /nfs/dbraw/zinc/11/00/30/567110030.db2.gz REFLDHVJSPXBHN-MAUKXSAKSA-N 0 3 386.330 3.294 10 0 GGAEHN O=C(Cc1cscc1Br)NCC1CCN(c2ccncc2)CC1 ZINC000497593625 567110583 /nfs/dbraw/zinc/11/05/83/567110583.db2.gz GGIQDIKDFGHVLF-UHFFFAOYSA-N 0 3 394.338 3.481 10 0 GGAEHN CC(C)[C@H](NC[C@@H](O)COc1c(Cl)cccc1Cl)[C@H](O)C(F)(F)F ZINC000565950560 567112999 /nfs/dbraw/zinc/11/29/99/567112999.db2.gz IIJLDBXTHTYSJA-LQJRIPTKSA-N 0 3 390.229 3.271 10 0 GGAEHN CS[C@H]1CN(C(=O)Nc2cccc(OCC(F)(F)F)c2)C[C@@H]1N(C)C ZINC000497655147 567114781 /nfs/dbraw/zinc/11/47/81/567114781.db2.gz BMSJHFRGBXKXER-KBPBESRZSA-N 0 3 377.432 3.137 10 0 GGAEHN CC[C@H](Cc1ccc(Cl)cc1)NC[C@H]1CS(=O)(=O)c2ccccc2O1 ZINC000658046187 567117174 /nfs/dbraw/zinc/11/71/74/567117174.db2.gz PBXQWQBXUMZCON-SJORKVTESA-N 0 3 379.909 3.486 10 0 GGAEHN C[C@@H](NC[C@@H]1CCN1C(C)(C)C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000658060172 567118422 /nfs/dbraw/zinc/11/84/22/567118422.db2.gz KGVZBSUNOKEYBM-MNOVXSKESA-N 0 3 394.368 3.164 10 0 GGAEHN CCOc1cc(C[NH2+]CCCN2CCCCCC2=O)cc(Br)c1[O-] ZINC000497705754 567118853 /nfs/dbraw/zinc/11/88/53/567118853.db2.gz PURXUBLKMNJDMQ-UHFFFAOYSA-N 0 3 399.329 3.436 10 0 GGAEHN CO[C@H](CN[C@H](c1ccc(Br)cc1)[C@@H]1CCCO1)[C@H]1CCOC1 ZINC000658079728 567120502 /nfs/dbraw/zinc/12/05/02/567120502.db2.gz XDGBDIDVKYZPBN-DZJNRPSUSA-N 0 3 384.314 3.310 10 0 GGAEHN COC[C@@H](CCN[C@H](C)c1nnn(-c2cccc(Br)c2)c1C)OC ZINC000658084792 567120838 /nfs/dbraw/zinc/12/08/38/567120838.db2.gz NYNJDYOVZJKMBC-MLGOLLRUSA-N 0 3 397.317 3.040 10 0 GGAEHN COC[C@H](CCN[C@H](C)c1nnn(-c2cccc(Br)c2)c1C)OC ZINC000658084793 567120911 /nfs/dbraw/zinc/12/09/11/567120911.db2.gz NYNJDYOVZJKMBC-WBMJQRKESA-N 0 3 397.317 3.040 10 0 GGAEHN CS(=O)(=O)CC1(CCN[C@H]2CCc3c2c(Br)ccc3F)CC1 ZINC000658077210 567120949 /nfs/dbraw/zinc/12/09/49/567120949.db2.gz HYICLSCXKFDIFN-AWEZNQCLSA-N 0 3 390.318 3.380 10 0 GGAEHN CC(C)C[C@@H](NCCNC(=O)c1ccc(Br)cn1)c1ccncc1 ZINC000658097389 567121959 /nfs/dbraw/zinc/12/19/59/567121959.db2.gz WXCZPEMVPVIUBC-QGZVFWFLSA-N 0 3 391.313 3.346 10 0 GGAEHN CC[C@@H](NC[C@@]1(OCCO)CCOC1)c1ccc(Br)cc1Cl ZINC000658143243 567123946 /nfs/dbraw/zinc/12/39/46/567123946.db2.gz GMPJOIFFSJAEER-CVEARBPZSA-N 0 3 392.721 3.311 10 0 GGAEHN CC[C@@H]1C[C@H](N[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)CCO1 ZINC000566082972 567124205 /nfs/dbraw/zinc/12/42/05/567124205.db2.gz MGSQNHGUCOHMKY-NFAWXSAZSA-N 0 3 388.327 3.215 10 0 GGAEHN C[C@@H](NCc1ccc(CN2CC[C@H](O)C2)cc1)c1ccc(Br)cn1 ZINC000658141086 567124361 /nfs/dbraw/zinc/12/43/61/567124361.db2.gz WEWNCWNWZSWAHK-KDOFPFPSSA-N 0 3 390.325 3.262 10 0 GGAEHN OCCO[C@]1(CN[C@@H](Cc2ccccc2Cl)c2ccsc2)CCOC1 ZINC000658143753 567125040 /nfs/dbraw/zinc/12/50/40/567125040.db2.gz IOVWIYOXJVYFKL-OALUTQOASA-N 0 3 381.925 3.443 10 0 GGAEHN C[C@@H](NC[C@]1(OCCO)CCOC1)c1ccc(SCC(F)(F)F)cc1 ZINC000658149171 567126056 /nfs/dbraw/zinc/12/60/56/567126056.db2.gz RATKUYQDJCZECH-CZUORRHYSA-N 0 3 379.444 3.160 10 0 GGAEHN COCCOc1ccc(Br)cc1NC(=O)[C@@H]1NCCCC1(C)C ZINC000566101411 567126876 /nfs/dbraw/zinc/12/68/76/567126876.db2.gz NQXWZJJZAHGWCH-HNNXBMFYSA-N 0 3 385.302 3.191 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@H]1C[C@H](Oc2ccccc2)C1 ZINC000658192004 567127622 /nfs/dbraw/zinc/12/76/22/567127622.db2.gz OKBKGLSHPWVUSN-QRTARXTBSA-N 0 3 377.282 3.199 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)NC[C@@H]1C[C@H](c2ccccc2)CO1 ZINC000658206635 567129737 /nfs/dbraw/zinc/12/97/37/567129737.db2.gz JWYMVGJOSQDBNE-ZVZYQTTQSA-N 0 3 391.309 3.162 10 0 GGAEHN CC(C)[C@@H](O)[C@H](N[C@H](C)Cn1cc(Br)ccc1=O)c1ccccc1 ZINC000658288416 567133624 /nfs/dbraw/zinc/13/36/24/567133624.db2.gz OPQZDYNXCBRYDC-NIKGAXFTSA-N 0 3 393.325 3.347 10 0 GGAEHN CCS(=O)(=O)C1(CN[C@H](Cc2ccccc2Br)C2CC2)CC1 ZINC000658299301 567133889 /nfs/dbraw/zinc/13/38/89/567133889.db2.gz DYFYJSREOOURDD-MRXNPFEDSA-N 0 3 386.355 3.327 10 0 GGAEHN C[C@@H](NC[C@H]1C(C)(C)C1(F)F)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000658282368 567134605 /nfs/dbraw/zinc/13/46/05/567134605.db2.gz UZMAMCPMOWIGAK-PELKAZGASA-N 0 3 397.285 3.038 10 0 GGAEHN O=C1N(CCN[C@@H]2CCc3c2cc(Br)cc3F)C[C@@H]2CCCCN12 ZINC000658305607 567135548 /nfs/dbraw/zinc/13/55/48/567135548.db2.gz AVTVZEXNNWKFSR-SUMWQHHRSA-N 0 3 396.304 3.455 10 0 GGAEHN O=C1N(CCN[C@H]2CCc3c2cccc3Br)C[C@@H]2CCCCN12 ZINC000658306470 567135641 /nfs/dbraw/zinc/13/56/41/567135641.db2.gz PWFUGUHNVWYBBJ-GUYCJALGSA-N 0 3 378.314 3.316 10 0 GGAEHN COc1ccc([C@@H](C)NCCN2C[C@@H]3CCCCN3C2=O)cc1Br ZINC000658309178 567136477 /nfs/dbraw/zinc/13/64/77/567136477.db2.gz NQSVUUUGZRMFMB-HIFRSBDPSA-N 0 3 396.329 3.398 10 0 GGAEHN O=C1N(CCN[C@H]2CCc3cc(Br)ccc32)C[C@H]2CCCCN12 ZINC000658305569 567136577 /nfs/dbraw/zinc/13/65/77/567136577.db2.gz ANOFYBLSJDQRJB-WBVHZDCISA-N 0 3 378.314 3.316 10 0 GGAEHN Cc1cc(C(=O)NCCCNCc2cccnc2)c(C)cc1Br ZINC000566203605 567137330 /nfs/dbraw/zinc/13/73/30/567137330.db2.gz QBEMTUQSJTWJHB-UHFFFAOYSA-N 0 3 376.298 3.371 10 0 GGAEHN O=S(=O)(Cc1ccc(Cl)c(F)c1)N[C@@H]1CNCC[C@@H]1c1ccccc1 ZINC000658391349 567139485 /nfs/dbraw/zinc/13/94/85/567139485.db2.gz BDSMBLJFNQJXFZ-CRAIPNDOSA-N 0 3 382.888 3.044 10 0 GGAEHN CC(C)C[C@H](NCc1ccc(F)c(Cl)c1Cl)C(=O)NCCN(C)C ZINC000432252426 567140420 /nfs/dbraw/zinc/14/04/20/567140420.db2.gz GCHUZJSVWZDZCE-AWEZNQCLSA-N 0 3 378.319 3.315 10 0 GGAEHN COc1ccccc1[C@@H]1C[NH2+]CCN1Cc1cccc([O-])c1Br ZINC000566230306 567140556 /nfs/dbraw/zinc/14/05/56/567140556.db2.gz ADDSUQCMFRGMOY-HNNXBMFYSA-N 0 3 377.282 3.310 10 0 GGAEHN O=S(=O)([N-][C@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)cc(Br)c1 ZINC000658401511 567141784 /nfs/dbraw/zinc/14/17/84/567141784.db2.gz FTOIBXLOZRLBFT-LBPRGKRZSA-N 0 3 393.734 3.056 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)c1ccc(F)cc1Br ZINC000523060263 567142551 /nfs/dbraw/zinc/14/25/51/567142551.db2.gz QFQNEKDJGHLKCN-HNNXBMFYSA-N 0 3 379.273 3.491 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1ccc(F)cc1Br ZINC000523060268 567142946 /nfs/dbraw/zinc/14/29/46/567142946.db2.gz QFQNEKDJGHLKCN-OAHLLOKOSA-N 0 3 379.273 3.491 10 0 GGAEHN C[C@@H](CNC(=O)c1cc(Oc2cccc(Br)c2)ccn1)N(C)C ZINC000474167513 567143645 /nfs/dbraw/zinc/14/36/45/567143645.db2.gz GUIFUCDBJVVBHC-LBPRGKRZSA-N 0 3 378.270 3.316 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000614865652 567144794 /nfs/dbraw/zinc/14/47/94/567144794.db2.gz WJKOMNMFDVCACM-MRXNPFEDSA-N 0 3 380.261 3.324 10 0 GGAEHN CCN(CC)CCN(C(=O)CC(C)(C)OC)c1ccc(Br)cn1 ZINC000566304778 567147264 /nfs/dbraw/zinc/14/72/64/567147264.db2.gz QXJXELSZFOFVHA-UHFFFAOYSA-N 0 3 386.334 3.334 10 0 GGAEHN O=C(NC[C@@H]1CCCCN1CCO)Nc1cc(C(F)(F)F)ccc1Cl ZINC000454137457 567148368 /nfs/dbraw/zinc/14/83/68/567148368.db2.gz OXMZAGGIDBTWAS-LBPRGKRZSA-N 0 3 379.810 3.327 10 0 GGAEHN CN1CCC[C@H](CNc2ncnc3c2NC(=O)CS3)[C@@H]1c1cccs1 ZINC000683752234 567152189 /nfs/dbraw/zinc/15/21/89/567152189.db2.gz KPHXVTRNBJCFIZ-IAQYHMDHSA-N 0 3 375.523 3.077 10 0 GGAEHN CN(C)C(=O)CCN1CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000474258914 567152310 /nfs/dbraw/zinc/15/23/10/567152310.db2.gz KVRDXGMYDHJVIY-UHFFFAOYSA-N 0 3 386.367 3.412 10 0 GGAEHN NC(=O)c1ncc(Br)cc1NC[C@@H](c1cccs1)N1CCCC1 ZINC000546736495 567152873 /nfs/dbraw/zinc/15/28/73/567152873.db2.gz YGEIKXXLMLIQFW-ZDUSSCGKSA-N 0 3 395.326 3.254 10 0 GGAEHN Cn1ncc(Br)c1CNC[C@@H]1CCN(c2ccc(F)c(F)c2)C1 ZINC000683766176 567153851 /nfs/dbraw/zinc/15/38/51/567153851.db2.gz BBLRNPVIVCHUIW-NSHDSACASA-N 0 3 385.256 3.077 10 0 GGAEHN COc1cc(Br)c(CNCC2(O)Cc3ccccc3C2)cc1OC ZINC000523391405 567155289 /nfs/dbraw/zinc/15/52/89/567155289.db2.gz UNECPXASWHHTKV-UHFFFAOYSA-N 0 3 392.293 3.086 10 0 GGAEHN C[C@H]1CCC[C@](CNC(=O)Cc2ccc(Br)cc2[O-])([NH+](C)C)C1 ZINC000432408610 567157499 /nfs/dbraw/zinc/15/74/99/567157499.db2.gz CLKJWTQKNZPDGT-UGSOOPFHSA-N 0 3 383.330 3.324 10 0 GGAEHN O=C(NC[C@H]1CCCCN1CCO)Nc1ccc(Br)cc1Cl ZINC000454260259 567157988 /nfs/dbraw/zinc/15/79/88/567157988.db2.gz VZNGHALTMYXAHU-GFCCVEGCSA-N 0 3 390.709 3.071 10 0 GGAEHN CN(C)C[C@@]1(O)CCCN(C(=O)CCCOc2ccc(Cl)cc2Cl)C1 ZINC000683910275 567160434 /nfs/dbraw/zinc/16/04/34/567160434.db2.gz SLUSZICTTYWODF-SFHVURJKSA-N 0 3 389.323 3.068 10 0 GGAEHN CN(C)C[C@]1(O)CCCN(C(=O)CCCOc2cccc(Cl)c2Cl)C1 ZINC000683914558 567160561 /nfs/dbraw/zinc/16/05/61/567160561.db2.gz XVZDJMAOFRZMQL-GOSISDBHSA-N 0 3 389.323 3.068 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)NCc1cccc(Br)c1 ZINC000523617734 567164030 /nfs/dbraw/zinc/16/40/30/567164030.db2.gz YMZZARIDNIYSQA-GOSISDBHSA-N 0 3 390.325 3.421 10 0 GGAEHN Cc1cc(Br)cc(C)c1CNC(=O)N1CC[C@@H](N2CCCC2)C1 ZINC000589218702 567165994 /nfs/dbraw/zinc/16/59/94/567165994.db2.gz VZWMKLJKBVBJAJ-MRXNPFEDSA-N 0 3 380.330 3.446 10 0 GGAEHN O=C(N[C@@H]1CCc2cc(Br)ccc21)N1CC[C@@H](N2CCCC2)C1 ZINC000589215753 567167321 /nfs/dbraw/zinc/16/73/21/567167321.db2.gz HOSKIMHLBNIKQN-NVXWUHKLSA-N 0 3 378.314 3.316 10 0 GGAEHN COc1cc(C(=O)N[C@@H](CC(C)C)CN(C)C)cc(OC)c1Br ZINC000498327834 567167532 /nfs/dbraw/zinc/16/75/32/567167532.db2.gz FEUXMLCACFSCFI-ZDUSSCGKSA-N 0 3 387.318 3.172 10 0 GGAEHN Clc1ccccc1-c1nnc(N2CCN(CC3CCOCC3)CC2)s1 ZINC000546889003 567168603 /nfs/dbraw/zinc/16/86/03/567168603.db2.gz VASVTJVEZNKEIX-UHFFFAOYSA-N 0 3 378.929 3.407 10 0 GGAEHN CN1CC[C@]2(CCN(C(=O)c3c(F)c(F)c(Br)c(F)c3F)C2)C1 ZINC000615204938 567169764 /nfs/dbraw/zinc/16/97/64/567169764.db2.gz XMHVIOXXCBBIHV-HNNXBMFYSA-N 0 3 395.194 3.173 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)CCCc1cccc(Br)c1 ZINC000615265998 567172638 /nfs/dbraw/zinc/17/26/38/567172638.db2.gz QXJDRSIZMYFSRG-ROUUACIJSA-N 0 3 395.341 3.093 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)CCOc1ccc(Cl)cc1Cl ZINC000615263001 567172688 /nfs/dbraw/zinc/17/26/88/567172688.db2.gz HELSVGXJMPCJKC-JKSUJKDBSA-N 0 3 387.307 3.084 10 0 GGAEHN CCc1ocnc1C(=O)N(CCN(CC)CC)c1ccc(Br)cn1 ZINC000566623471 567172936 /nfs/dbraw/zinc/17/29/36/567172936.db2.gz KISYMRUMAUHOTF-UHFFFAOYSA-N 0 3 395.301 3.383 10 0 GGAEHN O[C@H](CNCC1(C(F)(F)F)CC1)COc1cc(F)cc(Br)c1 ZINC000566616239 567173281 /nfs/dbraw/zinc/17/32/81/567173281.db2.gz URTOTQWIUIWIET-LLVKDONJSA-N 0 3 386.183 3.260 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)CCOc1ccc(Cl)cc1Cl ZINC000615262998 567173297 /nfs/dbraw/zinc/17/32/97/567173297.db2.gz HELSVGXJMPCJKC-HOTGVXAUSA-N 0 3 387.307 3.084 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000615277543 567174635 /nfs/dbraw/zinc/17/46/35/567174635.db2.gz WLSULDHXXSAZRS-IHETXDGRSA-N 0 3 383.319 3.419 10 0 GGAEHN C[C@H](CC(=O)N1CCOC[C@@H]1[C@@H]1CCCN1C)c1ccc(Br)cc1 ZINC000615269999 567175063 /nfs/dbraw/zinc/17/50/63/567175063.db2.gz NSUMHNAZXDGPQO-FHLIZLRMSA-N 0 3 395.341 3.264 10 0 GGAEHN Cc1ccc(C(=O)N2CCOC[C@H]2[C@@H]2CCCN2C)c(C)c1Br ZINC000615270849 567175442 /nfs/dbraw/zinc/17/54/42/567175442.db2.gz SNRDJZIJAMTRBC-HOTGVXAUSA-N 0 3 381.314 3.001 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)c1ccc(Br)c(Cl)c1 ZINC000615271803 567175679 /nfs/dbraw/zinc/17/56/79/567175679.db2.gz YPBXMCPNDRUHHI-HUUCEWRRSA-N 0 3 387.705 3.038 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N1CCOC[C@@H]1[C@@H]1CCCN1C ZINC000615266681 567175866 /nfs/dbraw/zinc/17/58/66/567175866.db2.gz ONJSDNQFVCYHLB-VBNZEHGJSA-N 0 3 387.307 3.082 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1ccc(Cl)c(Br)c1 ZINC000615269179 567175944 /nfs/dbraw/zinc/17/59/44/567175944.db2.gz KHDRMNGQBWPSGK-CABCVRRESA-N 0 3 387.705 3.038 10 0 GGAEHN N[C@@H]1CN(C(=O)Nc2cc(C(F)(F)F)ccc2Br)CC[C@H]1F ZINC000659013008 567177422 /nfs/dbraw/zinc/17/74/22/567177422.db2.gz WNOFWIUQZJXSBY-NXEZZACHSA-N 0 3 384.171 3.371 10 0 GGAEHN Cc1cc(NC(=O)N2CC[C@@H](F)[C@H](N)C2)nn1-c1ccc(Cl)cc1Cl ZINC000659007819 567177454 /nfs/dbraw/zinc/17/74/54/567177454.db2.gz UBKFCLJVCVXBRR-CHWSQXEVSA-N 0 3 386.258 3.391 10 0 GGAEHN N[C@@H]1CN(C(=O)Nc2ccnn2Cc2c(Cl)cccc2Cl)CC[C@H]1F ZINC000659010516 567177783 /nfs/dbraw/zinc/17/77/83/567177783.db2.gz YSYJSCXLWYZIKK-ZIAGYGMSSA-N 0 3 386.258 3.141 10 0 GGAEHN O=C(NCc1ccccc1Br)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659032857 567179223 /nfs/dbraw/zinc/17/92/23/567179223.db2.gz UFXATCZFYRGOOB-QGZVFWFLSA-N 0 3 390.281 3.432 10 0 GGAEHN COc1ccc(CCC(=O)N2CC[C@@]3(C2)CCCN(C)C3)c(Br)c1 ZINC000615354961 567179349 /nfs/dbraw/zinc/17/93/49/567179349.db2.gz BINNCRDJCCPSJT-IBGZPJMESA-N 0 3 395.341 3.335 10 0 GGAEHN O=C(NCc1ccc(Br)s1)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659034014 567179507 /nfs/dbraw/zinc/17/95/07/567179507.db2.gz YYKIGHLKXCMCIW-AWEZNQCLSA-N 0 3 396.310 3.493 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CCNC[C@@](C)(F)C1 ZINC000566679205 567180293 /nfs/dbraw/zinc/18/02/93/567180293.db2.gz PKYJFHSLHDGIED-QGZVFWFLSA-N 0 3 381.293 3.077 10 0 GGAEHN Cc1cn[nH]c1CN1CCC(Oc2ccccc2I)CC1 ZINC000589503239 567181323 /nfs/dbraw/zinc/18/13/23/567181323.db2.gz LEGSSKRRTFCGET-UHFFFAOYSA-N 0 3 397.260 3.366 10 0 GGAEHN C[C@H](CCc1ccc(I)cc1)NC[C@H](O)C(F)(F)F ZINC000474619680 567184540 /nfs/dbraw/zinc/18/45/40/567184540.db2.gz MDIZYRKFHUNISX-SKDRFNHKSA-N 0 3 387.183 3.125 10 0 GGAEHN CC(C)(C)N1CCCN(C(=O)Cc2noc3ccc(Br)cc32)CC1 ZINC000566732648 567185158 /nfs/dbraw/zinc/18/51/58/567185158.db2.gz GGEORZUVGAHOKX-UHFFFAOYSA-N 0 3 394.313 3.466 10 0 GGAEHN CN(C)CCOc1cc(-c2noc(-c3coc(Br)c3)n2)ccn1 ZINC000547171267 567187797 /nfs/dbraw/zinc/18/77/97/567187797.db2.gz CVWIGPNTLOWNQW-UHFFFAOYSA-N 0 3 379.214 3.095 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)N1CCOc2c(Br)cccc2C1 ZINC000684252375 567191926 /nfs/dbraw/zinc/19/19/26/567191926.db2.gz ANNFNUQQGCBYOB-HNNXBMFYSA-N 0 3 398.345 3.329 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)c1ccc(Br)cc1C(F)(F)F ZINC000566796171 567192158 /nfs/dbraw/zinc/19/21/58/567192158.db2.gz MVISXAOKBXUTHX-JTQLQIEISA-N 0 3 387.146 3.195 10 0 GGAEHN CC(C)[C@H](O)CN(C)Cc1cccc(Br)c1OC[C@H]1CCCO1 ZINC000432793847 567193022 /nfs/dbraw/zinc/19/30/22/567193022.db2.gz QUCCRYKIXWNOLI-NVXWUHKLSA-N 0 3 386.330 3.456 10 0 GGAEHN O=C(C[C@@H]1NCc2ccccc21)NCCOc1ccc(Br)cc1 ZINC000659254135 567194775 /nfs/dbraw/zinc/19/47/75/567194775.db2.gz IQMUGINGTDHQPY-KRWDZBQOSA-N 0 3 375.266 3.179 10 0 GGAEHN COc1ccc(CNC(=O)C[C@@H]2NCc3ccccc32)cc1Br ZINC000659264163 567195613 /nfs/dbraw/zinc/19/56/13/567195613.db2.gz WKMMNHGQRTUTIG-INIZCTEOSA-N 0 3 375.266 3.309 10 0 GGAEHN NC1(C(=O)Nc2ccnn2Cc2ccc(Br)cc2)CC2(CCC2)C1 ZINC000659259246 567195893 /nfs/dbraw/zinc/19/58/93/567195893.db2.gz JROOSJQRKVADHD-UHFFFAOYSA-N 0 3 389.297 3.294 10 0 GGAEHN CC(=O)c1ccc(Cl)c(Cl)c1OCC(=O)NC1CCN(C2CC2)CC1 ZINC000589852905 567196247 /nfs/dbraw/zinc/19/62/47/567196247.db2.gz WKHDWUVAKLDTLV-UHFFFAOYSA-N 0 3 385.291 3.318 10 0 GGAEHN NC1(C(=O)NCc2cc(Br)ccc2OC(F)F)CC2(CCC2)C1 ZINC000659264213 567196819 /nfs/dbraw/zinc/19/68/19/567196819.db2.gz XGFZXSFIYYKPOV-UHFFFAOYSA-N 0 3 389.240 3.328 10 0 GGAEHN Cc1ccc(C(=O)N[C@@H](CC(C)C)CN(C)C)cc1I ZINC000524415199 567199943 /nfs/dbraw/zinc/19/99/43/567199943.db2.gz NEVGSEDSTPOXGX-AWEZNQCLSA-N 0 3 388.293 3.306 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N2CCC[C@H]2CN(C)C)cc1OC ZINC000589982213 567201335 /nfs/dbraw/zinc/20/13/35/567201335.db2.gz PVWZJNJKUXTBHP-ZDUSSCGKSA-N 0 3 385.302 3.023 10 0 GGAEHN Cc1ccc([C@@H](CNc2ncc(I)cn2)N2CCCC2)o1 ZINC000547329711 567201535 /nfs/dbraw/zinc/20/15/35/567201535.db2.gz KOXVIEMWPMSTTQ-CYBMUJFWSA-N 0 3 398.248 3.232 10 0 GGAEHN O=C(Nc1ccc2c(c1)CNCC2)c1sc2c(c1Br)CNC2 ZINC000659296648 567202346 /nfs/dbraw/zinc/20/23/46/567202346.db2.gz HDPPLOFTSXYEGT-UHFFFAOYSA-N 0 3 378.295 3.012 10 0 GGAEHN C[C@@H]1CN(C(=O)[C@@H]2CCc3cc(Br)ccc32)CCN(C2CC2)C1 ZINC000566918245 567202915 /nfs/dbraw/zinc/20/29/15/567202915.db2.gz UDEIMYWBTSFXRT-SCLBCKFNSA-N 0 3 377.326 3.422 10 0 GGAEHN C[C@H]1CN(C(=O)[C@@H]2CCc3cc(Br)ccc32)CCN(C2CC2)C1 ZINC000566918244 567203083 /nfs/dbraw/zinc/20/30/83/567203083.db2.gz UDEIMYWBTSFXRT-FZKQIMNGSA-N 0 3 377.326 3.422 10 0 GGAEHN CN(C)CCN(C(=O)c1sc2c(c1Br)CNC2)C1CCCC1 ZINC000659316506 567203958 /nfs/dbraw/zinc/20/39/58/567203958.db2.gz NYTKLGULWSSGOD-UHFFFAOYSA-N 0 3 386.359 3.060 10 0 GGAEHN CN1C[C@H]2CCN(Cc3ccc(I)cc3Cl)[C@H]2C1 ZINC000590010388 567204124 /nfs/dbraw/zinc/20/41/24/567204124.db2.gz GUASUONZLZUKTK-RISCZKNCSA-N 0 3 376.669 3.081 10 0 GGAEHN CN1C[C@@H]2CCN(Cc3ccc(I)c(Cl)c3)[C@@H]2C1 ZINC000590010652 567204516 /nfs/dbraw/zinc/20/45/16/567204516.db2.gz OCABLSRBEQYBBL-SMDDNHRTSA-N 0 3 376.669 3.081 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)Cc1ccc(Br)cc1F ZINC000659324101 567205416 /nfs/dbraw/zinc/20/54/16/567205416.db2.gz BMYXKHQDOONFGR-QGZVFWFLSA-N 0 3 377.257 3.215 10 0 GGAEHN N[C@H](Cc1ccccc1)C(=O)NCC1(Cc2ccc(Br)cc2)CC1 ZINC000659359026 567207466 /nfs/dbraw/zinc/20/74/66/567207466.db2.gz NRSFWBCHWXKXDZ-GOSISDBHSA-N 0 3 387.321 3.458 10 0 GGAEHN O=C(NCCCNCc1cccnc1)N1Cc2cccc(Br)c2C1 ZINC000637625569 567208587 /nfs/dbraw/zinc/20/85/87/567208587.db2.gz WKMZNZZUBWTDGE-UHFFFAOYSA-N 0 3 389.297 3.049 10 0 GGAEHN CC1(OCC(=O)N2CCc3sccc3[C@H]2c2ccc(Cl)cc2)CNC1 ZINC000659371387 567208977 /nfs/dbraw/zinc/20/89/77/567208977.db2.gz FMDSBKRDUNQVQH-GOSISDBHSA-N 0 3 376.909 3.254 10 0 GGAEHN O=C(Cc1cccc(Br)c1)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659373973 567209428 /nfs/dbraw/zinc/20/94/28/567209428.db2.gz VPTNFAPYQBVEHQ-QGZVFWFLSA-N 0 3 375.266 3.291 10 0 GGAEHN O=C(Cc1ccc(Br)c(F)c1)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659366435 567209622 /nfs/dbraw/zinc/20/96/22/567209622.db2.gz JWRBGUHQDTWMIH-QGZVFWFLSA-N 0 3 393.256 3.430 10 0 GGAEHN N[C@H](CC(=O)N1CCOC[C@@H]1c1cccc(Br)c1)c1ccccc1 ZINC000659370436 567209671 /nfs/dbraw/zinc/20/96/71/567209671.db2.gz XXLPWHOUFKPFRW-QZTJIDSGSA-N 0 3 389.293 3.439 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)CSc1cccc(C(F)(F)F)c1 ZINC000590119389 567209960 /nfs/dbraw/zinc/20/99/60/567209960.db2.gz VGOFDYLJWBJQOB-AWEZNQCLSA-N 0 3 376.444 3.025 10 0 GGAEHN CN(C(=O)CCSc1ccccc1Br)[C@H]1CN2CCC1CC2 ZINC000524694424 567209957 /nfs/dbraw/zinc/20/99/57/567209957.db2.gz OQISKAWPEDDEHN-HNNXBMFYSA-N 0 3 383.355 3.484 10 0 GGAEHN COc1cc(Br)ccc1C(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659371695 567210306 /nfs/dbraw/zinc/21/03/06/567210306.db2.gz VMAOSRGYOAEPNO-KRWDZBQOSA-N 0 3 391.265 3.371 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)CCCCc1ccc(Br)cc1 ZINC000590116861 567210332 /nfs/dbraw/zinc/21/03/32/567210332.db2.gz DMKZHKKOOOKMKZ-SFHVURJKSA-N 0 3 397.357 3.389 10 0 GGAEHN O=C(Cc1ccc(F)c(Br)c1)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659373461 567210412 /nfs/dbraw/zinc/21/04/12/567210412.db2.gz SXQIPUNICXNQAB-KRWDZBQOSA-N 0 3 393.256 3.430 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)N[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]12 ZINC000637651167 567211014 /nfs/dbraw/zinc/21/10/14/567211014.db2.gz UHYLHEDPINDIAV-QBFPWWHVSA-N 0 3 392.341 3.069 10 0 GGAEHN CC(C)NCC(=O)N1CCc2cc(Br)c(Br)cc2C1 ZINC000659383418 567211589 /nfs/dbraw/zinc/21/15/89/567211589.db2.gz QIYQYJFUWIJBRV-UHFFFAOYSA-N 0 3 390.119 3.094 10 0 GGAEHN O=C(C[C@H]1CSCCN1)N[C@@H]1CCCCc2cc(Br)ccc21 ZINC000659386492 567212157 /nfs/dbraw/zinc/21/21/57/567212157.db2.gz OUSVAZNNDOVKRN-GOEBONIOSA-N 0 3 383.355 3.428 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)NCCOc1cccc(Br)c1 ZINC000615906472 567214949 /nfs/dbraw/zinc/21/49/49/567214949.db2.gz SDOWIODYZDXVOE-CQSZACIVSA-N 0 3 384.318 3.002 10 0 GGAEHN C[C@@H](NC[C@@H](C)c1ccncc1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000684554108 567215765 /nfs/dbraw/zinc/21/57/65/567215765.db2.gz PKWOLSPKUAUWMC-GHMZBOCLSA-N 0 3 388.320 3.490 10 0 GGAEHN CC[C@@H](CNC(=O)N1CC[C@@H](F)[C@H](N)C1)Cc1cccc(Br)c1 ZINC000659455996 567217149 /nfs/dbraw/zinc/21/71/49/567217149.db2.gz KLLPRGSDBWEYNT-DAXOMENPSA-N 0 3 386.309 3.099 10 0 GGAEHN CC[C@H](CNC(=O)N1CC[C@@H](F)[C@H](N)C1)Cc1cccc(Br)c1 ZINC000659455995 567217152 /nfs/dbraw/zinc/21/71/52/567217152.db2.gz KLLPRGSDBWEYNT-APHBMKBZSA-N 0 3 386.309 3.099 10 0 GGAEHN N[C@H](CNC(=O)N1CCOc2cc(Br)ccc2C1)c1ccccc1 ZINC000659520096 567218470 /nfs/dbraw/zinc/21/84/70/567218470.db2.gz PBLNNVWXHXAUQA-MRXNPFEDSA-N 0 3 390.281 3.053 10 0 GGAEHN Cc1ncsc1CS(=O)(=O)C(C)C(=O)N(Cc1ccccc1)C(C)C ZINC000567156299 567223602 /nfs/dbraw/zinc/22/36/02/567223602.db2.gz LLBYHBVPLROVSH-OAHLLOKOSA-N 0 3 380.535 3.192 10 0 GGAEHN CN1CCC[C@@H](NC(=O)N[C@H]2C[C@H](c3ccc(F)c(Br)c3)C2)C1 ZINC000684656096 567225075 /nfs/dbraw/zinc/22/50/75/567225075.db2.gz WNTVBOSXUZICME-MGPQQGTHSA-N 0 3 384.293 3.228 10 0 GGAEHN C[C@@H]1COCC[C@H]1NCC(=O)Nc1ccc(Br)c(C(F)(F)F)c1 ZINC000433136497 567225658 /nfs/dbraw/zinc/22/56/58/567225658.db2.gz MBYMXIHMYXQAAD-NOZJJQNGSA-N 0 3 395.219 3.421 10 0 GGAEHN CN(CCC(=O)N[C@@](C)(CO)c1cc(Cl)cc(Cl)c1)c1ccncc1 ZINC000616080295 567226678 /nfs/dbraw/zinc/22/66/78/567226678.db2.gz LRTYZXRBRSZVJP-SFHVURJKSA-N 0 3 382.291 3.239 10 0 GGAEHN COc1ccc(Br)c(CNC(=O)NCCN2CCCC[C@H]2C)c1 ZINC000616080729 567226933 /nfs/dbraw/zinc/22/69/33/567226933.db2.gz ZPQYZPOLJXLWIZ-CYBMUJFWSA-N 0 3 384.318 3.131 10 0 GGAEHN C[C@H]1OCC[C@@]1(O)CNCc1cnc(-c2ccc(Br)cc2)s1 ZINC000433189836 567229610 /nfs/dbraw/zinc/22/96/10/567229610.db2.gz SSLIPPXZHPQDPM-BDJLRTHQSA-N 0 3 383.311 3.202 10 0 GGAEHN Cc1nc2ccc(Br)cn2c1C(=O)N[C@@H](CC(C)C)CN(C)C ZINC000475175955 567230334 /nfs/dbraw/zinc/23/03/34/567230334.db2.gz SJYSYIVRORAEKH-AWEZNQCLSA-N 0 3 381.318 3.111 10 0 GGAEHN O=C(Cc1noc2ccc(Br)cc21)NC[C@H]1CCCCN1C1CC1 ZINC000567262803 567231227 /nfs/dbraw/zinc/23/12/27/567231227.db2.gz AQWYDJMZNGDMDP-CQSZACIVSA-N 0 3 392.297 3.266 10 0 GGAEHN CN1CC[C@H](NCC(=O)NCc2cccs2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000567283548 567232882 /nfs/dbraw/zinc/23/28/82/567232882.db2.gz LEYNDYZWWCCSHZ-FUHWJXTLSA-N 0 3 381.904 3.192 10 0 GGAEHN COc1ccc(NC(=O)C(C[C@H]2COCCO2)C(F)(F)F)cc1SC ZINC000616210415 567232774 /nfs/dbraw/zinc/23/27/74/567232774.db2.gz QZVPCYUKBJWYGH-RYUDHWBXSA-N 0 3 379.400 3.340 10 0 GGAEHN COc1ccc(NC(=O)C(C[C@H]2COCCO2)C(F)(F)F)cc1SC ZINC000616210414 567232940 /nfs/dbraw/zinc/23/29/40/567232940.db2.gz QZVPCYUKBJWYGH-NWDGAFQWSA-N 0 3 379.400 3.340 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N(CCN(C)C)Cc1ccsc1 ZINC000616238113 567234818 /nfs/dbraw/zinc/23/48/18/567234818.db2.gz BVGSTYVZHILDNT-UHFFFAOYSA-N 0 3 382.327 3.418 10 0 GGAEHN CC[NH+](CC)CC1CCN(C(=O)Cc2ccc(Br)cc2[O-])CC1 ZINC000433248059 567236780 /nfs/dbraw/zinc/23/67/80/567236780.db2.gz QLJAYVSYQJJECV-UHFFFAOYSA-N 0 3 383.330 3.278 10 0 GGAEHN Cc1nc(CCNC(=O)NC[C@H]2CCCN(C)[C@H]2c2cccs2)cs1 ZINC000525256619 567238027 /nfs/dbraw/zinc/23/80/27/567238027.db2.gz DCIKPBDKFNWJBI-RHSMWYFYSA-N 0 3 378.567 3.438 10 0 GGAEHN COc1cccc(SC)c1NC(=O)C(C[C@H]1COCCO1)C(F)(F)F ZINC000616350817 567239789 /nfs/dbraw/zinc/23/97/89/567239789.db2.gz OKYHGDRRSIABGX-QWRGUYRKSA-N 0 3 379.400 3.340 10 0 GGAEHN COc1cccc(SC)c1NC(=O)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000616350816 567240014 /nfs/dbraw/zinc/24/00/14/567240014.db2.gz OKYHGDRRSIABGX-MNOVXSKESA-N 0 3 379.400 3.340 10 0 GGAEHN Brc1ccc(OCCN2CCCC[C@H]2CN2CCOCC2)cc1 ZINC000525283314 567240836 /nfs/dbraw/zinc/24/08/36/567240836.db2.gz NFJLOJGITGWFCI-KRWDZBQOSA-N 0 3 383.330 3.015 10 0 GGAEHN COc1cccc(SC)c1NC(=O)C(C[C@H]1COCCO1)C(F)(F)F ZINC000616350818 567241854 /nfs/dbraw/zinc/24/18/54/567241854.db2.gz OKYHGDRRSIABGX-WDEREUQCSA-N 0 3 379.400 3.340 10 0 GGAEHN CSC1(CNC(=O)NCc2cc(F)c(Cl)cc2F)CCN(C)CC1 ZINC000567410231 567242920 /nfs/dbraw/zinc/24/29/20/567242920.db2.gz GELDNRUZSQSWNH-UHFFFAOYSA-N 0 3 377.888 3.245 10 0 GGAEHN CS[C@@H]1CN(C(=O)Cc2cscc2Br)C[C@H]1N1CCCC1 ZINC000499400979 567244218 /nfs/dbraw/zinc/24/42/18/567244218.db2.gz SRAQYJPPBCDSBB-ZIAGYGMSSA-N 0 3 389.384 3.091 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CCC[N@@H+](C2CCCC2)CC1 ZINC000433350530 567244516 /nfs/dbraw/zinc/24/45/16/567244516.db2.gz FOFICOAQQOWHPK-UHFFFAOYSA-N 0 3 381.314 3.174 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CCC[N@H+](C2CCCC2)CC1 ZINC000433350530 567244519 /nfs/dbraw/zinc/24/45/19/567244519.db2.gz FOFICOAQQOWHPK-UHFFFAOYSA-N 0 3 381.314 3.174 10 0 GGAEHN CN1C[C@@H]2CCCN(C(=O)c3c(F)c(F)c(Br)c(F)c3F)[C@@H]2C1 ZINC000616420632 567244732 /nfs/dbraw/zinc/24/47/32/567244732.db2.gz OZXZRAWSWAGTTR-JGVFFNPUSA-N 0 3 395.194 3.172 10 0 GGAEHN CN(C)Cc1ccc(S(=O)(=O)N2CC[C@H](C(F)(F)F)C(C)(C)C2)cc1 ZINC000433372674 567245686 /nfs/dbraw/zinc/24/56/86/567245686.db2.gz PMJGPFPQDBVOFD-HNNXBMFYSA-N 0 3 378.460 3.347 10 0 GGAEHN NC(=O)[C@@H](NCCCCOc1ccccc1)c1cccc(Br)c1 ZINC000475425666 567246544 /nfs/dbraw/zinc/24/65/44/567246544.db2.gz ZWINQJXIUKIBOH-KRWDZBQOSA-N 0 3 377.282 3.424 10 0 GGAEHN CCCN(C(=O)CCc1ccc(OC)cc1Br)[C@H]1CCN(C)C1 ZINC000616468228 567247232 /nfs/dbraw/zinc/24/72/32/567247232.db2.gz VDXSLGIKLJLMRN-HNNXBMFYSA-N 0 3 383.330 3.333 10 0 GGAEHN C[C@H](NC(=O)Nc1ccccc1CCN(C)C)c1ncc(Br)cn1 ZINC000455230495 567249646 /nfs/dbraw/zinc/24/96/46/567249646.db2.gz PPGHFZCMTPSJCX-LBPRGKRZSA-N 0 3 392.301 3.226 10 0 GGAEHN FC1(F)C[C@@H]1OCCNC1(c2ccc(Br)cc2)CCOCC1 ZINC000660033639 567250184 /nfs/dbraw/zinc/25/01/84/567250184.db2.gz BTZIBVRMUPFCCL-AWEZNQCLSA-N 0 3 376.241 3.469 10 0 GGAEHN O=C(Nc1cccc(Cl)c1)N1CCCN(CC2(O)CCSCC2)CC1 ZINC000660048468 567252511 /nfs/dbraw/zinc/25/25/11/567252511.db2.gz OUJDHABOSPYBDN-UHFFFAOYSA-N 0 3 383.945 3.138 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2csc(Br)c2)C[C@@H]1N1CCCC1 ZINC000547860620 567252581 /nfs/dbraw/zinc/25/25/81/567252581.db2.gz SYCWMDWVXREXNV-NWDGAFQWSA-N 0 3 375.357 3.162 10 0 GGAEHN O=S(=O)(NC[C@@H]1CN(Cc2ccccc2)CC12CCC2)c1cccs1 ZINC000660057747 567253710 /nfs/dbraw/zinc/25/37/10/567253710.db2.gz QRIYWWBYBCCZRF-QGZVFWFLSA-N 0 3 376.547 3.329 10 0 GGAEHN C[C@H]1C[C@H](NC(=O)CSCc2ccc(Br)cc2F)CCN1C ZINC000525617495 567254971 /nfs/dbraw/zinc/25/49/71/567254971.db2.gz ODFNUBVHOFIQMN-SMDDNHRTSA-N 0 3 389.334 3.420 10 0 GGAEHN CN1CC[C@@H](NCC(=O)Nc2ccc(Br)cc2)[C@H]1c1ccccc1 ZINC000567528469 567255260 /nfs/dbraw/zinc/25/52/60/567255260.db2.gz ZYHXGZSOJFBKPY-IEBWSBKVSA-N 0 3 388.309 3.423 10 0 GGAEHN CCOc1cc(C[NH2+]CC2(C(=O)OC)CCCC2)cc(Br)c1[O-] ZINC000590959818 567259592 /nfs/dbraw/zinc/25/95/92/567259592.db2.gz NZFZEBZTRWCERZ-UHFFFAOYSA-N 0 3 386.286 3.376 10 0 GGAEHN CCOc1ccc(CN[C@@H](C)Cn2cc(Br)ccc2=O)cc1OC ZINC000567598718 567259565 /nfs/dbraw/zinc/25/95/65/567259565.db2.gz JAXRGDWPLVYBRD-ZDUSSCGKSA-N 0 3 395.297 3.196 10 0 GGAEHN CN(C)Cc1ccc(NC(=O)[C@H](CN)c2ccc(F)cc2)cc1Br ZINC000567586065 567259786 /nfs/dbraw/zinc/25/97/86/567259786.db2.gz FAHPJQPJYSPUKU-MRXNPFEDSA-N 0 3 394.288 3.331 10 0 GGAEHN CC(C)N1CC[C@H](N[C@@H]2CCN(C)[C@@H](c3ccc(Br)cc3)C2)C1=O ZINC000638639588 567261736 /nfs/dbraw/zinc/26/17/36/567261736.db2.gz TVZUCEXFCYQFDX-FGTMMUONSA-N 0 3 394.357 3.183 10 0 GGAEHN COc1ccc(Br)cc1CN1CCN(c2ccncc2OC)CC1 ZINC000475624977 567262185 /nfs/dbraw/zinc/26/21/85/567262185.db2.gz NDAFGFJAZGIGOX-UHFFFAOYSA-N 0 3 392.297 3.184 10 0 GGAEHN COc1cc(CN(C)[C@H]2CCCN(Cc3cc(OC)ns3)CC2)sn1 ZINC000660126321 567264194 /nfs/dbraw/zinc/26/41/94/567264194.db2.gz WEACJYPNZOHGKS-ZDUSSCGKSA-N 0 3 382.555 3.103 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)N[C@H](c2cc(F)ccc2F)C(F)F)CCSC1 ZINC000433652170 567264578 /nfs/dbraw/zinc/26/45/78/567264578.db2.gz XBJWIQXFHNTCRQ-CZUORRHYSA-N 0 3 379.423 3.008 10 0 GGAEHN COc1ccc(CN2CCN(c3ccncc3OC)CC2)cc1Br ZINC000475630736 567264498 /nfs/dbraw/zinc/26/44/98/567264498.db2.gz ITYTYQGJRFKZOS-UHFFFAOYSA-N 0 3 392.297 3.184 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1cc(F)c(Br)cc1Cl ZINC000475655665 567266005 /nfs/dbraw/zinc/26/60/05/567266005.db2.gz JYFDGINGCWDJON-SNVBAGLBSA-N 0 3 393.684 3.082 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1cc(F)c(Br)cc1Cl ZINC000475655464 567266160 /nfs/dbraw/zinc/26/61/60/567266160.db2.gz JYFDGINGCWDJON-JTQLQIEISA-N 0 3 393.684 3.082 10 0 GGAEHN C[C@@H]1CCN(CCNC(=O)CSCc2ccc(Br)cc2F)C1 ZINC000525805932 567266262 /nfs/dbraw/zinc/26/62/62/567266262.db2.gz WGTCKDQSKYZPJK-GFCCVEGCSA-N 0 3 389.334 3.279 10 0 GGAEHN C[C@@]1(C(N)=O)CCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000475672130 567266487 /nfs/dbraw/zinc/26/64/87/567266487.db2.gz YBWXYCCIMOYRNH-MRXNPFEDSA-N 0 3 380.311 3.270 10 0 GGAEHN Brc1cnc2c(CN[C@@H]3CCOC4(CCSCC4)C3)cnn2c1 ZINC000638789551 567269070 /nfs/dbraw/zinc/26/90/70/567269070.db2.gz QIUGTLPDFTZZBM-CQSZACIVSA-N 0 3 397.342 3.026 10 0 GGAEHN CN1CC[C@H](N[C@H](CO)CC(F)(F)F)C[C@@H]1c1ccc(Br)cc1 ZINC000638833307 567275012 /nfs/dbraw/zinc/27/50/12/567275012.db2.gz VDAYVQITXKYWEU-SOUVJXGZSA-N 0 3 395.263 3.487 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000617006223 567275568 /nfs/dbraw/zinc/27/55/68/567275568.db2.gz YFXMNXBHCHTTIK-UONOGXRCSA-N 0 3 381.314 3.304 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)Cc1c[nH]c2cc(Br)ccc12 ZINC000617012312 567275640 /nfs/dbraw/zinc/27/56/40/567275640.db2.gz YPVGQESMLFQTGS-AWEZNQCLSA-N 0 3 378.314 3.462 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)c1[nH]nc(-c2ccccc2)c1Br ZINC000617015287 567275663 /nfs/dbraw/zinc/27/56/63/567275663.db2.gz ZBUGDIPBUHKNLK-CYBMUJFWSA-N 0 3 391.313 3.442 10 0 GGAEHN C[C@@H]1CN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C[C@@H](C)S1 ZINC000525928744 567276691 /nfs/dbraw/zinc/27/66/91/567276691.db2.gz DYLHEFGWIVRXHB-HGWMRPEMSA-N 0 3 379.492 3.327 10 0 GGAEHN C[C@H]1CN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C[C@H](C)S1 ZINC000525928745 567276755 /nfs/dbraw/zinc/27/67/55/567276755.db2.gz DYLHEFGWIVRXHB-XOEAPDPESA-N 0 3 379.492 3.327 10 0 GGAEHN CCOc1c(Br)cc(C(=O)NC[C@@H]2CCN2C(C)(C)C)cc1OC ZINC000617021216 567278303 /nfs/dbraw/zinc/27/83/03/567278303.db2.gz STLOQOBTEZEBQV-ZDUSSCGKSA-N 0 3 399.329 3.459 10 0 GGAEHN CCN(CC)Cc1ccc(C(=O)Nc2c[nH]cc(Br)c2=O)cc1 ZINC000548089601 567279062 /nfs/dbraw/zinc/27/90/62/567279062.db2.gz WMTBWPBYTVTZNL-UHFFFAOYSA-N 0 3 378.270 3.232 10 0 GGAEHN COC(=O)c1cc(NC(=O)N[C@@H](C)C2=CCN(C)CC2)ccc1Br ZINC000548081903 567279089 /nfs/dbraw/zinc/27/90/89/567279089.db2.gz UHAASVVBKWQICA-NSHDSACASA-N 0 3 396.285 3.008 10 0 GGAEHN COC(=O)CC1(NCC(=O)N(C)Cc2cc(Cl)cc(Cl)c2)CCCC1 ZINC000548098553 567280376 /nfs/dbraw/zinc/28/03/76/567280376.db2.gz WSEALXMIEPOITE-UHFFFAOYSA-N 0 3 387.307 3.417 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)Cc2c(F)ccc(Br)c2F)CCN1C ZINC000499888464 567281285 /nfs/dbraw/zinc/28/12/85/567281285.db2.gz RSGCVJXMPFMQQW-MNOVXSKESA-N 0 3 375.257 3.211 10 0 GGAEHN FC1(CNC[C@@H]2CCCN2Cc2ccc(I)cc2)CC1 ZINC000526002124 567281462 /nfs/dbraw/zinc/28/14/62/567281462.db2.gz ZPEZZSRIVYZTRG-HNNXBMFYSA-N 0 3 388.268 3.347 10 0 GGAEHN C[C@@H](NS(=O)(=O)c1ccc2ncsc2c1)[C@H]1CCCN(C2CCC2)C1 ZINC000548123785 567282106 /nfs/dbraw/zinc/28/21/06/567282106.db2.gz KFSXEBYFONWOJB-KGLIPLIRSA-N 0 3 379.551 3.228 10 0 GGAEHN CN(C)CCN(C[C@H]1CCCO1)C(=O)CCOc1cccc(Cl)c1Cl ZINC000499897746 567282449 /nfs/dbraw/zinc/28/24/49/567282449.db2.gz RNKYDVWHDOMDNO-CQSZACIVSA-N 0 3 389.323 3.332 10 0 GGAEHN Cc1cc(Br)ccc1CNC[C@@H]1CS(=O)(=O)c2ccccc2O1 ZINC000567854018 567283474 /nfs/dbraw/zinc/28/34/74/567283474.db2.gz WLJDNHWZODJKGA-OAHLLOKOSA-N 0 3 396.306 3.082 10 0 GGAEHN CC(C)(C)C(=O)N1CCC[C@@H](CN[C@@H](CO)c2cccc(Br)c2)C1 ZINC000660237416 567283546 /nfs/dbraw/zinc/28/35/46/567283546.db2.gz CFOUVOPVHAPVRI-YOEHRIQHSA-N 0 3 397.357 3.357 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)N(C)Cc1ccc(Br)cc1C ZINC000433926906 567283557 /nfs/dbraw/zinc/28/35/57/567283557.db2.gz OFJFUDIDPVTYQE-QGZVFWFLSA-N 0 3 398.345 3.010 10 0 GGAEHN Cc1cc(Br)ccc1CN(C)C(=O)N[C@@H]1CN(C2CC2)C[C@H]1C ZINC000433926103 567284524 /nfs/dbraw/zinc/28/45/24/567284524.db2.gz JIIZJBISODTDSS-CXAGYDPISA-N 0 3 380.330 3.382 10 0 GGAEHN Ic1cccc(C[C@H]2CCN(Cc3cnccn3)C2)c1 ZINC000567855905 567284781 /nfs/dbraw/zinc/28/47/81/567284781.db2.gz GWGZQCUEVJMDGC-CQSZACIVSA-N 0 3 379.245 3.146 10 0 GGAEHN CN(CCC(=O)N1CCc2cc(Br)cc(F)c2C1)c1ccncc1 ZINC000526036431 567284957 /nfs/dbraw/zinc/28/49/57/567284957.db2.gz NJTYVPUCESPROO-UHFFFAOYSA-N 0 3 392.272 3.394 10 0 GGAEHN CN(C)[C@H]1CCCN(C(=O)N[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000591573535 567287195 /nfs/dbraw/zinc/28/71/95/567287195.db2.gz WMHUJHHAALSHFP-DZGCQCFKSA-N 0 3 382.302 3.008 10 0 GGAEHN CN(C)[C@@H](CNC(=O)c1cc(Br)cc2nc[nH]c21)c1cccs1 ZINC000499950622 567287265 /nfs/dbraw/zinc/28/72/65/567287265.db2.gz QZCVFMXFMPJIHT-ZDUSSCGKSA-N 0 3 393.310 3.420 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)N1CCO[C@](C)(C(F)F)C1)c1ccsc1 ZINC000660340748 567288404 /nfs/dbraw/zinc/28/84/04/567288404.db2.gz YFBXANASXMHRPE-YOEHRIQHSA-N 0 3 375.485 3.197 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)N1CCO[C@](C)(C(F)F)C1)c1ccsc1 ZINC000660340743 567289066 /nfs/dbraw/zinc/28/90/66/567289066.db2.gz YFBXANASXMHRPE-PBHICJAKSA-N 0 3 375.485 3.197 10 0 GGAEHN COc1cc(C[NH2+]C[C@@]2(CO)C[C@H]2c2ccccc2)cc(Br)c1[O-] ZINC000685627263 567289442 /nfs/dbraw/zinc/28/94/42/567289442.db2.gz UVJBRVONFKAQBA-HNAYVOBHSA-N 0 3 392.293 3.419 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)Cc1ccc(F)c(Br)c1 ZINC000567927137 567289643 /nfs/dbraw/zinc/28/96/43/567289643.db2.gz VOIVIXGABNDOBZ-KRWDZBQOSA-N 0 3 377.257 3.215 10 0 GGAEHN CC(C)[C@@H](N[C@H](C)C(=O)NC(=O)NCC(F)(F)F)c1ccc(Cl)cc1 ZINC000567933049 567291534 /nfs/dbraw/zinc/29/15/34/567291534.db2.gz GFFZKTAOIJPAER-ZWNOBZJWSA-N 0 3 379.810 3.403 10 0 GGAEHN CN(C)CCn1nccc1NC(=O)N[C@@H]1COc2c1ccc(Cl)c2Cl ZINC000455656339 567292525 /nfs/dbraw/zinc/29/25/25/567292525.db2.gz KJAHSIRZRKSSBK-GFCCVEGCSA-N 0 3 384.267 3.007 10 0 GGAEHN C[S@](=O)c1ccc(CNC[C@H](O)COc2c(Cl)cccc2Cl)cc1 ZINC000591749743 567295129 /nfs/dbraw/zinc/29/51/29/567295129.db2.gz JKPZFTXMHYEXTB-RZFZLAGVSA-N 0 3 388.316 3.260 10 0 GGAEHN C[S@@](=O)c1ccc(CNC[C@H](O)COc2c(Cl)cccc2Cl)cc1 ZINC000591749742 567295136 /nfs/dbraw/zinc/29/51/36/567295136.db2.gz JKPZFTXMHYEXTB-RKNYENMMSA-N 0 3 388.316 3.260 10 0 GGAEHN C[S@@](=O)c1ccc(CNC[C@@H](O)COc2c(Cl)cccc2Cl)cc1 ZINC000591749744 567295539 /nfs/dbraw/zinc/29/55/39/567295539.db2.gz JKPZFTXMHYEXTB-YEBMWUKDSA-N 0 3 388.316 3.260 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)c1cc(F)cc(Br)c1 ZINC000617291082 567297613 /nfs/dbraw/zinc/29/76/13/567297613.db2.gz SFRWBQCABVGFHY-KRWDZBQOSA-N 0 3 379.273 3.491 10 0 GGAEHN COc1ccc(C(=O)N[C@H](Cc2ccccc2)CN(C)C)cc1Br ZINC000617289898 567298071 /nfs/dbraw/zinc/29/80/71/567298071.db2.gz MOWYVWGIPMNTDY-MRXNPFEDSA-N 0 3 391.309 3.360 10 0 GGAEHN CC(=O)c1nc(CCN[C@@H]2CCOc3c(Br)cccc32)[nH]c1C ZINC000660479160 567299998 /nfs/dbraw/zinc/29/99/98/567299998.db2.gz FRPJVRZRMIZYNT-CQSZACIVSA-N 0 3 378.270 3.339 10 0 GGAEHN CC(=O)c1[nH]c(CCN[C@@H]2CCOc3c(Br)cccc32)nc1C ZINC000660479160 567300006 /nfs/dbraw/zinc/30/00/06/567300006.db2.gz FRPJVRZRMIZYNT-CQSZACIVSA-N 0 3 378.270 3.339 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1c(C)ccc(F)c1Br ZINC000455744288 567300469 /nfs/dbraw/zinc/30/04/69/567300469.db2.gz FEJTZNZRSWWINK-LBPRGKRZSA-N 0 3 388.281 3.129 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)CCNc1ncc(C(F)(F)F)cc1Cl ZINC000476170320 567302073 /nfs/dbraw/zinc/30/20/73/567302073.db2.gz QWQJEAWDUATBGA-LBPRGKRZSA-N 0 3 378.826 3.108 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N1CCC(Nc2cccc(Br)c2)CC1 ZINC000434269347 567302333 /nfs/dbraw/zinc/30/23/33/567302333.db2.gz ZVCYZSPZCLWLRH-KRWDZBQOSA-N 0 3 395.345 3.129 10 0 GGAEHN CCO[C@@H]1C[C@@H](NC(=O)NC[C@H](c2ccsc2)N(CC)CC)[C@@H]1SC ZINC000591903582 567303544 /nfs/dbraw/zinc/30/35/44/567303544.db2.gz PTWRGPNCUDOKNS-VQHPVUNQSA-N 0 3 385.599 3.339 10 0 GGAEHN COc1ccc(Br)cc1CNC(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000660514622 567304598 /nfs/dbraw/zinc/30/45/98/567304598.db2.gz NUVLAWWZBCIAJK-AWEZNQCLSA-N 0 3 384.318 3.130 10 0 GGAEHN COc1ccc(Br)cc1CNC(=O)NC[C@H]1CCN1C(C)(C)C ZINC000660514623 567304845 /nfs/dbraw/zinc/30/48/45/567304845.db2.gz NUVLAWWZBCIAJK-CQSZACIVSA-N 0 3 384.318 3.130 10 0 GGAEHN Cc1ncc(Br)cc1NC(=O)N[C@H](Cc1ccccc1)CN(C)C ZINC000455792346 567305268 /nfs/dbraw/zinc/30/52/68/567305268.db2.gz CZLFPTXSOPFAEP-MRXNPFEDSA-N 0 3 391.313 3.447 10 0 GGAEHN CS[C@@H]1CN(c2nc(-c3cc(F)cc(F)c3)ns2)C[C@@H]1N1CCCC1 ZINC000591931950 567305275 /nfs/dbraw/zinc/30/52/75/567305275.db2.gz ICKRXMOOSKVVPN-LSDHHAIUSA-N 0 3 382.505 3.499 10 0 GGAEHN CN1CCC[C@@H](NC(=O)COc2ccc3ccccc3c2Br)C1 ZINC000617414312 567305787 /nfs/dbraw/zinc/30/57/87/567305787.db2.gz FQMJAEZYRSFEBW-CQSZACIVSA-N 0 3 377.282 3.192 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)c2cc(F)c(Br)cc2Cl)CCSC1 ZINC000476238884 567307811 /nfs/dbraw/zinc/30/78/11/567307811.db2.gz ZQQBEHRZDXIXJS-CQSZACIVSA-N 0 3 395.725 3.409 10 0 GGAEHN CN1CCC[C@@H](NC(=O)COc2ccc3cc(Br)ccc3c2)C1 ZINC000617416020 567307862 /nfs/dbraw/zinc/30/78/62/567307862.db2.gz YPWIAIPWRAWSJA-MRXNPFEDSA-N 0 3 377.282 3.192 10 0 GGAEHN O=C(NCC1(N2CCSCC2)CCCC1)N1CC[C@@H](CC(F)(F)F)C1 ZINC000434481390 567309972 /nfs/dbraw/zinc/30/99/72/567309972.db2.gz POTPPOHMJWEYFS-AWEZNQCLSA-N 0 3 379.492 3.332 10 0 GGAEHN Cn1cc([C@H](NCCOc2cccc(Br)c2)C2(CO)CCC2)cn1 ZINC000660605490 567311610 /nfs/dbraw/zinc/31/16/10/567311610.db2.gz UOJMAWWPJLPJIN-KRWDZBQOSA-N 0 3 394.313 3.055 10 0 GGAEHN CSC1(CNS(=O)(=O)c2cc3cccc(C)c3s2)CCN(C)CC1 ZINC000592052452 567311617 /nfs/dbraw/zinc/31/16/17/567311617.db2.gz MATGBBKLOZXBMQ-UHFFFAOYSA-N 0 3 384.592 3.315 10 0 GGAEHN Brc1ccc([C@@H](Cc2ccccn2)NC[C@H]2CCc3ncnn32)cc1 ZINC000639610482 567313146 /nfs/dbraw/zinc/31/31/46/567313146.db2.gz WLMXLRAQAXTFHT-QZTJIDSGSA-N 0 3 398.308 3.497 10 0 GGAEHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1cc(F)c(Br)cc1Cl ZINC000476303079 567313355 /nfs/dbraw/zinc/31/33/55/567313355.db2.gz DZJVVWJBFWVZEL-CLAHSXSESA-N 0 3 375.669 3.454 10 0 GGAEHN Brc1cccc(OC2CCN(C[C@H]3CCc4ncnn43)CC2)c1 ZINC000639585652 567313623 /nfs/dbraw/zinc/31/36/23/567313623.db2.gz OIDVDLFMNOCDEM-CQSZACIVSA-N 0 3 377.286 3.071 10 0 GGAEHN O[C@@H](COc1ccc(Br)cc1)CN1CCC[C@H](c2ccccn2)C1 ZINC000660628390 567313665 /nfs/dbraw/zinc/31/36/65/567313665.db2.gz LRMGTOKFSIRHGV-DOTOQJQBSA-N 0 3 391.309 3.463 10 0 GGAEHN Brc1ccc([C@@H](Cc2ccccn2)NC[C@@H]2CCc3ncnn32)cc1 ZINC000639610484 567313727 /nfs/dbraw/zinc/31/37/27/567313727.db2.gz WLMXLRAQAXTFHT-ZWKOTPCHSA-N 0 3 398.308 3.497 10 0 GGAEHN CCOC(=O)CC1(NCC(=O)Nc2ccccc2Br)CCCC1 ZINC000434620047 567315281 /nfs/dbraw/zinc/31/52/81/567315281.db2.gz HUDUTUBNBUTYOH-UHFFFAOYSA-N 0 3 383.286 3.243 10 0 GGAEHN O[C@@H](CNCC1(c2ccc(Br)cc2)CCOCC1)C(F)(F)F ZINC000568254696 567315350 /nfs/dbraw/zinc/31/53/50/567315350.db2.gz JCMGAGSRVZVBQD-ZDUSSCGKSA-N 0 3 382.220 3.010 10 0 GGAEHN CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)N(C)Cc2c(F)cccc2Cl)[C@@H]1SC ZINC000592165937 567318749 /nfs/dbraw/zinc/31/87/49/567318749.db2.gz CGQBUYSJUOFNSP-AHBIMHKDSA-N 0 3 388.936 3.325 10 0 GGAEHN CCN(C(=O)Cc1c(C)[nH]c2ccc(Br)cc21)[C@@H]1CCN(C)C1 ZINC000617556925 567321344 /nfs/dbraw/zinc/32/13/44/567321344.db2.gz ABUIHHAWRMXSED-CQSZACIVSA-N 0 3 378.314 3.334 10 0 GGAEHN COc1ccc(CNC[C@@H]2CS(=O)(=O)c3ccccc32)cc1Br ZINC000568355058 567321356 /nfs/dbraw/zinc/32/13/56/567321356.db2.gz HSNVYSREHXCUCG-CYBMUJFWSA-N 0 3 396.306 3.118 10 0 GGAEHN CCN(C(=O)c1cnn(-c2ccc(Br)cc2)c1C)[C@@H]1CCN(C)C1 ZINC000617559147 567321414 /nfs/dbraw/zinc/32/14/14/567321414.db2.gz UPDCMJIBZZRYHM-MRXNPFEDSA-N 0 3 391.313 3.109 10 0 GGAEHN CCN(C(=O)COc1ccc(Br)cc1Cl)[C@H]1CCN(C)C1 ZINC000617559894 567322208 /nfs/dbraw/zinc/32/22/08/567322208.db2.gz BPFBEXJEYCDNAB-LBPRGKRZSA-N 0 3 375.694 3.034 10 0 GGAEHN CCN(C(=O)c1cnn(-c2cccc(Br)c2)c1C)[C@H]1CCN(C)C1 ZINC000617556422 567322322 /nfs/dbraw/zinc/32/23/22/567322322.db2.gz PYWJMDUACNEFMV-INIZCTEOSA-N 0 3 391.313 3.109 10 0 GGAEHN CN1CC(=O)N(CCNC2(c3ccccc3Br)CCCCC2)C1=O ZINC000660737634 567324506 /nfs/dbraw/zinc/32/45/06/567324506.db2.gz HHNDBILROSOQAM-UHFFFAOYSA-N 0 3 394.313 3.092 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@H]1N(C)C ZINC000476456832 567324704 /nfs/dbraw/zinc/32/47/04/567324704.db2.gz JCTBFTPRLKYAEU-OLZOCXBDSA-N 0 3 395.725 3.359 10 0 GGAEHN OC[C@H](NC[C@H](O)Cc1cccc(Cl)c1)c1cccc(Br)c1 ZINC000568427349 567328934 /nfs/dbraw/zinc/32/89/34/567328934.db2.gz QWGYAEBLPOQVFI-SJORKVTESA-N 0 3 384.701 3.329 10 0 GGAEHN CN(CCNC(=O)N[C@@H]1CSCc2ccc(Br)cc21)C1CC1 ZINC000660839085 567329200 /nfs/dbraw/zinc/32/92/00/567329200.db2.gz MLHLDQZWDBEPTO-OAHLLOKOSA-N 0 3 384.343 3.130 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1ccc(Cl)c(Cl)c1 ZINC000617696081 567329434 /nfs/dbraw/zinc/32/94/34/567329434.db2.gz BDHZOJRZNPKOPV-MRXNPFEDSA-N 0 3 379.287 3.490 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)c1ccsc1Br ZINC000617696840 567329722 /nfs/dbraw/zinc/32/97/22/567329722.db2.gz PMQGNYPCQHYJOG-AWEZNQCLSA-N 0 3 395.322 3.007 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)c1cc(Cl)ccc1Cl ZINC000617696370 567329864 /nfs/dbraw/zinc/32/98/64/567329864.db2.gz HVLINMAEQGZEFY-INIZCTEOSA-N 0 3 379.287 3.490 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)c1cccc(Cl)c1Cl ZINC000617696579 567330099 /nfs/dbraw/zinc/33/00/99/567330099.db2.gz MBUADDJSXBIWEI-HNNXBMFYSA-N 0 3 379.287 3.490 10 0 GGAEHN CN1CCC[C@@H](CNC(=O)NCC2(Cc3ccc(Br)cc3)CC2)C1 ZINC000660848058 567330420 /nfs/dbraw/zinc/33/04/20/567330420.db2.gz UPJPOIHCAPLCKF-INIZCTEOSA-N 0 3 394.357 3.413 10 0 GGAEHN Cc1nccc(NC(=O)N2CCN(CC3CCCCC3)CC2)c1Br ZINC000527336736 567330570 /nfs/dbraw/zinc/33/05/70/567330570.db2.gz QEZZQDOJGOPEDF-UHFFFAOYSA-N 0 3 395.345 3.304 10 0 GGAEHN CNC(=O)Cc1nc(CS[C@H]2CCCN(Cc3ccccc3)C2)cs1 ZINC000592354512 567332469 /nfs/dbraw/zinc/33/24/69/567332469.db2.gz JERGKNTVGVLPLB-KRWDZBQOSA-N 0 3 375.563 3.329 10 0 GGAEHN CCO[C@@H]1C[C@@H](NCc2cnc3c(C)cc(Br)cn23)[C@@H]1SC ZINC000592377489 567334041 /nfs/dbraw/zinc/33/40/41/567334041.db2.gz YOYGHRCLKBGJNM-KFWWJZLASA-N 0 3 384.343 3.404 10 0 GGAEHN CCO[C@@H]1C[C@@H](N[C@H](c2ccc(Cl)cc2)[C@@H]2CN(C)CCO2)[C@@H]1SC ZINC000592394616 567335382 /nfs/dbraw/zinc/33/53/82/567335382.db2.gz JYMJVMNOMSOUAP-FQBWVUSXSA-N 0 3 384.973 3.210 10 0 GGAEHN CC[C@@H](NCc1cc(OC)c(O)cc1Br)C1(C(=O)OC)CCC1 ZINC000592399592 567335593 /nfs/dbraw/zinc/33/55/93/567335593.db2.gz NSEIGDFWMOAGBU-OAHLLOKOSA-N 0 3 386.286 3.375 10 0 GGAEHN CCN(CC)CCN(Cc1cccs1)S(=O)(=O)c1nc(C)c(C)s1 ZINC000434956079 567336609 /nfs/dbraw/zinc/33/66/09/567336609.db2.gz VHBJJDAKBOQLHS-UHFFFAOYSA-N 0 3 387.596 3.354 10 0 GGAEHN CCCCN(C)CCNC(=O)c1cc(I)c(F)cc1F ZINC000435011755 567337768 /nfs/dbraw/zinc/33/77/68/567337768.db2.gz DKHRCYARGHBXJF-UHFFFAOYSA-N 0 3 396.219 3.031 10 0 GGAEHN OC[C@@H]1CN(CCc2nc(-c3cccc(Cl)c3)no2)C[C@H]1C(F)(F)F ZINC000640042052 567339231 /nfs/dbraw/zinc/33/92/31/567339231.db2.gz LMUZWMLQXNTFJK-WCQYABFASA-N 0 3 375.778 3.035 10 0 GGAEHN C[C@H](NC(=O)N1CCOc2cc(Br)ccc2C1)C1=CCN(C)CC1 ZINC000661009339 567339852 /nfs/dbraw/zinc/33/98/52/567339852.db2.gz HQYIQODRQDVRQP-ZDUSSCGKSA-N 0 3 394.313 3.004 10 0 GGAEHN C[C@H](CNC(=O)N1CCc2ccc(F)c(Br)c2C1)N(C)C1CC1 ZINC000527592896 567344498 /nfs/dbraw/zinc/34/44/98/567344498.db2.gz DZZYHGYKNYUDKW-LLVKDONJSA-N 0 3 384.293 3.139 10 0 GGAEHN C[C@@H](CNC(=O)N1CCc2ccc(F)c(Br)c2C1)N(C)C1CC1 ZINC000527592897 567344524 /nfs/dbraw/zinc/34/45/24/567344524.db2.gz DZZYHGYKNYUDKW-NSHDSACASA-N 0 3 384.293 3.139 10 0 GGAEHN O=C(NC1CCN(C2CC2)CC1)N1CCc2ccc(F)c(Br)c2C1 ZINC000527590922 567344619 /nfs/dbraw/zinc/34/46/19/567344619.db2.gz IDJUBMMAJSFQPS-UHFFFAOYSA-N 0 3 396.304 3.283 10 0 GGAEHN COC(=O)CC[C@H](N)C(=O)NC1(c2cccc(Br)c2)CCCCC1 ZINC000592539332 567344828 /nfs/dbraw/zinc/34/48/28/567344828.db2.gz MAHHXWKWBOUVGO-HNNXBMFYSA-N 0 3 397.313 3.005 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000435173444 567344955 /nfs/dbraw/zinc/34/49/55/567344955.db2.gz LPEVADKHEAZHCN-NEPJUHHUSA-N 0 3 376.448 3.145 10 0 GGAEHN N[C@@H](CNC(=O)N1CCc2ccc(F)c(Br)c2C1)c1ccccc1 ZINC000527593000 567344971 /nfs/dbraw/zinc/34/49/71/567344971.db2.gz DDKRVZLMTYDQOK-INIZCTEOSA-N 0 3 392.272 3.356 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000548729256 567345372 /nfs/dbraw/zinc/34/53/72/567345372.db2.gz MQHLQZVQPBCHIY-MRXNPFEDSA-N 0 3 381.314 3.174 10 0 GGAEHN CCN(C(=O)c1cc(=O)[nH]c2ccc(Br)cc21)[C@H]1CCN(CC)C1 ZINC000617927993 567346007 /nfs/dbraw/zinc/34/60/07/567346007.db2.gz HLVNRCZFWXQHEN-ZDUSSCGKSA-N 0 3 392.297 3.259 10 0 GGAEHN CCN(C(=O)CSc1ncnc2sc(C)c(C)c21)[C@H]1CCN(CC)C1 ZINC000617933690 567346192 /nfs/dbraw/zinc/34/61/92/567346192.db2.gz WTXMVSYYYDBEIO-AWEZNQCLSA-N 0 3 378.567 3.343 10 0 GGAEHN CCN(C(=O)[C@@H](C)NC(=O)c1cccc(Cl)c1Cl)[C@H]1CCN(CC)C1 ZINC000617930680 567346651 /nfs/dbraw/zinc/34/66/51/567346651.db2.gz GEMQGZUQZCWKPK-OLZOCXBDSA-N 0 3 386.323 3.054 10 0 GGAEHN C[C@H]1C[C@H](NC(=O)N2CCc3ccc(F)c(Br)c3C2)CCN1C ZINC000527594686 567346833 /nfs/dbraw/zinc/34/68/33/567346833.db2.gz QCZIGYCIUIUCOR-WCQYABFASA-N 0 3 384.293 3.139 10 0 GGAEHN CCN(C(=O)Cc1c[nH]c2cc(Br)ccc12)[C@@H]1CCN(CC)C1 ZINC000617927258 567347075 /nfs/dbraw/zinc/34/70/75/567347075.db2.gz UFSLEEFWVUQPTL-OAHLLOKOSA-N 0 3 378.314 3.416 10 0 GGAEHN CCN(C(=O)[C@@H]1CCOc2ccc(Br)cc21)[C@H]1CCN(CC)C1 ZINC000617922951 567347147 /nfs/dbraw/zinc/34/71/47/567347147.db2.gz WBCLDPQNCFAARB-LSDHHAIUSA-N 0 3 381.314 3.258 10 0 GGAEHN CCN(C(=O)[C@H](C)NC(=O)c1cccc(Cl)c1Cl)[C@H]1CCN(CC)C1 ZINC000617930682 567347158 /nfs/dbraw/zinc/34/71/58/567347158.db2.gz GEMQGZUQZCWKPK-STQMWFEESA-N 0 3 386.323 3.054 10 0 GGAEHN CCN(C(=O)Cc1c[nH]c2cc(Br)ccc12)[C@H]1CCN(CC)C1 ZINC000617927257 567347207 /nfs/dbraw/zinc/34/72/07/567347207.db2.gz UFSLEEFWVUQPTL-HNNXBMFYSA-N 0 3 378.314 3.416 10 0 GGAEHN Cc1nc(-c2ccc(CCNC(=O)N3CCN4CCC3CC4)s2)cs1 ZINC000476787501 567349278 /nfs/dbraw/zinc/34/92/78/567349278.db2.gz GIFMSJZOLLRPPG-UHFFFAOYSA-N 0 3 376.551 3.212 10 0 GGAEHN CN(C(=O)NCCc1cc(Br)ccc1F)[C@@H]1CCN(C2CC2)C1 ZINC000476787389 567349516 /nfs/dbraw/zinc/34/95/16/567349516.db2.gz FQVKCPFSWVXHAY-OAHLLOKOSA-N 0 3 384.293 3.009 10 0 GGAEHN CCO[C@@H]1C[C@](N)(C(=O)N2CCc3ccc(F)c(Br)c3C2)C1(C)C ZINC000527617848 567350590 /nfs/dbraw/zinc/35/05/90/567350590.db2.gz RTISXANZGHQWDT-KDOFPFPSSA-N 0 3 399.304 3.005 10 0 GGAEHN O=C(CCCN1CC[C@H](Cn2ccnn2)C1)c1ccc(Br)cc1 ZINC000661138960 567351603 /nfs/dbraw/zinc/35/16/03/567351603.db2.gz FXSGATUOWYSHMW-AWEZNQCLSA-N 0 3 377.286 3.026 10 0 GGAEHN CC(C)Oc1cc(Cl)c(CNCC2(C(N)=O)CCOCC2)cc1Cl ZINC000527638139 567355095 /nfs/dbraw/zinc/35/50/95/567355095.db2.gz SFSCEQNVWHKWMB-UHFFFAOYSA-N 0 3 375.296 3.152 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)NCc1cc(F)c(Br)cc1F ZINC000527653968 567356726 /nfs/dbraw/zinc/35/67/26/567356726.db2.gz XYAZTMOGWSTNDY-LLVKDONJSA-N 0 3 376.245 3.011 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)NCc1cc(F)c(Br)cc1F ZINC000527653972 567356840 /nfs/dbraw/zinc/35/68/40/567356840.db2.gz XYAZTMOGWSTNDY-NSHDSACASA-N 0 3 376.245 3.011 10 0 GGAEHN CN(CCC(=O)N[C@@H]1CCOc2c(Br)cccc21)c1ccncc1 ZINC000548874962 567357049 /nfs/dbraw/zinc/35/70/49/567357049.db2.gz VIFSECLZSXFRBW-MRXNPFEDSA-N 0 3 390.281 3.310 10 0 GGAEHN OC[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NCc1ccsc1Br ZINC000527663896 567357784 /nfs/dbraw/zinc/35/77/84/567357784.db2.gz GJJCHRSACDWWNO-IRXDYDNUSA-N 0 3 395.366 3.483 10 0 GGAEHN OC[C@@H]1CN(Cc2ccccc2)CC[C@H]1NCc1ccsc1Br ZINC000527663894 567357907 /nfs/dbraw/zinc/35/79/07/567357907.db2.gz GJJCHRSACDWWNO-DLBZAZTESA-N 0 3 395.366 3.483 10 0 GGAEHN OC[C@H]1CCN(Cc2ccccc2)C[C@@H]1NCc1ccsc1Br ZINC000527667563 567357930 /nfs/dbraw/zinc/35/79/30/567357930.db2.gz XTFVINVMEVAVNL-SJORKVTESA-N 0 3 395.366 3.483 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)c1cc[nH]c(=O)c1Br)c1ccccc1 ZINC000435342472 567358167 /nfs/dbraw/zinc/35/81/67/567358167.db2.gz HGFNHBSKBSVKPD-HNNXBMFYSA-N 0 3 392.297 3.363 10 0 GGAEHN COc1ccc(Br)c(CNC(=O)NC[C@@H]2CCN2C2CCCC2)c1 ZINC000527668504 567358399 /nfs/dbraw/zinc/35/83/99/567358399.db2.gz GWUQLOZHUJVMBX-HNNXBMFYSA-N 0 3 396.329 3.274 10 0 GGAEHN O[C@@]1(CNCc2ccsc2Br)CCN(Cc2ccccc2)C1 ZINC000527665802 567358712 /nfs/dbraw/zinc/35/87/12/567358712.db2.gz QAHQVFSBAWOTCB-QGZVFWFLSA-N 0 3 381.339 3.237 10 0 GGAEHN CS(=O)(=O)N1CC[C@@H](CNC2(c3c(Cl)cccc3Cl)CCC2)C1 ZINC000548931604 567361684 /nfs/dbraw/zinc/36/16/84/567361684.db2.gz SARJSZBNRQCEMW-LBPRGKRZSA-N 0 3 377.337 3.244 10 0 GGAEHN Cc1cc(Br)c(CNC[C@@]2(O)CCO[C@H]2C)cc1Br ZINC000527698914 567363456 /nfs/dbraw/zinc/36/34/56/567363456.db2.gz ATECWAIBWDTDGI-HZMBPMFUSA-N 0 3 393.119 3.150 10 0 GGAEHN CC(C)(C)S(=O)(=O)N1CCC(NCc2ccsc2Br)CC1 ZINC000527699007 567364832 /nfs/dbraw/zinc/36/48/32/567364832.db2.gz FHZWAMSSSKROGY-UHFFFAOYSA-N 0 3 395.388 3.193 10 0 GGAEHN O=C1c2ccccc2C(=O)N1CCCNCc1ccsc1Br ZINC000527708719 567366924 /nfs/dbraw/zinc/36/69/24/567366924.db2.gz NOFBOZSCRLSMJR-UHFFFAOYSA-N 0 3 379.279 3.287 10 0 GGAEHN CCCN(C(=O)c1cc(C)ccc1I)[C@@H]1CCN(C)C1 ZINC000592830942 567368317 /nfs/dbraw/zinc/36/83/17/567368317.db2.gz ISCYGGYGYALADI-CYBMUJFWSA-N 0 3 386.277 3.156 10 0 GGAEHN CCCN(C(=O)c1cc(C)ccc1I)[C@H]1CCN(C)C1 ZINC000592830943 567368521 /nfs/dbraw/zinc/36/85/21/567368521.db2.gz ISCYGGYGYALADI-ZDUSSCGKSA-N 0 3 386.277 3.156 10 0 GGAEHN O=C(CN1CCc2ccc(Cl)c(Cl)c2C1)NC1CCN(C2CC2)CC1 ZINC000661373942 567369173 /nfs/dbraw/zinc/36/91/73/567369173.db2.gz OZVADXNRTQQQKA-UHFFFAOYSA-N 0 3 382.335 3.095 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000661397949 567371616 /nfs/dbraw/zinc/37/16/16/567371616.db2.gz GKSAXUFFGJKLMX-JTQLQIEISA-N 0 3 375.357 3.386 10 0 GGAEHN O[C@@H](CNCc1cnc(-c2ccc(Br)cc2)s1)[C@@H]1CCCO1 ZINC000527757252 567371808 /nfs/dbraw/zinc/37/18/08/567371808.db2.gz IUYMRJKHGJZZOB-GJZGRUSLSA-N 0 3 383.311 3.202 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)N[C@H](C)Cc1ccc(Cl)cc1Cl ZINC000477130960 567372232 /nfs/dbraw/zinc/37/22/32/567372232.db2.gz BNSIRBRUAJQUTO-CZUORRHYSA-N 0 3 388.339 3.334 10 0 GGAEHN CS[C@H]1CN(S(=O)(=O)c2cccc3ccccc32)C[C@H]1N1CCCC1 ZINC000477129644 567372539 /nfs/dbraw/zinc/37/25/39/567372539.db2.gz WXQXZFSHWBRBCN-MSOLQXFVSA-N 0 3 376.547 3.040 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)N[C@H](c1cncc(Br)c1)C1CC1 ZINC000661404764 567372661 /nfs/dbraw/zinc/37/26/61/567372661.db2.gz QYBQEXWDXHSIGI-HOTGVXAUSA-N 0 3 395.345 3.467 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)N[C@H](c1cncc(Br)c1)C1CC1 ZINC000661404763 567372817 /nfs/dbraw/zinc/37/28/17/567372817.db2.gz QYBQEXWDXHSIGI-CVEARBPZSA-N 0 3 395.345 3.467 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)N[C@H](C)Cc1ccc(Cl)cc1Cl ZINC000477130959 567372862 /nfs/dbraw/zinc/37/28/62/567372862.db2.gz BNSIRBRUAJQUTO-CJNGLKHVSA-N 0 3 388.339 3.334 10 0 GGAEHN CCN(CC)CCN(C(=O)Cc1ccnn1C)c1cccc(Br)c1 ZINC000435499459 567372894 /nfs/dbraw/zinc/37/28/94/567372894.db2.gz FVMDRXBVCPFCMB-UHFFFAOYSA-N 0 3 393.329 3.100 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)NCC(=O)Nc1cc(Cl)ccc1Cl ZINC000661398931 567373200 /nfs/dbraw/zinc/37/32/00/567373200.db2.gz WWDQBNJLHLYEQT-LBPRGKRZSA-N 0 3 387.311 3.104 10 0 GGAEHN COc1ccc(CNC[C@H]2c3ccccc3C(=O)N2C)cc1Br ZINC000527804949 567374632 /nfs/dbraw/zinc/37/46/32/567374632.db2.gz HBCRJEBQXCLSSD-INIZCTEOSA-N 0 3 375.266 3.374 10 0 GGAEHN COc1ccc(CCNCc2cc(OC)c(OC)cc2Br)cn1 ZINC000527793688 567374660 /nfs/dbraw/zinc/37/46/60/567374660.db2.gz MVWKQJVIBCHAGI-UHFFFAOYSA-N 0 3 381.270 3.202 10 0 GGAEHN C[C@@H](NC(=O)NC[C@@H]1CCCN1C)c1cc(F)c(Br)cc1F ZINC000527799628 567374677 /nfs/dbraw/zinc/37/46/77/567374677.db2.gz YBWQPMWNTNWWDF-ZJUUUORDSA-N 0 3 376.245 3.182 10 0 GGAEHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)NCc1cc(F)c(Br)cc1F ZINC000527820517 567376213 /nfs/dbraw/zinc/37/62/13/567376213.db2.gz LXIQKSXXSPPLMW-RFAUZJTJSA-N 0 3 388.256 3.009 10 0 GGAEHN CC(C)(CNCc1cccc(I)c1)C(=O)N1CCCC1 ZINC000527810675 567376875 /nfs/dbraw/zinc/37/68/75/567376875.db2.gz HLPAVNIPULLFBT-UHFFFAOYSA-N 0 3 386.277 3.029 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)NCc2ccc(Br)c(F)c2F)CN1C1CC1 ZINC000527814331 567377059 /nfs/dbraw/zinc/37/70/59/567377059.db2.gz SWAZBYGVLHIFRY-KOLCDFICSA-N 0 3 388.256 3.152 10 0 GGAEHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)NCc1cc(F)c(Br)cc1F ZINC000527820515 567377153 /nfs/dbraw/zinc/37/71/53/567377153.db2.gz LXIQKSXXSPPLMW-BJOHPYRUSA-N 0 3 388.256 3.009 10 0 GGAEHN CCN(Cc1cccc(Br)c1)C(=O)NC[C@H]1CCCN1CCOC ZINC000477185001 567378942 /nfs/dbraw/zinc/37/89/42/567378942.db2.gz GWLHTPUZMFPHGO-QGZVFWFLSA-N 0 3 398.345 3.091 10 0 GGAEHN C[C@@H](NC(=O)NC[C@@H]1CCN1C1CCCC1)c1ccc(Br)cn1 ZINC000527893881 567381660 /nfs/dbraw/zinc/38/16/60/567381660.db2.gz LBLCOTCFAXVTFG-DOMZBBRYSA-N 0 3 381.318 3.221 10 0 GGAEHN C[C@H](NC[C@@H]1CCCCN1CCO)c1cc(F)c(Br)cc1F ZINC000527900650 567383169 /nfs/dbraw/zinc/38/31/69/567383169.db2.gz DLAOACBYFUTWLM-RYUDHWBXSA-N 0 3 377.273 3.225 10 0 GGAEHN C[C@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CCC[C@](O)(C2CC2)C1 ZINC000661630871 567383570 /nfs/dbraw/zinc/38/35/70/567383570.db2.gz CYTFBSPBPZJZSJ-AUUYWEPGSA-N 0 3 395.341 3.033 10 0 GGAEHN Cc1cc(N2CCC[C@@H](N3C[C@@H](C)[C@H](O)[C@@H](C)C3)C2=O)ccc1Br ZINC000661629525 567384072 /nfs/dbraw/zinc/38/40/72/567384072.db2.gz XQUKMOAIRSGGHH-NONVJHHQSA-N 0 3 395.341 3.202 10 0 GGAEHN C[C@@H](Cc1cnccn1)NCc1ccc(I)cc1Cl ZINC000501378545 567384210 /nfs/dbraw/zinc/38/42/10/567384210.db2.gz RBJWKMJJKJONKO-JTQLQIEISA-N 0 3 387.652 3.455 10 0 GGAEHN Cc1cc(N2CCC[C@H](N3C[C@H](C)C(O)[C@@H](C)C3)C2=O)ccc1Br ZINC000661629754 567384383 /nfs/dbraw/zinc/38/43/83/567384383.db2.gz XQUKMOAIRSGGHH-ZQIUZPCESA-N 0 3 395.341 3.202 10 0 GGAEHN CN1CCC2(CC1)C[C@H](NC(=O)[C@H]1C[C@@]1(C)Br)c1ccccc1O2 ZINC000527928958 567384612 /nfs/dbraw/zinc/38/46/12/567384612.db2.gz FBTGWCCJQKFXNZ-RVKKMQEKSA-N 0 3 393.325 3.264 10 0 GGAEHN O=S1(=O)CC[C@@H](NCC[C@H]2CCCOC2)c2cc(Br)ccc21 ZINC000527928152 567384689 /nfs/dbraw/zinc/38/46/89/567384689.db2.gz NFKAJOMWIDSGPV-IUODEOHRSA-N 0 3 388.327 3.074 10 0 GGAEHN O=S1(=O)CC[C@H](NCC[C@H]2CCCOC2)c2cc(Br)ccc21 ZINC000527928150 567385011 /nfs/dbraw/zinc/38/50/11/567385011.db2.gz NFKAJOMWIDSGPV-DOMZBBRYSA-N 0 3 388.327 3.074 10 0 GGAEHN C[C@@H](NCC[C@H]1CCCOC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000527924736 567385148 /nfs/dbraw/zinc/38/51/48/567385148.db2.gz HMTRJLTZTKTREG-GHMZBOCLSA-N 0 3 381.325 3.108 10 0 GGAEHN C[C@H]1C[C@H](C)C[NH+](CCCNC(=O)Cc2ccc(Br)cc2[O-])C1 ZINC000477279234 567385318 /nfs/dbraw/zinc/38/53/18/567385318.db2.gz HOGAWBDWGMTVKK-KBPBESRZSA-N 0 3 383.330 3.181 10 0 GGAEHN O=S1(=O)CC[C@H](NCC[C@@H]2CCCOC2)c2cc(Br)ccc21 ZINC000527928155 567385381 /nfs/dbraw/zinc/38/53/81/567385381.db2.gz NFKAJOMWIDSGPV-WFASDCNBSA-N 0 3 388.327 3.074 10 0 GGAEHN C[C@@H](NC(=O)NC[C@@H]1CCN1C1CCCCC1)c1ncc(Br)cn1 ZINC000527966935 567386414 /nfs/dbraw/zinc/38/64/14/567386414.db2.gz OMCLTJZIXBUPPV-DOMZBBRYSA-N 0 3 396.333 3.006 10 0 GGAEHN C[C@@H](NCc1ccc(Br)c(F)c1F)C1CCS(=O)(=O)CC1 ZINC000527983410 567387624 /nfs/dbraw/zinc/38/76/24/567387624.db2.gz DDRVFDOAZUDPIX-SECBINFHSA-N 0 3 382.270 3.030 10 0 GGAEHN Fc1cc(CNC2CCN(c3cnccn3)CC2)c(F)cc1Br ZINC000527983329 567387635 /nfs/dbraw/zinc/38/76/35/567387635.db2.gz UXPZDRUCFOZCEN-UHFFFAOYSA-N 0 3 383.240 3.276 10 0 GGAEHN CC(=O)N1CCC(NCc2ccc(I)cc2Cl)CC1 ZINC000501455773 567389797 /nfs/dbraw/zinc/38/97/97/567389797.db2.gz RTSPIYPBXBBXJP-UHFFFAOYSA-N 0 3 392.668 3.045 10 0 GGAEHN CN(C)C[C@@H](NC1CCN(C(=O)N(C)C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000528011104 567390260 /nfs/dbraw/zinc/39/02/60/567390260.db2.gz OQJCLWRDVIURDV-QGZVFWFLSA-N 0 3 387.355 3.332 10 0 GGAEHN COc1ccc([C@H](N[C@H](C)Cn2cc(Br)ccc2=O)C2CC2)cn1 ZINC000528043708 567391756 /nfs/dbraw/zinc/39/17/56/567391756.db2.gz RKZGSVMRDBTXIE-KZULUSFZSA-N 0 3 392.297 3.144 10 0 GGAEHN Cn1cc(C[C@@H]2CCC[C@@H]2NCc2cn3cc(Br)ccc3n2)cn1 ZINC000661780284 567392668 /nfs/dbraw/zinc/39/26/68/567392668.db2.gz PTPPLSDRHONING-YOEHRIQHSA-N 0 3 388.313 3.331 10 0 GGAEHN Cn1cc(C[C@H]2CCC[C@@H]2NCC(=O)Nc2ccccc2Br)cn1 ZINC000661777587 567393261 /nfs/dbraw/zinc/39/32/61/567393261.db2.gz IFPOARYREGNIKF-ZBFHGGJFSA-N 0 3 391.313 3.122 10 0 GGAEHN O[C@H](CN[C@@H]1CCOc2c(Br)cccc21)COCc1ccccc1 ZINC000501518558 567394615 /nfs/dbraw/zinc/39/46/15/567394615.db2.gz IWCUJUVVDUVWSP-CRAIPNDOSA-N 0 3 392.293 3.440 10 0 GGAEHN COc1cc(-c2noc([C@H]3C[C@@]3(C)Br)n2)ccc1OCCN(C)C ZINC000528105218 567395749 /nfs/dbraw/zinc/39/57/49/567395749.db2.gz XOKTVYCVNHQFKH-SJKOYZFVSA-N 0 3 396.285 3.327 10 0 GGAEHN COc1cc(-c2noc([C@@H]3C[C@]3(C)Br)n2)ccc1OCCN(C)C ZINC000528105215 567395859 /nfs/dbraw/zinc/39/58/59/567395859.db2.gz XOKTVYCVNHQFKH-SJCJKPOMSA-N 0 3 396.285 3.327 10 0 GGAEHN C[C@H](NC[C@H]1CSc2ccccc2O1)c1ccc(NS(C)(=O)=O)cc1 ZINC000569339483 567398242 /nfs/dbraw/zinc/39/82/42/567398242.db2.gz IBBANHUATCQUNB-BBRMVZONSA-N 0 3 378.519 3.262 10 0 GGAEHN C[C@@]1(Br)C[C@@H]1C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1 ZINC000528180233 567399828 /nfs/dbraw/zinc/39/98/28/567399828.db2.gz PDVGNFOZVSODME-IEBWSBKVSA-N 0 3 392.341 3.331 10 0 GGAEHN C[C@]1(Br)C[C@@H]1C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1 ZINC000528180236 567399880 /nfs/dbraw/zinc/39/98/80/567399880.db2.gz PDVGNFOZVSODME-MJGOQNOKSA-N 0 3 392.341 3.331 10 0 GGAEHN C[C@@]1(Br)C[C@H]1C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1 ZINC000528180239 567399987 /nfs/dbraw/zinc/39/99/87/567399987.db2.gz PDVGNFOZVSODME-PKOBYXMFSA-N 0 3 392.341 3.331 10 0 GGAEHN CN1CCC[C@@H](NC(=O)N[C@H]2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)C1 ZINC000618555776 567400761 /nfs/dbraw/zinc/40/07/61/567400761.db2.gz VTTAYOHPMHZBLF-KXNHARMFSA-N 0 3 375.357 3.289 10 0 GGAEHN Cn1cc(Br)c(C(=O)N2CCN(C(C)(C)CC(C)(C)C)CC2)n1 ZINC000456700196 567403733 /nfs/dbraw/zinc/40/37/33/567403733.db2.gz FURSCLLVMDPPOR-UHFFFAOYSA-N 0 3 385.350 3.155 10 0 GGAEHN COc1cc(Br)ccc1CCCN1CC[C@@H](N(C)C(=O)N(C)C)C1 ZINC000662013565 567404293 /nfs/dbraw/zinc/40/42/93/567404293.db2.gz UKYWZSRNXGTSFB-MRXNPFEDSA-N 0 3 398.345 3.078 10 0 GGAEHN CN(CC1CCN(C)CC1)C(=O)NCc1cc(F)c(Br)cc1F ZINC000528254423 567404562 /nfs/dbraw/zinc/40/45/62/567404562.db2.gz RGNCRURZTGBJLF-UHFFFAOYSA-N 0 3 390.272 3.211 10 0 GGAEHN C[C@@]1(Br)C[C@@H]1C(=O)N1CCC(N2CCc3ccccc3C2)CC1 ZINC000528270120 567405462 /nfs/dbraw/zinc/40/54/62/567405462.db2.gz MMFFRHNPSWPGHI-IEBWSBKVSA-N 0 3 377.326 3.209 10 0 GGAEHN CC[C@@H](Cc1ccc(Br)cc1)NC(=O)N1CCN2CCC1CC2 ZINC000662046088 567405961 /nfs/dbraw/zinc/40/59/61/567405961.db2.gz ZUSAPHHFAPDRGJ-INIZCTEOSA-N 0 3 380.330 3.260 10 0 GGAEHN COc1ccc(CN2CCC(CNC(=O)[C@@H]3C[C@@]3(C)Br)CC2)cc1 ZINC000528280767 567407072 /nfs/dbraw/zinc/40/70/72/567407072.db2.gz QSXUXZGESVLSTR-PKOBYXMFSA-N 0 3 395.341 3.197 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)NCc1cc(F)cc(Br)c1 ZINC000569482259 567407510 /nfs/dbraw/zinc/40/75/10/567407510.db2.gz DWWRHUDSTUHPJY-KRWDZBQOSA-N 0 3 392.272 3.356 10 0 GGAEHN O=C(COc1ccc2cc(Br)ccc2c1)N[C@H]1CNCCC1(F)F ZINC000569484021 567407669 /nfs/dbraw/zinc/40/76/69/567407669.db2.gz ZTATUZUKHZOKJM-HNNXBMFYSA-N 0 3 399.235 3.095 10 0 GGAEHN CNC(=O)CCCN1CCc2cc(Br)c(Br)cc2C1 ZINC000662111816 567412242 /nfs/dbraw/zinc/41/22/42/567412242.db2.gz RWNNJQGAZYMBKH-UHFFFAOYSA-N 0 3 390.119 3.096 10 0 GGAEHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1cc[nH]c(=O)c1Br ZINC000569548513 567412365 /nfs/dbraw/zinc/41/23/65/567412365.db2.gz GRECSLCRAUADKZ-HNNXBMFYSA-N 0 3 390.281 3.117 10 0 GGAEHN CN1CCC(CC(=O)N2CCOC[C@H]2c2cccc(Br)c2)CC1 ZINC000618774095 567412864 /nfs/dbraw/zinc/41/28/64/567412864.db2.gz OBNXEEKDOWSFKH-KRWDZBQOSA-N 0 3 381.314 3.081 10 0 GGAEHN C[C@@H]1CC[C@H](C)N1CC(=O)N1CCOC[C@H]1c1cccc(Br)c1 ZINC000618775087 567414144 /nfs/dbraw/zinc/41/41/44/567414144.db2.gz TZKSATPHCCMFPH-VBQJREDUSA-N 0 3 381.314 3.222 10 0 GGAEHN Brc1ccc2nc(Cn3cc(CNC4CCCC4)nn3)oc2c1 ZINC000641130027 567415364 /nfs/dbraw/zinc/41/53/64/567415364.db2.gz HIPDMMNIISPISD-UHFFFAOYSA-N 0 3 376.258 3.262 10 0 GGAEHN Brc1ccc2oc(Cn3cc(CNC4CCCC4)nn3)nc2c1 ZINC000641130175 567415922 /nfs/dbraw/zinc/41/59/22/567415922.db2.gz JVDLLUVLOVTMKT-UHFFFAOYSA-N 0 3 376.258 3.262 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)c1scc(Br)c1Br ZINC000528373300 567417093 /nfs/dbraw/zinc/41/70/93/567417093.db2.gz PGEGEBWVASXVCW-MRVPVSSYSA-N 0 3 396.148 3.439 10 0 GGAEHN C[C@H](NCCN(C)S(=O)(=O)c1ccc(F)cc1)c1cc2c(s1)CCC2 ZINC000436306416 567418627 /nfs/dbraw/zinc/41/86/27/567418627.db2.gz ICGCPWIWDOJQPQ-ZDUSSCGKSA-N 0 3 382.526 3.347 10 0 GGAEHN CN1CC[C@@H](c2nc(C3(c4cccc(Br)c4)CCOCC3)no2)C1 ZINC000569648432 567420313 /nfs/dbraw/zinc/42/03/13/567420313.db2.gz BDBRYOWVPHFBOP-CYBMUJFWSA-N 0 3 392.297 3.348 10 0 GGAEHN Fc1c(Br)ccc(CN2CCN(C3CCOCC3)CC2)c1F ZINC000528399071 567420498 /nfs/dbraw/zinc/42/04/98/567420498.db2.gz IUATUVCNKPDJCU-UHFFFAOYSA-N 0 3 375.257 3.024 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cnc(-c3c(F)cccc3F)s2)C[C@@H]1N(C)C ZINC000593560752 567423568 /nfs/dbraw/zinc/42/35/68/567423568.db2.gz HIUZPBBRCXOWAT-JSGCOSHPSA-N 0 3 383.489 3.206 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cnc(-c3c(F)cccc3F)s2)C[C@H]1N(C)C ZINC000593560753 567423766 /nfs/dbraw/zinc/42/37/66/567423766.db2.gz HIUZPBBRCXOWAT-OCCSQVGLSA-N 0 3 383.489 3.206 10 0 GGAEHN Brc1cccc(C[C@@H]2CCCCN2C[C@H]2CCC3(CNC3)O2)c1 ZINC000662282069 567424253 /nfs/dbraw/zinc/42/42/53/567424253.db2.gz CQJRHOIGLNQJJG-ZWKOTPCHSA-N 0 3 379.342 3.367 10 0 GGAEHN CCOCCOC[C@H](O)CN[C@H](C)c1cc2cc(Br)ccc2o1 ZINC000477930355 567425567 /nfs/dbraw/zinc/42/55/67/567425567.db2.gz KKBMLJCPQKSNNY-IUODEOHRSA-N 0 3 386.286 3.260 10 0 GGAEHN O=C(Nc1cnc2c(Br)cccn12)N1CCN(C2CCCC2)CC1 ZINC000436482859 567426324 /nfs/dbraw/zinc/42/63/24/567426324.db2.gz BTEZHIOENVQCJF-UHFFFAOYSA-N 0 3 392.301 3.189 10 0 GGAEHN CS[C@H]1CN(C(=O)[C@@H]2CSC[C@H]2c2ccccc2)C[C@H]1N1CCCC1 ZINC000593603759 567426962 /nfs/dbraw/zinc/42/69/62/567426962.db2.gz WNTUKGPBAQDGOL-MANSERQUSA-N 0 3 376.591 3.171 10 0 GGAEHN CN(CC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)[C@H](CN)C(F)(F)F ZINC000662329439 567427531 /nfs/dbraw/zinc/42/75/31/567427531.db2.gz LRPDRJMTSAATHB-ZIAGYGMSSA-N 0 3 398.256 3.478 10 0 GGAEHN CN(CC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)[C@@H](CN)C(F)(F)F ZINC000662329435 567427570 /nfs/dbraw/zinc/42/75/70/567427570.db2.gz LRPDRJMTSAATHB-KGLIPLIRSA-N 0 3 398.256 3.478 10 0 GGAEHN CN(C)Cc1ccccc1CNC(=O)c1sc2c(c1Br)CNC2 ZINC000662354050 567428415 /nfs/dbraw/zinc/42/84/15/567428415.db2.gz AXSJUMRAHMOVFX-UHFFFAOYSA-N 0 3 394.338 3.105 10 0 GGAEHN CN(C)[C@@H]1CCOc2c(Nc3ncc(I)cn3)cccc21 ZINC000618983957 567428941 /nfs/dbraw/zinc/42/89/41/567428941.db2.gz HSTPDQWROLENQF-CYBMUJFWSA-N 0 3 396.232 3.210 10 0 GGAEHN C/C(=C\c1ccccc1C(F)(F)F)CN1CCC[C@H](CS(N)(=O)=O)C1 ZINC000502344835 567429243 /nfs/dbraw/zinc/42/92/43/567429243.db2.gz KAVKTFBEEOFTMW-SSUFTNFISA-N 0 3 376.444 3.109 10 0 GGAEHN CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)[C@H]1C[C@@]1(C)Br ZINC000528513148 567432697 /nfs/dbraw/zinc/43/26/97/567432697.db2.gz RLLZGHHBTSHWSJ-JFIYKMOQSA-N 0 3 380.330 3.068 10 0 GGAEHN CN(C)CCOc1cc(NC(=O)COc2ccc(Cl)c(Cl)c2)ccn1 ZINC000478044248 567433493 /nfs/dbraw/zinc/43/34/93/567433493.db2.gz YKXVETYGYQZKST-UHFFFAOYSA-N 0 3 384.263 3.346 10 0 GGAEHN O=C(Cc1c(Cl)cccc1Br)NCCCNCc1cccnc1 ZINC000662398577 567433708 /nfs/dbraw/zinc/43/37/08/567433708.db2.gz XCIVQXCIHUQUGC-UHFFFAOYSA-N 0 3 396.716 3.336 10 0 GGAEHN Cn1c(=O)ccc2c1CCC[C@H]2NCc1ccc(I)cc1 ZINC000593695259 567436156 /nfs/dbraw/zinc/43/61/56/567436156.db2.gz ZLODJUDDAPHURH-OAHLLOKOSA-N 0 3 394.256 3.157 10 0 GGAEHN CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)C1(NC2CC2)CCC1 ZINC000662457997 567437698 /nfs/dbraw/zinc/43/76/98/567437698.db2.gz OQDOOCJDTIXSTE-UHFFFAOYSA-N 0 3 384.307 3.455 10 0 GGAEHN CC[C@@H]1CCCCN1CCNC(=O)c1sc2c(c1Br)CNC2 ZINC000662457923 567438194 /nfs/dbraw/zinc/43/81/94/567438194.db2.gz GAOQJXWNCNWIRK-LLVKDONJSA-N 0 3 386.359 3.108 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1cc(Cl)cc(F)c1Br ZINC000550297416 567440106 /nfs/dbraw/zinc/44/01/06/567440106.db2.gz LVBWLJGCZUVCTQ-NSHDSACASA-N 0 3 393.684 3.082 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1cc(Cl)cc(F)c1Br ZINC000550297415 567440489 /nfs/dbraw/zinc/44/04/89/567440489.db2.gz LVBWLJGCZUVCTQ-LLVKDONJSA-N 0 3 393.684 3.082 10 0 GGAEHN Cc1ccc(I)c(C(=O)N(C)[C@H]2CCN(C(C)C)C2)c1 ZINC000457110704 567441198 /nfs/dbraw/zinc/44/11/98/567441198.db2.gz IHVYBXZHCBABAZ-ZDUSSCGKSA-N 0 3 386.277 3.154 10 0 GGAEHN O[C@H](CNC[C@@H]1COc2ccccc2O1)COc1c(Cl)cccc1Cl ZINC000550328361 567441135 /nfs/dbraw/zinc/44/11/35/567441135.db2.gz RGBPGUUILACYPE-CHWSQXEVSA-N 0 3 384.259 3.163 10 0 GGAEHN CN(C)CCOc1ccc(NC(=O)[C@H]2C[C@]2(C)Br)cc1Cl ZINC000528590891 567441418 /nfs/dbraw/zinc/44/14/18/567441418.db2.gz IHNFHIXVFHJPHX-ABAIWWIYSA-N 0 3 375.694 3.392 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)Cc3csc4ccc(Cl)cc34)[C@H]2C1 ZINC000502551743 567442386 /nfs/dbraw/zinc/44/23/86/567442386.db2.gz MYYGWNRPJMNPOR-DLBZAZTESA-N 0 3 378.925 3.419 10 0 GGAEHN O[C@@H](CNCc1ccc2c(c1)OCCO2)COc1c(Cl)cccc1Cl ZINC000550349248 567442781 /nfs/dbraw/zinc/44/27/81/567442781.db2.gz FLAULAKTAURILK-ZDUSSCGKSA-N 0 3 384.259 3.294 10 0 GGAEHN CS[C@@H](C)C(=O)N1CCC(N2CCN(c3cccc(Cl)c3)CC2)CC1 ZINC000457119287 567442798 /nfs/dbraw/zinc/44/27/98/567442798.db2.gz RGZFBCYJELGQAK-HNNXBMFYSA-N 0 3 381.973 3.205 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@H]3C[C@H]3c3ccc(Cl)cc3Cl)[C@H]2C1 ZINC000502567456 567443680 /nfs/dbraw/zinc/44/36/80/567443680.db2.gz BIZDDSPCONWQGE-UOVPBQLFSA-N 0 3 383.319 3.419 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3Cl)[C@H]2C1 ZINC000502567454 567444095 /nfs/dbraw/zinc/44/40/95/567444095.db2.gz BIZDDSPCONWQGE-CIRFHOKZSA-N 0 3 383.319 3.419 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3cc(C)c(Br)cc3C)[C@H]2C1 ZINC000502636612 567444943 /nfs/dbraw/zinc/44/49/43/567444943.db2.gz LFOGYVNUJOWBJD-DLBZAZTESA-N 0 3 381.314 3.001 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3cc(Cl)ccc3Br)[C@H]2C1 ZINC000502634663 567445211 /nfs/dbraw/zinc/44/52/11/567445211.db2.gz MOIZKPHERHUQEF-LSDHHAIUSA-N 0 3 387.705 3.038 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@@H](C)Cc3ccc(Cl)cc3Cl)[C@H]2C1 ZINC000502633672 567445466 /nfs/dbraw/zinc/44/54/66/567445466.db2.gz BHTMJXMMVCOBJZ-DOPJRALCSA-N 0 3 385.335 3.494 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)CCOc3cccc(Cl)c3Cl)[C@H]2C1 ZINC000502656249 567445613 /nfs/dbraw/zinc/44/56/13/567445613.db2.gz UVVWTDWLILWOHE-LSDHHAIUSA-N 0 3 387.307 3.084 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3c[nH]cc3-c3ccc(Cl)s3)[C@H]2C1 ZINC000502678892 567446944 /nfs/dbraw/zinc/44/69/44/567446944.db2.gz KHBPDKIWASTQIY-LSDHHAIUSA-N 0 3 379.913 3.332 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@@H](C)Oc3cc(Cl)cc(Cl)c3)[C@H]2C1 ZINC000502695104 567447447 /nfs/dbraw/zinc/44/74/47/567447447.db2.gz QPFVEDBZWXTDAJ-OAUYIBNBSA-N 0 3 387.307 3.082 10 0 GGAEHN COC1CCN(C(C)(C)CNC(=O)COc2ccc(Cl)c(Cl)c2)CC1 ZINC000593920343 567447888 /nfs/dbraw/zinc/44/78/88/567447888.db2.gz ZAGNDLGLBKAKIT-UHFFFAOYSA-N 0 3 389.323 3.378 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@H]3C[C@@H]3c3ccc(Cl)c(Cl)c3)[C@H]2C1 ZINC000502738913 567448505 /nfs/dbraw/zinc/44/85/05/567448505.db2.gz QGOKNBPGFFYHIH-IDCJVQTKSA-N 0 3 383.319 3.419 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@H](C)Oc3ccc(Cl)cc3Cl)[C@H]2C1 ZINC000502722256 567448580 /nfs/dbraw/zinc/44/85/80/567448580.db2.gz QZOLREUBRWCEIJ-YLQAJVPDSA-N 0 3 387.307 3.082 10 0 GGAEHN CN(C)C(=O)CCCN1CCC[C@@H]1c1ccccc1I ZINC000593957754 567449623 /nfs/dbraw/zinc/44/96/23/567449623.db2.gz IJLJKQHXICRPKL-OAHLLOKOSA-N 0 3 386.277 3.297 10 0 GGAEHN O=C(NCCc1ccc(Br)s1)Nc1ccc2c(c1)OCCNC2 ZINC000528714437 567451708 /nfs/dbraw/zinc/45/17/08/567451708.db2.gz KCRLTWXQODMLGT-UHFFFAOYSA-N 0 3 396.310 3.357 10 0 GGAEHN C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1NCC(=O)Nc1ccc(Br)cc1Cl ZINC000528757498 567452766 /nfs/dbraw/zinc/45/27/66/567452766.db2.gz CFLJKKVSVQMAMR-DRNSDYETSA-N 0 3 375.694 3.443 10 0 GGAEHN C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1NCC(=O)Nc1c(F)cc(F)cc1Br ZINC000528757967 567452919 /nfs/dbraw/zinc/45/29/19/567452919.db2.gz DFCKSMSHINLXPC-GMAGZHIISA-N 0 3 377.229 3.067 10 0 GGAEHN C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1NCC(=O)Nc1c(F)cc(F)cc1Br ZINC000528757971 567453570 /nfs/dbraw/zinc/45/35/70/567453570.db2.gz DFCKSMSHINLXPC-XULOGPSESA-N 0 3 377.229 3.067 10 0 GGAEHN COC(=O)c1cnc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)c(Cl)c1 ZINC000594031927 567453786 /nfs/dbraw/zinc/45/37/86/567453786.db2.gz QROBFZCTXVTBKC-ZJUUUORDSA-N 0 3 380.750 3.208 10 0 GGAEHN O=C(Nc1nccn1Cc1ccc(Br)cc1)C1(NC2CC2)CCC1 ZINC000662653618 567453861 /nfs/dbraw/zinc/45/38/61/567453861.db2.gz ALLNISHSDYGMMP-UHFFFAOYSA-N 0 3 389.297 3.307 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)N1CCc2ccc(Cl)c(Cl)c2C1 ZINC000662627934 567454502 /nfs/dbraw/zinc/45/45/02/567454502.db2.gz LORZTCSKTABQNR-URKNILKWSA-N 0 3 383.319 3.411 10 0 GGAEHN O=S(=O)(c1cccc(C(F)(F)F)c1)N1CCCC[C@@H](N2CCCC2)C1 ZINC000594042063 567454715 /nfs/dbraw/zinc/45/47/15/567454715.db2.gz MVPGSMCEZYWWNR-OAHLLOKOSA-N 0 3 376.444 3.344 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)Cc2cccc(Cl)c2Cl)CC1 ZINC000478443687 567456943 /nfs/dbraw/zinc/45/69/43/567456943.db2.gz IATVDACOHUMMKD-UHFFFAOYSA-N 0 3 380.275 3.288 10 0 GGAEHN CC[C@H]1CC[C@H](C(=O)N(CCN(CC)CC)c2ccc(Br)cn2)O1 ZINC000570097554 567456996 /nfs/dbraw/zinc/45/69/96/567456996.db2.gz HTLUXIVUOXYBCY-JKSUJKDBSA-N 0 3 398.345 3.477 10 0 GGAEHN COC1CCN(C(C)(C)CNC(=O)Nc2nc(C(F)(F)F)cs2)CC1 ZINC000594065497 567457077 /nfs/dbraw/zinc/45/70/77/567457077.db2.gz FQBIMUYLNKULFM-UHFFFAOYSA-N 0 3 380.436 3.173 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1cc(C)c(Br)c(Cl)c1 ZINC000550690976 567457291 /nfs/dbraw/zinc/45/72/91/567457291.db2.gz UMLNHSYGTZITIM-CYBMUJFWSA-N 0 3 389.721 3.252 10 0 GGAEHN CC[C@@H]1CC[C@@H](C(=O)N(CCN(CC)CC)c2ccc(Br)cn2)O1 ZINC000570097549 567457400 /nfs/dbraw/zinc/45/74/00/567457400.db2.gz HTLUXIVUOXYBCY-CVEARBPZSA-N 0 3 398.345 3.477 10 0 GGAEHN O=C(NC[C@H]1CCN(c2ccc(Br)cc2)C1)C1(NC2CC2)CCC1 ZINC000662691562 567457379 /nfs/dbraw/zinc/45/73/79/567457379.db2.gz JODTWNLFGMYFGG-CQSZACIVSA-N 0 3 392.341 3.066 10 0 GGAEHN C[C@@]1(Br)C[C@H]1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000528809616 567458191 /nfs/dbraw/zinc/45/81/91/567458191.db2.gz QKDCRHDYAZQDDE-FUHWJXTLSA-N 0 3 381.314 3.003 10 0 GGAEHN C[C@]1(Br)C[C@@H]1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000528809615 567458579 /nfs/dbraw/zinc/45/85/79/567458579.db2.gz QKDCRHDYAZQDDE-AEFFLSMTSA-N 0 3 381.314 3.003 10 0 GGAEHN C[C@]1(Br)C[C@H]1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 ZINC000528809618 567458923 /nfs/dbraw/zinc/45/89/23/567458923.db2.gz QKDCRHDYAZQDDE-WMZOPIPTSA-N 0 3 381.314 3.003 10 0 GGAEHN CCO[C@@H]1C[C@](N)(C(=O)N2Cc3ccc(C)c(Br)c3C2)C1(C)C ZINC000662737676 567459362 /nfs/dbraw/zinc/45/93/62/567459362.db2.gz APHRYUSHDORMJR-KDOFPFPSSA-N 0 3 381.314 3.132 10 0 GGAEHN Cc1ccc2c(c1Br)CN(C(=O)[C@]1(N)[C@@H]3CCCO[C@H]3C1(C)C)C2 ZINC000662740098 567459631 /nfs/dbraw/zinc/45/96/31/567459631.db2.gz WREKYNJONYDRIL-IDHHARJASA-N 0 3 393.325 3.132 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2cc(Br)ccc2C)CC1 ZINC000478461875 567459917 /nfs/dbraw/zinc/45/99/17/567459917.db2.gz RKPIQYCVMBTTOX-UHFFFAOYSA-N 0 3 390.281 3.124 10 0 GGAEHN COc1ccccc1[C@H]1[C@@H](N)CCCN1C(=O)c1occc1Br ZINC000457359292 567460321 /nfs/dbraw/zinc/46/03/21/567460321.db2.gz FPKMRRSWEVHTRA-ZFWWWQNUSA-N 0 3 379.254 3.355 10 0 GGAEHN O[C@@H](CNC[C@@H]1COc2ccccc2O1)COc1ccc(Cl)c(Cl)c1 ZINC000641938788 567460847 /nfs/dbraw/zinc/46/08/47/567460847.db2.gz GOJKROIEBNDJTO-GXTWGEPZSA-N 0 3 384.259 3.163 10 0 GGAEHN O=C([C@H]1CNCc2ccccc21)N1CCOc2cc(Br)ccc2C1 ZINC000662743505 567461201 /nfs/dbraw/zinc/46/12/01/567461201.db2.gz KGQTYEJOUDIVBM-KRWDZBQOSA-N 0 3 387.277 3.057 10 0 GGAEHN CCN1CC[C@H](N(C)C(=O)c2sc3c(c2Br)CNC3)C[C@@H]1C ZINC000662743906 567461394 /nfs/dbraw/zinc/46/13/94/567461394.db2.gz WZXTUZKPQNZWEZ-QWRGUYRKSA-N 0 3 386.359 3.059 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2cccc(C)c2Br)CC1 ZINC000478494953 567461896 /nfs/dbraw/zinc/46/18/96/567461896.db2.gz WJHCHKLWGQKPAE-UHFFFAOYSA-N 0 3 390.281 3.124 10 0 GGAEHN COCCOc1ccc(Br)cc1NC(=O)c1cccc2c1CNC2 ZINC000662788504 567462063 /nfs/dbraw/zinc/46/20/63/567462063.db2.gz OBYMKCRCTICRLA-UHFFFAOYSA-N 0 3 391.265 3.330 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2ccc(C)c(Br)c2)CC1 ZINC000478489362 567462393 /nfs/dbraw/zinc/46/23/93/567462393.db2.gz MMJOGJDVIDGWDP-UHFFFAOYSA-N 0 3 390.281 3.124 10 0 GGAEHN Cc1cc(CN)cc(NC(=O)[C@@H]2CCO[C@H]2c2cncc(Br)c2)c1 ZINC000662818910 567463140 /nfs/dbraw/zinc/46/31/40/567463140.db2.gz FQJMPABCZZRHHM-SJORKVTESA-N 0 3 390.281 3.328 10 0 GGAEHN Cc1ccc(I)c(C(=O)N[C@H]2CCCN3CCCC[C@H]23)c1 ZINC000594199382 567464423 /nfs/dbraw/zinc/46/44/23/567464423.db2.gz YFDNNWUZNXVMSI-JKSUJKDBSA-N 0 3 398.288 3.346 10 0 GGAEHN O=C(N1CCc2[nH]c3ccc(Br)cc3c2C1)C1(NC2CC2)CCC1 ZINC000662861992 567465725 /nfs/dbraw/zinc/46/57/25/567465725.db2.gz CTPCFFXMRITKQI-UHFFFAOYSA-N 0 3 388.309 3.490 10 0 GGAEHN COc1cc(NC(=O)c2cn[n-]c2[C@@H]2CC[NH2+]C2)c(Cl)cc1Br ZINC000662920013 567469132 /nfs/dbraw/zinc/46/91/32/567469132.db2.gz QQQKNOUXEDCGLL-MRVPVSSYSA-N 0 3 399.676 3.163 10 0 GGAEHN CS[C@@H]1CN(C(=O)C[C@@H]2OCc3cc(Cl)ccc32)C[C@@H]1N1CCCC1 ZINC000594339530 567469543 /nfs/dbraw/zinc/46/95/43/567469543.db2.gz QHGIFNJHHWJCRA-OKZBNKHCSA-N 0 3 380.941 3.340 10 0 GGAEHN O=C(c1cccc2c1CCNC2)N1CCOc2cc(Br)ccc2C1 ZINC000662940885 567470380 /nfs/dbraw/zinc/47/03/80/567470380.db2.gz ZIZGADCIPMTVAU-UHFFFAOYSA-N 0 3 387.277 3.130 10 0 GGAEHN CCOC(=O)CC[C@@H](O)CNCc1ccc(Br)cc1C(F)(F)F ZINC000570274038 567471541 /nfs/dbraw/zinc/47/15/41/567471541.db2.gz UXVPJIPORLDCCF-GFCCVEGCSA-N 0 3 398.219 3.262 10 0 GGAEHN CCOC(=O)CC[C@H](O)CNCc1ccc(Br)cc1C(F)(F)F ZINC000570274039 567472173 /nfs/dbraw/zinc/47/21/73/567472173.db2.gz UXVPJIPORLDCCF-LBPRGKRZSA-N 0 3 398.219 3.262 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)N[C@H](c1cncc(Br)c1)C1CC1 ZINC000551025581 567473827 /nfs/dbraw/zinc/47/38/27/567473827.db2.gz LODFUASTFJHHRW-GUYCJALGSA-N 0 3 395.345 3.469 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)N[C@@H](c1cncc(Br)c1)C1CC1 ZINC000551025582 567473862 /nfs/dbraw/zinc/47/38/62/567473862.db2.gz LODFUASTFJHHRW-SUMWQHHRSA-N 0 3 395.345 3.469 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)COc1ccc(F)cc1Br ZINC000570333427 567476555 /nfs/dbraw/zinc/47/65/55/567476555.db2.gz DFNDTVCHVVFKGN-MRXNPFEDSA-N 0 3 393.256 3.052 10 0 GGAEHN CC(C)N1CCCN(C(=O)Cc2c(F)ccc(Br)c2F)CC1 ZINC000503324004 567479628 /nfs/dbraw/zinc/47/96/28/567479628.db2.gz NSYKDLZRATXACB-UHFFFAOYSA-N 0 3 375.257 3.213 10 0 GGAEHN CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)N(C)CCN(C)C ZINC000478731982 567480743 /nfs/dbraw/zinc/48/07/43/567480743.db2.gz IOXRATQMKJRMOH-INIZCTEOSA-N 0 3 388.339 3.158 10 0 GGAEHN CN(C[C@@H]1CCCN(C)C1)S(=O)(=O)c1cccc(Br)c1Cl ZINC000551135760 567481083 /nfs/dbraw/zinc/48/10/83/567481083.db2.gz KSIHQOBVKCVKFB-LLVKDONJSA-N 0 3 395.750 3.065 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CNCC[C@H](C)[S@](C)=O ZINC000594497170 567481719 /nfs/dbraw/zinc/48/17/19/567481719.db2.gz DEQKSSKNLYLZFL-YTEVENLXSA-N 0 3 384.343 3.190 10 0 GGAEHN C[C@H]1CN(C)CC[C@@H]1N(C)S(=O)(=O)c1cccc(Br)c1Cl ZINC000551168328 567482771 /nfs/dbraw/zinc/48/27/71/567482771.db2.gz XUUHFSXGGRHQER-JQWIXIFHSA-N 0 3 395.750 3.063 10 0 GGAEHN Cc1nc(-c2ccc(CCNC(=O)N[C@H]3CNCCC3(F)F)s2)cs1 ZINC000570424675 567483436 /nfs/dbraw/zinc/48/34/36/567483436.db2.gz FSSKFAWIEVDYON-AWEZNQCLSA-N 0 3 386.493 3.019 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCC1)Nc1cnc2c(Br)cccn12 ZINC000529100197 567486445 /nfs/dbraw/zinc/48/64/45/567486445.db2.gz MBAYRRDRAYUWPG-ZDUSSCGKSA-N 0 3 392.301 3.235 10 0 GGAEHN CC(C)N(Cc1ccccc1)C(=O)C(C)S(=O)(=O)c1ncc(Cl)s1 ZINC000663248545 567486635 /nfs/dbraw/zinc/48/66/35/567486635.db2.gz FUIYGXHZFNGONC-LBPRGKRZSA-N 0 3 386.926 3.396 10 0 GGAEHN C[C@@H](CNC(=O)N[C@@H]1CCOc2c(Br)cccc21)N(C)C1CC1 ZINC000570464236 567487355 /nfs/dbraw/zinc/48/73/55/567487355.db2.gz OKIRZOHIHHOQIO-XHDPSFHLSA-N 0 3 382.302 3.055 10 0 GGAEHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)COc1ccsc1 ZINC000503483113 567488195 /nfs/dbraw/zinc/48/81/95/567488195.db2.gz PRJHQPQAROTLHD-UHFFFAOYSA-N 0 3 397.338 3.480 10 0 GGAEHN COC(=O)c1cc(CNC[C@@H](CO)Cc2ccc(Br)cc2)c(C)o1 ZINC000594615500 567491786 /nfs/dbraw/zinc/49/17/86/567491786.db2.gz VICJIWIQKMRDRY-AWEZNQCLSA-N 0 3 396.281 3.078 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NCc1ccc(OC(F)F)cc1 ZINC000551268253 567492370 /nfs/dbraw/zinc/49/23/70/567492370.db2.gz SXGOOCUCMIGKNE-LLVKDONJSA-N 0 3 387.224 3.391 10 0 GGAEHN CCc1ccc(S(=O)(=O)N(C)C[C@H]2CCN(Cc3ccccc3)C2)s1 ZINC000437333671 567493614 /nfs/dbraw/zinc/49/36/14/567493614.db2.gz ORMBUVONKOLKMI-QGZVFWFLSA-N 0 3 378.563 3.453 10 0 GGAEHN Cc1cc(Cl)c(C)c(S(=O)(=O)N(C)[C@H](CN)C(F)(F)F)c1Cl ZINC000663309950 567495736 /nfs/dbraw/zinc/49/57/36/567495736.db2.gz FGMCCGIXKSXJMZ-SECBINFHSA-N 0 3 379.231 3.120 10 0 GGAEHN C[C@@H](CNC(=O)N1CCN2CCC1CC2)Sc1ccc(Br)cc1 ZINC000551308389 567496865 /nfs/dbraw/zinc/49/68/65/567496865.db2.gz JRQYRKUPGGZCCC-ZDUSSCGKSA-N 0 3 398.370 3.419 10 0 GGAEHN CCCOc1c(Br)cc(CN2CCNC[C@@H]2C(F)F)cc1OC ZINC000570632510 567501104 /nfs/dbraw/zinc/50/11/04/567501104.db2.gz QULGIPBNSUQJMO-CYBMUJFWSA-N 0 3 393.272 3.285 10 0 GGAEHN C[C@H](O)[C@@H](NCCC(=O)Nc1cccc(Br)c1)c1ccccc1 ZINC000663376992 567502435 /nfs/dbraw/zinc/50/24/35/567502435.db2.gz XPHDZHZLPQWSMY-SCLBCKFNSA-N 0 3 377.282 3.489 10 0 GGAEHN C[C@H](c1ccccc1)[C@H](O)CNC[C@@H](O)COc1c(Cl)cccc1Cl ZINC000663380769 567502727 /nfs/dbraw/zinc/50/27/27/567502727.db2.gz ZPOAEDAHPQVZLT-DDUZABMNSA-N 0 3 384.303 3.487 10 0 GGAEHN C[C@H](O)[C@@H](NC[C@H](O)COc1cc(F)cc(Br)c1)c1ccccc1 ZINC000663376387 567502761 /nfs/dbraw/zinc/50/27/61/567502761.db2.gz QTXJSFGLIFNAHX-ULFGMLNVSA-N 0 3 398.272 3.040 10 0 GGAEHN C[C@H](O)[C@H](NC[C@@H](O)COc1cc(F)cc(Br)c1)c1ccccc1 ZINC000663376388 567502788 /nfs/dbraw/zinc/50/27/88/567502788.db2.gz QTXJSFGLIFNAHX-XZOAIXRZSA-N 0 3 398.272 3.040 10 0 GGAEHN CN1CCC[C@]2(CCN(C(=O)NCc3cc(F)cc(Br)c3)C2)C1 ZINC000457907715 567503168 /nfs/dbraw/zinc/50/31/68/567503168.db2.gz CCYPJTSNJYZMFR-KRWDZBQOSA-N 0 3 384.293 3.216 10 0 GGAEHN CCN1CCN(CCNc2ncc(Br)c3ccc(F)cc32)CC1 ZINC000663398330 567504054 /nfs/dbraw/zinc/50/40/54/567504054.db2.gz QJTQLHMEIBPRRK-UHFFFAOYSA-N 0 3 381.293 3.186 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000437721903 567506281 /nfs/dbraw/zinc/50/62/81/567506281.db2.gz IHYKBRMBYPCHNL-UKPHBRMFSA-N 0 3 386.323 3.259 10 0 GGAEHN CC(C)N1CC[C@@H](N(C)C(=O)N[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000457937936 567506899 /nfs/dbraw/zinc/50/68/99/567506899.db2.gz PEPJLLKHTSQFJQ-GDBMZVCRSA-N 0 3 396.329 3.397 10 0 GGAEHN CC(C)N1CC[C@@H](N(C)C(=O)N[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000457937939 567507409 /nfs/dbraw/zinc/50/74/09/567507409.db2.gz PEPJLLKHTSQFJQ-ZBFHGGJFSA-N 0 3 396.329 3.397 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)N1CC2(CC2)c2ccc(Br)cc21 ZINC000529338758 567507768 /nfs/dbraw/zinc/50/77/68/567507768.db2.gz JVBVFXXPHHMPMG-CYBMUJFWSA-N 0 3 386.240 3.008 10 0 GGAEHN Cc1sc2ncnc(SCC(=O)N[C@@H](CC(C)C)CN(C)C)c2c1C ZINC000620256504 567508579 /nfs/dbraw/zinc/50/85/79/567508579.db2.gz MAKKAZSUVWQYPW-AWEZNQCLSA-N 0 3 380.583 3.493 10 0 GGAEHN Brc1ccccc1-c1ccc(CN2CCOC3(CNC3)C2)s1 ZINC000663513632 567511641 /nfs/dbraw/zinc/51/16/41/567511641.db2.gz WSBNKJKVHVFRNJ-UHFFFAOYSA-N 0 3 379.323 3.352 10 0 GGAEHN CC(C)Oc1ccc([C@H](CNC(=O)[C@H]2C[C@@]2(C)Br)N(C)C)cc1 ZINC000529392701 567511882 /nfs/dbraw/zinc/51/18/82/567511882.db2.gz PCLDCYRKERNJSG-SOLBZPMBSA-N 0 3 383.330 3.366 10 0 GGAEHN CCN(C(=O)N[C@@H](C)c1ccc(OC)c(Br)c1)[C@@H]1CCN(C)C1 ZINC000663516474 567513194 /nfs/dbraw/zinc/51/31/94/567513194.db2.gz QNGPSUUPRHYQOQ-GXTWGEPZSA-N 0 3 384.318 3.254 10 0 GGAEHN CCN(C(=O)N[C@H](C)c1ccc(OC)c(Br)c1)[C@H]1CCN(C)C1 ZINC000663516476 567513650 /nfs/dbraw/zinc/51/36/50/567513650.db2.gz QNGPSUUPRHYQOQ-OCCSQVGLSA-N 0 3 384.318 3.254 10 0 GGAEHN CS[C@@H]1CN(C(=O)Nc2cccc(Br)c2)C[C@H]1N1CCCC1 ZINC000437914905 567514359 /nfs/dbraw/zinc/51/43/59/567514359.db2.gz AJEYNYDSCBFJTK-HUUCEWRRSA-N 0 3 384.343 3.493 10 0 GGAEHN CN(C)[C@@H](CNC(=O)c1cc(Br)cc2nc[nH]c21)c1ccsc1 ZINC000503957291 567514738 /nfs/dbraw/zinc/51/47/38/567514738.db2.gz HGZWEEFRHHBHOH-AWEZNQCLSA-N 0 3 393.310 3.420 10 0 GGAEHN O=C(Nc1c[nH]cc(Br)c1=O)c1ccc(CN2CCCCC2)cc1 ZINC000551526337 567515016 /nfs/dbraw/zinc/51/50/16/567515016.db2.gz JNYJXSKSEKZGJT-UHFFFAOYSA-N 0 3 390.281 3.376 10 0 GGAEHN C[C@H](Oc1ccccc1Br)C(=O)N1CCc2ccccc2[C@@H]1CN ZINC000570801882 567515654 /nfs/dbraw/zinc/51/56/54/567515654.db2.gz GMPDRHQBSVJPJR-GUYCJALGSA-N 0 3 389.293 3.301 10 0 GGAEHN C[C@H](CNC(=O)c1cc(Br)cc2[nH]cnc21)N1CCC[C@@H](C)C1 ZINC000503975999 567515941 /nfs/dbraw/zinc/51/59/41/567515941.db2.gz ZPESLIYYGXJIMM-VXGBXAGGSA-N 0 3 379.302 3.176 10 0 GGAEHN C[C@@H](CNC(=O)c1cc(Br)cc2[nH]cnc21)N1CCCC[C@H]1C ZINC000503975636 567516184 /nfs/dbraw/zinc/51/61/84/567516184.db2.gz FXJPHXZYPLAZOX-NEPJUHHUSA-N 0 3 379.302 3.318 10 0 GGAEHN C[C@@H]1CCCN(CCNC(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000503986841 567516640 /nfs/dbraw/zinc/51/66/40/567516640.db2.gz OIBUJQCRPURZJL-LLVKDONJSA-N 0 3 375.257 3.118 10 0 GGAEHN CC(C)(C)[C@@H](O)C[C@@H](CO)NCc1ccc(OC(F)F)c(Br)c1 ZINC000551569415 567518810 /nfs/dbraw/zinc/51/88/10/567518810.db2.gz RIHMBWPYRARVJE-FZMZJTMJSA-N 0 3 396.272 3.298 10 0 GGAEHN CC(C)(C)[C@H](O)C[C@H](CO)NCc1ccc(OC(F)F)c(Br)c1 ZINC000551569412 567519323 /nfs/dbraw/zinc/51/93/23/567519323.db2.gz RIHMBWPYRARVJE-BXUZGUMPSA-N 0 3 396.272 3.298 10 0 GGAEHN Cc1nc(C)c(Br)c(NCC2(N3CCCCC3)CCN(C)CC2)n1 ZINC000663669497 567521376 /nfs/dbraw/zinc/52/13/76/567521376.db2.gz XMXVKQBIDBWFBD-UHFFFAOYSA-N 0 3 396.377 3.218 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NCc1cccc(N2CCOCC2)n1 ZINC000479283174 567521669 /nfs/dbraw/zinc/52/16/69/567521669.db2.gz JCWLZCZFPDWDLD-HNNXBMFYSA-N 0 3 390.325 3.402 10 0 GGAEHN NC(=O)C[C@@H]1CCCCN1Cc1c[nH]nc1-c1ccc(Br)s1 ZINC000529526148 567525007 /nfs/dbraw/zinc/52/50/07/567525007.db2.gz SAEAJPSHCUWVGV-NSHDSACASA-N 0 3 383.315 3.131 10 0 GGAEHN NC(=O)[C@H]1CCC[C@@H](NCc2cc(Cl)ccc2I)C1 ZINC000594923119 567525218 /nfs/dbraw/zinc/52/52/18/567525218.db2.gz SKLDLZMLNPMBMI-JOYOIKCWSA-N 0 3 392.668 3.078 10 0 GGAEHN C[C@@H](Cc1cnccn1)NCc1cc(Cl)ccc1I ZINC000594918909 567525394 /nfs/dbraw/zinc/52/53/94/567525394.db2.gz VDGKWEANUIIDPF-JTQLQIEISA-N 0 3 387.652 3.455 10 0 GGAEHN Brc1cnc(C2CC2)nc1N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000663732312 567525855 /nfs/dbraw/zinc/52/58/55/567525855.db2.gz VAFXOAOSPBZBQW-OAHLLOKOSA-N 0 3 395.345 3.198 10 0 GGAEHN COCCCN(CCO)Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000438337632 567526330 /nfs/dbraw/zinc/52/63/30/567526330.db2.gz AAOSIDFDKIHVLD-UHFFFAOYSA-N 0 3 385.327 3.403 10 0 GGAEHN CCN(C(=O)NCCc1ccc(F)c(Br)c1)[C@H]1CCN(CC)C1 ZINC000663758396 567526552 /nfs/dbraw/zinc/52/65/52/567526552.db2.gz CQHVMPBPOSJFSM-AWEZNQCLSA-N 0 3 386.309 3.256 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)[C@H](CN)c1ccccc1 ZINC000570962309 567526679 /nfs/dbraw/zinc/52/66/79/567526679.db2.gz VLZOFIIPFKMXHX-MLGOLLRUSA-N 0 3 377.282 3.377 10 0 GGAEHN O=C(Nc1nnc(SCc2ccc(F)cc2)s1)[C@@H]1CNCCC1(F)F ZINC000644017138 567527892 /nfs/dbraw/zinc/52/78/92/567527892.db2.gz AEHZAMFZOYFVIU-NSHDSACASA-N 0 3 388.440 3.153 10 0 GGAEHN CN1CCC(CC(=O)NCc2cc3cccnc3cc2Br)CC1 ZINC000644041394 567528046 /nfs/dbraw/zinc/52/80/46/567528046.db2.gz WRVLDDQXKPRLIO-UHFFFAOYSA-N 0 3 376.298 3.345 10 0 GGAEHN CN(C(=O)N[C@@H]1C[C@H]1c1ccc(Br)cc1)[C@H]1CCN(C2CC2)C1 ZINC000438361271 567528315 /nfs/dbraw/zinc/52/83/15/567528315.db2.gz WFOAQWGKHSNZNB-YESZJQIVSA-N 0 3 378.314 3.183 10 0 GGAEHN CC1(C)CN[C@@H]1C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1 ZINC000644055387 567528453 /nfs/dbraw/zinc/52/84/53/567528453.db2.gz ZCDKBPGZDUCIFM-MRXNPFEDSA-N 0 3 380.275 3.140 10 0 GGAEHN CCCN(C)CC(C)(C)NC(=O)CCCS(=O)(=O)c1ccc(Cl)cc1 ZINC000620621752 567530619 /nfs/dbraw/zinc/53/06/19/567530619.db2.gz SYAKAUFLNDJBSX-UHFFFAOYSA-N 0 3 388.961 3.131 10 0 GGAEHN CCNC(=O)N1CC[C@@H](N[C@H](c2ccc(Br)cc2F)C2CC2)C1 ZINC000479382460 567530756 /nfs/dbraw/zinc/53/07/56/567530756.db2.gz AAOVLUAYEHUGPY-CJNGLKHVSA-N 0 3 384.293 3.433 10 0 GGAEHN CCC[N@H+](C)CC(C)(C)NC(=O)c1cc(=O)c2cc(Br)ccc2[n-]1 ZINC000620624153 567531412 /nfs/dbraw/zinc/53/14/12/567531412.db2.gz OZTJTULYYLPXMI-UHFFFAOYSA-N 0 3 394.313 3.141 10 0 GGAEHN CCC[N@@H+](C)CC(C)(C)NC(=O)c1cc(=O)c2cc(Br)ccc2[n-]1 ZINC000620624153 567531418 /nfs/dbraw/zinc/53/14/18/567531418.db2.gz OZTJTULYYLPXMI-UHFFFAOYSA-N 0 3 394.313 3.141 10 0 GGAEHN Cc1cncc(CCNCc2cc(Cl)ccc2I)n1 ZINC000594994246 567533131 /nfs/dbraw/zinc/53/31/31/567533131.db2.gz ITFCWFZRFAEWTO-UHFFFAOYSA-N 0 3 387.652 3.375 10 0 GGAEHN COc1cc(CNC[C@@]2(C)CC2(F)F)cc(I)c1OC ZINC000594985719 567532263 /nfs/dbraw/zinc/53/22/63/567532263.db2.gz NTDIPYVRVKAAGM-CYBMUJFWSA-N 0 3 397.203 3.443 10 0 GGAEHN Ic1ccc(CCNCc2cc3n(n2)CCCC3)cc1 ZINC000594995176 567533113 /nfs/dbraw/zinc/53/31/13/567533113.db2.gz PZHLEDRQMKCAEA-UHFFFAOYSA-N 0 3 381.261 3.156 10 0 GGAEHN C[C@H]1CN(C(=O)c2n[nH]c3ccc(Br)cc32)CCN(C2CCC2)C1 ZINC000571070854 567533985 /nfs/dbraw/zinc/53/39/85/567533985.db2.gz GVJVXHWAXMYBDQ-GFCCVEGCSA-N 0 3 391.313 3.272 10 0 GGAEHN C[C@@H]1CN(C(=O)c2n[nH]c3ccc(Br)cc32)CCN(C2CCC2)C1 ZINC000571070855 567534167 /nfs/dbraw/zinc/53/41/67/567534167.db2.gz GVJVXHWAXMYBDQ-LBPRGKRZSA-N 0 3 391.313 3.272 10 0 GGAEHN O[C@H](CNCc1cc(Br)c2c(c1)OCCO2)Cc1ccc(F)cc1 ZINC000571074605 567535035 /nfs/dbraw/zinc/53/50/35/567535035.db2.gz XADZSRISFHHKKH-HNNXBMFYSA-N 0 3 396.256 3.053 10 0 GGAEHN C[C@@H](CSCCF)NCc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1 ZINC000595016242 567535703 /nfs/dbraw/zinc/53/57/03/567535703.db2.gz JBSXRHFTTMVFOJ-HOTGVXAUSA-N 0 3 388.574 3.288 10 0 GGAEHN CN(C)Cc1ccc(NC(=O)[C@H](N)Cc2ccccc2)cc1Br ZINC000644151489 567536405 /nfs/dbraw/zinc/53/64/05/567536405.db2.gz LLQHRARCKHTYPJ-QGZVFWFLSA-N 0 3 376.298 3.019 10 0 GGAEHN C[C@@H](CSCCF)N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 ZINC000595034237 567537761 /nfs/dbraw/zinc/53/77/61/567537761.db2.gz WHCHNUSSVVPOOA-GXTWGEPZSA-N 0 3 378.435 3.487 10 0 GGAEHN CC1(N2CCOCC2)CCN(Cc2cc(Br)cc3c2OCC3)CC1 ZINC000529661646 567538336 /nfs/dbraw/zinc/53/83/36/567538336.db2.gz ASHXXBKEAMRGGS-UHFFFAOYSA-N 0 3 395.341 3.071 10 0 GGAEHN C[C@@H](CSCCF)N[C@@H]1CCN(c2cccc(Br)c2)C1=O ZINC000595050835 567538918 /nfs/dbraw/zinc/53/89/18/567538918.db2.gz UJYWWNDASYISOQ-SMDDNHRTSA-N 0 3 375.307 3.235 10 0 GGAEHN COC(=O)CC1CC(NCc2cc(Cl)ccc2I)C1 ZINC000595057470 567539039 /nfs/dbraw/zinc/53/90/39/567539039.db2.gz XKWKMIBDTUFCQO-UHFFFAOYSA-N 0 3 393.652 3.376 10 0 GGAEHN C[C@H](CSCCF)N[C@@H]1CCN(c2cccc(Br)c2)C1=O ZINC000595049079 567539434 /nfs/dbraw/zinc/53/94/34/567539434.db2.gz UJYWWNDASYISOQ-BXUZGUMPSA-N 0 3 375.307 3.235 10 0 GGAEHN CCOc1cc(C[NH2+]CC(C)(C)C(=O)N2CCCC2)cc(Br)c1[O-] ZINC000529678417 567539751 /nfs/dbraw/zinc/53/97/51/567539751.db2.gz MJKDPIFKPIHPBR-UHFFFAOYSA-N 0 3 399.329 3.292 10 0 GGAEHN C[C@@H]1CN(C)C[C@H]1N[C@H](CO)c1ccc(Br)cc1C(F)(F)F ZINC000479513347 567540070 /nfs/dbraw/zinc/54/00/70/567540070.db2.gz DZUINVZZBVOLCW-OWYVNGRQSA-N 0 3 381.236 3.041 10 0 GGAEHN C[C@@H]1CN(C)C[C@@H]1N[C@@H](CO)c1ccc(Br)cc1C(F)(F)F ZINC000479513346 567540892 /nfs/dbraw/zinc/54/08/92/567540892.db2.gz DZUINVZZBVOLCW-IIMNLJJBSA-N 0 3 381.236 3.041 10 0 GGAEHN C[C@@H]1CN(C)C[C@H]1N[C@@H](CO)c1ccc(Br)cc1C(F)(F)F ZINC000479513345 567541233 /nfs/dbraw/zinc/54/12/33/567541233.db2.gz DZUINVZZBVOLCW-FZQKWOKYSA-N 0 3 381.236 3.041 10 0 GGAEHN C[C@@H](NCCc1ccc(I)cc1)c1cc2n(n1)CCC2 ZINC000595094238 567541492 /nfs/dbraw/zinc/54/14/92/567541492.db2.gz JBHDINDBUVKQJE-GFCCVEGCSA-N 0 3 381.261 3.327 10 0 GGAEHN Cn1ccnc1[C@H](NCCc1ccc(I)cc1)C1CC1 ZINC000595094865 567541534 /nfs/dbraw/zinc/54/15/34/567541534.db2.gz NEEAEESRPRQTOD-OAHLLOKOSA-N 0 3 381.261 3.308 10 0 GGAEHN CCN(C(=O)NCc1ccc(OC)c(Br)c1)[C@H]1CCN(CC)C1 ZINC000663916705 567541467 /nfs/dbraw/zinc/54/14/67/567541467.db2.gz WVRFULZHQOHOFA-AWEZNQCLSA-N 0 3 384.318 3.083 10 0 GGAEHN O=C(N[C@@H]1CCc2c1ccc(Cl)c2Cl)N[C@H]1CCCN(CCCO)C1 ZINC000458383459 567542846 /nfs/dbraw/zinc/54/28/46/567542846.db2.gz ZRCINLPBAFPXFO-BLLLJJGKSA-N 0 3 386.323 3.127 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)N[C@H](CO)c1ccc(Br)cc1 ZINC000504695469 567544219 /nfs/dbraw/zinc/54/42/19/567544219.db2.gz PCGYEWGPRCJFHF-JKIFEVAISA-N 0 3 398.345 3.045 10 0 GGAEHN CN1CCC[C@H](CNC(=O)N2CC(F)(F)C(F)(F)C2)[C@@H]1c1cccs1 ZINC000458425746 567546410 /nfs/dbraw/zinc/54/64/10/567546410.db2.gz LRRVXGBVZKJZQZ-DGCLKSJQSA-N 0 3 379.423 3.427 10 0 GGAEHN CC[C@@H]1CN(C(=O)c2cnn(-c3ccc(Br)cc3)c2C)C[C@H](C)N1 ZINC000620906069 567550260 /nfs/dbraw/zinc/55/02/60/567550260.db2.gz OEGJVJTZZKCLDB-SWLSCSKDSA-N 0 3 391.313 3.156 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1cccc(Br)c1 ZINC000620917353 567550404 /nfs/dbraw/zinc/55/04/04/567550404.db2.gz HMDVBRZHJMYFQU-MRXNPFEDSA-N 0 3 381.314 3.165 10 0 GGAEHN CC[C@@H]1CN(C(=O)CSc2nnc(-c3ccc(Cl)cc3)o2)C[C@H](C)N1 ZINC000620907715 567550450 /nfs/dbraw/zinc/55/04/50/567550450.db2.gz XKXDPUOJDDIIQU-SMDDNHRTSA-N 0 3 380.901 3.081 10 0 GGAEHN CC[C@@H]1CN(C(=O)c2cc(Br)cc(N3CCCC3)c2)C[C@H](C)N1 ZINC000620904004 567550815 /nfs/dbraw/zinc/55/08/15/567550815.db2.gz JXALKLCUMUUHJQ-XJKSGUPXSA-N 0 3 380.330 3.262 10 0 GGAEHN O=S(=O)(c1cccs1)N1CC[C@@H](CNCc2cnc(C3CCC3)s2)C1 ZINC000552015837 567550778 /nfs/dbraw/zinc/55/07/78/567550778.db2.gz YZVGLZZGGCHAGQ-ZDUSSCGKSA-N 0 3 397.591 3.273 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1cccc(Br)c1F ZINC000620912300 567550968 /nfs/dbraw/zinc/55/09/68/567550968.db2.gz OBSXWQVHNKEJAL-CYBMUJFWSA-N 0 3 399.304 3.304 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1ccc(F)c(Br)c1 ZINC000620915326 567551084 /nfs/dbraw/zinc/55/10/84/567551084.db2.gz IGPTZCUDERHBJJ-CQSZACIVSA-N 0 3 399.304 3.304 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1ccc(F)c(Br)c1 ZINC000620915325 567551132 /nfs/dbraw/zinc/55/11/32/567551132.db2.gz IGPTZCUDERHBJJ-AWEZNQCLSA-N 0 3 399.304 3.304 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1cccc(Br)c1 ZINC000620917352 567551175 /nfs/dbraw/zinc/55/11/75/567551175.db2.gz HMDVBRZHJMYFQU-INIZCTEOSA-N 0 3 381.314 3.165 10 0 GGAEHN C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)NC1COCCOC1 ZINC000644422311 567552017 /nfs/dbraw/zinc/55/20/17/567552017.db2.gz NXXHKAQKFACPEO-SNVBAGLBSA-N 0 3 380.794 3.081 10 0 GGAEHN CCc1nc(C(=O)N(CCN(CC)CC)c2ccc(Br)cn2)co1 ZINC000571289156 567552138 /nfs/dbraw/zinc/55/21/38/567552138.db2.gz RRSSMSNULAEQKB-UHFFFAOYSA-N 0 3 395.301 3.383 10 0 GGAEHN COc1cc(Br)ccc1CNC1CCN(c2cc(C)[nH]n2)CC1 ZINC000438918944 567554693 /nfs/dbraw/zinc/55/46/93/567554693.db2.gz LXBWRRJNBQCBCE-UHFFFAOYSA-N 0 3 379.302 3.248 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1cnnn1-c1c(Cl)cccc1Cl ZINC000479729350 567554804 /nfs/dbraw/zinc/55/48/04/567554804.db2.gz KPVQGMXVZYNWJN-GFCCVEGCSA-N 0 3 382.295 3.178 10 0 GGAEHN C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)NC1COCCOC1 ZINC000644552775 567558489 /nfs/dbraw/zinc/55/84/89/567558489.db2.gz RWXICCSTAAMEIQ-SNVBAGLBSA-N 0 3 380.794 3.081 10 0 GGAEHN C[C@@H](Cc1c(Cl)cccc1Cl)NC[C@@H]1CCCCN1S(C)(=O)=O ZINC000552100756 567558864 /nfs/dbraw/zinc/55/88/64/567558864.db2.gz UAYNLQYHTBXFBI-STQMWFEESA-N 0 3 379.353 3.328 10 0 GGAEHN Cc1cc(NCc2ccc(CN3CC[C@@H](O)C3)cc2)ncc1Br ZINC000664235287 567559343 /nfs/dbraw/zinc/55/93/43/567559343.db2.gz DRQBMIJCIJTUIP-MRXNPFEDSA-N 0 3 376.298 3.331 10 0 GGAEHN O=c1[nH]c2c(cc1CNC[C@H](O)COc1c(Cl)cccc1Cl)CCC2 ZINC000644564232 567559850 /nfs/dbraw/zinc/55/98/50/567559850.db2.gz FXIGGIOWFVMLMZ-ZDUSSCGKSA-N 0 3 383.275 3.112 10 0 GGAEHN CC(=O)Nc1ccccc1CNC[C@@H](O)COc1c(Cl)cccc1Cl ZINC000644574690 567560899 /nfs/dbraw/zinc/56/08/99/567560899.db2.gz ATLNVUXQUWXCBS-CQSZACIVSA-N 0 3 383.275 3.481 10 0 GGAEHN C[C@@H](Oc1ccccc1Br)C(=O)NC[C@@H]1CCN1C1CCCC1 ZINC000530031086 567561598 /nfs/dbraw/zinc/56/15/98/567561598.db2.gz ZEUJPVWPPRTTPQ-HIFRSBDPSA-N 0 3 381.314 3.350 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCC1)c1cccc(I)c1 ZINC000530024196 567561675 /nfs/dbraw/zinc/56/16/75/567561675.db2.gz AILXZGWNFWQLAX-OAHLLOKOSA-N 0 3 384.261 3.038 10 0 GGAEHN Cc1nc2ccc(Br)cn2c1C(=O)NC[C@H]1CCN1C1CCCC1 ZINC000530030496 567562330 /nfs/dbraw/zinc/56/23/30/567562330.db2.gz ZVSRWDPJNMSJBG-OAHLLOKOSA-N 0 3 391.313 3.152 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCC1)c1[nH]nc2ccc(Br)cc21 ZINC000530029514 567562430 /nfs/dbraw/zinc/56/24/30/567562430.db2.gz OKOSQLADEPZKFA-ZDUSSCGKSA-N 0 3 377.286 3.072 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCC1)c1ccccc1I ZINC000530029484 567562544 /nfs/dbraw/zinc/56/25/44/567562544.db2.gz ZSHHVQMNXYZWBE-ZDUSSCGKSA-N 0 3 384.261 3.038 10 0 GGAEHN CN(C)C[C@H](NC(=O)[C@H]1CCc2cncn2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031857 567563643 /nfs/dbraw/zinc/56/36/43/567563643.db2.gz CTOLTVONUHJALI-GUYCJALGSA-N 0 3 381.307 3.171 10 0 GGAEHN CC(C)[C@H]1CN(C(=O)c2c(F)c(F)c(Br)c(F)c2F)CCN1 ZINC000621161357 567564483 /nfs/dbraw/zinc/56/44/83/567564483.db2.gz XTLXLZVYPOATCH-SSDOTTSWSA-N 0 3 383.183 3.076 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cscc2Br)C[C@@H]1N1CCCC1 ZINC000552161476 567564669 /nfs/dbraw/zinc/56/46/69/567564669.db2.gz GKKRSMWHCJGORH-QWHCGFSZSA-N 0 3 375.357 3.162 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cscc2Br)C[C@H]1N1CCCC1 ZINC000552161474 567564721 /nfs/dbraw/zinc/56/47/21/567564721.db2.gz GKKRSMWHCJGORH-CHWSQXEVSA-N 0 3 375.357 3.162 10 0 GGAEHN CN(C)C[C@H]1CCCCN1C(=O)Cc1noc2ccc(Br)cc21 ZINC000644624863 567566276 /nfs/dbraw/zinc/56/62/76/567566276.db2.gz AHNWTDCYCYJNJI-CYBMUJFWSA-N 0 3 380.286 3.076 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N1CCC(c2ccccc2Br)CC1 ZINC000439113774 567566429 /nfs/dbraw/zinc/56/64/29/567566429.db2.gz CPYMMCZBBAQHGB-HNNXBMFYSA-N 0 3 380.330 3.432 10 0 GGAEHN COc1cc(Br)ccc1CNC[C@@H](O)COCc1cccs1 ZINC000644625766 567566540 /nfs/dbraw/zinc/56/65/40/567566540.db2.gz RACDSQXTXMXLMB-CQSZACIVSA-N 0 3 386.311 3.187 10 0 GGAEHN COc1cc(Br)ccc1CNC[C@H](O)COCc1ccccc1 ZINC000644625778 567566565 /nfs/dbraw/zinc/56/65/65/567566565.db2.gz SGHPCFALOUUZHF-KRWDZBQOSA-N 0 3 380.282 3.125 10 0 GGAEHN CCN(C(=O)NCC(C)(C)c1ccccc1Br)[C@@H]1CCN(C)C1 ZINC000664499929 567572054 /nfs/dbraw/zinc/57/20/54/567572054.db2.gz LTVBPEIJMUHFKQ-CQSZACIVSA-N 0 3 382.346 3.462 10 0 GGAEHN O=C(COc1cc(Cl)ccc1Br)NC1CCN(C2CC2)CC1 ZINC000530124943 567572256 /nfs/dbraw/zinc/57/22/56/567572256.db2.gz FVYBCUXPIUDRIZ-UHFFFAOYSA-N 0 3 387.705 3.224 10 0 GGAEHN CN(C(=O)N[C@@H](c1cncc(Br)c1)C1CC1)[C@H]1CCN(C2CC2)C1 ZINC000505393496 567572759 /nfs/dbraw/zinc/57/27/59/567572759.db2.gz BZWNGSVCKVORDK-DLBZAZTESA-N 0 3 393.329 3.173 10 0 GGAEHN CN(C(=O)N[C@H](c1cncc(Br)c1)C1CC1)[C@@H]1CCN(C2CC2)C1 ZINC000505393499 567573214 /nfs/dbraw/zinc/57/32/14/567573214.db2.gz BZWNGSVCKVORDK-SJORKVTESA-N 0 3 393.329 3.173 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2CC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000644735784 567573959 /nfs/dbraw/zinc/57/39/59/567573959.db2.gz GCYWLUYWDPHKQO-WBAXXEDZSA-N 0 3 382.335 3.293 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2CC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000644735781 567573979 /nfs/dbraw/zinc/57/39/79/567573979.db2.gz GCYWLUYWDPHKQO-QGTPRVQTSA-N 0 3 382.335 3.293 10 0 GGAEHN COc1cc(CN[C@H]2CCN(C)[C@H]2c2ccccc2)c(Br)cn1 ZINC000621290947 567574476 /nfs/dbraw/zinc/57/44/76/567574476.db2.gz AALSSWSXUBWRKM-WMZOPIPTSA-N 0 3 376.298 3.388 10 0 GGAEHN CCN(C(=O)N[C@H](C)[C@@H](OC)c1ccc(Br)cc1)[C@H]1CCN(C)C1 ZINC000664583660 567577275 /nfs/dbraw/zinc/57/72/75/567577275.db2.gz YUMIVQUTUWBMEW-XOKHGSTOSA-N 0 3 398.345 3.261 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)NCCc1ccc(Br)s1 ZINC000571639231 567577960 /nfs/dbraw/zinc/57/79/60/567577960.db2.gz KZWFENKEAFDRDA-OAHLLOKOSA-N 0 3 394.338 3.321 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3csc(-c4cc(Br)cs4)n3)[C@H]2C1 ZINC000644812110 567578897 /nfs/dbraw/zinc/57/88/97/567578897.db2.gz CBVWBGKZJNKVLI-SKDRFNHKSA-N 0 3 398.351 3.410 10 0 GGAEHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)Cc1c(F)ccc(Br)c1F ZINC000552333014 567578926 /nfs/dbraw/zinc/57/89/26/567578926.db2.gz QSTYWQDXSGJTOF-RYUDHWBXSA-N 0 3 387.268 3.355 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3csc(-c4ccc(Br)s4)n3)[C@H]2C1 ZINC000644822371 567580474 /nfs/dbraw/zinc/58/04/74/567580474.db2.gz SCQMCNOVHYAWFY-KOLCDFICSA-N 0 3 398.351 3.410 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)CCc3nc4cc(Br)ccc4s3)[C@H]2C1 ZINC000644818939 567580754 /nfs/dbraw/zinc/58/07/54/567580754.db2.gz OYSBVLCKEMGGHM-RISCZKNCSA-N 0 3 394.338 3.154 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3coc(-c4ccc(Br)cc4F)n3)[C@@H]2C1 ZINC000644816369 567580946 /nfs/dbraw/zinc/58/09/46/567580946.db2.gz VBVOCJOHWSPFCC-MEBBXXQBSA-N 0 3 394.244 3.019 10 0 GGAEHN Cc1cc(C(=O)N2CC[C@H]3CN(C)C[C@H]32)nn1-c1ccc(Cl)cc1Cl ZINC000644818381 567581030 /nfs/dbraw/zinc/58/10/30/567581030.db2.gz LVVRQLATAYIQLW-YVEFUNNKSA-N 0 3 379.291 3.264 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3cc(Br)cc(C(F)(F)F)c3)[C@@H]2C1 ZINC000644813349 567581041 /nfs/dbraw/zinc/58/10/41/567581041.db2.gz BEGSXNXPKLXSBE-NOZJJQNGSA-N 0 3 377.204 3.244 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)Cc3csc4ccc(Br)cc34)[C@H]2C1 ZINC000644820465 567581076 /nfs/dbraw/zinc/58/10/76/567581076.db2.gz WOHDBPHVFQCXPD-ABAIWWIYSA-N 0 3 379.323 3.369 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3ccc(Br)c(OC(F)(F)F)c3)[C@H]2C1 ZINC000644814673 567581085 /nfs/dbraw/zinc/58/10/85/567581085.db2.gz LNQUBBQLFFRCBN-PWSUYJOCSA-N 0 3 393.203 3.124 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)c3coc(-c4ccc(Br)cc4F)n3)[C@@H]2C1 ZINC000644816371 567581112 /nfs/dbraw/zinc/58/11/12/567581112.db2.gz VBVOCJOHWSPFCC-ZUZCIYMTSA-N 0 3 394.244 3.019 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)c3cc(C(F)(F)F)ccc3Br)[C@@H]2C1 ZINC000644821002 567581220 /nfs/dbraw/zinc/58/12/20/567581220.db2.gz GPHWWPUORRHVGT-NOZJJQNGSA-N 0 3 377.204 3.244 10 0 GGAEHN Brc1cnn(CCCNCc2ccnn2CCc2ccccc2)c1 ZINC000621355764 567581590 /nfs/dbraw/zinc/58/15/90/567581590.db2.gz XCFIYHLPCHZSGR-UHFFFAOYSA-N 0 3 388.313 3.265 10 0 GGAEHN CSc1ccc([C@H](CNC(=O)N[C@@H](CO)c2ccsc2)N(C)C)cc1 ZINC000458878933 567582209 /nfs/dbraw/zinc/58/22/09/567582209.db2.gz BWKZNNISOUQTPT-IRXDYDNUSA-N 0 3 379.551 3.106 10 0 GGAEHN COc1cc(CN2CC[C@H]3CN(C)C[C@H]32)cc(Br)c1OC(F)F ZINC000644839966 567582657 /nfs/dbraw/zinc/58/26/57/567582657.db2.gz HTTWSUXTRNETMQ-WCQYABFASA-N 0 3 391.256 3.195 10 0 GGAEHN CCN(C(=O)NCc1cc2cc(Br)ccc2[nH]1)[C@H]1CCN(C)C1 ZINC000664690783 567583178 /nfs/dbraw/zinc/58/31/78/567583178.db2.gz WQLKIFJFCJMQFT-HNNXBMFYSA-N 0 3 379.302 3.166 10 0 GGAEHN O=C1N[C@@H](c2ccc(Br)cc2)C(=O)N1C[C@@H]1CCN1C1CCCC1 ZINC000530212584 567584848 /nfs/dbraw/zinc/58/48/48/567584848.db2.gz LEMOXJMQIGDAIO-HOTGVXAUSA-N 0 3 392.297 3.059 10 0 GGAEHN C[C@]1(CNC[C@H](O)c2ccccc2Br)COc2ccccc2O1 ZINC000530234318 567586293 /nfs/dbraw/zinc/58/62/93/567586293.db2.gz ASPRXWJDNFJUQC-YJBOKZPZSA-N 0 3 378.266 3.302 10 0 GGAEHN COC[C@H](NC[C@H](O)COc1cc(F)cc(Br)c1)c1ccccc1 ZINC000439460168 567588910 /nfs/dbraw/zinc/58/89/10/567588910.db2.gz WZCSJAFWCSZWQO-WMZOPIPTSA-N 0 3 398.272 3.305 10 0 GGAEHN CN(CCC(=O)N[C@H](c1cncc(Br)c1)C1CC1)c1ccncc1 ZINC000552429595 567590076 /nfs/dbraw/zinc/59/00/76/567590076.db2.gz AZJBTVBPMPWEPF-SFHVURJKSA-N 0 3 389.297 3.333 10 0 GGAEHN O=C(NC/C=C/c1ccc(Br)cc1)N1CC[C@@H](N2CC=CC2)C1 ZINC000458958325 567590285 /nfs/dbraw/zinc/59/02/85/567590285.db2.gz ACVMTKAHNWBDBX-REMYHPOOSA-N 0 3 376.298 3.118 10 0 GGAEHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)N[C@@H]1CCOC1(C)C ZINC000458956598 567590367 /nfs/dbraw/zinc/59/03/67/567590367.db2.gz PXRZEPXJIHTXHW-MRXNPFEDSA-N 0 3 398.345 3.090 10 0 GGAEHN CCN(C(=O)N[C@H]1CCOc2c(Br)cccc21)[C@@H]1CCN(CC)C1 ZINC000664822730 567592184 /nfs/dbraw/zinc/59/21/84/567592184.db2.gz BSEMJFPQFXUCMV-CJNGLKHVSA-N 0 3 396.329 3.398 10 0 GGAEHN CCN(C(=O)N[C@@H]1CCOc2c(Br)cccc21)[C@H]1CCN(CC)C1 ZINC000664822737 567592483 /nfs/dbraw/zinc/59/24/83/567592483.db2.gz BSEMJFPQFXUCMV-XJKSGUPXSA-N 0 3 396.329 3.398 10 0 GGAEHN CCN(C(=O)N[C@H](c1cncc(Br)c1)C1CC1)[C@H]1CCN(CC)C1 ZINC000664850177 567594943 /nfs/dbraw/zinc/59/49/43/567594943.db2.gz IJQGBCTZNRUKKS-IRXDYDNUSA-N 0 3 395.345 3.421 10 0 GGAEHN Cc1nccc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c1Br ZINC000530354404 567595433 /nfs/dbraw/zinc/59/54/33/567595433.db2.gz CXCSHUWXWIKKSM-DOTOQJQBSA-N 0 3 389.297 3.141 10 0 GGAEHN CCN(CC)CCN(C(=O)c1ccn(C)c1)c1ccc(Br)cn1 ZINC000571885187 567596571 /nfs/dbraw/zinc/59/65/71/567596571.db2.gz DIYLLJKGXNIEHI-UHFFFAOYSA-N 0 3 379.302 3.171 10 0 GGAEHN O=C(N[C@@H]1CCc2c1ccc(F)c2Br)N1CCN2CCC1CC2 ZINC000459049721 567596724 /nfs/dbraw/zinc/59/67/24/567596724.db2.gz WERMLRWDNNPPIH-OAHLLOKOSA-N 0 3 382.277 3.065 10 0 GGAEHN CCN(C(=O)NCc1cc(F)c(F)cc1Br)[C@H]1CCN(CC)C1 ZINC000664887548 567597529 /nfs/dbraw/zinc/59/75/29/567597529.db2.gz UKDZNCGIPKWSNJ-LBPRGKRZSA-N 0 3 390.272 3.353 10 0 GGAEHN O=C(N[C@H]1CCc2c1ccc(F)c2Br)N1CC[C@H](N2CC=CC2)C1 ZINC000459072728 567598038 /nfs/dbraw/zinc/59/80/38/567598038.db2.gz SUZOEVMCLDXYQC-LRDDRELGSA-N 0 3 394.288 3.231 10 0 GGAEHN Brc1ccc([C@H](Cc2ccccn2)NC[C@H]2COCCO2)cc1 ZINC000552575767 567598294 /nfs/dbraw/zinc/59/82/94/567598294.db2.gz HMYZUMJJXMZNND-ROUUACIJSA-N 0 3 377.282 3.133 10 0 GGAEHN CCN(C(=O)NCCc1c[nH]c2cccc(Br)c12)[C@H]1CCN(C)C1 ZINC000664920279 567598997 /nfs/dbraw/zinc/59/89/97/567598997.db2.gz NRYXPMZOMQLFNY-AWEZNQCLSA-N 0 3 393.329 3.209 10 0 GGAEHN Cc1c(Cl)cccc1S(=O)(=O)NC[C@H]1CCN(Cc2ccccc2)C1 ZINC000480437258 567604955 /nfs/dbraw/zinc/60/49/55/567604955.db2.gz ORCFIQDCUCDKRF-QGZVFWFLSA-N 0 3 378.925 3.449 10 0 GGAEHN CCN(C(=O)N[C@@H]1CCc2c1ccc(F)c2Br)[C@@H]1CCN(C)C1 ZINC000665040721 567606193 /nfs/dbraw/zinc/60/61/93/567606193.db2.gz UFMLSCYFQSBBKA-IAQYHMDHSA-N 0 3 384.293 3.311 10 0 GGAEHN CCN(C(=O)N[C@@H]1CCc2c1ccc(F)c2Br)[C@H]1CCN(C)C1 ZINC000665040728 567606331 /nfs/dbraw/zinc/60/63/31/567606331.db2.gz UFMLSCYFQSBBKA-XHDPSFHLSA-N 0 3 384.293 3.311 10 0 GGAEHN OC[C@H](CNCc1cc(O)ccc1Br)Cc1ccc(F)c(F)c1 ZINC000480463161 567607648 /nfs/dbraw/zinc/60/76/48/567607648.db2.gz SAMCXPIBKRRSRO-LBPRGKRZSA-N 0 3 386.236 3.374 10 0 GGAEHN O=C(Nc1ccc(Br)cc1)C(C[C@H]1COCCO1)C(F)(F)F ZINC000665074483 567608032 /nfs/dbraw/zinc/60/80/32/567608032.db2.gz CNDXIIJRCOQFAB-RYUDHWBXSA-N 0 3 382.176 3.372 10 0 GGAEHN O=C(Nc1cccc(Br)c1)C(C[C@H]1COCCO1)C(F)(F)F ZINC000665075061 567608111 /nfs/dbraw/zinc/60/81/11/567608111.db2.gz IROQNHBMBODHLG-NWDGAFQWSA-N 0 3 382.176 3.372 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)N1CCO[C@]2(CCSC2)C1)c1ccsc1 ZINC000645141759 567608623 /nfs/dbraw/zinc/60/86/23/567608623.db2.gz RAYQUBBLJZLKCP-SJLPKXTDSA-N 0 3 383.583 3.049 10 0 GGAEHN C[C@@H](CN[C@H](c1ccc(Br)cc1)C(F)F)CN1CCN(C)CC1 ZINC000621751669 567608549 /nfs/dbraw/zinc/60/85/49/567608549.db2.gz LGAAISJNESQWBJ-XJKSGUPXSA-N 0 3 390.316 3.228 10 0 GGAEHN C[C@@H](CCN1CCN(C)CC1)N[C@H](c1ccc(Br)cc1)C(F)F ZINC000621760696 567610749 /nfs/dbraw/zinc/61/07/49/567610749.db2.gz PYLSASPSTASJQZ-XJKSGUPXSA-N 0 3 390.316 3.371 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)NCc1cc(F)c(F)cc1Br ZINC000506164204 567612814 /nfs/dbraw/zinc/61/28/14/567612814.db2.gz PNXNLUFXNIUFNC-NSHDSACASA-N 0 3 390.272 3.401 10 0 GGAEHN CCN(C(=O)Nc1nnc(SCc2ccccc2)s1)[C@@H]1CCN(C)C1 ZINC000665190027 567613350 /nfs/dbraw/zinc/61/33/50/567613350.db2.gz WRJWIBDZSNCWFT-CQSZACIVSA-N 0 3 377.539 3.388 10 0 GGAEHN Cc1cc(S(=O)(=O)N2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)c(C)s1 ZINC000480583682 567613863 /nfs/dbraw/zinc/61/38/63/567613863.db2.gz HHWAXRCEFGLVII-HDICACEKSA-N 0 3 376.547 3.117 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)c1cc2c(cc1Br)OCO2 ZINC000621861289 567616573 /nfs/dbraw/zinc/61/65/73/567616573.db2.gz XFLMXENHYAPNRL-RYUDHWBXSA-N 0 3 383.286 3.171 10 0 GGAEHN CCOc1cc(CN2CC[C@H](C[NH+]3CCCC3)C2)cc(Br)c1[O-] ZINC000459337123 567616980 /nfs/dbraw/zinc/61/69/80/567616980.db2.gz FCYFUCSZWYHLSG-CQSZACIVSA-N 0 3 383.330 3.471 10 0 GGAEHN COc1ccc(Br)cc1C1(NC(=O)N[C@@H]2CCN(C)[C@H](C)C2)CC1 ZINC000645323790 567617697 /nfs/dbraw/zinc/61/76/97/567617697.db2.gz VCRSMUHKGIKIBF-TZMCWYRMSA-N 0 3 396.329 3.229 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1cc(Br)c2ccccc2c1 ZINC000645308559 567618262 /nfs/dbraw/zinc/61/82/62/567618262.db2.gz ZLFKEXHAXBKMSD-MRXNPFEDSA-N 0 3 391.309 3.443 10 0 GGAEHN COC(=O)[C@@H]1CC12CCN(C[C@H](O)COc1c(Cl)cccc1Cl)CC2 ZINC000506264397 567619997 /nfs/dbraw/zinc/61/99/97/567619997.db2.gz OLAQIKHIIPFHDZ-STQMWFEESA-N 0 3 388.291 3.008 10 0 GGAEHN Brc1cccc(N2CC[C@H](CNCc3cn4cccnc4n3)C2)c1 ZINC000459388577 567620195 /nfs/dbraw/zinc/62/01/95/567620195.db2.gz FZYCMDUMKACTIN-CQSZACIVSA-N 0 3 386.297 3.108 10 0 GGAEHN O=C(c1cscc1C(F)(F)F)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000621912884 567620770 /nfs/dbraw/zinc/62/07/70/567620770.db2.gz VYLVDKJMNINSPZ-CYBMUJFWSA-N 0 3 376.444 3.484 10 0 GGAEHN COC(=O)CCC1CCN(C[C@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000530763169 567622190 /nfs/dbraw/zinc/62/21/90/567622190.db2.gz XWDIEYGWGBBBCD-AWEZNQCLSA-N 0 3 390.307 3.398 10 0 GGAEHN CCOc1cc(C[NH2+]C[C@H](O)Cc2ccccc2)cc(Br)c1[O-] ZINC000459399202 567622731 /nfs/dbraw/zinc/62/27/31/567622731.db2.gz ARIFCPSPRSZUAX-OAHLLOKOSA-N 0 3 380.282 3.247 10 0 GGAEHN CCOc1cc(C[NH2+]C[C@H](CO)c2ccccc2)cc(Br)c1[O-] ZINC000459426227 567623396 /nfs/dbraw/zinc/62/33/96/567623396.db2.gz NNGNHFIFGLEVEO-OAHLLOKOSA-N 0 3 380.282 3.419 10 0 GGAEHN CCN1CCN(Cc2ccc(CNC(=O)c3sccc3Cl)cc2)CC1 ZINC000506460540 567626899 /nfs/dbraw/zinc/62/68/99/567626899.db2.gz OWKAXNRWEAANTN-UHFFFAOYSA-N 0 3 377.941 3.469 10 0 GGAEHN COc1cc(Br)ccc1CCCNCc1cn2cccnc2n1 ZINC000459479237 567627520 /nfs/dbraw/zinc/62/75/20/567627520.db2.gz KBEUMRXFWWEIEZ-UHFFFAOYSA-N 0 3 375.270 3.223 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000665529394 567628471 /nfs/dbraw/zinc/62/84/71/567628471.db2.gz JGTQYWSWIZUKJV-MRXNPFEDSA-N 0 3 380.330 3.263 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)c1c(F)c(F)c(Br)c(F)c1F ZINC000665529477 567629023 /nfs/dbraw/zinc/62/90/23/567629023.db2.gz LNOHKABUFRTUPM-SSDOTTSWSA-N 0 3 383.183 3.220 10 0 GGAEHN CCOc1cc(C[NH2+][C@H](CO)Cc2ccccc2)cc(Br)c1[O-] ZINC000459507680 567631108 /nfs/dbraw/zinc/63/11/08/567631108.db2.gz KXHFJKKOGFDRQP-HNNXBMFYSA-N 0 3 380.282 3.247 10 0 GGAEHN CCCN(C(=O)N[C@@H]1CCOc2c(Br)cccc21)[C@@H]1CCN(C)C1 ZINC000645491990 567632846 /nfs/dbraw/zinc/63/28/46/567632846.db2.gz FZVJLKXXMWJJQZ-CZUORRHYSA-N 0 3 396.329 3.398 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)NCCCCc1ccc(Cl)s1)CCO2 ZINC000645497233 567633769 /nfs/dbraw/zinc/63/37/69/567633769.db2.gz NNWHNULYCBAXNM-UHFFFAOYSA-N 0 3 385.961 3.230 10 0 GGAEHN CCOc1cc(CN2CCC[C@H]3C[N@H+](C)CC[C@H]32)cc(Br)c1[O-] ZINC000459550642 567635907 /nfs/dbraw/zinc/63/59/07/567635907.db2.gz KKHXLWMFJHXOHO-GOEBONIOSA-N 0 3 383.330 3.470 10 0 GGAEHN CCOc1cc(CN2CCC[C@H]3C[N@@H+](C)CC[C@H]32)cc(Br)c1[O-] ZINC000459550642 567635911 /nfs/dbraw/zinc/63/59/11/567635911.db2.gz KKHXLWMFJHXOHO-GOEBONIOSA-N 0 3 383.330 3.470 10 0 GGAEHN CCOc1cc(C[NH2+]C[C@H](O)Cc2cccc(F)c2)cc(Br)c1[O-] ZINC000459572565 567639017 /nfs/dbraw/zinc/63/90/17/567639017.db2.gz QVCDGIAOWHSYRC-OAHLLOKOSA-N 0 3 398.272 3.386 10 0 GGAEHN CCOc1cc(C[NH2+]C[C@@H](O)Cc2cccc(F)c2)cc(Br)c1[O-] ZINC000459572562 567639843 /nfs/dbraw/zinc/63/98/43/567639843.db2.gz QVCDGIAOWHSYRC-HNNXBMFYSA-N 0 3 398.272 3.386 10 0 GGAEHN CCOc1cc(CN[C@H](C(=O)N(C)CC)C(C)C)cc(Br)c1O ZINC000459570518 567640112 /nfs/dbraw/zinc/64/01/12/567640112.db2.gz DNPPLOHQBYCBCF-HNNXBMFYSA-N 0 3 387.318 3.146 10 0 GGAEHN CCN(C(=O)Nc1cc(OC)c(OC)cc1Br)[C@H]1CCN(C)C1 ZINC000665836126 567640149 /nfs/dbraw/zinc/64/01/49/567640149.db2.gz KZLGLGVSDTZYTP-NSHDSACASA-N 0 3 386.290 3.024 10 0 GGAEHN COc1cc(C[NH2+]C[C@@H](CO)Cc2ccc(F)cc2)cc(Br)c1[O-] ZINC000531094441 567640753 /nfs/dbraw/zinc/64/07/53/567640753.db2.gz BSRNFVBBIGKTEX-AWEZNQCLSA-N 0 3 398.272 3.243 10 0 GGAEHN CCN(C(=O)Nc1ccccc1I)[C@H]1CCN(CC)C1 ZINC000596627043 567643778 /nfs/dbraw/zinc/64/37/78/567643778.db2.gz SORDBTGGZIGHTN-LBPRGKRZSA-N 0 3 387.265 3.239 10 0 GGAEHN O=C(C(C[C@H]1COCCO1)C(F)(F)F)N1CCCSc2ccccc21 ZINC000665927608 567644710 /nfs/dbraw/zinc/64/47/10/567644710.db2.gz WRYNYDKGKFIYON-STQMWFEESA-N 0 3 375.412 3.499 10 0 GGAEHN CCN(C(=O)Nc1cccc(I)c1)[C@H]1CCN(CC)C1 ZINC000596630850 567645277 /nfs/dbraw/zinc/64/52/77/567645277.db2.gz APVAQVDZKQDFAP-AWEZNQCLSA-N 0 3 387.265 3.239 10 0 GGAEHN CN(CCNS(=O)(=O)Cc1ccc(Br)cc1)C1CCCCC1 ZINC000480960823 567646358 /nfs/dbraw/zinc/64/63/58/567646358.db2.gz SSEOVEUFSRNSFC-UHFFFAOYSA-N 0 3 389.359 3.133 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNS(=O)(=O)Cc1ccc(Br)cc1 ZINC000480988435 567649523 /nfs/dbraw/zinc/64/95/23/567649523.db2.gz NSQMVXGNZUUSDM-ZIAGYGMSSA-N 0 3 389.359 3.131 10 0 GGAEHN OC[C@@]1(O)CCCN(Cc2ccc(-c3cccc(Br)c3)s2)C1 ZINC000459726406 567654293 /nfs/dbraw/zinc/65/42/93/567654293.db2.gz QFTOUMBQAPXSPY-QGZVFWFLSA-N 0 3 382.323 3.497 10 0 GGAEHN Cc1cc(Br)cc(C)c1S(=O)(=O)NCCCN1CCCCC1 ZINC000507019878 567654404 /nfs/dbraw/zinc/65/44/04/567654404.db2.gz GQYYVZIJHRMWFN-UHFFFAOYSA-N 0 3 389.359 3.220 10 0 GGAEHN COc1cccc2c1OCC[C@H]2N[C@H](C)Cn1cc(Br)ccc1=O ZINC000666100629 567654491 /nfs/dbraw/zinc/65/44/91/567654491.db2.gz PGZDHPDUKVRQOU-IUODEOHRSA-N 0 3 393.281 3.121 10 0 GGAEHN CCN(C(=O)Nc1ccc(Br)cc1C(=O)OC)[C@H]1CCN(CC)C1 ZINC000596805120 567654699 /nfs/dbraw/zinc/65/46/99/567654699.db2.gz JFBOEMJEKPTBRG-ZDUSSCGKSA-N 0 3 398.301 3.184 10 0 GGAEHN C[N@H+](CCC[N-]S(=O)(=O)c1cccnc1C(F)(F)F)C1CCCCC1 ZINC000553436393 567655266 /nfs/dbraw/zinc/65/52/66/567655266.db2.gz ZCEONZOLXZQGGP-UHFFFAOYSA-N 0 3 379.448 3.033 10 0 GGAEHN C[N@@H+](CCC[N-]S(=O)(=O)c1cccnc1C(F)(F)F)C1CCCCC1 ZINC000553436393 567655271 /nfs/dbraw/zinc/65/52/71/567655271.db2.gz ZCEONZOLXZQGGP-UHFFFAOYSA-N 0 3 379.448 3.033 10 0 GGAEHN OCC1(NCc2cnn(-c3ccc(Br)cc3)c2)Cc2ccccc2C1 ZINC000553454721 567655281 /nfs/dbraw/zinc/65/52/81/567655281.db2.gz PRDWBWVKMOILNH-UHFFFAOYSA-N 0 3 398.304 3.254 10 0 GGAEHN C[S@@](=O)c1ccc(CN[C@@H]2CCO[C@H]2c2cncc(Br)c2)cc1 ZINC000459752755 567656521 /nfs/dbraw/zinc/65/65/21/567656521.db2.gz CBHJPQIJGZWNAQ-SAHWJRBASA-N 0 3 395.322 3.201 10 0 GGAEHN COC(=O)c1cc(NC(=O)NC[C@@H]2CCN2C(C)(C)C)ccc1Br ZINC000596821050 567657273 /nfs/dbraw/zinc/65/72/73/567657273.db2.gz SFNAZVSWIBZYFG-LBPRGKRZSA-N 0 3 398.301 3.230 10 0 GGAEHN Brc1ccc2ncc(CNCC[C@H]3COc4ccccc4O3)n2c1 ZINC000481085014 567657209 /nfs/dbraw/zinc/65/72/09/567657209.db2.gz AQUXQYOHXDLKQQ-HNNXBMFYSA-N 0 3 388.265 3.417 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cnc(-c3ccc(F)c(F)c3)s2)C[C@H]1N(C)C ZINC000507087737 567658503 /nfs/dbraw/zinc/65/85/03/567658503.db2.gz QKOZXPPIVHUMIU-HIFRSBDPSA-N 0 3 383.489 3.206 10 0 GGAEHN Cc1cc(C(=O)NC[C@@H](C)N2CCCC2)nn1-c1ccc(Br)cc1 ZINC000531429353 567658704 /nfs/dbraw/zinc/65/87/04/567658704.db2.gz WBYXZCBCNXWKPC-CQSZACIVSA-N 0 3 391.313 3.157 10 0 GGAEHN C[C@@H]1CCCN(CCNC(=O)N[C@H]2CCOc3c(Br)cccc32)C1 ZINC000507100468 567660417 /nfs/dbraw/zinc/66/04/17/567660417.db2.gz HHOBGIZTQSITPB-CJNGLKHVSA-N 0 3 396.329 3.304 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@H]1CCOc2c(F)cccc21 ZINC000572741850 567661380 /nfs/dbraw/zinc/66/13/80/567661380.db2.gz FZSWTFHRQXDFDE-ABAIWWIYSA-N 0 3 381.245 3.252 10 0 GGAEHN COC(=O)c1cccc(NC(=O)NC[C@H]2CCN2C(C)(C)C)c1Br ZINC000596873072 567661535 /nfs/dbraw/zinc/66/15/35/567661535.db2.gz QIHOYOILAUNEMJ-LLVKDONJSA-N 0 3 398.301 3.230 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@H]1CCOc2c(F)cccc21 ZINC000572741851 567662014 /nfs/dbraw/zinc/66/20/14/567662014.db2.gz FZSWTFHRQXDFDE-NHYWBVRUSA-N 0 3 381.245 3.252 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)C(C)(C)c2cccc(Br)c2)CCSC1 ZINC000481220097 567663684 /nfs/dbraw/zinc/66/36/84/567663684.db2.gz HUSBOZGPLKMJCU-QGZVFWFLSA-N 0 3 385.371 3.280 10 0 GGAEHN CCN(C(=O)Nc1cc(C)cc(I)c1)[C@@H]1CCN(C)C1 ZINC000596913598 567664639 /nfs/dbraw/zinc/66/46/39/567664639.db2.gz KBEAYPMVTXACTO-CQSZACIVSA-N 0 3 387.265 3.158 10 0 GGAEHN CN(C)C[C@H]1CN(C(=O)Cc2cscc2Br)c2ccccc2O1 ZINC000645787643 567666695 /nfs/dbraw/zinc/66/66/95/567666695.db2.gz SPWOSCWTQSJGFN-ZDUSSCGKSA-N 0 3 395.322 3.409 10 0 GGAEHN CCN(C(=O)Nc1nc(SCc2ccccc2)ns1)[C@H]1CCN(C)C1 ZINC000666349062 567666763 /nfs/dbraw/zinc/66/67/63/567666763.db2.gz CHBSOJAGUMCYCJ-AWEZNQCLSA-N 0 3 377.539 3.388 10 0 GGAEHN CN(C)CC(C)(C)NC(=O)N[C@H]1CSCc2ccc(Br)cc21 ZINC000666400028 567672181 /nfs/dbraw/zinc/67/21/81/567672181.db2.gz AAOYYFXLDNQKIK-AWEZNQCLSA-N 0 3 386.359 3.376 10 0 GGAEHN CCN(C(=O)N[C@H]1CSCc2ccc(Br)cc21)[C@H]1CCN(C)C1 ZINC000666399420 567672266 /nfs/dbraw/zinc/67/22/66/567672266.db2.gz LKMPVWHKYKGTDK-HOCLYGCPSA-N 0 3 398.370 3.473 10 0 GGAEHN CC[C@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccc(Br)cc1 ZINC000507268277 567672582 /nfs/dbraw/zinc/67/25/82/567672582.db2.gz QEBOJIWFTIMODG-CVEARBPZSA-N 0 3 389.359 3.304 10 0 GGAEHN CCN(C(=O)N[C@H]1CSCc2ccc(Br)cc21)[C@@H]1CCN(C)C1 ZINC000666399421 567672634 /nfs/dbraw/zinc/67/26/34/567672634.db2.gz LKMPVWHKYKGTDK-ZBFHGGJFSA-N 0 3 398.370 3.473 10 0 GGAEHN CN(CCN1CCCC1)C(=O)N[C@H]1CSCc2ccc(Br)cc21 ZINC000666401205 567673481 /nfs/dbraw/zinc/67/34/81/567673481.db2.gz BWTHRWKOVSBNBR-INIZCTEOSA-N 0 3 398.370 3.474 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)N1CCC(c2ccc(Br)cc2)CC1 ZINC000507305531 567673717 /nfs/dbraw/zinc/67/37/17/567673717.db2.gz OAZWDYMYJFNTQT-KRWDZBQOSA-N 0 3 380.330 3.432 10 0 GGAEHN CN1C[C@@H](c2ccccc2)[C@H](CNS(=O)(=O)Cc2cccc(Cl)c2)C1 ZINC000645843223 567673798 /nfs/dbraw/zinc/67/37/98/567673798.db2.gz FJYCGPLMERSRPO-MJGOQNOKSA-N 0 3 378.925 3.105 10 0 GGAEHN CSc1ccccc1S(=O)(=O)NC[C@@H]1CN(C)C[C@H]1c1ccccc1 ZINC000645843401 567674473 /nfs/dbraw/zinc/67/44/73/567674473.db2.gz PAWLUWZLIILUBC-SJORKVTESA-N 0 3 376.547 3.032 10 0 GGAEHN CN(CCN(C)C1CC1)C(=O)N[C@H]1CSCc2ccc(Br)cc21 ZINC000666401853 567674631 /nfs/dbraw/zinc/67/46/31/567674631.db2.gz QRDFFUDFBWMLMS-INIZCTEOSA-N 0 3 398.370 3.473 10 0 GGAEHN CN1CC=C(CNC(=O)N[C@H]2CSCc3ccc(Br)cc32)CC1 ZINC000666402089 567674764 /nfs/dbraw/zinc/67/47/64/567674764.db2.gz UWXLWFNJNFRVDN-INIZCTEOSA-N 0 3 396.354 3.298 10 0 GGAEHN C[C@H](NCCCN1CCC[C@@H]1C(=O)N(C)C)c1sccc1Br ZINC000531705948 567674945 /nfs/dbraw/zinc/67/49/45/567674945.db2.gz DZBFKBPPKHUTOO-GXTWGEPZSA-N 0 3 388.375 3.104 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1cscc1C(F)(F)F ZINC000622992739 567677351 /nfs/dbraw/zinc/67/73/51/567677351.db2.gz XHDDLIKVIJJDKI-LBPRGKRZSA-N 0 3 376.444 3.482 10 0 GGAEHN CC(=O)NCCCNCc1cc(Br)c(C)cc1Br ZINC000623346833 567703505 /nfs/dbraw/zinc/70/35/05/567703505.db2.gz DRVLIQCGACDGHJ-UHFFFAOYSA-N 0 3 378.108 3.136 10 0 GGAEHN Cc1nc(C)c(S(=O)(=O)NCc2ccccc2CN2CCCCC2)s1 ZINC000481463465 567679755 /nfs/dbraw/zinc/67/97/55/567679755.db2.gz JHWPRTHCQFUDAF-UHFFFAOYSA-N 0 3 379.551 3.224 10 0 GGAEHN CN(C)Cc1ccc(NC(=O)[C@@H]2CNCc3ccccc32)cc1Br ZINC000572999454 567681036 /nfs/dbraw/zinc/68/10/36/567681036.db2.gz XQAUISYGWLVSBD-QGZVFWFLSA-N 0 3 388.309 3.336 10 0 GGAEHN CS[C@@H]1CN(CC(=O)Nc2cc(Cl)ccc2Cl)C[C@H]1N1CCCC1 ZINC000460351910 567685218 /nfs/dbraw/zinc/68/52/18/567685218.db2.gz BDOLKKKYMPLXNS-HZPDHXFCSA-N 0 3 388.364 3.444 10 0 GGAEHN CN1CC[C@H](CNC(=O)c2cc(Oc3cccc(Br)c3)ccn2)C1 ZINC000531885580 567685537 /nfs/dbraw/zinc/68/55/37/567685537.db2.gz BOXRDGVXHQZCQG-CYBMUJFWSA-N 0 3 390.281 3.318 10 0 GGAEHN CCO[C@@H]1C[C@](N)(C(=O)N[C@@H](C)c2ccc(Br)cc2OC)C1(C)C ZINC000573088687 567685908 /nfs/dbraw/zinc/68/59/08/567685908.db2.gz YIGDUPPNLPJMQO-POHZPAGDSA-N 0 3 399.329 3.167 10 0 GGAEHN CCOc1cc(C[NH2+][C@@H]2CCC[C@H]([S@](C)=O)C2)cc(Br)c1[O-] ZINC000597184839 567687154 /nfs/dbraw/zinc/68/71/54/567687154.db2.gz QJYMHOCUCSNCCV-IFMYKAFSSA-N 0 3 390.343 3.333 10 0 GGAEHN CC1(C)CCCN[C@H]1C(=O)NC[C@H]1CCN(c2cccc(Br)c2)C1 ZINC000573094238 567688307 /nfs/dbraw/zinc/68/83/07/567688307.db2.gz UNIXFDXELPJBGZ-PBHICJAKSA-N 0 3 394.357 3.170 10 0 GGAEHN COC(=O)c1ccc2c(c1)[C@@H](CNCc1c(Br)cnn1C)CCC2 ZINC000597202314 567688568 /nfs/dbraw/zinc/68/85/68/567688568.db2.gz XMCZZBUZSPJCSC-CQSZACIVSA-N 0 3 392.297 3.179 10 0 GGAEHN CN(C)c1c(Cl)cccc1NC(=O)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000666613930 567688966 /nfs/dbraw/zinc/68/89/66/567688966.db2.gz IYYLSOHMEDREER-MNOVXSKESA-N 0 3 380.794 3.329 10 0 GGAEHN CCN(C(=O)c1cccc(I)c1C)[C@@H]1CCN(CC)C1 ZINC000598038456 567734441 /nfs/dbraw/zinc/73/44/41/567734441.db2.gz DECDQSTVDVLTPE-CYBMUJFWSA-N 0 3 386.277 3.156 10 0 GGAEHN CC[C@@H](NCCNS(=O)(=O)c1cccc(Cl)c1)c1cccc(OC)c1 ZINC000531952160 567689918 /nfs/dbraw/zinc/68/99/18/567689918.db2.gz HNIZEZUBBQIWPH-GOSISDBHSA-N 0 3 382.913 3.368 10 0 GGAEHN CCOC(=O)CC1(NCc2ccc(Br)cc2OC)CCOCC1 ZINC000597235003 567691692 /nfs/dbraw/zinc/69/16/92/567691692.db2.gz CDTKIQYYDYVJRH-UHFFFAOYSA-N 0 3 386.286 3.050 10 0 GGAEHN CCCCN([C@H]1CCN(CC(F)(F)F)C1=O)[C@H]1CCc2ncsc2C1 ZINC000646129167 567694519 /nfs/dbraw/zinc/69/45/19/567694519.db2.gz YUMQMBHSMPUGIH-JSGCOSHPSA-N 0 3 375.460 3.266 10 0 GGAEHN CN1CCC2(CC1)CN(CCCC(=O)c1ccc(Br)cc1)CCO2 ZINC000646106698 567695697 /nfs/dbraw/zinc/69/56/97/567695697.db2.gz MHWDHNMMCFRJPH-UHFFFAOYSA-N 0 3 395.341 3.209 10 0 GGAEHN C[C@@H](CN[C@@H](c1cc(F)cc(Br)c1)C1CC1)CS(C)(=O)=O ZINC000481736704 567700208 /nfs/dbraw/zinc/70/02/08/567700208.db2.gz CBIRTGAPEKCTAX-ZUZCIYMTSA-N 0 3 378.307 3.310 10 0 GGAEHN Cc1ccc(Br)cc1NC(=O)N1CCOC2(CCN(C)CC2)C1 ZINC000646229708 567701771 /nfs/dbraw/zinc/70/17/71/567701771.db2.gz DOMAVOPOZVRNLE-UHFFFAOYSA-N 0 3 382.302 3.086 10 0 GGAEHN CCN(C(=O)Nc1cc(Br)cc2nc(C)oc21)[C@@H]1CCN(C)C1 ZINC000666742568 567702158 /nfs/dbraw/zinc/70/21/58/567702158.db2.gz DDBDWODPWGPOBK-GFCCVEGCSA-N 0 3 381.274 3.457 10 0 GGAEHN COc1c(Cl)cc(NC(=O)N2CCOC3(CCN(C)CC3)C2)cc1Cl ZINC000646253332 567702667 /nfs/dbraw/zinc/70/26/67/567702667.db2.gz FEUCUWKEKORRCQ-UHFFFAOYSA-N 0 3 388.295 3.331 10 0 GGAEHN Cc1cc(CNC2CCN(C(=O)c3ccoc3)CC2)ncc1Br ZINC000623354377 567703040 /nfs/dbraw/zinc/70/30/40/567703040.db2.gz QVGSKZYBXHQXCJ-UHFFFAOYSA-N 0 3 378.270 3.140 10 0 GGAEHN Cc1cc(CNC2CCN(Cc3ccccn3)CC2)ncc1Br ZINC000623361494 567705112 /nfs/dbraw/zinc/70/51/12/567705112.db2.gz GCRVNJMXWDMLKC-UHFFFAOYSA-N 0 3 375.314 3.302 10 0 GGAEHN Cc1cc(Br)c(CNCCCC(=O)N(C)C)cc1Br ZINC000623379867 567705772 /nfs/dbraw/zinc/70/57/72/567705772.db2.gz LWQFSUSLDLRBLU-UHFFFAOYSA-N 0 3 392.135 3.478 10 0 GGAEHN CCN(C(=O)Nc1cc(Br)c(OC)cc1OC)[C@@H]1CCN(C)C1 ZINC000666808211 567705903 /nfs/dbraw/zinc/70/59/03/567705903.db2.gz AWWVEBQREBJTOJ-LLVKDONJSA-N 0 3 386.290 3.024 10 0 GGAEHN O=S(=O)([N-]CCCCC[NH+]1CCCCC1)c1cnccc1C(F)(F)F ZINC000442762131 567706788 /nfs/dbraw/zinc/70/67/88/567706788.db2.gz GQWMYIJJJPFTNQ-UHFFFAOYSA-N 0 3 379.448 3.035 10 0 GGAEHN O=S1(=O)CCC[C@H](CN[C@@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000554085900 567708330 /nfs/dbraw/zinc/70/83/30/567708330.db2.gz HSYVGKFSEMCPFU-APWZRJJASA-N 0 3 378.925 3.433 10 0 GGAEHN O=S1(=O)CCC[C@H](CN[C@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000554085906 567708549 /nfs/dbraw/zinc/70/85/49/567708549.db2.gz HSYVGKFSEMCPFU-VQIMIIECSA-N 0 3 378.925 3.433 10 0 GGAEHN CN(C(=O)NCCOCc1ccc(Cl)cc1Cl)[C@H]1CCN(C2CC2)C1 ZINC000554084527 567708902 /nfs/dbraw/zinc/70/89/02/567708902.db2.gz NLFYZTPHGQYQHR-INIZCTEOSA-N 0 3 386.323 3.388 10 0 GGAEHN CS(=O)(=O)[C@H]1CCC[C@@H](NCc2cccc(F)c2OCC(F)(F)F)C1 ZINC000623428395 567709252 /nfs/dbraw/zinc/70/92/52/567709252.db2.gz JCLIHXKPGWMPQM-OLZOCXBDSA-N 0 3 383.407 3.212 10 0 GGAEHN CN(C(=O)N[C@H]1CCOc2c(Br)cccc21)[C@@H]1CCN(C2CC2)C1 ZINC000507827304 567709606 /nfs/dbraw/zinc/70/96/06/567709606.db2.gz RBENPQVSDYLZDY-CJNGLKHVSA-N 0 3 394.313 3.151 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NC[C@H](C)N1CCC(C)CC1 ZINC000460920324 567710791 /nfs/dbraw/zinc/71/07/91/567710791.db2.gz BPBDXFHCCWMLFH-AWEZNQCLSA-N 0 3 383.330 3.237 10 0 GGAEHN Cc1cc(Br)c(CNC[C@]2(O)CCSC2)cc1Br ZINC000623438543 567710798 /nfs/dbraw/zinc/71/07/98/567710798.db2.gz CVBOAVAMKSDWLA-CYBMUJFWSA-N 0 3 395.160 3.478 10 0 GGAEHN C[C@@H](Cc1ccc(Cl)cc1)N[C@H]1CCN(S(=O)(=O)c2ccccc2)C1 ZINC000554139827 567711201 /nfs/dbraw/zinc/71/12/01/567711201.db2.gz NBNWVXNRIQDMJX-YJBOKZPZSA-N 0 3 378.925 3.324 10 0 GGAEHN C[C@H](CCC(F)(F)F)[NH2+]CC[N-]S(=O)(=O)c1ccc(Cl)cc1F ZINC000442857590 567712032 /nfs/dbraw/zinc/71/20/32/567712032.db2.gz GJPBLLORDNLBIK-SECBINFHSA-N 0 3 376.803 3.078 10 0 GGAEHN C[C@H](N[C@H]1CCN(S(=O)(=O)c2ccccc2)C1)c1cc2c(s1)CCC2 ZINC000554140968 567713062 /nfs/dbraw/zinc/71/30/62/567713062.db2.gz RGYATUGPEJFGPV-HOCLYGCPSA-N 0 3 376.547 3.351 10 0 GGAEHN O=S1(=O)CCC(CCNCc2cccc(F)c2OCC(F)(F)F)CC1 ZINC000623479907 567714268 /nfs/dbraw/zinc/71/42/68/567714268.db2.gz GALHJUWEGZKHRA-UHFFFAOYSA-N 0 3 383.407 3.071 10 0 GGAEHN C[NH+](C)C1(C[N-]S(=O)(=O)c2cnccc2C(F)(F)F)CCCCCC1 ZINC000442914689 567717323 /nfs/dbraw/zinc/71/73/23/567717323.db2.gz UOMKAKNKDXCGAF-UHFFFAOYSA-N 0 3 379.448 3.033 10 0 GGAEHN C[C@H](Oc1cccc(Cl)c1Cl)C(=O)N1CCOC[C@@H]1[C@@H]1CCCN1C ZINC000646447498 567718187 /nfs/dbraw/zinc/71/81/87/567718187.db2.gz UNISWQOALOZPGB-AEGPPILISA-N 0 3 387.307 3.082 10 0 GGAEHN C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)N1CCOC[C@@H]1[C@@H]1CCCN1C ZINC000646456738 567718216 /nfs/dbraw/zinc/71/82/16/567718216.db2.gz XOHWOZHHXCNVDR-AFAVFJNCSA-N 0 3 387.307 3.082 10 0 GGAEHN Cc1cc(C(=O)N2CCOC[C@@H]2[C@H]2CCCN2C)c(C)cc1Br ZINC000646447139 567718616 /nfs/dbraw/zinc/71/86/16/567718616.db2.gz QLMUYGLXIZCTOL-IAGOWNOFSA-N 0 3 381.314 3.001 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1cc2cc(Br)ccc2o1 ZINC000646448283 567718720 /nfs/dbraw/zinc/71/87/20/567718720.db2.gz ZMJVCGTWFUYSBR-LSDHHAIUSA-N 0 3 393.281 3.131 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)c1cc(F)ccc1I ZINC000597859839 567719592 /nfs/dbraw/zinc/71/95/92/567719592.db2.gz ZBIGZFPPGDZWQP-NSHDSACASA-N 0 3 390.240 3.033 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000646450852 567719187 /nfs/dbraw/zinc/71/91/87/567719187.db2.gz ZJOGJNFTGVAETA-MLHJIOFPSA-N 0 3 383.319 3.419 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)c1ccc(F)cc1I ZINC000597859101 567719392 /nfs/dbraw/zinc/71/93/92/567719392.db2.gz RYMPXBXIDNYKRB-NSHDSACASA-N 0 3 390.240 3.033 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)c1ccc(F)cc1I ZINC000597859100 567719521 /nfs/dbraw/zinc/71/95/21/567719521.db2.gz RYMPXBXIDNYKRB-LLVKDONJSA-N 0 3 390.240 3.033 10 0 GGAEHN Cc1ccc(C(=O)NC[C@@H]2CCN2C(C)(C)C)cc1I ZINC000597856862 567719542 /nfs/dbraw/zinc/71/95/42/567719542.db2.gz BPQOKKOXDZXGAC-ZDUSSCGKSA-N 0 3 386.277 3.202 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000461087184 567719597 /nfs/dbraw/zinc/71/95/97/567719597.db2.gz RODBSDMLQGGMGL-MRXNPFEDSA-N 0 3 381.314 3.087 10 0 GGAEHN Cc1cccc(C(=O)NC[C@H]2CCN2C(C)(C)C)c1I ZINC000597859861 567719835 /nfs/dbraw/zinc/71/98/35/567719835.db2.gz ZPLFRGMHWKVMEY-GFCCVEGCSA-N 0 3 386.277 3.202 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)c1ccc(I)cc1F ZINC000597860026 567720981 /nfs/dbraw/zinc/72/09/81/567720981.db2.gz KBKADBDUJSZCFV-NSHDSACASA-N 0 3 390.240 3.033 10 0 GGAEHN Cc1cc(Br)c(CNC[C@H]2CCCNC2=O)cc1Br ZINC000623547742 567720982 /nfs/dbraw/zinc/72/09/82/567720982.db2.gz AGGOCFHLNKEGTK-SNVBAGLBSA-N 0 3 390.119 3.136 10 0 GGAEHN CC(C)Oc1cc(Cl)c(CNC[C@@]2(OCCO)CCOC2)cc1Cl ZINC000623563798 567721676 /nfs/dbraw/zinc/72/16/76/567721676.db2.gz KHFLOLHMILMFHB-KRWDZBQOSA-N 0 3 378.296 3.038 10 0 GGAEHN CO[C@@H]1CCC[C@@H]([C@@H](CO)NCc2ccc(Br)c(F)c2F)C1 ZINC000623562929 567722189 /nfs/dbraw/zinc/72/21/89/567722189.db2.gz IBNUUUXRTKGZNE-MPKXVKKWSA-N 0 3 378.257 3.383 10 0 GGAEHN Cc1cc(CNCc2ccc(CN3CC[C@@H](O)C3)cc2)ncc1Br ZINC000623564093 567722359 /nfs/dbraw/zinc/72/23/59/567722359.db2.gz RRUBKDJGHHWCNY-GOSISDBHSA-N 0 3 390.325 3.009 10 0 GGAEHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)[C@H]1CCc2cc(Br)ccc21 ZINC000573567934 567723407 /nfs/dbraw/zinc/72/34/07/567723407.db2.gz RPSRXXXUXRFDOZ-WMZOPIPTSA-N 0 3 395.341 3.048 10 0 GGAEHN CC(C)[C@H](C(=O)NCc1cc(Cl)ccc1I)N(C)C ZINC000597898014 567723684 /nfs/dbraw/zinc/72/36/84/567723684.db2.gz NHTBOVNPJHCEDV-CYBMUJFWSA-N 0 3 394.684 3.147 10 0 GGAEHN CN(CC(=O)Nc1ccc(Br)cc1Cl)[C@H]1CCN(C2CC2)C1 ZINC000554364630 567724350 /nfs/dbraw/zinc/72/43/50/567724350.db2.gz KZOGNGOVJWPFMY-ZDUSSCGKSA-N 0 3 386.721 3.210 10 0 GGAEHN CC(C)Oc1cc(Cl)c(CNCCCN2CCC[C@H]2C(N)=O)cc1Cl ZINC000623620023 567724978 /nfs/dbraw/zinc/72/49/78/567724978.db2.gz CVPHNYBCQWFFHM-INIZCTEOSA-N 0 3 388.339 3.210 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N(CCN(C)C)Cc1ccccc1F ZINC000667113434 567725750 /nfs/dbraw/zinc/72/57/50/567725750.db2.gz LEGXYHNXWIZQHS-UHFFFAOYSA-N 0 3 394.288 3.496 10 0 GGAEHN OCCOC1(CNCc2cc(Cl)cc3c2OCC3)CCC(F)(F)CC1 ZINC000623638159 567726090 /nfs/dbraw/zinc/72/60/90/567726090.db2.gz WXCOXHHJFSRSKC-UHFFFAOYSA-N 0 3 375.843 3.322 10 0 GGAEHN CN1CCC[C@@H](NC(=O)Nc2cnc(-c3ccc(Br)s3)nc2)C1 ZINC000646541861 567726351 /nfs/dbraw/zinc/72/63/51/567726351.db2.gz YDSBNGYJEJQNKW-SNVBAGLBSA-N 0 3 396.314 3.183 10 0 GGAEHN CC(C)n1cc(CN[C@]2(CO)CCc3cc(Br)ccc3C2)cn1 ZINC000623644229 567727957 /nfs/dbraw/zinc/72/79/57/567727957.db2.gz QONOKEBSVDUHNG-GOSISDBHSA-N 0 3 378.314 3.236 10 0 GGAEHN CC[C@@H](Cc1ccc(Br)cc1)NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000667132744 567728662 /nfs/dbraw/zinc/72/86/62/567728662.db2.gz HOLDOHJZSHXGJR-ROUUACIJSA-N 0 3 392.341 3.426 10 0 GGAEHN CCN(C(=O)c1ccc(I)c(Cl)c1)[C@@H]1CCN(C)C1 ZINC000597945038 567728956 /nfs/dbraw/zinc/72/89/56/567728956.db2.gz GVRGOLPNNBLJCR-LLVKDONJSA-N 0 3 392.668 3.111 10 0 GGAEHN CCN(C(=O)c1ccc(I)cc1Cl)[C@H]1CCN(C)C1 ZINC000597947244 567729177 /nfs/dbraw/zinc/72/91/77/567729177.db2.gz WMXLISWDNZCGII-NSHDSACASA-N 0 3 392.668 3.111 10 0 GGAEHN COc1ncc(Br)cc1CNC1CCN(Cc2ccccn2)CC1 ZINC000623664860 567729509 /nfs/dbraw/zinc/72/95/09/567729509.db2.gz QSWFRRRXLZTTOF-UHFFFAOYSA-N 0 3 391.313 3.002 10 0 GGAEHN CCN(C(=O)Nc1ccn(-c2ccc(Br)cc2)n1)[C@H]1CCN(C)C1 ZINC000667145888 567729580 /nfs/dbraw/zinc/72/95/80/567729580.db2.gz AICQQDVYBYTKBH-HNNXBMFYSA-N 0 3 392.301 3.193 10 0 GGAEHN CCCN(Cc1cc(=O)n2cc(Br)ccc2n1)C[C@@H]1CCCCO1 ZINC000532715387 567730741 /nfs/dbraw/zinc/73/07/41/567730741.db2.gz JSQILEONQJQFIC-INIZCTEOSA-N 0 3 394.313 3.238 10 0 GGAEHN O=C(CCc1cc(F)ccc1Br)NCCCNCc1cccnc1 ZINC000646617692 567733087 /nfs/dbraw/zinc/73/30/87/567733087.db2.gz ZZPCVBQCWIVLFB-UHFFFAOYSA-N 0 3 394.288 3.212 10 0 GGAEHN COc1cc(Br)ccc1[C@H]1CCCN1C(=O)NC[C@@H]1CCCN1C ZINC000623716670 567733101 /nfs/dbraw/zinc/73/31/01/567733101.db2.gz WBPCSYRLUUMNGJ-GOEBONIOSA-N 0 3 396.329 3.398 10 0 GGAEHN O=C(N[C@@H]1CCN(C2CC2)C1)c1cc(Br)cc(N2CCCC2)c1 ZINC000667182060 567733202 /nfs/dbraw/zinc/73/32/02/567733202.db2.gz TXYCPCPWMMINIV-OAHLLOKOSA-N 0 3 378.314 3.016 10 0 GGAEHN CN1CCC[C@@H](CNC(=O)NCC/C=C\c2ccc(Br)cc2)C1 ZINC000623721847 567733794 /nfs/dbraw/zinc/73/37/94/567733794.db2.gz SIQHDEGONYQXNZ-ASKPUQFJSA-N 0 3 380.330 3.493 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)[C@@H]1CCO[C@H]1c1cncc(Br)c1 ZINC000667215566 567737020 /nfs/dbraw/zinc/73/70/20/567737020.db2.gz JJFHYNPYMNSVBX-BBWFWOEESA-N 0 3 398.345 3.014 10 0 GGAEHN C[C@H](NC[C@H]1CN(Cc2ccncc2)CCO1)c1ccc(Br)s1 ZINC000623782145 567738088 /nfs/dbraw/zinc/73/80/88/567738088.db2.gz KIALYYLOEQMQCH-ZFWWWQNUSA-N 0 3 396.354 3.457 10 0 GGAEHN Cc1noc([C@H]2OCC[C@H]2N[C@H](C)Cc2ccc(F)cc2Br)n1 ZINC000623816644 567739213 /nfs/dbraw/zinc/73/92/13/567739213.db2.gz HZWITFVXMXMQPL-ZWZTZDBGSA-N 0 3 384.249 3.330 10 0 GGAEHN CN(C)c1ccc(Cl)cc1NC(=O)C(C[C@H]1COCCO1)C(F)(F)F ZINC000667289534 567740424 /nfs/dbraw/zinc/74/04/24/567740424.db2.gz TVYVEVBWYLSUOI-NWDGAFQWSA-N 0 3 380.794 3.329 10 0 GGAEHN NS(=O)(=O)c1ccc(CNCc2ccccc2CC(F)(F)F)cc1Cl ZINC000623821342 567740380 /nfs/dbraw/zinc/74/03/80/567740380.db2.gz PDUJJWIKFQSBPP-UHFFFAOYSA-N 0 3 392.830 3.382 10 0 GGAEHN CN(C)c1ccc(Cl)cc1NC(=O)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000667289536 567740622 /nfs/dbraw/zinc/74/06/22/567740622.db2.gz TVYVEVBWYLSUOI-VXGBXAGGSA-N 0 3 380.794 3.329 10 0 GGAEHN CN(C)c1ccc(Cl)cc1NC(=O)C(C[C@H]1COCCO1)C(F)(F)F ZINC000667289535 567740736 /nfs/dbraw/zinc/74/07/36/567740736.db2.gz TVYVEVBWYLSUOI-RYUDHWBXSA-N 0 3 380.794 3.329 10 0 GGAEHN C[C@@H](Cc1ncc(C(F)(F)F)cc1Cl)NCCNC(=O)c1ccco1 ZINC000623855313 567741253 /nfs/dbraw/zinc/74/12/53/567741253.db2.gz WMMWUAJAHQWJGT-JTQLQIEISA-N 0 3 375.778 3.297 10 0 GGAEHN CN1CC[C@H](NCCS(=O)(=O)c2ccccc2)[C@H]1c1ccc(Cl)cc1 ZINC000573884976 567742151 /nfs/dbraw/zinc/74/21/51/567742151.db2.gz CFVXLLFSLSVNNW-RBUKOAKNSA-N 0 3 378.925 3.149 10 0 GGAEHN C[C@@H](NC(=O)N1CCc2cc(F)cc(Br)c2C1)C1=CCN(C)CC1 ZINC000623873760 567742401 /nfs/dbraw/zinc/74/24/01/567742401.db2.gz QQQMGERICKXBON-GFCCVEGCSA-N 0 3 396.304 3.306 10 0 GGAEHN C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@@H]1CC(=O)N([C@H]2C[C@H]2C)C1 ZINC000623918120 567746469 /nfs/dbraw/zinc/74/64/69/567746469.db2.gz IPHSKVCNLRHSCM-NOBRSGAKSA-N 0 3 375.822 3.284 10 0 GGAEHN CO[C@H]1CC[C@@H](C(=O)N(CCN(C)C)Cc2ccc(Br)cc2)C1 ZINC000667427345 567746572 /nfs/dbraw/zinc/74/65/72/567746572.db2.gz CGOJRHXMTRCOHA-WBVHZDCISA-N 0 3 383.330 3.154 10 0 GGAEHN CN(C)C1(CNC(=O)NCc2ccc(Br)c(F)c2F)CCC1 ZINC000623916789 567746905 /nfs/dbraw/zinc/74/69/05/567746905.db2.gz ZSBJJOIWUAMVRB-UHFFFAOYSA-N 0 3 376.245 3.011 10 0 GGAEHN COCc1nc2n(n1)C[C@@H](N[C@H](C)c1cc(Br)ccc1C)CC2 ZINC000623920079 567747035 /nfs/dbraw/zinc/74/70/35/567747035.db2.gz ZWKLHZBHOKEMEU-OCCSQVGLSA-N 0 3 379.302 3.161 10 0 GGAEHN CN(C)C1(CNC(=O)NCc2cc(F)c(Br)cc2F)CCC1 ZINC000623916719 567747262 /nfs/dbraw/zinc/74/72/62/567747262.db2.gz XRKMBWGEUKTJEK-UHFFFAOYSA-N 0 3 376.245 3.011 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)C3(c4cccc(Br)c4)CCCC3)[C@H]2C1 ZINC000646920985 567747871 /nfs/dbraw/zinc/74/78/71/567747871.db2.gz YIBYGSDHPRUTLX-PBHICJAKSA-N 0 3 377.326 3.423 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)C3(c4cccc(Br)c4)CCCC3)[C@@H]2C1 ZINC000646920987 567748446 /nfs/dbraw/zinc/74/84/46/567748446.db2.gz YIBYGSDHPRUTLX-WMLDXEAASA-N 0 3 377.326 3.423 10 0 GGAEHN Cc1cc(CC(C)(C)C(=O)N2CC[C@H]3CN(C)C[C@@H]32)ccc1Br ZINC000646920370 567748756 /nfs/dbraw/zinc/74/87/56/567748756.db2.gz QISGVOQIPZSZSU-RDJZCZTQSA-N 0 3 379.342 3.489 10 0 GGAEHN Cc1ccc(Br)cc1[C@H](C)N[C@H]1C[C@@H](C)N(c2cnn(C)c2)C1=O ZINC000623939312 567749001 /nfs/dbraw/zinc/74/90/01/567749001.db2.gz MHFCTNVDXJDWQY-IGCXYCKISA-N 0 3 391.313 3.336 10 0 GGAEHN Cc1cc(Br)ccc1CN(C)CCN1C(=O)NC2(CCCC2)C1=O ZINC000574001783 567749412 /nfs/dbraw/zinc/74/94/12/567749412.db2.gz HKRJFHVJXZVMDZ-UHFFFAOYSA-N 0 3 394.313 3.054 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)c2ccc(Br)cc2C(F)(F)F)C1 ZINC000646937720 567749796 /nfs/dbraw/zinc/74/97/96/567749796.db2.gz QYRNLLCUPSHMGW-ZANVPECISA-N 0 3 377.204 3.244 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)COc3ccc4cc(Br)ccc4c3)[C@H]2C1 ZINC000646937429 567749812 /nfs/dbraw/zinc/74/98/12/567749812.db2.gz LKFANQPKKRRPOU-QAPCUYQASA-N 0 3 389.293 3.144 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)Cc2csc(Cc3cccc(Cl)c3)n2)C1 ZINC000646943412 567750893 /nfs/dbraw/zinc/75/08/93/567750893.db2.gz IPGWOHZERNNPHC-YOEHRIQHSA-N 0 3 375.925 3.092 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)Cc3csc(Cc4cccc(Cl)c4)n3)[C@@H]2C1 ZINC000646943410 567751077 /nfs/dbraw/zinc/75/10/77/567751077.db2.gz IPGWOHZERNNPHC-RHSMWYFYSA-N 0 3 375.925 3.092 10 0 GGAEHN C[C@@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccc(F)cc1C(F)(F)F ZINC000623982329 567751815 /nfs/dbraw/zinc/75/18/15/567751815.db2.gz OVLXLNOZWNEOGL-DGCLKSJQSA-N 0 3 382.423 3.309 10 0 GGAEHN C[C@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccc(F)cc1C(F)(F)F ZINC000623982330 567752228 /nfs/dbraw/zinc/75/22/28/567752228.db2.gz OVLXLNOZWNEOGL-WCQYABFASA-N 0 3 382.423 3.309 10 0 GGAEHN CC(C)(C)[C@@H]1CCN(C[C@H](O)COc2ccc(Cl)cc2Cl)C[C@H]1O ZINC000554854055 567752825 /nfs/dbraw/zinc/75/28/25/567752825.db2.gz KCFOYPAYMZSVFM-SQWLQELKSA-N 0 3 376.324 3.462 10 0 GGAEHN CC(C)(C)[C@@H]1CCN(C[C@@H](O)COc2ccc(Cl)cc2Cl)C[C@H]1O ZINC000554854053 567752966 /nfs/dbraw/zinc/75/29/66/567752966.db2.gz KCFOYPAYMZSVFM-IIAWOOMASA-N 0 3 376.324 3.462 10 0 GGAEHN C[C@@H](Cc1ncc(C(F)(F)F)cc1Cl)NCC1(CS(C)(=O)=O)CCC1 ZINC000624002135 567753442 /nfs/dbraw/zinc/75/34/42/567753442.db2.gz WTXMWOJTHZFICA-NSHDSACASA-N 0 3 398.878 3.489 10 0 GGAEHN O=C([C@@H]1CCCN(CCOc2ccc(Br)cc2)C1)N1CCCC1 ZINC000574066839 567753712 /nfs/dbraw/zinc/75/37/12/567753712.db2.gz LIOYVIQZMGQESB-OAHLLOKOSA-N 0 3 381.314 3.162 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CNCC[C@H](O)C(F)(F)F ZINC000554883937 567754304 /nfs/dbraw/zinc/75/43/04/567754304.db2.gz QXNIVYBYFPIPLK-AWEZNQCLSA-N 0 3 392.219 3.346 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1CC(=O)Nc1ccc(Br)cc1F ZINC000574083976 567754628 /nfs/dbraw/zinc/75/46/28/567754628.db2.gz IIOMYVPXPQLYDZ-QGZVFWFLSA-N 0 3 392.272 3.085 10 0 GGAEHN OC[C@@H](CNCc1cccc(Br)c1OC(F)F)c1cccnc1 ZINC000574074679 567755380 /nfs/dbraw/zinc/75/53/80/567755380.db2.gz ZWAVQXJVJXJBGK-CYBMUJFWSA-N 0 3 387.224 3.311 10 0 GGAEHN CC[C@H](Cc1ccccc1Br)C(=O)N[C@H]1CNCCC1(F)F ZINC000647076224 567758765 /nfs/dbraw/zinc/75/87/65/567758765.db2.gz BVGZNKFDSLBXNA-RISCZKNCSA-N 0 3 375.257 3.131 10 0 GGAEHN COc1ncc([C@H](C)NCC2(OCCO)CCC(F)(F)CC2)cc1Cl ZINC000624103707 567759230 /nfs/dbraw/zinc/75/92/30/567759230.db2.gz LDSDLIFTWZIABX-LBPRGKRZSA-N 0 3 378.847 3.351 10 0 GGAEHN COc1ncc([C@@H](C)NCC2(OCCO)CCC(F)(F)CC2)cc1Cl ZINC000624103706 567759399 /nfs/dbraw/zinc/75/93/99/567759399.db2.gz LDSDLIFTWZIABX-GFCCVEGCSA-N 0 3 378.847 3.351 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)NCc1csc(Br)c1 ZINC000574155874 567759436 /nfs/dbraw/zinc/75/94/36/567759436.db2.gz HIWFYUKXTWSEJZ-CQSZACIVSA-N 0 3 380.311 3.278 10 0 GGAEHN N[C@H]1CCCc2cn(Cc3nc(-c4cc(Br)cs4)no3)nc21 ZINC000574150969 567759563 /nfs/dbraw/zinc/75/95/63/567759563.db2.gz SNURTFQZIHDBKT-JTQLQIEISA-N 0 3 380.271 3.142 10 0 GGAEHN C[C@@H](N[C@@H]1CCN(c2ccc3nncn3n2)C1)c1cc(Cl)cc(Cl)c1 ZINC000624114779 567760337 /nfs/dbraw/zinc/76/03/37/567760337.db2.gz HITPGPYWXXTBLK-IAQYHMDHSA-N 0 3 377.279 3.361 10 0 GGAEHN C[C@H](N[C@H]1CCN(c2ccc3nncn3n2)C1)c1cccc(Cl)c1Cl ZINC000624113309 567760380 /nfs/dbraw/zinc/76/03/80/567760380.db2.gz CDKLFYYVQXKLMN-RYUDHWBXSA-N 0 3 377.279 3.361 10 0 GGAEHN C[C@H](N[C@H]1CCN(c2ccc3nncn3n2)C1)c1cc(Cl)cc(Cl)c1 ZINC000624114780 567760432 /nfs/dbraw/zinc/76/04/32/567760432.db2.gz HITPGPYWXXTBLK-NHYWBVRUSA-N 0 3 377.279 3.361 10 0 GGAEHN CC1CCN(CCNC(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)CC1 ZINC000624119825 567760438 /nfs/dbraw/zinc/76/04/38/567760438.db2.gz KPLYEBRUMSIPJG-BPQIPLTHSA-N 0 3 377.326 3.183 10 0 GGAEHN C[C@@H](N[C@H]1CCN(c2ccc3nncn3n2)C1)c1cc(Cl)cc(Cl)c1 ZINC000624114778 567760589 /nfs/dbraw/zinc/76/05/89/567760589.db2.gz HITPGPYWXXTBLK-ABAIWWIYSA-N 0 3 377.279 3.361 10 0 GGAEHN C[C@H](NCC1(OCCO)CCC(F)(F)CC1)c1cncc(Br)c1 ZINC000624104108 567760824 /nfs/dbraw/zinc/76/08/24/567760824.db2.gz YIBROUHGCQWCQL-LBPRGKRZSA-N 0 3 393.272 3.452 10 0 GGAEHN C[C@H](N[C@@H]1CCN(c2ccc3nncn3n2)C1)c1cc(Cl)cc(Cl)c1 ZINC000624114781 567760904 /nfs/dbraw/zinc/76/09/04/567760904.db2.gz HITPGPYWXXTBLK-XHDPSFHLSA-N 0 3 377.279 3.361 10 0 GGAEHN CN(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)[C@H]1CCN(C2CC2)C1 ZINC000533303241 567763641 /nfs/dbraw/zinc/76/36/41/567763641.db2.gz YCCYKDJWCLMBEU-ZDUSSCGKSA-N 0 3 375.822 3.466 10 0 GGAEHN C[C@@H]1CCCN(CCNC(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)C1 ZINC000624138409 567763916 /nfs/dbraw/zinc/76/39/16/567763916.db2.gz MSCNEKZWUZYRBT-UOAMXJAYSA-N 0 3 377.326 3.183 10 0 GGAEHN Fc1cc(CNC2CCN([C@@H]3CCOC3)CC2)c(F)cc1Br ZINC000624160906 567765226 /nfs/dbraw/zinc/76/52/26/567765226.db2.gz RIOOIABWYIOAND-CYBMUJFWSA-N 0 3 375.257 3.070 10 0 GGAEHN Cc1c([C@@H](C)NC[C@H]2COCCN2C)cnn1-c1ccc(Cl)cc1Cl ZINC000624173991 567765434 /nfs/dbraw/zinc/76/54/34/567765434.db2.gz PBOCIJUKNZONHL-DOMZBBRYSA-N 0 3 383.323 3.469 10 0 GGAEHN NC(=O)[C@@H]1CCC[C@@H](NCc2cc(OC(F)F)ccc2Br)C1 ZINC000647185313 567767478 /nfs/dbraw/zinc/76/74/78/567767478.db2.gz XURULDYEZCIMBI-MWLCHTKSSA-N 0 3 377.229 3.184 10 0 GGAEHN NC(=O)[C@H]1CCC[C@@H](NCc2cc(OC(F)F)ccc2Br)C1 ZINC000647185311 567767504 /nfs/dbraw/zinc/76/75/04/567767504.db2.gz XURULDYEZCIMBI-GXSJLCMTSA-N 0 3 377.229 3.184 10 0 GGAEHN FC(F)Oc1ccc(Br)c(CNCCCCN2CCOCC2)c1 ZINC000647171352 567767777 /nfs/dbraw/zinc/76/77/77/567767777.db2.gz GXHORDINRNIUCX-UHFFFAOYSA-N 0 3 393.272 3.253 10 0 GGAEHN O=S(=O)(c1ccccc1)N1CC[C@H](NCCc2ccc(F)cc2Cl)C1 ZINC000555098953 567768457 /nfs/dbraw/zinc/76/84/57/567768457.db2.gz MQTJRNRSFACHKF-INIZCTEOSA-N 0 3 382.888 3.074 10 0 GGAEHN Brc1cccc(N2CC[C@H](NCc3ccnn3-c3ccccn3)C2)c1 ZINC000647207099 567771671 /nfs/dbraw/zinc/77/16/71/567771671.db2.gz WRRSZANLIUCZDN-INIZCTEOSA-N 0 3 398.308 3.398 10 0 GGAEHN COc1ccc([C@H](C)N[C@@H]2CCO[C@@H]2c2nc(C)no2)cc1Br ZINC000624303115 567772284 /nfs/dbraw/zinc/77/22/84/567772284.db2.gz UNRWUZGXVQLPND-RJIBLYRGSA-N 0 3 382.258 3.330 10 0 GGAEHN CS(=O)(=O)Nc1cccc(CNCC[C@@H]2CSc3ccccc3O2)c1 ZINC000647227524 567772461 /nfs/dbraw/zinc/77/24/61/567772461.db2.gz BEMFNNLNPNGFBR-MRXNPFEDSA-N 0 3 378.519 3.091 10 0 GGAEHN COc1ccc([C@@H](C)N[C@@H]2CCO[C@@H]2c2nc(C)no2)cc1Br ZINC000624303114 567772811 /nfs/dbraw/zinc/77/28/11/567772811.db2.gz UNRWUZGXVQLPND-PKPZWWHKSA-N 0 3 382.258 3.330 10 0 GGAEHN O=S1(=O)C[C@@H](CN[C@@H]2CCc3cccc(Cl)c3C2)Oc2ccccc21 ZINC000647223633 567772977 /nfs/dbraw/zinc/77/29/77/567772977.db2.gz IMQJIWJNXYYTMJ-HUUCEWRRSA-N 0 3 377.893 3.022 10 0 GGAEHN Cc1noc([C@@H]2OCC[C@@H]2N[C@@H]2CCc3c2ccc(F)c3Br)n1 ZINC000624305682 567773438 /nfs/dbraw/zinc/77/34/38/567773438.db2.gz KOVMWNCCBYEBSQ-VNHYZAJKSA-N 0 3 382.233 3.387 10 0 GGAEHN CO[C@H]1C[C@@H](CN[C@@H](C)c2nnn(-c3cccc(Br)c3)c2C)C1 ZINC000624309799 567773917 /nfs/dbraw/zinc/77/39/17/567773917.db2.gz XZHWRFFJAUCTFL-DETPVDSQSA-N 0 3 379.302 3.414 10 0 GGAEHN CC(C)(CNCc1nc(-c2ccc(Br)cc2)c[nH]1)[C@]1(O)CCOC1 ZINC000647246452 567774309 /nfs/dbraw/zinc/77/43/09/567774309.db2.gz GOWZKASTODKFLD-SFHVURJKSA-N 0 3 394.313 3.106 10 0 GGAEHN O=C(Nc1cnc2c(c1)CNCC2)N[C@H]1COc2c1ccc(Cl)c2Cl ZINC000667797141 567774679 /nfs/dbraw/zinc/77/46/79/567774679.db2.gz DFIHXGXLTAIIMI-AWEZNQCLSA-N 0 3 379.247 3.289 10 0 GGAEHN C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@H]1CCN(C2CCC2)C1=O ZINC000624345205 567774844 /nfs/dbraw/zinc/77/48/44/567774844.db2.gz ZCJIJOCHEJYBIH-YGRLFVJLSA-N 0 3 375.822 3.428 10 0 GGAEHN CC(=O)NCc1ccc(C(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)s1 ZINC000555232104 567775044 /nfs/dbraw/zinc/77/50/44/567775044.db2.gz PWBSWGJVFRDVIC-INIZCTEOSA-N 0 3 379.913 3.070 10 0 GGAEHN NCc1cccc2c1N(S(=O)(=O)c1ccc(Br)c(F)c1)CCC2 ZINC000624389199 567777483 /nfs/dbraw/zinc/77/74/83/567777483.db2.gz UGAHOSBOWLNPMW-UHFFFAOYSA-N 0 3 399.285 3.188 10 0 GGAEHN C[C@H](NC[C@H](CO)Cc1cccc(Br)c1)c1cc2n(n1)CCCC2 ZINC000647301482 567778666 /nfs/dbraw/zinc/77/86/66/567778666.db2.gz VJPGNTSUINAIDP-GOEBONIOSA-N 0 3 392.341 3.484 10 0 GGAEHN O[C@@H]1CCN(Cc2ccc(CNc3ncc(Br)cc3F)cc2)C1 ZINC000624392776 567778744 /nfs/dbraw/zinc/77/87/44/567778744.db2.gz YZZXIMMSKNJKPI-OAHLLOKOSA-N 0 3 380.261 3.162 10 0 GGAEHN C[C@H](NC[C@@H](CO)Cc1ccc(Br)cc1)c1cc2n(n1)CCCC2 ZINC000647301295 567778975 /nfs/dbraw/zinc/77/89/75/567778975.db2.gz BEUPVOZRSPPWEK-HOCLYGCPSA-N 0 3 392.341 3.484 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)C(C)(C)c1ccc(Br)c(C)c1 ZINC000574443188 567779175 /nfs/dbraw/zinc/77/91/75/567779175.db2.gz ROAQFIHKOIEYGJ-INIZCTEOSA-N 0 3 397.357 3.262 10 0 GGAEHN CCN(CC)CCN(C(=O)c1cccnc1)c1ccc(Br)cn1 ZINC000574456888 567779339 /nfs/dbraw/zinc/77/93/39/567779339.db2.gz KEEIOPWGEKQRJF-UHFFFAOYSA-N 0 3 377.286 3.228 10 0 GGAEHN CC(C)(CN[C@@H]1CCCOc2c(Br)cccc21)[C@@]1(O)CCOC1 ZINC000647340350 567779880 /nfs/dbraw/zinc/77/98/80/567779880.db2.gz IEODEPSEQXXNPO-CRAIPNDOSA-N 0 3 384.314 3.430 10 0 GGAEHN CC(C)(CN[C@H]1CCCOc2cc(Br)ccc21)[C@]1(O)CCOC1 ZINC000647340191 567780035 /nfs/dbraw/zinc/78/00/35/567780035.db2.gz GDFPRMMRDXXDGX-YJBOKZPZSA-N 0 3 384.314 3.430 10 0 GGAEHN CC(C)(CN[C@@H]1CCCOc2cc(Br)ccc21)[C@]1(O)CCOC1 ZINC000647340190 567780226 /nfs/dbraw/zinc/78/02/26/567780226.db2.gz GDFPRMMRDXXDGX-QAPCUYQASA-N 0 3 384.314 3.430 10 0 GGAEHN CC(C)(CN[C@H]1CCCOc2cc(Br)ccc21)[C@@]1(O)CCOC1 ZINC000647340189 567780268 /nfs/dbraw/zinc/78/02/68/567780268.db2.gz GDFPRMMRDXXDGX-MAUKXSAKSA-N 0 3 384.314 3.430 10 0 GGAEHN CC(C)(CN[C@H]1CCCOc2c(Br)cccc21)[C@@]1(O)CCOC1 ZINC000647340351 567780279 /nfs/dbraw/zinc/78/02/79/567780279.db2.gz IEODEPSEQXXNPO-MAUKXSAKSA-N 0 3 384.314 3.430 10 0 GGAEHN CN1CC[C@@H]2CN(C(=O)NCC/C=C/c3ccc(Br)cc3)C[C@@H]21 ZINC000624489103 567784465 /nfs/dbraw/zinc/78/44/65/567784465.db2.gz USXLBWNQYMQFRO-VOXDIGERSA-N 0 3 378.314 3.198 10 0 GGAEHN CCCN1CCC(CNS(=O)(=O)c2cc(C)cc(Br)c2)CC1 ZINC000444030386 567785874 /nfs/dbraw/zinc/78/58/74/567785874.db2.gz KOQXPFYNNKHQPA-UHFFFAOYSA-N 0 3 389.359 3.158 10 0 GGAEHN Cc1cc(N2CCC[C@H](NCc3ccc(F)cc3Br)C2)n(C)n1 ZINC000444016477 567785554 /nfs/dbraw/zinc/78/55/54/567785554.db2.gz ZNJCLBZOBSBIIU-HNNXBMFYSA-N 0 3 381.293 3.389 10 0 GGAEHN Cc1cc(N2CCC[C@@H](NCc3ccc(F)c(Br)c3)C2)n(C)n1 ZINC000444007664 567785631 /nfs/dbraw/zinc/78/56/31/567785631.db2.gz GXLJYOMNUZFYDN-CQSZACIVSA-N 0 3 381.293 3.389 10 0 GGAEHN COc1sc(CN[C@H]2CCCN(c3cc(C)nn3C)C2)cc1Br ZINC000444034282 567785738 /nfs/dbraw/zinc/78/57/38/567785738.db2.gz PINGQICBCOWPDR-LBPRGKRZSA-N 0 3 399.358 3.320 10 0 GGAEHN COc1cc(Br)ccc1CN[C@H]1CCCN(c2cc(C)nn2C)C1 ZINC000444016413 567785942 /nfs/dbraw/zinc/78/59/42/567785942.db2.gz ZFIXGJYFAZOSGV-INIZCTEOSA-N 0 3 393.329 3.258 10 0 GGAEHN Cc1cc(N2CCC[C@H](NCc3ccc(Br)c(F)c3)C2)n(C)n1 ZINC000444013897 567785977 /nfs/dbraw/zinc/78/59/77/567785977.db2.gz GLWTUZQCIDTSGL-AWEZNQCLSA-N 0 3 381.293 3.389 10 0 GGAEHN CN(C)CCn1cc(NC(=O)CCc2ccc(Cl)cc2Cl)ccc1=O ZINC000533780102 567786454 /nfs/dbraw/zinc/78/64/54/567786454.db2.gz BRJUKARETGUGJF-UHFFFAOYSA-N 0 3 382.291 3.288 10 0 GGAEHN Cc1cc(N2CC[C@H](N[C@@H]3CO[C@H](C4CC4)C3)C2=O)ccc1Br ZINC000667993415 567787181 /nfs/dbraw/zinc/78/71/81/567787181.db2.gz YCLUGZLXBZIWDV-JQFCIGGWSA-N 0 3 379.298 3.020 10 0 GGAEHN CS(=O)(=O)N1CCC[C@@H](CN2CCC[C@H]2Cc2c(F)cccc2Cl)C1 ZINC000444060543 567787992 /nfs/dbraw/zinc/78/79/92/567787992.db2.gz VUPAWDGIMMFMJG-GJZGRUSLSA-N 0 3 388.936 3.158 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)c1cc(-c2ccc(Br)cc2)no1 ZINC000668013477 567789183 /nfs/dbraw/zinc/78/91/83/567789183.db2.gz YYMGNZCZGKPAKN-CQSZACIVSA-N 0 3 378.270 3.270 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000668013490 567789191 /nfs/dbraw/zinc/78/91/91/567789191.db2.gz ZJIJKJNSHAEZJM-INIZCTEOSA-N 0 3 380.330 3.216 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)c1cc(-c2cccc(Br)c2)no1 ZINC000668012951 567789235 /nfs/dbraw/zinc/78/92/35/567789235.db2.gz OFROWSFYXDSWNF-CQSZACIVSA-N 0 3 378.270 3.270 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000668013491 567789310 /nfs/dbraw/zinc/78/93/10/567789310.db2.gz ZJIJKJNSHAEZJM-MRXNPFEDSA-N 0 3 380.330 3.216 10 0 GGAEHN Cc1ccc(C[C@@H](CO)NC[C@H](O)COc2c(Cl)cccc2Cl)cc1 ZINC000647530008 567789408 /nfs/dbraw/zinc/78/94/08/567789408.db2.gz BYRPRIIPLQWBQQ-HOTGVXAUSA-N 0 3 384.303 3.235 10 0 GGAEHN Cc1ccc(C[C@@H](CO)NC[C@@H](O)COc2c(Cl)cccc2Cl)cc1 ZINC000647530010 567789648 /nfs/dbraw/zinc/78/96/48/567789648.db2.gz BYRPRIIPLQWBQQ-JKSUJKDBSA-N 0 3 384.303 3.235 10 0 GGAEHN Cc1ccc(C[C@H](CO)NC[C@H](O)COc2c(Cl)cccc2Cl)cc1 ZINC000647530007 567789876 /nfs/dbraw/zinc/78/98/76/567789876.db2.gz BYRPRIIPLQWBQQ-CVEARBPZSA-N 0 3 384.303 3.235 10 0 GGAEHN Cc1ccsc1[C@@H](CO)NC[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000555589688 567791599 /nfs/dbraw/zinc/79/15/99/567791599.db2.gz CCWSDQCBEQXAMJ-TZMCWYRMSA-N 0 3 376.305 3.426 10 0 GGAEHN NC(=O)[C@@H](Cc1ccc(Cl)cc1)NCC[C@@H]1CSc2ccccc2O1 ZINC000647607062 567792855 /nfs/dbraw/zinc/79/28/55/567792855.db2.gz ZZIDIMXGNIFRCF-HZPDHXFCSA-N 0 3 376.909 3.269 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1cc(Cl)cc(Br)c1F ZINC000444168766 567795060 /nfs/dbraw/zinc/79/50/60/567795060.db2.gz JBCYNUDXSHAYMY-NSHDSACASA-N 0 3 393.684 3.082 10 0 GGAEHN COC[C@@H](CC1CCOCC1)N[C@@H]1COc2cc(F)c(Br)cc21 ZINC000668107561 567797306 /nfs/dbraw/zinc/79/73/06/567797306.db2.gz GCAVJODHCIVFBH-MLGOLLRUSA-N 0 3 388.277 3.443 10 0 GGAEHN CN(C)C1(CN(C)C(=O)NCc2cc(F)c(Br)cc2F)CCC1 ZINC000624705640 567797711 /nfs/dbraw/zinc/79/77/11/567797711.db2.gz GGASXIKPGNCPOO-UHFFFAOYSA-N 0 3 390.272 3.353 10 0 GGAEHN C[C@H](N[C@@H]1CO[C@@H](C2CC2)C1)c1ccc(Br)cc1OCCCO ZINC000668183616 567799451 /nfs/dbraw/zinc/79/94/51/567799451.db2.gz KBKCPSLCPSEADU-YLQAJVPDSA-N 0 3 384.314 3.428 10 0 GGAEHN CS[C@H]1CN(C(=O)C(C)(C)c2cccc(Br)c2)C[C@@H]1N(C)C ZINC000534093233 567799682 /nfs/dbraw/zinc/79/96/82/567799682.db2.gz SFEXEBBQPLIWDU-GJZGRUSLSA-N 0 3 385.371 3.231 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCC1)N[C@H](CO)c1cccc(Cl)c1Cl ZINC000624788567 567800048 /nfs/dbraw/zinc/80/00/48/567800048.db2.gz WAUZAWDHZLROAY-XJKSGUPXSA-N 0 3 386.323 3.343 10 0 GGAEHN COC[C@@H](CC1CCOCC1)N[C@H](CO)c1ccc(Br)c(F)c1 ZINC000668188666 567800532 /nfs/dbraw/zinc/80/05/32/567800532.db2.gz LAGRBKGASPCSBN-RHSMWYFYSA-N 0 3 390.293 3.043 10 0 GGAEHN Cn1nc2c(c1CNC[C@@H](O)COc1cc(Cl)ccc1Cl)CCCC2 ZINC000574871002 567801468 /nfs/dbraw/zinc/80/14/68/567801468.db2.gz JTEYCKKYWKYCEI-CYBMUJFWSA-N 0 3 384.307 3.135 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2ccsc2Br)n1 ZINC000598977648 567802321 /nfs/dbraw/zinc/80/23/21/567802321.db2.gz MGBAOHQIHRTNPK-UHFFFAOYSA-N 0 3 375.313 3.476 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)CSc1cc(Cl)ccc1Cl ZINC000647822536 567803247 /nfs/dbraw/zinc/80/32/47/567803247.db2.gz VGIMKJJDSOCESM-LSDHHAIUSA-N 0 3 389.348 3.407 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1[nH]c2ccc(Cl)cc2c1Cl ZINC000647822078 567803321 /nfs/dbraw/zinc/80/33/21/567803321.db2.gz PXKLLSMZDSMQPA-LSDHHAIUSA-N 0 3 382.291 3.410 10 0 GGAEHN C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)N1CCOC[C@@H]1[C@H]1CCCN1C ZINC000647823519 567803345 /nfs/dbraw/zinc/80/33/45/567803345.db2.gz JREKJTKDSZUAKX-FSPWUOQZSA-N 0 3 385.335 3.494 10 0 GGAEHN CSCC[C@H](N[C@H](C)Cc1ncc(C(F)(F)F)cc1Cl)C(=O)N(C)C ZINC000599046428 567803576 /nfs/dbraw/zinc/80/35/76/567803576.db2.gz JGCVQHXJAGHAOZ-MFKMUULPSA-N 0 3 397.894 3.484 10 0 GGAEHN CNC(=O)[C@H](CCSC)N[C@@H](C)Cc1ncc(C(F)(F)F)cc1Cl ZINC000599047254 567804028 /nfs/dbraw/zinc/80/40/28/567804028.db2.gz QXPOLFJGINNYRT-CABZTGNLSA-N 0 3 383.867 3.142 10 0 GGAEHN O=C1[C@@H](N[C@H]2CCc3ccc(I)cc32)CCN1C1CCC1 ZINC000599092526 567804691 /nfs/dbraw/zinc/80/46/91/567804691.db2.gz JVDBBEQGPFMWOF-HOTGVXAUSA-N 0 3 396.272 3.022 10 0 GGAEHN O=C1[C@H](N[C@@H]2CCc3ccc(I)cc32)CCN1C1CCC1 ZINC000599092527 567805131 /nfs/dbraw/zinc/80/51/31/567805131.db2.gz JVDBBEQGPFMWOF-HZPDHXFCSA-N 0 3 396.272 3.022 10 0 GGAEHN Cc1noc([C@H]2OCC[C@H]2N[C@H](C)c2ccc(I)cc2)n1 ZINC000599093665 567805797 /nfs/dbraw/zinc/80/57/97/567805797.db2.gz VCWOBOCWANJNIF-FZQKWOKYSA-N 0 3 399.232 3.163 10 0 GGAEHN Cc1noc([C@H]2OCC[C@H]2N[C@@H](C)c2ccc(I)cc2)n1 ZINC000599093666 567805952 /nfs/dbraw/zinc/80/59/52/567805952.db2.gz VCWOBOCWANJNIF-FZZIBODNSA-N 0 3 399.232 3.163 10 0 GGAEHN C[C@@H](CNC(=O)c1cc(Br)cc(N2CCCC2)c1)N1CCCC1 ZINC000668297535 567806014 /nfs/dbraw/zinc/80/60/14/567806014.db2.gz UNMAIPWIDHPHMI-AWEZNQCLSA-N 0 3 380.330 3.263 10 0 GGAEHN C[C@H](NC[C@@H]1CS(=O)(=O)c2ccccc21)c1cncc(Br)c1 ZINC000575003002 567807728 /nfs/dbraw/zinc/80/77/28/567807728.db2.gz ASWFJZZAUWPTAA-WCQYABFASA-N 0 3 381.295 3.066 10 0 GGAEHN C[C@@H](NC[C@H]1CS(=O)(=O)c2ccccc21)c1cncc(Br)c1 ZINC000575003003 567807761 /nfs/dbraw/zinc/80/77/61/567807761.db2.gz ASWFJZZAUWPTAA-YPMHNXCESA-N 0 3 381.295 3.066 10 0 GGAEHN CCOC(=O)c1cnc(N[C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)cn1 ZINC000599172058 567808793 /nfs/dbraw/zinc/80/87/93/567808793.db2.gz JNYBFOANCDKARK-HNNXBMFYSA-N 0 3 383.279 3.097 10 0 GGAEHN C[C@H](Cc1cc(Br)ccc1F)NC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000534379511 567808946 /nfs/dbraw/zinc/80/89/46/567808946.db2.gz CNPARHBWEMBSDO-MLGOLLRUSA-N 0 3 398.320 3.397 10 0 GGAEHN Cc1nn(C)c(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c1Br ZINC000647984305 567809066 /nfs/dbraw/zinc/80/90/66/567809066.db2.gz PTDDHLWSBLVGIY-ZFWWWQNUSA-N 0 3 392.301 3.058 10 0 GGAEHN COc1ccc(CCC(=O)N2CC[C@H](N3CCCCC3)C2)c(Br)c1 ZINC000668443174 567809826 /nfs/dbraw/zinc/80/98/26/567809826.db2.gz WILCHERWGMWSNM-INIZCTEOSA-N 0 3 395.341 3.477 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)c1nn(C(C)(C)C)cc1Br ZINC000668430280 567809891 /nfs/dbraw/zinc/80/98/91/567809891.db2.gz DUOLHBIVIZOZCH-STQMWFEESA-N 0 3 385.350 3.393 10 0 GGAEHN CN1CCC[C@@H](CNC(=O)c2cc(Br)cc(N3CCCC3)c2)C1 ZINC000668463480 567810458 /nfs/dbraw/zinc/81/04/58/567810458.db2.gz QZZMIRCUEPCGAA-AWEZNQCLSA-N 0 3 380.330 3.121 10 0 GGAEHN O=C(N[C@H]1CCN(CC2CC2)C1)c1cc(Br)cc(N2CCCC2)c1 ZINC000668457733 567810996 /nfs/dbraw/zinc/81/09/96/567810996.db2.gz ODACURWDWRUMJN-KRWDZBQOSA-N 0 3 392.341 3.263 10 0 GGAEHN CCN1CCCN(C(=O)c2cc(Br)cc(N3CCCC3)c2)CC1 ZINC000668474061 567811609 /nfs/dbraw/zinc/81/16/09/567811609.db2.gz MKZXYFVZNZTUKS-UHFFFAOYSA-N 0 3 380.330 3.217 10 0 GGAEHN CN(C)CCN(CC(=O)OC(C)(C)C)C(=O)c1csc(C(F)(F)F)c1 ZINC000599250430 567812093 /nfs/dbraw/zinc/81/20/93/567812093.db2.gz OBSFTUQHORNOBJ-UHFFFAOYSA-N 0 3 380.432 3.112 10 0 GGAEHN O[C@@H](CCNCc1cc(OC(F)F)ccc1Br)C(F)(F)F ZINC000648034762 567812103 /nfs/dbraw/zinc/81/21/03/567812103.db2.gz DVUFADVEAHWQMS-JTQLQIEISA-N 0 3 378.135 3.453 10 0 GGAEHN O[C@H](COc1ccc(Br)cc1)CN1CC[C@H](CC(F)(F)F)C1 ZINC000444713760 567812280 /nfs/dbraw/zinc/81/22/80/567812280.db2.gz ZRGDVVZPXKRTIV-YPMHNXCESA-N 0 3 382.220 3.463 10 0 GGAEHN O[C@H](CCNCc1ccc(OC(F)F)c(Br)c1)C(F)(F)F ZINC000575095341 567812337 /nfs/dbraw/zinc/81/23/37/567812337.db2.gz HWWKESDEXHJZHM-SNVBAGLBSA-N 0 3 378.135 3.453 10 0 GGAEHN CO[C@@H]1CS(=O)(=O)C[C@@H]1N[C@@H]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000668506057 567812514 /nfs/dbraw/zinc/81/25/14/567812514.db2.gz GGDSAEINVOGQRX-BQDHKBFISA-N 0 3 378.321 3.031 10 0 GGAEHN CO[C@@H]1CS(=O)(=O)C[C@@H]1N[C@H]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000668506058 567812565 /nfs/dbraw/zinc/81/25/65/567812565.db2.gz GGDSAEINVOGQRX-IPOQPSJVSA-N 0 3 378.321 3.031 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1C[C@H](C)C(O)[C@@H](C)C1 ZINC000668554291 567813506 /nfs/dbraw/zinc/81/35/06/567813506.db2.gz MXEZIJCZARHGHT-STQMWFEESA-N 0 3 378.314 3.392 10 0 GGAEHN C[C@H](Cc1ccc(Br)c(F)c1)N[C@H]1CC[C@@H](C)S(=O)(=O)C1 ZINC000668561686 567813711 /nfs/dbraw/zinc/81/37/11/567813711.db2.gz QFCZUSVBDMSZJL-WZRBSPASSA-N 0 3 378.307 3.075 10 0 GGAEHN C[C@H](Cc1ccc(Br)c(F)c1)N[C@H]1CC[C@H](C)S(=O)(=O)C1 ZINC000668561683 567813891 /nfs/dbraw/zinc/81/38/91/567813891.db2.gz QFCZUSVBDMSZJL-MDZLAQPJSA-N 0 3 378.307 3.075 10 0 GGAEHN CN(C(=O)c1cc(Br)cc(N2CCCC2)c1)[C@@H]1CCN(C2CC2)C1 ZINC000668599004 567814643 /nfs/dbraw/zinc/81/46/43/567814643.db2.gz QMBHMAGNAPLXOH-QGZVFWFLSA-N 0 3 392.341 3.358 10 0 GGAEHN CN(C(=O)c1cc(Br)cc(N2CCCC2)c1)[C@H]1CCN(C2CC2)C1 ZINC000668599003 567814795 /nfs/dbraw/zinc/81/47/95/567814795.db2.gz QMBHMAGNAPLXOH-KRWDZBQOSA-N 0 3 392.341 3.358 10 0 GGAEHN Cc1[nH]c2ccc(C(=O)NCc3ccc(N4CCCN(C)CC4)nc3)cc2c1C ZINC000048288405 570227987 /nfs/dbraw/zinc/22/79/87/570227987.db2.gz AIKGAKVQSHJVQM-UHFFFAOYSA-N 0 3 391.519 3.252 10 0 GGAEHN CCN1CCN(c2ccc(NC(=O)[C@@H]3COc4ccccc4C3)c(C)c2)CC1 ZINC000048342566 570239962 /nfs/dbraw/zinc/23/99/62/570239962.db2.gz FWYGODZWYCNELM-IBGZPJMESA-N 0 3 379.504 3.327 10 0 GGAEHN COc1ccc2c(CC(=O)N3CCN(C4CCC(C)CC4)CC3)cc(=O)oc2c1 ZINC000115481295 570275625 /nfs/dbraw/zinc/27/56/25/570275625.db2.gz YATYZCFXKUMPEV-UHFFFAOYSA-N 0 3 398.503 3.067 10 0 GGAEHN O[C@H](CNC[C@@H](c1ccco1)N1CCCC1)COCc1ccccc1Cl ZINC000022038988 570303195 /nfs/dbraw/zinc/30/31/95/570303195.db2.gz BNABYTVVRHRFLS-MJGOQNOKSA-N 0 3 378.900 3.237 10 0 GGAEHN CCOC(=O)c1cc(C)c2c(c1)O[C@]1(CCN(C(=O)OC(C)(C)C)C1)C[C@H]2N ZINC000725260784 570310746 /nfs/dbraw/zinc/31/07/46/570310746.db2.gz WSCGUPNRDWZURE-QVKFZJNVSA-N 0 3 390.480 3.334 10 0 GGAEHN CC[C@H](C(=O)NCc1ccccc1)N1CCC[C@H](C(=O)Nc2ccccc2)C1 ZINC000012328402 570315916 /nfs/dbraw/zinc/31/59/16/570315916.db2.gz ILSLJICGBDOEPC-PZJWPPBQSA-N 0 3 379.504 3.432 10 0 GGAEHN COCC(=O)N(C[C@H]1CN(Cc2ccc[nH]2)C[C@@H]1c1ccccc1OC)C(C)C ZINC000034740896 570327689 /nfs/dbraw/zinc/32/76/89/570327689.db2.gz JONTVLQYLHESRM-NQIIRXRSSA-N 0 3 399.535 3.122 10 0 GGAEHN C[C@H](NCC1(N2CCOCC2)CCCCC1)C(=O)Nc1ccc2c(c1)CCC2 ZINC000022913985 570334800 /nfs/dbraw/zinc/33/48/00/570334800.db2.gz KNKCJHLFEDYVEY-SFHVURJKSA-N 0 3 385.552 3.127 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)c1nc(-c2ccco2)n(-c2cccc(C)c2)n1 ZINC000034911559 570341173 /nfs/dbraw/zinc/34/11/73/570341173.db2.gz JWYQTNCYHUBVJM-KRWDZBQOSA-N 0 3 379.464 3.050 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)CC1CCN(C(=O)Nc2ccccc2)CC1 ZINC000035399207 570349711 /nfs/dbraw/zinc/34/97/11/570349711.db2.gz WNNSTVKQOQPONV-SFHVURJKSA-N 0 3 386.540 3.311 10 0 GGAEHN COc1cc2c(cc1OC)[C@@H]1CN(C)CC[C@@H]1N=C2c1ccc(NC(C)=O)cc1 ZINC000003780828 570350773 /nfs/dbraw/zinc/35/07/73/570350773.db2.gz DCDXHGMCXGHXBM-PMACEKPBSA-N 0 3 393.487 3.301 10 0 in-man GGAEHN COc1ccc(C2=NC3(CCN(Cc4cc(C)ccc4C)CC3)NC2=O)cc1 ZINC000035430981 570359117 /nfs/dbraw/zinc/35/91/17/570359117.db2.gz HBMMAASRLKKHMT-UHFFFAOYSA-N 0 3 377.488 3.223 10 0 biogenic GGAEHN O[C@@H](CNCCNc1ncccc1C(F)(F)F)Cn1ccc2ccccc21 ZINC000004299483 570366049 /nfs/dbraw/zinc/36/60/49/570366049.db2.gz UFMTVOCZUJUSKF-HNNXBMFYSA-N 0 3 378.398 3.118 10 0 GGAEHN COC(=O)c1cccc(OC[C@@H](O)CN(C)[C@@H](C)c2ccc(F)c(F)c2)c1 ZINC000023674170 570368935 /nfs/dbraw/zinc/36/89/35/570368935.db2.gz OQRDPNFIUUEVEG-BBRMVZONSA-N 0 3 379.403 3.184 10 0 GGAEHN C[C@@H]1CN(Cc2ccccc2CNCc2c[nH]nc2-c2cccnc2)C[C@H](C)O1 ZINC000237776041 570395850 /nfs/dbraw/zinc/39/58/50/570395850.db2.gz UUMRINVWULRCQU-HDICACEKSA-N 0 3 391.519 3.371 10 0 GGAEHN Cc1ccccc1Sc1nccnc1SCC(=O)NCCN1CCCC1 ZINC000033289006 570405995 /nfs/dbraw/zinc/40/59/95/570405995.db2.gz KQIASCXWMXPAIL-UHFFFAOYSA-N 0 3 388.562 3.240 10 0 GGAEHN Cc1ccc(-c2nnc(CCC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)o2)cc1 ZINC000025252344 570409635 /nfs/dbraw/zinc/40/96/35/570409635.db2.gz MVXPWJLGDYVSSR-HXUWFJFHSA-N 0 3 390.487 3.368 10 0 GGAEHN Cc1ccc(-c2nnc(CCC(=O)N[C@H]3CCN(Cc4ccccc4)C3)o2)cc1 ZINC000025252348 570409735 /nfs/dbraw/zinc/40/97/35/570409735.db2.gz MVXPWJLGDYVSSR-FQEVSTJZSA-N 0 3 390.487 3.368 10 0 GGAEHN CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)N[C@H]2CCCN(C3CCCCC3)C2)C1 ZINC000241965693 570432139 /nfs/dbraw/zinc/43/21/39/570432139.db2.gz UVALKUHHBLZHRP-HGHSHCQRSA-N 0 3 383.602 3.163 10 0 GGAEHN CCN1CCC(NC(=O)c2nn(-c3ccc(F)cc3)c3c2CCCCC3)CC1 ZINC000029608432 570476729 /nfs/dbraw/zinc/47/67/29/570476729.db2.gz DVWZWJWELUOPSG-UHFFFAOYSA-N 0 3 384.499 3.494 10 0 GGAEHN COCCN1CCC(CNC(=O)Nc2nn([C@@H](C)c3ccccc3)cc2C)CC1 ZINC000252509504 570477003 /nfs/dbraw/zinc/47/70/03/570477003.db2.gz YOVYSNRSJUQYQV-SFHVURJKSA-N 0 3 399.539 3.281 10 0 GGAEHN CC(C)c1ccccc1NC(=O)[C@@H](C)N1CCN(C2CCN(C)CC2)[C@H](C)C1 ZINC000252511718 570477444 /nfs/dbraw/zinc/47/74/44/570477444.db2.gz KARPIIIHJYUWBH-RTBURBONSA-N 0 3 386.584 3.237 10 0 GGAEHN CN(Cc1ccc(C(=O)NCC(F)(F)F)cc1)Cn1cnc2ccccc21 ZINC000029898448 570482497 /nfs/dbraw/zinc/48/24/97/570482497.db2.gz DAHJFHDOCOZUOK-UHFFFAOYSA-N 0 3 376.382 3.418 10 0 GGAEHN CCOC(=O)c1c(C)c(-c2ccccc2)n(CC(=O)NCCN2CCCC2)c1C ZINC000006805001 570493935 /nfs/dbraw/zinc/49/39/35/570493935.db2.gz QCKDXNBXKVGQMU-UHFFFAOYSA-N 0 3 397.519 3.161 10 0 GGAEHN CCOC(=O)C1=C(CN(C)C2CCCCC2)N(C)C(=O)N[C@H]1c1ccccc1 ZINC000035991609 570505589 /nfs/dbraw/zinc/50/55/89/570505589.db2.gz VJPFDWNJMBXXKL-FQEVSTJZSA-N 0 3 385.508 3.464 10 0 GGAEHN O=C(/C=C/c1ccc2c(c1)OCCO2)NCCCN1CCc2ccccc2C1 ZINC000046239259 570528812 /nfs/dbraw/zinc/52/88/12/570528812.db2.gz GJCTUUVJYPBPQJ-VQHVLOKHSA-N 0 3 378.472 3.036 10 0 GGAEHN COc1ccc(CN(C[C@H](O)COCc2ccccc2)C[C@H]2CCCO2)cc1 ZINC000036095263 570534235 /nfs/dbraw/zinc/53/42/35/570534235.db2.gz DNBYZIGABNUDHN-JTHBVZDNSA-N 0 3 385.504 3.254 10 0 GGAEHN COc1ccc(OC[C@H](O)CN(Cc2cc(OC)cc(OC)c2)C2CC2)cc1 ZINC000036095110 570534618 /nfs/dbraw/zinc/53/46/18/570534618.db2.gz VELIMQPYATYCCW-GOSISDBHSA-N 0 3 387.476 3.117 10 0 GGAEHN COc1ccc(OC[C@H](O)CN(Cc2ccc(OC)c(OC)c2)C(C)C)cc1 ZINC000036095796 570535045 /nfs/dbraw/zinc/53/50/45/570535045.db2.gz WMHDHLAZNVGNBE-GOSISDBHSA-N 0 3 389.492 3.363 10 0 GGAEHN COc1cccc(CN(C[C@H](O)COCc2ccccc2)C[C@@H]2CCCO2)c1 ZINC000036100266 570538102 /nfs/dbraw/zinc/53/81/02/570538102.db2.gz CCSFFZXXRJDHTL-GMAHTHKFSA-N 0 3 385.504 3.254 10 0 GGAEHN COc1ccc(OC[C@@H](O)CN(Cc2ccccc2C)C[C@@H]2CCCO2)cc1 ZINC000036100015 570538162 /nfs/dbraw/zinc/53/81/62/570538162.db2.gz JMPCQSYIWZWKNS-REWPJTCUSA-N 0 3 385.504 3.425 10 0 GGAEHN CCN1CCN(c2ccc(NC(=O)CCc3ccc4c(c3)OCO4)cc2)CC1 ZINC000008745839 570539883 /nfs/dbraw/zinc/53/98/83/570539883.db2.gz SQAKUYABVKLUEX-UHFFFAOYSA-N 0 3 381.476 3.129 10 0 GGAEHN CCn1nnc2cc(C(=O)N3c4ccc(C)cc4[C@@H]4CN(C)CC[C@H]43)ccc21 ZINC000008745147 570540096 /nfs/dbraw/zinc/54/00/96/570540096.db2.gz IPAIELBNOFVNEU-FXAWDEMLSA-N 0 3 375.476 3.208 10 0 GGAEHN CCn1nnc2cc(C(=O)N3c4ccc(C)cc4[C@H]4CN(C)CC[C@@H]43)ccc21 ZINC000008745144 570540131 /nfs/dbraw/zinc/54/01/31/570540131.db2.gz IPAIELBNOFVNEU-XLIONFOSSA-N 0 3 375.476 3.208 10 0 GGAEHN CCCC(=O)OC[C@H](O)CN(Cc1ccc2c(c1)OCO2)Cc1ccccc1C ZINC000036104645 570541508 /nfs/dbraw/zinc/54/15/08/570541508.db2.gz BBQUCCYAODIDTL-HXUWFJFHSA-N 0 3 399.487 3.430 10 0 GGAEHN CCNC(=O)N(CCN(C)C)Cc1csc(COc2cccc(C)c2)n1 ZINC000036115167 570543223 /nfs/dbraw/zinc/54/32/23/570543223.db2.gz KUXBLXCNVLCHNX-UHFFFAOYSA-N 0 3 376.526 3.124 10 0 GGAEHN CN1CCN(CCCNC(=O)Cn2c(-c3cccs3)cc3ccccc32)CC1 ZINC000022795259 570548489 /nfs/dbraw/zinc/54/84/89/570548489.db2.gz YZAPCHGVEVFDNV-UHFFFAOYSA-N 0 3 396.560 3.124 10 0 GGAEHN CCC(=O)Nc1ccc(N(C)C)c(CN(CCN(C)C)C(=O)C(CC)CC)c1 ZINC000006722107 570550627 /nfs/dbraw/zinc/55/06/27/570550627.db2.gz ZKXMVTIKWHEEPB-UHFFFAOYSA-N 0 3 390.572 3.428 10 0 GGAEHN O=C(CC1CCN(C(=O)C2CCCCC2)CC1)NCCN1CCCCCC1 ZINC000032974384 570562268 /nfs/dbraw/zinc/56/22/68/570562268.db2.gz AGQGKNGWWBXSEO-UHFFFAOYSA-N 0 3 377.573 3.188 10 0 GGAEHN COc1ccc(CN2CCCN(C[C@@H](C)NC(=O)OC(C)(C)C)CC2)cc1 ZINC000225418384 570572049 /nfs/dbraw/zinc/57/20/49/570572049.db2.gz GYWTZJMDGORAQM-QGZVFWFLSA-N 0 3 377.529 3.116 10 0 GGAEHN CC1=C(C(=O)NC2CCN(Cc3ccccc3)CC2)C2(CCCCC2)OC1=O ZINC000006772395 570582254 /nfs/dbraw/zinc/58/22/54/570582254.db2.gz SEECABYBDHDBTH-UHFFFAOYSA-N 0 3 382.504 3.343 10 0 biogenic GGAEHN CC1=C(C(=O)NCCCN2CCc3ccccc3C2)C2(CCCCC2)OC1=O ZINC000006772437 570582316 /nfs/dbraw/zinc/58/23/16/570582316.db2.gz CNBQHFUDNBYVBW-UHFFFAOYSA-N 0 3 382.504 3.127 10 0 GGAEHN COCCN1CCC[C@H]1CN[C@H](C)c1cnccc1NC(=O)OC(C)(C)C ZINC000225565802 570589051 /nfs/dbraw/zinc/58/90/51/570589051.db2.gz PFOPCHLPKUBFQB-CVEARBPZSA-N 0 3 378.517 3.190 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)c1cc(-c2cccnc2)n(-c2ccc(F)cc2)n1 ZINC000064919411 570590466 /nfs/dbraw/zinc/59/04/66/570590466.db2.gz SBCBGLWGPJSZNQ-LJQANCHMSA-N 0 3 393.466 3.288 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)c1cc(-c2cccnc2)n(-c2ccc(F)cc2)n1 ZINC000064919413 570590499 /nfs/dbraw/zinc/59/04/99/570590499.db2.gz SBCBGLWGPJSZNQ-IBGZPJMESA-N 0 3 393.466 3.288 10 0 GGAEHN CCN(CC(=O)N1CCC(C)CC1)[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1 ZINC000225670115 570601070 /nfs/dbraw/zinc/60/10/70/570601070.db2.gz NQTKYYQXBOQWAB-GOSISDBHSA-N 0 3 381.561 3.356 10 0 GGAEHN CCN(CC)CCCNc1ccc(S(=O)(=O)Cc2ccc(Cl)cc2)nn1 ZINC000064942904 570601571 /nfs/dbraw/zinc/60/15/71/570601571.db2.gz BRCLLNOITKYOCD-UHFFFAOYSA-N 0 3 396.944 3.248 10 0 GGAEHN COc1ccc(CN(C[C@@H](O)Cc2ccccc2)C[C@@H]2CCCO2)cc1OC ZINC000169681643 570602021 /nfs/dbraw/zinc/60/20/21/570602021.db2.gz WKOIPQHLGKCXDR-SFTDATJTSA-N 0 3 385.504 3.288 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1cnn(-c2ccccc2)c1-n1cccc1 ZINC000006807045 570607474 /nfs/dbraw/zinc/60/74/74/570607474.db2.gz QGDCUXGUOGCKLM-GOSISDBHSA-N 0 3 377.492 3.267 10 0 GGAEHN Cc1cc2nc3sc(C(=O)NCCN4CCCC[C@@H]4C)cc(=O)n3c2cc1C ZINC000033009095 570620439 /nfs/dbraw/zinc/62/04/39/570620439.db2.gz NWAHEGSOFJDSLT-HNNXBMFYSA-N 0 3 398.532 3.130 10 0 GGAEHN O=C(NCCN1CCCCCC1)c1cccc(-c2cc(N3CCCC3)ncn2)c1 ZINC000064989577 570632180 /nfs/dbraw/zinc/63/21/80/570632180.db2.gz WJGDYJFAJVDYPU-UHFFFAOYSA-N 0 3 393.535 3.350 10 0 GGAEHN Cc1ncc(C(=O)N2CC[C@H](C3CCN(Cc4cccc(F)c4F)CC3)C2)[nH]1 ZINC000012299903 570635129 /nfs/dbraw/zinc/63/51/29/570635129.db2.gz ZEBSTYDNMIDXSY-INIZCTEOSA-N 0 3 388.462 3.371 10 0 GGAEHN COC1CCN(C(=O)C2(N(C)CCc3ccccc3)Cc3ccccc3C2)CC1 ZINC000012303703 570637778 /nfs/dbraw/zinc/63/77/78/570637778.db2.gz JHBKIELISSMHNJ-UHFFFAOYSA-N 0 3 392.543 3.336 10 0 GGAEHN O=C(NCCN1CCCCCC1)c1cccc(-c2cnc(N3CCCC3)nc2)c1 ZINC000065025707 570650324 /nfs/dbraw/zinc/65/03/24/570650324.db2.gz FDWPFJBERSCDAL-UHFFFAOYSA-N 0 3 393.535 3.350 10 0 GGAEHN CN(CCCNC(=O)c1noc2c1COc1ccccc1-2)Cc1ccccc1 ZINC000033028799 570666630 /nfs/dbraw/zinc/66/66/30/570666630.db2.gz DWXMXPHYOJJIEH-UHFFFAOYSA-N 0 3 377.444 3.486 10 0 GGAEHN COc1ccc2c(c1)c(CN1CCC(C(=O)NCc3ccco3)CC1)cn2C ZINC000065060026 570668051 /nfs/dbraw/zinc/66/80/51/570668051.db2.gz HYIYIJRHZRSSSW-UHFFFAOYSA-N 0 3 381.476 3.308 10 0 GGAEHN CN(C)CCNC(=O)c1cccc([C@@H]2CCCN(C(=O)Nc3ccccc3)C2)c1 ZINC000033035683 570671991 /nfs/dbraw/zinc/67/19/91/570671991.db2.gz UAYDJAFUHVQKRS-HXUWFJFHSA-N 0 3 394.519 3.390 10 0 GGAEHN Cc1cccc(N2CCN(CC[C@@H](C)NC(=O)Cc3ccc(F)cc3)CC2)c1 ZINC000032579785 570675408 /nfs/dbraw/zinc/67/54/08/570675408.db2.gz XEHLJISQNBKSJL-LJQANCHMSA-N 0 3 383.511 3.394 10 0 GGAEHN O[C@H](CN[C@@H]1CCSc2ccc(F)cc21)COCc1ccc2c(c1)OCO2 ZINC000036396208 570679616 /nfs/dbraw/zinc/67/96/16/570679616.db2.gz QWMUNGGWXKVVCI-NVXWUHKLSA-N 0 3 391.464 3.259 10 0 GGAEHN O=C(N[C@@H]1CCCN(CCc2ccccc2)C1)c1cc2ccccc2oc1=O ZINC000012592594 570688335 /nfs/dbraw/zinc/68/83/35/570688335.db2.gz LMRWELLROFQSET-LJQANCHMSA-N 0 3 376.456 3.230 10 0 GGAEHN CC[C@H]1c2ccsc2CCN1C[C@H](O)COCc1ccc2c(c1)OCO2 ZINC000036412987 570696664 /nfs/dbraw/zinc/69/66/64/570696664.db2.gz OZQYJNMRXUTVLF-RDJZCZTQSA-N 0 3 375.490 3.364 10 0 GGAEHN CCCCNC(=O)c1sc2ncnc(N3CCN(CCC)CC3)c2c1C ZINC000033048384 570699775 /nfs/dbraw/zinc/69/97/75/570699775.db2.gz FBYXTLKVKNNCNT-UHFFFAOYSA-N 0 3 375.542 3.062 10 0 GGAEHN CN(C)Cc1ccccc1CNC(=O)Nc1cccc(CN2CCOC2=O)c1 ZINC000057987281 570705326 /nfs/dbraw/zinc/70/53/26/570705326.db2.gz KAICIWRORVCXKR-UHFFFAOYSA-N 0 3 382.464 3.022 10 0 GGAEHN COc1ccc(-c2cc(C(=O)NCCCN(C)Cc3ccccc3)[nH]n2)cc1 ZINC000006942643 570715357 /nfs/dbraw/zinc/71/53/57/570715357.db2.gz LRAJQVDFXSMLGX-UHFFFAOYSA-N 0 3 378.476 3.337 10 0 biogenic GGAEHN Cc1cc(NC(=O)[C@H](C)NCC2(c3ccc(Cl)cc3)CCOCC2)no1 ZINC000058191306 570717849 /nfs/dbraw/zinc/71/78/49/570717849.db2.gz WAVOWIRLBPWLBL-AWEZNQCLSA-N 0 3 377.872 3.301 10 0 GGAEHN Cc1c(C(=O)N2CCCC[C@H]2CN(C)C)cnn1-c1ccc(C(F)(F)F)cn1 ZINC000058202166 570719409 /nfs/dbraw/zinc/71/94/09/570719409.db2.gz HGDZUGRKHSLDDM-HNNXBMFYSA-N 0 3 395.429 3.151 10 0 GGAEHN CC(=O)N1CCc2sc(C(=O)NC3CCN(Cc4ccccc4)CC3)cc2C1 ZINC000065200834 570727481 /nfs/dbraw/zinc/72/74/81/570727481.db2.gz OZULRCXNSLNDRN-UHFFFAOYSA-N 0 3 397.544 3.047 10 0 GGAEHN O=C(/C=C/c1ccc(Cl)c(C(F)(F)F)c1)NC[C@@H]1CN2CCC[C@@H]2CO1 ZINC000058377727 570729821 /nfs/dbraw/zinc/72/98/21/570729821.db2.gz YBWAXKXVGNZOIE-IOKDEZFASA-N 0 3 388.817 3.351 10 0 GGAEHN CCCN1CCN(C(=O)c2cc3c(n2C)CCN(Cc2cccc(C)c2)C3)CC1 ZINC000065210888 570730223 /nfs/dbraw/zinc/73/02/23/570730223.db2.gz WRFPAEULNIOSBL-UHFFFAOYSA-N 0 3 394.563 3.060 10 0 GGAEHN O=C(NCCN1CCCCC1)c1ccc2c(c1)N(C(=O)c1ccc(F)cc1)CC2 ZINC000065210367 570730506 /nfs/dbraw/zinc/73/05/06/570730506.db2.gz PACGJUZTFIBDRM-UHFFFAOYSA-N 0 3 395.478 3.244 10 0 GGAEHN CN(C)Cc1ccccc1CNC(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000058406738 570731791 /nfs/dbraw/zinc/73/17/91/570731791.db2.gz YMJUJJSCFLOYPL-KRWDZBQOSA-N 0 3 384.499 3.213 10 0 GGAEHN CCN1CCC(NC(=O)C2(c3cccc(C(F)(F)F)c3)CCOCC2)CC1 ZINC000058428772 570733136 /nfs/dbraw/zinc/73/31/36/570733136.db2.gz SMYSYLOJXQIHSB-UHFFFAOYSA-N 0 3 384.442 3.354 10 0 GGAEHN Cc1ccc(CC(=O)N2CCC3(CN(C)C[C@H]3c3noc(C4CC4)n3)CC2)cc1 ZINC000097940994 570742952 /nfs/dbraw/zinc/74/29/52/570742952.db2.gz BTWRORSCAMFFFN-IBGZPJMESA-N 0 3 394.519 3.136 10 0 GGAEHN CN(C)CCn1nnc2cc(-c3noc(Cc4ccc(Cl)cc4)n3)ccc21 ZINC000065254985 570752829 /nfs/dbraw/zinc/75/28/29/570752829.db2.gz MUIHOHYZYNSYQW-UHFFFAOYSA-N 0 3 382.855 3.287 10 0 GGAEHN O=C(NCc1ccc(F)cc1)c1cccnc1N1CCN[C@H](c2ccccc2)C1 ZINC000065255762 570753743 /nfs/dbraw/zinc/75/37/43/570753743.db2.gz SQBZMPYTUITMCR-NRFANRHFSA-N 0 3 390.462 3.302 10 0 GGAEHN O=C(NCc1cccs1)c1cccnc1N1CCN[C@H](c2ccccc2)C1 ZINC000065255790 570754363 /nfs/dbraw/zinc/75/43/63/570754363.db2.gz VRFXUYHXHCJFLI-IBGZPJMESA-N 0 3 378.501 3.224 10 0 GGAEHN O=C(NCc1cccc(F)c1)c1cccnc1N1CCN[C@H](c2ccccc2)C1 ZINC000065255784 570754419 /nfs/dbraw/zinc/75/44/19/570754419.db2.gz QFMHKYLYFRLOHG-NRFANRHFSA-N 0 3 390.462 3.302 10 0 GGAEHN O=C(NCCc1cccs1)c1ccc(N2CCN[C@@H](c3ccccc3)C2)nc1 ZINC000065256121 570754599 /nfs/dbraw/zinc/75/45/99/570754599.db2.gz VIAXAZIINSWAIM-HXUWFJFHSA-N 0 3 392.528 3.267 10 0 GGAEHN Cc1ccc(CNC(=O)c2ccc(N3CCN[C@H](c4ccccc4)C3)nc2)cc1 ZINC000065256096 570754860 /nfs/dbraw/zinc/75/48/60/570754860.db2.gz ZBALYTVDLXZAGX-QFIPXVFZSA-N 0 3 386.499 3.471 10 0 GGAEHN O=C(NCCc1cccs1)c1cccc(N2CCN[C@H](c3ccccc3)C2)n1 ZINC000065256281 570755178 /nfs/dbraw/zinc/75/51/78/570755178.db2.gz PCBKBJDGVQEZMO-FQEVSTJZSA-N 0 3 392.528 3.267 10 0 GGAEHN Cc1cccc(CNC(=O)c2cccc(N3CCN[C@H](c4ccccc4)C3)n2)c1 ZINC000065256277 570755303 /nfs/dbraw/zinc/75/53/03/570755303.db2.gz MTSPDWYDRVKYFE-QFIPXVFZSA-N 0 3 386.499 3.471 10 0 GGAEHN O=C(Nc1ccccc1)c1ccc(N2CC[C@@H](NCc3ccc(O)cc3)C2)nc1 ZINC000065257034 570755553 /nfs/dbraw/zinc/75/55/53/570755553.db2.gz YAJQMGOUKKIQBF-HXUWFJFHSA-N 0 3 388.471 3.408 10 0 GGAEHN CCCCN1CCN(c2nnc(-c3nc(C4CC4)no3)c3ccccc32)CC1 ZINC000065258297 570759798 /nfs/dbraw/zinc/75/97/98/570759798.db2.gz YBCNOGGGIFBXEG-UHFFFAOYSA-N 0 3 378.480 3.479 10 0 GGAEHN CCOc1ccc(CN2CC[C@@H](c3nc4cccnc4n3CCOC)C2)cc1 ZINC000065285387 570781068 /nfs/dbraw/zinc/78/10/68/570781068.db2.gz SCUXGOQUXNNXDH-GOSISDBHSA-N 0 3 380.492 3.466 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)c1nc(-c2oc3ccc(OC)cc3c2C)no1 ZINC000065010331 570784657 /nfs/dbraw/zinc/78/46/57/570784657.db2.gz ROEQAGZXACWZRR-CYBMUJFWSA-N 0 3 384.436 3.014 10 0 GGAEHN CCc1nn(C)cc1CN1CCC2(C[C@@H]2N(Cc2ccsc2)C(C)=O)CC1 ZINC000583622168 570802272 /nfs/dbraw/zinc/80/22/72/570802272.db2.gz UUIJHOGVFIKLMG-FQEVSTJZSA-N 0 3 386.565 3.447 10 0 GGAEHN O=C(NCCN1CCCCC1)C1CCN(c2nc3cc(Cl)ccc3[nH]2)CC1 ZINC000033071149 570803043 /nfs/dbraw/zinc/80/30/43/570803043.db2.gz KBPRBCNZNWEPTA-UHFFFAOYSA-N 0 3 389.931 3.035 10 0 GGAEHN O=C(NCCN1CCCCC1)C1CCN(c2nc3ccc(Cl)cc3[nH]2)CC1 ZINC000033071149 570803047 /nfs/dbraw/zinc/80/30/47/570803047.db2.gz KBPRBCNZNWEPTA-UHFFFAOYSA-N 0 3 389.931 3.035 10 0 GGAEHN O=C(C1CCN(c2ccncc2)CC1)N1CCN(c2ccc(Cl)cc2)CC1 ZINC000033128917 570817992 /nfs/dbraw/zinc/81/79/92/570817992.db2.gz LQSSASSMXVAYOA-UHFFFAOYSA-N 0 3 384.911 3.300 10 0 GGAEHN Cc1cccc(N2CCN(C(=O)C3CCN(c4ccncc4)CC3)CC2)c1C ZINC000033128935 570818058 /nfs/dbraw/zinc/81/80/58/570818058.db2.gz PJTRGTKDPNZVQO-UHFFFAOYSA-N 0 3 378.520 3.264 10 0 GGAEHN CCN1CCN(c2ccc(NC(=O)CN3CCC[C@H](C(F)(F)F)C3)cc2)CC1 ZINC000012517065 570825785 /nfs/dbraw/zinc/82/57/85/570825785.db2.gz GAQMYXXCZHBJGH-INIZCTEOSA-N 0 3 398.473 3.041 10 0 GGAEHN CC(C)c1ccc(CNc2nn3c(nc(CN4CCC(C)CC4)cc3=O)[nH]2)cc1 ZINC000101796813 570834435 /nfs/dbraw/zinc/83/44/35/570834435.db2.gz GORHPICAZVWBPZ-UHFFFAOYSA-N 0 3 394.523 3.385 10 0 GGAEHN CC(=O)NCCc1ccc([C@H](C)NCc2ccc(-n3nc(C)cc3C)nc2)cc1 ZINC000170591501 570848928 /nfs/dbraw/zinc/84/89/28/570848928.db2.gz HZDYIUPVYJECAE-SFHVURJKSA-N 0 3 391.519 3.414 10 0 GGAEHN COc1cc(OC)cc([C@@H]2CCN(C3CCN(C(=O)c4ccco4)CC3)C2)c1 ZINC000170602808 570861593 /nfs/dbraw/zinc/86/15/93/570861593.db2.gz WJBUUCZBLOOOMI-MRXNPFEDSA-N 0 3 384.476 3.391 10 0 GGAEHN C[C@@H](NC(=O)c1cccs1)C(=O)NCc1ccccc1CN1CCCCC1 ZINC000032869205 570864483 /nfs/dbraw/zinc/86/44/83/570864483.db2.gz CEISXAOHXOBZML-MRXNPFEDSA-N 0 3 385.533 3.169 10 0 GGAEHN CN(C)CCN(C(=O)c1ccc2c(c1)nnn2C)c1cccc(Cl)c1Cl ZINC000170610486 570866891 /nfs/dbraw/zinc/86/68/91/570866891.db2.gz BERMZZITOMGMLY-UHFFFAOYSA-N 0 3 392.290 3.484 10 0 GGAEHN O=C(c1ccnc(N2CCN[C@@H](c3ccccc3)C2)c1)N1CCc2ccccc2C1 ZINC000065256039 570881206 /nfs/dbraw/zinc/88/12/06/570881206.db2.gz VZMNGERVQGTTJS-HSZRJFAPSA-N 0 3 398.510 3.431 10 0 GGAEHN CCN1CCN(CCNC(=O)c2ccc(-n3ccc4ccccc43)s2)CC1 ZINC000022937353 570882413 /nfs/dbraw/zinc/88/24/13/570882413.db2.gz VIROXPINBLGSOG-UHFFFAOYSA-N 0 3 382.533 3.059 10 0 GGAEHN O=C(NCc1ccccc1CN1CCCCC1)c1cc2ccccc2[nH]c1=O ZINC000012616111 570891062 /nfs/dbraw/zinc/89/10/62/570891062.db2.gz LVFWZBNBMWBHST-UHFFFAOYSA-N 0 3 375.472 3.444 10 0 GGAEHN CCn1c(=O)cc(SCC(=O)NCCN2CCCC[C@H]2C)c2ccccc21 ZINC000004564061 570891283 /nfs/dbraw/zinc/89/12/83/570891283.db2.gz GQCUHZMWDRYLPT-MRXNPFEDSA-N 0 3 387.549 3.104 10 0 GGAEHN CCn1c(=O)cc(SCC(=O)NCCN2CCCC[C@@H]2C)c2ccccc21 ZINC000004564059 570891425 /nfs/dbraw/zinc/89/14/25/570891425.db2.gz GQCUHZMWDRYLPT-INIZCTEOSA-N 0 3 387.549 3.104 10 0 GGAEHN CCC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccc3c(c2)OCCO3)cc1 ZINC000032899641 570895360 /nfs/dbraw/zinc/89/53/60/570895360.db2.gz CIAQBADRSAMMIY-CRAIPNDOSA-N 0 3 385.460 3.141 10 0 GGAEHN C[C@H](C(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F)N1C[C@H](C)C[C@H](C)C1 ZINC000104213877 570897639 /nfs/dbraw/zinc/89/76/39/570897639.db2.gz NTNOGZXQOWPDOJ-QLFBSQMISA-N 0 3 399.457 3.469 10 0 GGAEHN Cc1ccc2c(c1)-c1onc(C(=O)NCCN(C)Cc3ccccc3)c1CO2 ZINC000032920449 570932943 /nfs/dbraw/zinc/93/29/43/570932943.db2.gz RAOQFSPLPWCHDA-UHFFFAOYSA-N 0 3 377.444 3.404 10 0 GGAEHN CCN1CCC(N(C)C(=O)CCC(=O)N2CCC[C@H]2C2CCCCC2)CC1 ZINC000073708480 570933145 /nfs/dbraw/zinc/93/31/45/570933145.db2.gz OGSMDAVRLXDEER-FQEVSTJZSA-N 0 3 377.573 3.281 10 0 GGAEHN COc1ccc(CN(C)CC(=O)NC2CCN(Cc3ccccc3)CC2)cc1F ZINC000007583650 570948971 /nfs/dbraw/zinc/94/89/71/570948971.db2.gz FYXWNFHDFANJDV-UHFFFAOYSA-N 0 3 399.510 3.047 10 0 GGAEHN CCOC(=O)C1=C(CN[C@@H]2CCCC[C@H]2C)NC(=O)N[C@H]1c1cccs1 ZINC000252444190 570957156 /nfs/dbraw/zinc/95/71/56/570957156.db2.gz OIPNTTZDLKGVMK-XNJGSVPQSA-N 0 3 377.510 3.088 10 0 GGAEHN CCN1CCN(Cc2ccc(CNC(=O)N[C@H]3CCc4ccccc43)cc2)CC1 ZINC000045305362 570990025 /nfs/dbraw/zinc/99/00/25/570990025.db2.gz IWOFCFWFSHOEAN-QHCPKHFHSA-N 0 3 392.547 3.311 10 0 GGAEHN C[C@@H]1CN(C(=O)C2CCN(CCOc3ccc(Cl)cc3)CC2)C[C@H](C)O1 ZINC000045803033 570997227 /nfs/dbraw/zinc/99/72/27/570997227.db2.gz MMJBEIBGIKQISQ-IYBDPMFKSA-N 0 3 380.916 3.067 10 0 GGAEHN CN1CCN(CCCNC(=O)C2(c3ccc(F)cc3)CC2)[C@H](c2ccccc2)C1 ZINC000046388370 570998425 /nfs/dbraw/zinc/99/84/25/570998425.db2.gz HAFAWDRLFRNEDK-QFIPXVFZSA-N 0 3 395.522 3.352 10 0 GGAEHN CC(=O)c1ccc(OCC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)cc1 ZINC000170653302 570999632 /nfs/dbraw/zinc/99/96/32/570999632.db2.gz KSKUFYIAYDLGLJ-VGSWGCGISA-N 0 3 380.488 3.295 10 0 GGAEHN COCCc1ccc(Oc2ccc(NC(=O)C(C)(C)N3CCNCC3)cc2)cc1 ZINC000170677644 571009152 /nfs/dbraw/zinc/00/91/52/571009152.db2.gz UAIDBBATNAPCDC-UHFFFAOYSA-N 0 3 397.519 3.290 10 0 GGAEHN Clc1ccc(CN(CCN2CCCC2)c2nccc(-n3cccn3)n2)cc1 ZINC000084617994 571027427 /nfs/dbraw/zinc/02/74/27/571027427.db2.gz UWHLVCQKPTZTET-UHFFFAOYSA-N 0 3 382.899 3.418 10 0 GGAEHN CN(C)CCNC(=O)[C@H]1CC[C@@H](c2ccccc2)N(C(=O)c2ccccc2F)C1 ZINC000037545747 571029233 /nfs/dbraw/zinc/02/92/33/571029233.db2.gz HREXZVDJFVYUGO-RXVVDRJESA-N 0 3 397.494 3.097 10 0 GGAEHN CC(C)CC(=O)N(Cc1ccccc1)c1ccc(CC(=O)NCCN(C)C)cc1 ZINC000037556328 571030818 /nfs/dbraw/zinc/03/08/18/571030818.db2.gz FWRHIECMXUNLOT-UHFFFAOYSA-N 0 3 395.547 3.486 10 0 GGAEHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N1CCN(c2ccc(F)cc2)CC1 ZINC000053540695 1406434940 /nfs/dbraw/zinc/43/49/40/1406434940.db2.gz AVSBSEYJEUDPGE-JOCHJYFZSA-N 0 3 396.510 3.494 10 0 GGAEHN O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCN(c2ccccc2Cl)CC1 ZINC000053549122 1406439565 /nfs/dbraw/zinc/43/95/65/1406439565.db2.gz DWADWHKXMZMEIE-IBGZPJMESA-N 0 3 398.938 3.446 10 0 GGAEHN Ic1ccc(CN2CCN[C@@H](c3ccccc3)C2)cc1 ZINC000115905909 1412813965 /nfs/dbraw/zinc/81/39/65/1412813965.db2.gz KAMVSYIZIFAOTP-QGZVFWFLSA-N 0 3 378.257 3.438 10 0 GGAEHN CCOC(=O)c1c(NC(=O)CNCCCOC)sc(C)c1-c1ccccc1 ZINC000003292320 1398332713 /nfs/dbraw/zinc/33/27/13/1398332713.db2.gz MJMSTCAEADMTCK-UHFFFAOYSA-N 0 3 390.505 3.465 10 0 GGAEHN COCCN(CCOC)C[C@@H](O)CO[C@H](c1ccccc1)c1ccccc1C ZINC000006940289 1398575901 /nfs/dbraw/zinc/57/59/01/1398575901.db2.gz CNHBVPIBRBYILG-FYYLOGMGSA-N 0 3 387.520 3.057 10 0 GGAEHN CC[NH+](CC)CCC[C@@H](C)[N-]S(=O)(=O)c1ccc(Br)s1 ZINC000007612715 1398713872 /nfs/dbraw/zinc/71/38/72/1398713872.db2.gz VLFRJULQWOTDBZ-LLVKDONJSA-N 0 3 383.377 3.299 10 0 GGAEHN CC[NH+](CC)CCC[C@H](C)[N-]S(=O)(=O)c1ccc(Br)s1 ZINC000007612716 1398713720 /nfs/dbraw/zinc/71/37/20/1398713720.db2.gz VLFRJULQWOTDBZ-NSHDSACASA-N 0 3 383.377 3.299 10 0 GGAEHN COc1ccc([C@@H](CNC(=O)c2cc3c(c(Cl)c2)OCO3)N(C)C)cc1 ZINC000008772517 1398846180 /nfs/dbraw/zinc/84/61/80/1398846180.db2.gz QFQMVEQXZNRKRQ-MRXNPFEDSA-N 0 3 376.840 3.110 10 0 GGAEHN CN(C)[C@@H](CNC(=O)c1ccc(NC(=O)c2ccco2)cc1)Cc1ccccc1 ZINC000008777360 1398846794 /nfs/dbraw/zinc/84/67/94/1398846794.db2.gz ATQSETBSHUUXOP-HXUWFJFHSA-N 0 3 391.471 3.435 10 0 GGAEHN CC[C@@]1(c2ccc(OC)cc2)NC(=O)N(CN(CC(C)C)CC(C)C)C1=O ZINC000008937139 1398849813 /nfs/dbraw/zinc/84/98/13/1398849813.db2.gz RIIPYNFZEYEWIZ-NRFANRHFSA-N 0 3 375.513 3.424 10 0 GGAEHN COc1ccc(S(=O)(=O)[N-]c2ccc(C[NH+]3CCCCC3)cc2)cc1OC ZINC000014231247 1399094354 /nfs/dbraw/zinc/09/43/54/1399094354.db2.gz QBTZYXCQKRNFEM-UHFFFAOYSA-N 0 3 390.505 3.491 10 0 GGAEHN C[C@H](NC[C@@H](O)COc1cccc2ccccc21)c1ccc(S(C)(=O)=O)cc1 ZINC000025695364 1399830660 /nfs/dbraw/zinc/83/06/60/1399830660.db2.gz QAZWFTXDIOKNHV-QFBILLFUSA-N 0 3 399.512 3.334 10 0 GGAEHN C[C@@H](NC[C@@H](O)COc1cccc2ccccc21)c1ccc(S(C)(=O)=O)cc1 ZINC000025695361 1399830744 /nfs/dbraw/zinc/83/07/44/1399830744.db2.gz QAZWFTXDIOKNHV-VQIMIIECSA-N 0 3 399.512 3.334 10 0 GGAEHN O=C(NCc1cc(-c2ccccc2)no1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000043239734 1403732462 /nfs/dbraw/zinc/73/24/62/1403732462.db2.gz BKGXUIFQWRALFQ-IBGZPJMESA-N 0 3 376.460 3.415 10 0 GGAEHN COc1ccc(C(=O)NN=C2CCN(CCc3ccccc3)CC2)cc1OC ZINC000043914091 1403844230 /nfs/dbraw/zinc/84/42/30/1403844230.db2.gz ARLKOJJTOCQIKT-UHFFFAOYSA-N 0 3 381.476 3.128 10 0 GGAEHN O=C(CNC(=O)c1ccccc1Cl)NC[C@H](c1ccccc1)N1CCCC1 ZINC000057615856 1407667419 /nfs/dbraw/zinc/66/74/19/1407667419.db2.gz UFHITHXKHJKPOV-LJQANCHMSA-N 0 3 385.895 3.023 10 0 GGAEHN Cc1nn(CCO)c(C)c1CNCc1ccc(-n2cnc3ccccc32)cc1 ZINC000060952790 1408055263 /nfs/dbraw/zinc/05/52/63/1408055263.db2.gz AECPIVRESOWDSW-UHFFFAOYSA-N 0 3 375.476 3.121 10 0 GGAEHN COc1cc(CNCc2ccc(NS(C)(=O)=O)cc2)cc(Cl)c1OC ZINC000061024795 1408067372 /nfs/dbraw/zinc/06/73/72/1408067372.db2.gz DJBJGJMXYZGBEJ-UHFFFAOYSA-N 0 3 384.885 3.019 10 0 GGAEHN CCc1[nH]c(C(=O)N(CCCc2ccccc2)CCN(C)C)c(C)c1C(=O)OC ZINC000063485870 1408362791 /nfs/dbraw/zinc/36/27/91/1408362791.db2.gz IFGDBCWNVMQJEH-UHFFFAOYSA-N 0 3 399.535 3.309 10 0 GGAEHN C[C@H]1CN(Cc2cccc(CNCc3cccc4c3OCCCO4)c2)CCO1 ZINC000063524178 1408366934 /nfs/dbraw/zinc/36/69/34/1408366934.db2.gz FESYGAJLCZKXOY-SFHVURJKSA-N 0 3 382.504 3.358 10 0 GGAEHN COC(=O)c1c(NC(=O)CN(C)C(C2CC2)C2CC2)sc2c1CCCC2 ZINC000065243443 1408656568 /nfs/dbraw/zinc/65/65/68/1408656568.db2.gz IBJCTPHKYSBXLY-UHFFFAOYSA-N 0 3 376.522 3.472 10 0 GGAEHN CCOC(=O)N[C@H](CNC(=O)NC[C@H](c1ccc(C)cc1)N(C)C)CC(C)C ZINC000065468767 1408673520 /nfs/dbraw/zinc/67/35/20/1408673520.db2.gz GPZPEXSXQLDZDV-RBUKOAKNSA-N 0 3 392.544 3.058 10 0 GGAEHN CN1CCN(c2ncccc2CNCc2ccccc2OC(F)(F)F)CC1 ZINC000066876824 1408939931 /nfs/dbraw/zinc/93/99/31/1408939931.db2.gz GTRPLDLCVBXJST-UHFFFAOYSA-N 0 3 380.414 3.022 10 0 GGAEHN CC1CCN(c2ccc(CNCc3cn(C)nc3-c3ccncc3)cn2)CC1 ZINC000067189373 1409036444 /nfs/dbraw/zinc/03/64/44/1409036444.db2.gz HCMZRVHRQHZMDB-UHFFFAOYSA-N 0 3 376.508 3.403 10 0 GGAEHN O[C@H](CNCc1ccccc1OCc1ccccn1)COc1ccc(F)cc1 ZINC000067252326 1409053094 /nfs/dbraw/zinc/05/30/94/1409053094.db2.gz ACZMJCFCIRIGKI-HXUWFJFHSA-N 0 3 382.435 3.329 10 0 GGAEHN CS(=O)(=O)Cc1ccc(CNCc2ccc(OCC(F)(F)F)cc2)cc1 ZINC000067449245 1409121920 /nfs/dbraw/zinc/12/19/20/1409121920.db2.gz CVRZFSVTKWEZCT-UHFFFAOYSA-N 0 3 387.423 3.462 10 0 GGAEHN CCCOc1ccc(CNCc2ccc(C(=O)N3CCN(C)CC3)cc2)cc1 ZINC000067668637 1409203006 /nfs/dbraw/zinc/20/30/06/1409203006.db2.gz FSYNFJVWBTUYBP-UHFFFAOYSA-N 0 3 381.520 3.153 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)N[C@@H](C)COCC(F)(F)F)c1ccsc1 ZINC000067710390 1409212639 /nfs/dbraw/zinc/21/26/39/1409212639.db2.gz FTNBWXGBGAHCFL-JSGCOSHPSA-N 0 3 381.464 3.398 10 0 GGAEHN O=C(NC[C@H]1CCCO1)c1cccc(CNCc2ccc3ncccc3c2)c1 ZINC000067979585 1409268961 /nfs/dbraw/zinc/26/89/61/1409268961.db2.gz COJNFYIKIDCNJY-OAQYLSRUSA-N 0 3 375.472 3.433 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)CCCn1cncn1)c1ccc(C(F)(F)F)cc1 ZINC000068461922 1409410258 /nfs/dbraw/zinc/41/02/58/1409410258.db2.gz HKTISOLIIJJBOT-KRWDZBQOSA-N 0 3 397.445 3.276 10 0 GGAEHN CCN1CCc2c(cccc2-n2nnc(C(=O)NCC3CCCCC3)c2C)C1 ZINC000069564982 1409652966 /nfs/dbraw/zinc/65/29/66/1409652966.db2.gz SXMMQELGEXQTIO-UHFFFAOYSA-N 0 3 381.524 3.264 10 0 GGAEHN Cc1nn(C)c(Cl)c1CNCc1ccc(CN2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000073803789 1409865863 /nfs/dbraw/zinc/86/58/63/1409865863.db2.gz DEUDOVRBMIMFRN-HUUCEWRRSA-N 0 3 376.932 3.281 10 0 GGAEHN C[C@@H](c1ccccc1)N(C)C(=O)NCc1cccc(CN2CCN(C)CC2)c1 ZINC000076425267 1409888485 /nfs/dbraw/zinc/88/84/85/1409888485.db2.gz IABQLTUKXMAKGW-IBGZPJMESA-N 0 3 380.536 3.337 10 0 GGAEHN Cc1nn(C)c(Cl)c1CNCc1ccccc1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000079761702 1409988495 /nfs/dbraw/zinc/98/84/95/1409988495.db2.gz HQQDFLMDTLSJEY-GASCZTMLSA-N 0 3 376.932 3.281 10 0 GGAEHN Cc1nn(C)c(Cl)c1CNCc1ccccc1CN1C[C@H](C)O[C@@H](C)C1 ZINC000079761708 1409988555 /nfs/dbraw/zinc/98/85/55/1409988555.db2.gz HQQDFLMDTLSJEY-GJZGRUSLSA-N 0 3 376.932 3.281 10 0 GGAEHN C[C@H]1CN(c2ccc(CNCc3cn(C)nc3-c3cccs3)cn2)CCO1 ZINC000093947757 1410289529 /nfs/dbraw/zinc/28/95/29/1410289529.db2.gz FRLYTAGQQQBXEO-HNNXBMFYSA-N 0 3 383.521 3.059 10 0 GGAEHN Cn1cc(CNC[C@@H](O)COc2ccc(C(F)(F)F)cc2)c(C(C)(C)C)n1 ZINC000093961398 1410290096 /nfs/dbraw/zinc/29/00/96/1410290096.db2.gz DETLSGSUMDLTRB-OAHLLOKOSA-N 0 3 385.430 3.266 10 0 GGAEHN Cc1cc(CN(C)C)cc(NC(=O)[C@H]2CCn3c(cnc3C(F)(F)F)C2)c1 ZINC000095993274 1410319835 /nfs/dbraw/zinc/31/98/35/1410319835.db2.gz RPDGTDSUOXSRMH-AWEZNQCLSA-N 0 3 380.414 3.473 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1ccc2ncnc(N3CCCCC3)c2c1 ZINC000096399977 1410332194 /nfs/dbraw/zinc/33/21/94/1410332194.db2.gz BIVDRTCFHYFDNJ-QGZVFWFLSA-N 0 3 381.524 3.224 10 0 GGAEHN CC[C@H](NC(=O)NCCCN1CCC[C@@H]1C(=O)N(C)C)c1ccc(Cl)cc1 ZINC000102050450 1410550528 /nfs/dbraw/zinc/55/05/28/1410550528.db2.gz HVJRJYYGLOGCPG-ZWKOTPCHSA-N 0 3 394.947 3.033 10 0 GGAEHN COc1cc(CN[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc(OC)c1 ZINC000105463189 1411068954 /nfs/dbraw/zinc/06/89/54/1411068954.db2.gz CVUHPTHYCCJZGJ-MRXNPFEDSA-N 0 3 387.499 3.446 10 0 GGAEHN COc1ccc(CNC[C@@H](O)COc2ccc(F)c(F)c2)cc1OC(F)F ZINC000105499918 1411072644 /nfs/dbraw/zinc/07/26/44/1411072644.db2.gz ALNOJJHNDQKJGE-GFCCVEGCSA-N 0 3 389.345 3.104 10 0 GGAEHN COc1cc(CNC[C@H](O)COc2ccc(F)c(F)c2)ccc1OC(F)F ZINC000105499993 1411072906 /nfs/dbraw/zinc/07/29/06/1411072906.db2.gz DVVRJUSQFSNHJP-LBPRGKRZSA-N 0 3 389.345 3.104 10 0 GGAEHN O=C(NCCCCN1CCN(c2ccccc2)CC1)[C@H]1Cc2ccccc2S1 ZINC000108473723 1411513005 /nfs/dbraw/zinc/51/30/05/1411513005.db2.gz CZIOHPRDWDMKPT-JOCHJYFZSA-N 0 3 395.572 3.422 10 0 GGAEHN O=C1[C@@H](NCc2ccc(-n3cnc4ccccc43)cc2)CCN1CC(F)(F)F ZINC000112101205 1412076022 /nfs/dbraw/zinc/07/60/22/1412076022.db2.gz AFTNJYOLYGNLNL-KRWDZBQOSA-N 0 3 388.393 3.278 10 0 GGAEHN COc1ccc(OC(F)F)c(CNC[C@H](c2ccccc2)N2CCOCC2)c1 ZINC000112709510 1412200702 /nfs/dbraw/zinc/20/07/02/1412200702.db2.gz AYFNNSVSQJSCGY-LJQANCHMSA-N 0 3 392.446 3.460 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)Nc3cccc(Cn4cccn4)c3)cc2)CC1 ZINC000114168523 1412386226 /nfs/dbraw/zinc/38/62/26/1412386226.db2.gz AMYJXIPQBALGGU-UHFFFAOYSA-N 0 3 389.503 3.326 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)Nc3ccccc3-n3cccn3)cc2)CC1 ZINC000114169445 1412386544 /nfs/dbraw/zinc/38/65/44/1412386544.db2.gz PKQRJHZZQBJNJJ-UHFFFAOYSA-N 0 3 375.476 3.267 10 0 GGAEHN COC(=O)COc1cccc(NC(=O)c2oc3ccccc3c2CN(C)C)c1 ZINC000114235024 1412396133 /nfs/dbraw/zinc/39/61/33/1412396133.db2.gz AYMQPLWQAOKCHS-UHFFFAOYSA-N 0 3 382.416 3.299 10 0 GGAEHN O=C(CCCc1nnc(-c2ccccc2)o1)N1CCN([C@H]2C[C@H]3CC[C@@H]2C3)CC1 ZINC000177324830 1428690536 /nfs/dbraw/zinc/69/05/36/1428690536.db2.gz HYMJIGGMILWMSM-SXLOBPIMSA-N 0 3 394.519 3.392 10 0 GGAEHN C[C@@H]1CN(Cc2ccc(CNCc3ccc4c(c3)OCCO4)cc2)C[C@H](C)O1 ZINC000119682811 1413530397 /nfs/dbraw/zinc/53/03/97/1413530397.db2.gz CJPADUVPXZIXRT-HDICACEKSA-N 0 3 382.504 3.357 10 0 GGAEHN COc1cc(CN2CC[C@H](N3CCOCC3)C2)ccc1OCc1ccccc1 ZINC000121061789 1413992733 /nfs/dbraw/zinc/99/27/33/1413992733.db2.gz RMYJJBNAPWBZJU-NRFANRHFSA-N 0 3 382.504 3.181 10 0 GGAEHN Cc1nccn1-c1ccc(CNCc2ccc(OC[C@H]3CCCO3)cc2)cn1 ZINC000121177545 1414034824 /nfs/dbraw/zinc/03/48/24/1414034824.db2.gz BNONSQWJSXEXCI-OAQYLSRUSA-N 0 3 378.476 3.423 10 0 GGAEHN CC[NH+](CC)CCN(Cc1ccccc1)C(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000122028064 1414343672 /nfs/dbraw/zinc/34/36/72/1414343672.db2.gz DOMVRNHYQSYWBJ-UHFFFAOYSA-N 0 3 383.492 3.335 10 0 GGAEHN CCSc1cc(Cl)ccc1C(=O)NCCCN1CCC[C@@H]1C(=O)N(C)C ZINC000123167044 1414658651 /nfs/dbraw/zinc/65/86/51/1414658651.db2.gz GKPSCIZXRYVUBO-MRXNPFEDSA-N 0 3 397.972 3.125 10 0 GGAEHN Cc1cc(S(=O)(=O)[N-]CC2([NH+](C)C)CCCCC2)sc1Br ZINC000123749302 1414819808 /nfs/dbraw/zinc/81/98/08/1414819808.db2.gz BDUSXMXAXBRWKD-UHFFFAOYSA-N 0 3 395.388 3.362 10 0 GGAEHN CN(C)[C@@H](CNC(=O)NCc1cnn(Cc2ccccc2)c1)c1ccccc1 ZINC000125676717 1415252063 /nfs/dbraw/zinc/25/20/63/1415252063.db2.gz DVIGMRBXDMQELA-NRFANRHFSA-N 0 3 377.492 3.034 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN[C@H](C)CO[C@@H]1CCOC1 ZINC000126515186 1415475744 /nfs/dbraw/zinc/47/57/44/1415475744.db2.gz FSLDJWLRPBPCTG-FZKQIMNGSA-N 0 3 394.313 3.227 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN[C@@H](C)CO[C@@H]1CCOC1 ZINC000126514963 1415475754 /nfs/dbraw/zinc/47/57/54/1415475754.db2.gz FSLDJWLRPBPCTG-SCLBCKFNSA-N 0 3 394.313 3.227 10 0 GGAEHN COc1ccc(Br)c(CNC[C@@H]2CCN(CC(F)(F)F)C2)c1 ZINC000126859199 1415586905 /nfs/dbraw/zinc/58/69/05/1415586905.db2.gz AUEXRIIRUFEEQU-NSHDSACASA-N 0 3 381.236 3.432 10 0 GGAEHN O=S(=O)(C[C@H](O)CNCc1ccc(-c2ccccc2)s1)c1cccs1 ZINC000129491451 1416218168 /nfs/dbraw/zinc/21/81/68/1416218168.db2.gz HPNYUYAILFCUDM-OAHLLOKOSA-N 0 3 393.555 3.401 10 0 GGAEHN CCN(C(C)=O)c1nc(CNC2CCN([C@H](C)c3ccncc3)CC2)cs1 ZINC000131177115 1416519781 /nfs/dbraw/zinc/51/97/81/1416519781.db2.gz CKQWFLHVPVOWLJ-OAHLLOKOSA-N 0 3 387.553 3.226 10 0 GGAEHN C[C@@H](NCc1ccc(N2CCCC2)nc1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000131228644 1416526425 /nfs/dbraw/zinc/52/64/25/1416526425.db2.gz GFUVDFRENIRKPD-QGZVFWFLSA-N 0 3 394.519 3.190 10 0 GGAEHN Cn1cc(CNCc2ccc(NC(=O)c3cccnc3)cc2)c(-c2ccncc2)n1 ZINC000131486142 1416565401 /nfs/dbraw/zinc/56/54/01/1416565401.db2.gz CZPNASLAVYEBSN-UHFFFAOYSA-N 0 3 398.470 3.419 10 0 GGAEHN COc1ncccc1CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 ZINC000131813132 1416626570 /nfs/dbraw/zinc/62/65/70/1416626570.db2.gz APGUCQBQYGJILX-LJQANCHMSA-N 0 3 393.409 3.161 10 0 GGAEHN Cc1ccc(CNCc2cnc(N3CCN(C)CC3)nc2)c(OCCC(C)C)c1 ZINC000134403710 1417065223 /nfs/dbraw/zinc/06/52/23/1417065223.db2.gz HJTUSNWEAIOYMC-UHFFFAOYSA-N 0 3 397.567 3.252 10 0 GGAEHN CN1CCN(c2ncc(CN[C@@H](c3ccccc3F)C3CCCC3)cn2)CC1 ZINC000134405176 1417065401 /nfs/dbraw/zinc/06/54/01/1417065401.db2.gz CCNNMYXGLFWUMK-OAQYLSRUSA-N 0 3 383.515 3.389 10 0 GGAEHN C[C@@H](CNCc1ncccc1C(F)(F)F)N1CCN(c2ccccc2)CC1 ZINC000152143894 1418156939 /nfs/dbraw/zinc/15/69/39/1418156939.db2.gz AIGNPRKUDCVXRJ-INIZCTEOSA-N 0 3 378.442 3.401 10 0 GGAEHN CCc1nn(C)c(Cl)c1CNC[C@H]1CCN(c2cc(OC)cc(OC)c2)C1 ZINC000153862261 1422801120 /nfs/dbraw/zinc/80/11/20/1422801120.db2.gz HZFDYDSJLONEQG-CQSZACIVSA-N 0 3 392.931 3.269 10 0 GGAEHN CN(CC1CCOCC1)[C@@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1 ZINC000155881704 1423575619 /nfs/dbraw/zinc/57/56/19/1423575619.db2.gz CWUQIHBOJXJBMF-JOCHJYFZSA-N 0 3 396.487 3.131 10 0 GGAEHN CC(C)(C)OC(=O)N1CCC[C@@H](N[C@H](CO)c2cccc(Br)c2)C1 ZINC000156741567 1423857680 /nfs/dbraw/zinc/85/76/80/1423857680.db2.gz YQLIGGJUIOOURO-HZPDHXFCSA-N 0 3 399.329 3.472 10 0 GGAEHN Cc1cc(=O)n(C)cc1NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 ZINC000162560851 1424866235 /nfs/dbraw/zinc/86/62/35/1424866235.db2.gz HVYCBZGJZSPZJL-KRWDZBQOSA-N 0 3 388.537 3.350 10 0 GGAEHN O[C@@H](CNCc1ccc(OC(F)F)c(F)c1)COc1ccc(F)c(F)c1 ZINC000168267241 1425236794 /nfs/dbraw/zinc/23/67/94/1425236794.db2.gz HGIRDZPTFNWBCS-NSHDSACASA-N 0 3 377.309 3.235 10 0 GGAEHN O=C(CN1CCCCCC1)N1CC(Oc2ccccc2-c2nc(C3CC3)no2)C1 ZINC000169784614 1425256766 /nfs/dbraw/zinc/25/67/66/1425256766.db2.gz HBWIGGBEDMTIQL-UHFFFAOYSA-N 0 3 396.491 3.080 10 0 GGAEHN CCCN(C(=O)NCc1ccnc(C)n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000171017296 1425438788 /nfs/dbraw/zinc/43/87/88/1425438788.db2.gz AILWCMUIYQLHRT-NRFANRHFSA-N 0 3 381.524 3.371 10 0 GGAEHN Cc1ccc([C@H](CNC(=O)N(C)[C@H](C)CNC(=O)OC(C)(C)C)N(C)C)cc1 ZINC000171904955 1425848258 /nfs/dbraw/zinc/84/82/58/1425848258.db2.gz ALFZZYWAFVJTFJ-AEFFLSMTSA-N 0 3 392.544 3.152 10 0 GGAEHN COc1ccc(OC[C@@H](O)CN2CCC(Oc3ccc(F)cc3)CC2)cc1 ZINC000172308737 1425989910 /nfs/dbraw/zinc/98/99/10/1425989910.db2.gz AASJENDFRDUQCC-KRWDZBQOSA-N 0 3 375.440 3.117 10 0 GGAEHN COc1ccc(OC[C@H](O)CN2CCC(Oc3ccc(F)cc3)CC2)cc1 ZINC000172308736 1425990103 /nfs/dbraw/zinc/99/01/03/1425990103.db2.gz AASJENDFRDUQCC-QGZVFWFLSA-N 0 3 375.440 3.117 10 0 GGAEHN COc1cccc(CNC(=O)[C@@H](C)N[C@H](C)c2ccc(-n3cccn3)cc2)c1 ZINC000174368795 1427123838 /nfs/dbraw/zinc/12/38/38/1427123838.db2.gz GPKLCWUEVNEDFN-IAGOWNOFSA-N 0 3 378.476 3.236 10 0 GGAEHN C[C@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)NC(=O)Nc1ccccc1F ZINC000174375188 1427127085 /nfs/dbraw/zinc/12/70/85/1427127085.db2.gz GFSIBDVFWKMTHP-GJZGRUSLSA-N 0 3 395.438 3.399 10 0 GGAEHN C[C@@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)C(=O)NC(=O)Nc1ccccc1 ZINC000174374972 1427127189 /nfs/dbraw/zinc/12/71/89/1427127189.db2.gz FIFXMTWURYYHPB-JKSUJKDBSA-N 0 3 377.448 3.260 10 0 GGAEHN O=C(Nc1ccc(CN2CCCC2=O)cc1)N1CCN([C@H]2C[C@H]3CC[C@@H]2C3)CC1 ZINC000175213911 1427605168 /nfs/dbraw/zinc/60/51/68/1427605168.db2.gz FCYGBFMOCJSMNR-ZVDOUQERSA-N 0 3 396.535 3.147 10 0 GGAEHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)[C@@H]1COc2ccccc2C1 ZINC000175900740 1427959756 /nfs/dbraw/zinc/95/97/56/1427959756.db2.gz AZGIGHITARESNV-FQEVSTJZSA-N 0 3 380.488 3.081 10 0 GGAEHN COc1ccccc1[C@@H](C)NC(=O)CN[C@H](C)c1ccc(-n2cccn2)cc1 ZINC000180846043 1430067667 /nfs/dbraw/zinc/06/76/67/1430067667.db2.gz GJFPKASTSZIASF-IAGOWNOFSA-N 0 3 378.476 3.409 10 0 GGAEHN COc1ccccc1[C@H](C)NC(=O)CN[C@H](C)c1ccc(-n2cccn2)cc1 ZINC000180846010 1430068045 /nfs/dbraw/zinc/06/80/45/1430068045.db2.gz GJFPKASTSZIASF-SJORKVTESA-N 0 3 378.476 3.409 10 0 GGAEHN C[C@@H](N[C@H](C)c1ccc(-c2ccncc2)cc1)C(=O)NC(=O)NCC(F)(F)F ZINC000180903383 1430099431 /nfs/dbraw/zinc/09/94/31/1430099431.db2.gz HSBDDZAHWLXNKE-CHWSQXEVSA-N 0 3 394.397 3.176 10 0 GGAEHN CCOC(=O)c1cc(CC)sc1NC(=O)[C@@H](C)N(C)CCCn1ccnc1 ZINC000181059984 1430192145 /nfs/dbraw/zinc/19/21/45/1430192145.db2.gz IAEKTSKMYKBKMS-CQSZACIVSA-N 0 3 392.525 3.033 10 0 GGAEHN CCOC(=O)c1cc(CC)sc1NC(=O)[C@H](C)N(C)CCCn1ccnc1 ZINC000181060005 1430192538 /nfs/dbraw/zinc/19/25/38/1430192538.db2.gz IAEKTSKMYKBKMS-AWEZNQCLSA-N 0 3 392.525 3.033 10 0 GGAEHN CN(C)C[C@@H]1CN(C(=O)Nc2ccccc2N2CCc3ccccc32)CCO1 ZINC000181163775 1430233252 /nfs/dbraw/zinc/23/32/52/1430233252.db2.gz DNZHJKPMHPFQQF-GOSISDBHSA-N 0 3 380.492 3.175 10 0 GGAEHN CC(=O)c1oc2ccccc2c1NC(=O)[C@H](C)N[C@H](CC(N)=O)C1CCCCC1 ZINC000182077432 1430407242 /nfs/dbraw/zinc/40/72/42/1430407242.db2.gz ICJQLXRHNDUZOK-SUMWQHHRSA-N 0 3 399.491 3.376 10 0 GGAEHN CCC[C@@H](NCC(=O)Nc1nc(CC(=O)OCC)cs1)c1ccccc1 ZINC000182329898 1430449426 /nfs/dbraw/zinc/44/94/26/1430449426.db2.gz CWVSGWZPAKHPAM-MRXNPFEDSA-N 0 3 375.494 3.318 10 0 GGAEHN CC(C)(C)OC(=O)N1CC[C@@H](N[C@H](CO)c2cccc(Br)c2)C1 ZINC000182619438 1430503732 /nfs/dbraw/zinc/50/37/32/1430503732.db2.gz GDJMHVVSDGQPKJ-HUUCEWRRSA-N 0 3 385.302 3.082 10 0 GGAEHN CCc1cc(N2CCC(N[C@H](COC)c3ccc(F)c(F)c3)CC2)ncn1 ZINC000183071836 1430605711 /nfs/dbraw/zinc/60/57/11/1430605711.db2.gz HOAYEEQOTIRKTR-LJQANCHMSA-N 0 3 376.451 3.263 10 0 GGAEHN CN1CCN(CCC(C)(C)NC(=O)[C@@H]2C[C@@H]2c2ccc3ccccc3c2)CC1 ZINC000184199904 1430855475 /nfs/dbraw/zinc/85/54/75/1430855475.db2.gz HMQBTJZZIJGPIC-FGZHOGPDSA-N 0 3 379.548 3.476 10 0 GGAEHN CC[C@@H](N[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1nc(C)cs1 ZINC000184346744 1430876147 /nfs/dbraw/zinc/87/61/47/1430876147.db2.gz DJUNIBGCGBNIAG-QXAKKESOSA-N 0 3 386.565 3.271 10 0 GGAEHN COc1ccc2c(c1)CCC[C@H]2NCc1cccc(N2CCCS2(=O)=O)c1 ZINC000185288320 1431100763 /nfs/dbraw/zinc/10/07/63/1431100763.db2.gz FVOJVPCIQOFKSJ-OAQYLSRUSA-N 0 3 386.517 3.402 10 0 GGAEHN COc1ccc2c(c1)CCC[C@@H]2NCc1cccc(N2CCCS2(=O)=O)c1 ZINC000185288307 1431100978 /nfs/dbraw/zinc/10/09/78/1431100978.db2.gz FVOJVPCIQOFKSJ-NRFANRHFSA-N 0 3 386.517 3.402 10 0 GGAEHN C[C@@H](NCc1cccc(N2CCCS2(=O)=O)c1)c1ccc(-n2ccnc2)cc1 ZINC000185297885 1431103983 /nfs/dbraw/zinc/10/39/83/1431103983.db2.gz ASPWALZRVIQHOY-QGZVFWFLSA-N 0 3 396.516 3.263 10 0 GGAEHN C[C@H](NCc1cccc(N2CCCS2(=O)=O)c1)c1ccc(-n2ccnc2)cc1 ZINC000185297868 1431104144 /nfs/dbraw/zinc/10/41/44/1431104144.db2.gz ASPWALZRVIQHOY-KRWDZBQOSA-N 0 3 396.516 3.263 10 0 GGAEHN COc1ccccc1[C@@H](CNC(=O)N1CCCN(C2CC2)CC1)OC(C)C ZINC000185769883 1431230247 /nfs/dbraw/zinc/23/02/47/1431230247.db2.gz ZJPCRECTUXKCEO-HXUWFJFHSA-N 0 3 375.513 3.041 10 0 GGAEHN CCOC(=O)c1nn(C)cc1CNc1ccc(CN2CCSCC2)cc1C ZINC000186285611 1431371652 /nfs/dbraw/zinc/37/16/52/1431371652.db2.gz APEUEEPBJSUITB-UHFFFAOYSA-N 0 3 388.537 3.066 10 0 GGAEHN CN(Cc1cccnc1)C[C@H]1CCN(C(=O)C2=Cc3cc(Cl)ccc3OC2)C1 ZINC000190649313 1432430597 /nfs/dbraw/zinc/43/05/97/1432430597.db2.gz FVXOQQOBLKTKQL-QGZVFWFLSA-N 0 3 397.906 3.491 10 0 GGAEHN O[C@@H](COCc1ccccc1)CN1CCC(Oc2ccc(F)cc2F)CC1 ZINC000193671078 1433037755 /nfs/dbraw/zinc/03/77/55/1433037755.db2.gz JDZFIGZBEOPBMO-GOSISDBHSA-N 0 3 377.431 3.386 10 0 GGAEHN CC(C)(C)OC(=O)N1CCC2(CCN2C[C@H](O)COc2ccc(F)cc2)CC1 ZINC000193751805 1433052246 /nfs/dbraw/zinc/05/22/46/1433052246.db2.gz YKZFABLEINQESU-KRWDZBQOSA-N 0 3 394.487 3.041 10 0 GGAEHN Cc1ccccc1OC[C@H](O)CN1CCC12CCN(C(=O)OC(C)(C)C)CC2 ZINC000193752640 1433052503 /nfs/dbraw/zinc/05/25/03/1433052503.db2.gz IBPSBNJMEFMJLV-GOSISDBHSA-N 0 3 390.524 3.210 10 0 GGAEHN COc1cccc2c1CCC[C@@H]2NCc1cccc(N2CCCS2(=O)=O)c1 ZINC000194960325 1433272766 /nfs/dbraw/zinc/27/27/66/1433272766.db2.gz IBSCFGXKTMQEBT-FQEVSTJZSA-N 0 3 386.517 3.402 10 0 GGAEHN CCN(CC)C[C@@H](C)NS(=O)(=O)/C=C\c1ccc(Br)cc1 ZINC000221923619 1433366147 /nfs/dbraw/zinc/36/61/47/1433366147.db2.gz QGNJPNZZHSAPLA-BSYHEUMXSA-N 0 3 375.332 3.070 10 0 GGAEHN CCO[C@H](O)[C@@H]1N[C@H](c2ccc(Cl)cc2)C([N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000230199228 1433372652 /nfs/dbraw/zinc/37/26/52/1433372652.db2.gz RTTHNEXNTOBPTG-NNIGNNQHSA-N 0 3 376.840 3.137 10 0 GGAEHN CCOc1c(Cl)cc(CNC[C@H](O)COc2ccc(F)cc2)cc1OC ZINC000236846932 1433380913 /nfs/dbraw/zinc/38/09/13/1433380913.db2.gz BGFHQKNXKBWMDH-HNNXBMFYSA-N 0 3 383.847 3.416 10 0 GGAEHN Cc1nn(C)c(OCC(F)(F)F)c1CNC[C@H](C)N1CCc2ccccc21 ZINC000237346852 1433398317 /nfs/dbraw/zinc/39/83/17/1433398317.db2.gz FOPLZENAXXWLBN-ZDUSSCGKSA-N 0 3 382.430 3.210 10 0 GGAEHN O[C@@H](CNCc1cccc(OC(F)(F)F)c1)COc1ccc(F)c(F)c1 ZINC000238048796 1433441166 /nfs/dbraw/zinc/44/11/66/1433441166.db2.gz BVXFSOWRIAXXMU-LBPRGKRZSA-N 0 3 377.309 3.393 10 0 GGAEHN COc1ccc(CN(C[C@@H](O)COc2ccccc2C)C[C@H]2CCCO2)cc1 ZINC000245229227 1433455536 /nfs/dbraw/zinc/45/55/36/1433455536.db2.gz RJDQZZHLYOTZFW-IFMALSPDSA-N 0 3 385.504 3.425 10 0 GGAEHN COc1ccc(CN(C[C@@H](O)COCc2ccccc2)C[C@H]2CCCO2)cc1 ZINC000245279126 1433455941 /nfs/dbraw/zinc/45/59/41/1433455941.db2.gz DNBYZIGABNUDHN-FYYLOGMGSA-N 0 3 385.504 3.254 10 0 GGAEHN COCCOC[C@@H]1CCN([C@@H](C)C(=O)N[C@H](C)c2cccc3ccccc32)C1 ZINC000245436050 1433467486 /nfs/dbraw/zinc/46/74/86/1433467486.db2.gz DDMPIJLSUFZACG-CEXWTWQISA-N 0 3 384.520 3.390 10 0 GGAEHN CC(=O)N1CC[C@H](CN(C)[C@H](C)C(=O)N[C@@H](C)c2cccc3ccccc32)C1 ZINC000246036188 1433560138 /nfs/dbraw/zinc/56/01/38/1433560138.db2.gz AEIZZZFQFIYQBX-YQVWRLOYSA-N 0 3 381.520 3.206 10 0 GGAEHN COc1cccc([C@H](O)CN2CCC[C@H](CN(C)C(=O)OC(C)(C)C)C2)c1 ZINC000246704898 1433652795 /nfs/dbraw/zinc/65/27/95/1433652795.db2.gz FAWNOOHQEDSVGP-VQIMIIECSA-N 0 3 378.513 3.308 10 0 GGAEHN COc1cccc(CN2C[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)[C@@H]3C2)c1OC ZINC000248588273 1433810048 /nfs/dbraw/zinc/81/00/48/1433810048.db2.gz GQRIOBMWLZOXPG-USXIJHARSA-N 0 3 376.497 3.439 10 0 GGAEHN CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(C[C@@H](O)c3ccc(F)c(F)c3)C[C@@H]12 ZINC000248593605 1433810220 /nfs/dbraw/zinc/81/02/20/1433810220.db2.gz LSTMNBJZYBNANX-DTTOXWODSA-N 0 3 382.451 3.233 10 0 GGAEHN COc1c(C)cnc(CN2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)[C@H]3C2)c1C ZINC000248598636 1433810423 /nfs/dbraw/zinc/81/04/23/1433810423.db2.gz NENDYIDOMYQCIY-ULQDDVLXSA-N 0 3 375.513 3.442 10 0 GGAEHN COc1ccc(OC)c(CN2C[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)[C@@H]3C2)c1 ZINC000248613074 1433811437 /nfs/dbraw/zinc/81/14/37/1433811437.db2.gz QWRTZHPYSCICAT-BMGDILEWSA-N 0 3 376.497 3.439 10 0 GGAEHN CNC(=O)c1cccc(NC(=O)[C@H](C)N[C@@H](C[C@H]2CCOC2)c2ccccc2)c1 ZINC000248716778 1433817294 /nfs/dbraw/zinc/81/72/94/1433817294.db2.gz FECYZXSBTISHHP-FVJLSDCUSA-N 0 3 395.503 3.131 10 0 GGAEHN CCOc1cc(CN2CC[C@H](O)[C@@H](C)C2)ccc1OCC(=O)Nc1ccccc1 ZINC000249836991 1433853070 /nfs/dbraw/zinc/85/30/70/1433853070.db2.gz FOTVEOLOBUYTTH-PXNSSMCTSA-N 0 3 398.503 3.306 10 0 GGAEHN CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)N[C@H](C)c2ccc(OC(C)C)cc2)C1 ZINC000253556961 1433869358 /nfs/dbraw/zinc/86/93/58/1433869358.db2.gz ANYWBGZEAOVDLW-ZIFCJYIRSA-N 0 3 390.524 3.315 10 0 GGAEHN CN(C)CCN(Cc1ccco1)C(=O)Nc1nnc(/C=C\c2ccco2)s1 ZINC000255318704 1433880179 /nfs/dbraw/zinc/88/01/79/1433880179.db2.gz HSYDCBWVOQPOPD-FPLPWBNLSA-N 0 3 387.465 3.490 10 0 GGAEHN Cc1ccc(CN2CCC[C@H](C(=O)NCc3ccccc3)CCNC(=O)CC2)o1 ZINC000257184871 1433894106 /nfs/dbraw/zinc/89/41/06/1433894106.db2.gz VMSZNKBOXSHUMB-FQEVSTJZSA-N 0 3 397.519 3.013 10 0 GGAEHN COC(=O)C1CCN(CCCNC(=O)[C@H]2C[C@H]2c2cccc3ccccc32)CC1 ZINC000264407004 1434108455 /nfs/dbraw/zinc/10/84/55/1434108455.db2.gz DMHRVEGAMRZDEF-VXKWHMMOSA-N 0 3 394.515 3.335 10 0 GGAEHN O=C(NCc1ccccc1CN1CCC(O)CC1)NC1CC(c2ccccc2)C1 ZINC000267297180 1434420314 /nfs/dbraw/zinc/42/03/14/1434420314.db2.gz DXJTZLOHZGENQC-UHFFFAOYSA-N 0 3 393.531 3.389 10 0 GGAEHN Cc1nc(Cc2ccccc2)sc1C(=O)Nc1ccc(=O)n(CCN(C)C)c1 ZINC000270046578 1434696446 /nfs/dbraw/zinc/69/64/46/1434696446.db2.gz BMZANDKOEIPIHX-UHFFFAOYSA-N 0 3 396.516 3.018 10 0 GGAEHN CN(C)CCn1cc(NC(=O)C[C@@H](c2ccccc2)C(F)(F)F)ccc1=O ZINC000270057793 1434697874 /nfs/dbraw/zinc/69/78/74/1434697874.db2.gz DQQMPZCKYSAPIW-INIZCTEOSA-N 0 3 381.398 3.085 10 0 GGAEHN Cc1ccccc1-c1nc(C(=O)Nc2ccc(=O)n(CCN(C)C)c2)cs1 ZINC000270079106 1434700270 /nfs/dbraw/zinc/70/02/70/1434700270.db2.gz IFYXEWGDGRKBIB-UHFFFAOYSA-N 0 3 382.489 3.094 10 0 GGAEHN COC(=O)COc1c(C)cc(CNCc2ccc(N3CCOC3=O)cc2)cc1C ZINC000272809735 1434932577 /nfs/dbraw/zinc/93/25/77/1434932577.db2.gz GQRKDRIAMCCYKL-UHFFFAOYSA-N 0 3 398.459 3.102 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cnc3c(C)cc(F)cc3c2O)C[C@H]1N1CCCC1 ZINC000275080128 1435114952 /nfs/dbraw/zinc/11/49/52/1435114952.db2.gz DYXXGDWXAGGITF-SJORKVTESA-N 0 3 389.496 3.040 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cnc3c(C)cc(F)cc3c2O)C[C@H]1N1CCCC1 ZINC000275080119 1435115006 /nfs/dbraw/zinc/11/50/06/1435115006.db2.gz DYXXGDWXAGGITF-IAGOWNOFSA-N 0 3 389.496 3.040 10 0 GGAEHN COc1ccc(OCc2ccccn2)c(CN[C@@H]2Cc3ccccc3[C@@H]2O)c1 ZINC000172068411 1126076782 /nfs/dbraw/zinc/07/67/82/1126076782.db2.gz PKBSQDQAXOMQJX-GGAORHGYSA-N 0 3 376.456 3.417 10 0 GGAEHN COc1ccc(OCc2ccccn2)c(CN[C@H]2Cc3ccccc3[C@H]2O)c1 ZINC000172068422 1126076792 /nfs/dbraw/zinc/07/67/92/1126076792.db2.gz PKBSQDQAXOMQJX-JTHBVZDNSA-N 0 3 376.456 3.417 10 0 GGAEHN COc1ccccc1-c1ncc(CN[C@H](CO)Cc2ccc(C)c(C)c2)cn1 ZINC000453620739 1126093398 /nfs/dbraw/zinc/09/33/98/1126093398.db2.gz IKYNWGZCSUEAHM-FQEVSTJZSA-N 0 3 377.488 3.462 10 0 GGAEHN OC[C@@]1(NCc2cnc(-c3ccncc3)s2)CCCN(Cc2ccccc2)C1 ZINC000674675751 1126105161 /nfs/dbraw/zinc/10/51/61/1126105161.db2.gz JUMDNJFTJSMFGX-JOCHJYFZSA-N 0 3 394.544 3.322 10 0 GGAEHN Cc1nn(-c2ccncc2)cc1CN[C@H](Cc1ccccc1)[C@@H](O)C(F)(F)F ZINC000680121102 1126105558 /nfs/dbraw/zinc/10/55/58/1126105558.db2.gz QYMJUBHYXDSRSS-RTBURBONSA-N 0 3 390.409 3.200 10 0 GGAEHN Cc1nn(C)c2nc(Cl)c(CN[C@@](C)(CO)Cc3ccc(F)cc3)cc12 ZINC000865715183 1126114798 /nfs/dbraw/zinc/11/47/98/1126114798.db2.gz LAZNOOZHRLQNMN-LJQANCHMSA-N 0 3 376.863 3.153 10 0 GGAEHN CCc1onc(C)c1CN[C@@]1(CO)CCc2cc(Br)ccc2C1 ZINC001171949482 1126148668 /nfs/dbraw/zinc/14/86/68/1126148668.db2.gz SNKXOOADPUPXDK-SFHVURJKSA-N 0 3 379.298 3.318 10 0 GGAEHN C[C@](CO)(Cc1ccc(Br)cc1)NCc1cc(CO)ccc1F ZINC001473840360 1126200817 /nfs/dbraw/zinc/20/08/17/1126200817.db2.gz WFHIRRLVVXGMEY-GOSISDBHSA-N 0 3 382.273 3.164 10 0 GGAEHN COc1ncc(Br)cc1CN[C@](C)(CO)Cc1ccc(F)cc1 ZINC001620624656 1126241744 /nfs/dbraw/zinc/24/17/44/1126241744.db2.gz BOEKZADEBODRKG-KRWDZBQOSA-N 0 3 383.261 3.075 10 0 GGAEHN COc1cc(C)nc(CN[C@](C)(CO)Cc2ccc(Br)cc2)c1 ZINC001655736802 1126256077 /nfs/dbraw/zinc/25/60/77/1126256077.db2.gz UGUGTBMMKXXIQU-SFHVURJKSA-N 0 3 379.298 3.244 10 0 GGAEHN C[C@](CO)(Cc1ccc(F)cc1)[NH2+]Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC001656293392 1126257368 /nfs/dbraw/zinc/25/73/68/1126257368.db2.gz LPBBFHUVLVVWMT-OAQYLSRUSA-N 0 3 381.407 3.304 10 0 GGAEHN C[C@@](CO)(Cc1ccc(F)cc1)[NH2+]Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC001656293391 1126257379 /nfs/dbraw/zinc/25/73/79/1126257379.db2.gz LPBBFHUVLVVWMT-NRFANRHFSA-N 0 3 381.407 3.304 10 0 GGAEHN Cn1c2ccccc2nc1CN[C@@](C)(CO)Cc1ccc(Br)cc1 ZINC001660388551 1126264237 /nfs/dbraw/zinc/26/42/37/1126264237.db2.gz JJIMVLDLZCZPON-LJQANCHMSA-N 0 3 388.309 3.419 10 0 GGAEHN N[C@@H](CNC(=O)c1ccc(Cl)cc1)c1ccc(C(=O)Nc2ccncc2)cc1 ZINC000090486490 212152021 /nfs/dbraw/zinc/15/20/21/212152021.db2.gz WDKDDNLSJBOHAE-IBGZPJMESA-N 0 3 394.862 3.417 10 0 GGAEHN COc1cccc(N2CCN([C@@H]3CCC[C@H](Oc4ccccc4)[C@H]3O)CC2)c1 ZINC000255977059 212138582 /nfs/dbraw/zinc/13/85/82/212138582.db2.gz HPEPZLBLXSPXLO-VJBWXMMDSA-N 0 3 382.504 3.178 10 0 GGAEHN COc1cccc(N2C(=O)C3ON(c4ccccc4)[C@H](c4ccco4)[C@H]3C2=O)c1 ZINC000245296153 212134592 /nfs/dbraw/zinc/13/45/92/212134592.db2.gz KYNAPNJVTRUHCO-VAMGGRTRSA-N 0 3 390.395 3.339 10 0 GGAEHN CCOC(=O)C1=C(CN2C[C@H](C)C[C@@H](C)C2)NC(=O)N[C@H]1c1ccc(C)cc1 ZINC000245258106 212134066 /nfs/dbraw/zinc/13/40/66/212134066.db2.gz JOAZBEZPXLZMIT-QINHECLXSA-N 0 3 385.508 3.144 10 0 GGAEHN CC(=O)N[C@@H](CC(=O)NC[C@H]1CCCN(Cc2cccs2)C1)c1ccccc1 ZINC000359996520 212130495 /nfs/dbraw/zinc/13/04/95/212130495.db2.gz RISQIIQEGABPIX-NQIIRXRSSA-N 0 3 399.560 3.344 10 0 GGAEHN CN1CCN(CC2(C)CCN(C(=O)/C=C/c3ccnc4ccccc34)CC2)CC1 ZINC000359962614 212127559 /nfs/dbraw/zinc/12/75/59/212127559.db2.gz WFNUUWKVVZSCOF-BQYQJAHWSA-N 0 3 392.547 3.124 10 0 GGAEHN CC[C@H](C(=O)NCc1ccccc1)N1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000024835890 212112683 /nfs/dbraw/zinc/11/26/83/212112683.db2.gz ILSLJICGBDOEPC-TZIWHRDSSA-N 0 3 379.504 3.432 10 0 GGAEHN CCn1cc([C@H]2OCCC[C@@H]2NCc2ccc(Oc3cnccn3)cc2)cn1 ZINC000328623273 212085258 /nfs/dbraw/zinc/08/52/58/212085258.db2.gz BVKDXAMSPPCFFP-PZJWPPBQSA-N 0 3 379.464 3.495 10 0 GGAEHN CCCN1CCN(c2nnc(-n3cccc3CNCc3ccccc3)s2)CC1 ZINC000007002136 220982838 /nfs/dbraw/zinc/98/28/38/220982838.db2.gz URNOLOSCOIPYAA-UHFFFAOYSA-N 0 3 396.564 3.151 10 0 GGAEHN Cc1ccc(N2C[C@@H](C(=O)NC3CCN(Cc4ccccc4)CC3)CC2=O)cc1 ZINC000008392026 221039903 /nfs/dbraw/zinc/03/99/03/221039903.db2.gz OQOUYPWMZBQJRA-FQEVSTJZSA-N 0 3 391.515 3.129 10 0 GGAEHN CCN1CCN(c2ccc(NC(=O)c3ccc(OC)c(OC)c3)cc2C)CC1 ZINC000007987792 221020465 /nfs/dbraw/zinc/02/04/65/221020465.db2.gz DCKNZYFBHOWNPU-UHFFFAOYSA-N 0 3 383.492 3.406 10 0 GGAEHN COc1ccc([C@H](CNC(=O)c2cc3c(c(Cl)c2)OCO3)N(C)C)cc1 ZINC000008772516 221058299 /nfs/dbraw/zinc/05/82/99/221058299.db2.gz QFQMVEQXZNRKRQ-INIZCTEOSA-N 0 3 376.840 3.110 10 0 GGAEHN CC[C@]1(c2ccc(OC)cc2)NC(=O)N(CN(CC(C)C)CC(C)C)C1=O ZINC000008937144 221064206 /nfs/dbraw/zinc/06/42/06/221064206.db2.gz RIIPYNFZEYEWIZ-OAQYLSRUSA-N 0 3 375.513 3.424 10 0 GGAEHN COc1cc(CNCCOCCO)ccc1OCc1c(F)cccc1Cl ZINC000010436169 221102561 /nfs/dbraw/zinc/10/25/61/221102561.db2.gz QYLMXHRYJBJEGX-UHFFFAOYSA-N 0 3 383.847 3.165 10 0 GGAEHN Cc1ccc(COc2ccc(Br)cc2CNCCOCCO)cc1 ZINC000010436350 221102923 /nfs/dbraw/zinc/10/29/23/221102923.db2.gz OYHRLNIFWWLJML-UHFFFAOYSA-N 0 3 394.309 3.435 10 0 GGAEHN Cc1nn2cnnc2c(C)c1CCC(=O)Nc1ccc(CN2CCCCC2)cc1 ZINC000009689473 221090201 /nfs/dbraw/zinc/09/02/01/221090201.db2.gz NCPJVFJPKFLFTP-UHFFFAOYSA-N 0 3 392.507 3.298 10 0 GGAEHN O=C(c1cn(C/C=C/c2ccccc2)nn1)N1CCCN(C2CCCC2)CC1 ZINC000011766791 221124297 /nfs/dbraw/zinc/12/42/97/221124297.db2.gz DNFKNUDCNOLMMZ-UXBLZVDNSA-N 0 3 379.508 3.082 10 0 GGAEHN O=C(NC[C@@H]1CCCN(Cc2ccccc2)C1)c1cn(C2CCCCC2)nn1 ZINC000011839495 221130547 /nfs/dbraw/zinc/13/05/47/221130547.db2.gz QHWZPFPPDYGPMP-IBGZPJMESA-N 0 3 381.524 3.425 10 0 GGAEHN COc1ccc(F)c(CN2CCC[C@@]3(CCN(Cc4cccnc4)C3)C2=O)c1 ZINC000011937370 221138538 /nfs/dbraw/zinc/13/85/38/221138538.db2.gz LEDJJNXXFIOLQB-QFIPXVFZSA-N 0 3 383.467 3.244 10 0 GGAEHN COc1ccc(CCN(C)[C@@H]2CCCN(C(=O)NC(C)(C)C)C2)cc1OC ZINC000012050815 221144956 /nfs/dbraw/zinc/14/49/56/221144956.db2.gz RGLZNFGEIDPESY-QGZVFWFLSA-N 0 3 377.529 3.151 10 0 GGAEHN O=C1NC(=O)[C@@](CCCc2ccccc2)(C2CCN(Cc3ccccc3)CC2)N1 ZINC000012053163 221145773 /nfs/dbraw/zinc/14/57/73/221145773.db2.gz GSOXWAZIEKIAQY-XMMPIXPASA-N 0 3 391.515 3.500 10 0 GGAEHN COc1ccc(F)c(CN2CCC[C@]3(CCN(Cc4ccccn4)C3)C2=O)c1 ZINC000012441068 221195154 /nfs/dbraw/zinc/19/51/54/221195154.db2.gz UJFWSCYMBVRWQA-JOCHJYFZSA-N 0 3 383.467 3.244 10 0 GGAEHN COc1ccc(F)c(CN2CCC[C@@]3(CCN(Cc4ccccn4)C3)C2=O)c1 ZINC000012441066 221195607 /nfs/dbraw/zinc/19/56/07/221195607.db2.gz UJFWSCYMBVRWQA-QFIPXVFZSA-N 0 3 383.467 3.244 10 0 GGAEHN CCN1CCN(c2ccc(NC(=O)Cc3ccc(OC)c(OC)c3)cc2C)CC1 ZINC000012554313 221205854 /nfs/dbraw/zinc/20/58/54/221205854.db2.gz BHEXSXAFMXNAOW-UHFFFAOYSA-N 0 3 397.519 3.335 10 0 GGAEHN CCOC(=O)c1sc(NC(=O)CNC(C)(C)CC)c(C(=O)OCC)c1C ZINC000012794503 221232527 /nfs/dbraw/zinc/23/25/27/221232527.db2.gz SWWFLUGZLJBDBR-UHFFFAOYSA-N 0 3 384.498 3.127 10 0 GGAEHN CC(C)[C@H](NCC(=O)N1CCN(c2ccccn2)CC1)c1ccc(Cl)cc1 ZINC000012919201 221246138 /nfs/dbraw/zinc/24/61/38/221246138.db2.gz LVHMNEXNUQACNG-NRFANRHFSA-N 0 3 386.927 3.371 10 0 GGAEHN Cc1ccc(C)n1CCN1CCN(C(=O)c2cc(-c3ccc(C)cc3)[nH]n2)CC1 ZINC000013366592 221267055 /nfs/dbraw/zinc/26/70/55/221267055.db2.gz NDHGQYSVVHYLOR-UHFFFAOYSA-N 0 3 391.519 3.261 10 0 GGAEHN COc1ccc(-c2n[nH]cc2CN2CCC(N3CCSCC3)CC2)cc1F ZINC000013637132 221278361 /nfs/dbraw/zinc/27/83/61/221278361.db2.gz UOSSEEGPSVEUCA-UHFFFAOYSA-N 0 3 390.528 3.238 10 0 GGAEHN CCOc1cccc(CNCCOCCO)c1OCc1ccc(Cl)cc1 ZINC000013717469 221284532 /nfs/dbraw/zinc/28/45/32/221284532.db2.gz SKYYZQCCOXIEML-UHFFFAOYSA-N 0 3 379.884 3.416 10 0 GGAEHN CCOC(=O)C1=C(CN[C@@H]2CCCC[C@H]2C)NC(=O)N[C@@H]1c1cccs1 ZINC000014122664 221300357 /nfs/dbraw/zinc/30/03/57/221300357.db2.gz OIPNTTZDLKGVMK-PBFPGSCMSA-N 0 3 377.510 3.088 10 0 GGAEHN O[C@@H](COCCOc1ccc(Cl)cc1)CN1CCC[C@@H](C(F)(F)F)C1 ZINC000014200852 221303297 /nfs/dbraw/zinc/30/32/97/221303297.db2.gz UEVFWOBSABNDMR-UKRRQHHQSA-N 0 3 381.822 3.371 10 0 GGAEHN CCOC(=O)c1ccc(OC[C@H](O)CN(C)[C@@H](C)c2ccc(F)cc2)cc1 ZINC000014242194 221307457 /nfs/dbraw/zinc/30/74/57/221307457.db2.gz TUVLYSBOWWNEJR-HNAYVOBHSA-N 0 3 375.440 3.435 10 0 GGAEHN Cc1c2cc(C)cc(C)c2[nH]c1C(=O)N1CCC[C@H](N2CCC(CO)CC2)C1 ZINC000014976470 221323406 /nfs/dbraw/zinc/32/34/06/221323406.db2.gz YJEWAKVKAWLBEQ-IBGZPJMESA-N 0 3 383.536 3.402 10 0 GGAEHN COc1ccc([C@@H](CNC(=O)c2ccc3c(c2)NC(=O)[C@H](C)S3)N(C)C)cc1 ZINC000015387850 221335425 /nfs/dbraw/zinc/33/54/25/221335425.db2.gz CCKDCWXGOYKCJJ-SCLBCKFNSA-N 0 3 399.516 3.161 10 0 GGAEHN C[C@]1(C2CCN(Cc3cccc(Oc4ccccc4)c3)CC2)NC(=O)NC1=O ZINC000014994385 221324550 /nfs/dbraw/zinc/32/45/50/221324550.db2.gz HWKJLZXWGOEZKR-JOCHJYFZSA-N 0 3 379.460 3.289 10 0 GGAEHN CC(C)CN1CCN(c2cccc3c2C(=O)N(Cc2cccc(F)c2)C3=O)CC1 ZINC000014992388 221325570 /nfs/dbraw/zinc/32/55/70/221325570.db2.gz PVTQUWPRWCBUAM-UHFFFAOYSA-N 0 3 395.478 3.400 10 0 GGAEHN COCCc1ncc(CN2CC[C@@]3(C2)CCCN(Cc2ccccc2F)C3)cn1 ZINC000015069889 221329473 /nfs/dbraw/zinc/32/94/73/221329473.db2.gz ABZOKCJQCQKUQF-QHCPKHFHSA-N 0 3 398.526 3.293 10 0 GGAEHN Cn1cc(NC(=O)NCCCN2CCc3ccccc3C2)c2ccccc2c1=O ZINC000015680509 221340226 /nfs/dbraw/zinc/34/02/26/221340226.db2.gz HNVBCISPNCDXAG-UHFFFAOYSA-N 0 3 390.487 3.108 10 0 GGAEHN Cc1oc2ncnc(N3CCCCC3)c2c1C(=O)NCCN1C[C@@H](C)C[C@H](C)C1 ZINC000015727613 221340964 /nfs/dbraw/zinc/34/09/64/221340964.db2.gz BOFVIDYWLXDPJP-HOTGVXAUSA-N 0 3 399.539 3.229 10 0 GGAEHN c1ccc(CCN2CCc3nc(N4CCN(c5ccccc5)CC4)ncc3C2)cc1 ZINC000015779501 221344986 /nfs/dbraw/zinc/34/49/86/221344986.db2.gz HJJPPJAEZVHBHI-UHFFFAOYSA-N 0 3 399.542 3.404 10 0 GGAEHN CCN1CCN(c2ccc(NC(=O)COc3ccccc3OC)cc2C)CC1 ZINC000016725277 221369435 /nfs/dbraw/zinc/36/94/35/221369435.db2.gz PRNKDCDRZLPHIK-UHFFFAOYSA-N 0 3 383.492 3.163 10 0 GGAEHN c1[nH]nc(-c2ccc3c(c2)OCO3)c1CNCc1ccnc(N2CCCCC2)c1 ZINC000058157502 136154480 /nfs/dbraw/zinc/15/44/80/136154480.db2.gz JTQRHBLSMHGLGL-UHFFFAOYSA-N 0 3 391.475 3.481 10 0 GGAEHN COc1ccccc1NC(=O)c1ccc(N2CCN[C@@H](c3ccccc3)C2)nc1 ZINC000065256075 136161916 /nfs/dbraw/zinc/16/19/16/136161916.db2.gz NLOFLVMUWHNJSK-HXUWFJFHSA-N 0 3 388.471 3.493 10 0 GGAEHN COc1cc2c(cc1OC)CN([C@H]1CCCN(c3ncnc4[nH]ccc43)C1)CC2 ZINC000072149038 136167154 /nfs/dbraw/zinc/16/71/54/136167154.db2.gz VIPJENVMOJBLCL-KRWDZBQOSA-N 0 3 393.491 3.002 10 0 GGAEHN COc1cccc(N2C[C@@H](C(=O)Nc3cnccc3N3CCCCC3)CC2=O)c1 ZINC000095958978 136182808 /nfs/dbraw/zinc/18/28/08/136182808.db2.gz DAJFEMWBQPIAGY-INIZCTEOSA-N 0 3 394.475 3.072 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1ccc2ncnc(N3CCCCC3)c2c1 ZINC000096399978 136187062 /nfs/dbraw/zinc/18/70/62/136187062.db2.gz BIVDRTCFHYFDNJ-KRWDZBQOSA-N 0 3 381.524 3.224 10 0 GGAEHN O[C@@H](CNC[C@@H](c1ccco1)N1CCCC1)COCc1ccccc1Cl ZINC000022038991 221551105 /nfs/dbraw/zinc/55/11/05/221551105.db2.gz BNABYTVVRHRFLS-HKUYNNGSSA-N 0 3 378.900 3.237 10 0 GGAEHN Cn1nc2nc(NCCN3CCCCC3)nc(-c3ccccc3Cl)c2c1N ZINC000035929776 221835432 /nfs/dbraw/zinc/83/54/32/221835432.db2.gz HTQHFVXEWDEFHG-UHFFFAOYSA-N 0 3 385.903 3.164 10 0 GGAEHN Cc1nc2ccccc2n1CCCNC(=O)N[C@@H](Cc1ccccc1)CN(C)C ZINC000057205218 222029555 /nfs/dbraw/zinc/02/95/55/222029555.db2.gz AVIZDJPHEASQCB-FQEVSTJZSA-N 0 3 393.535 3.207 10 0 GGAEHN Cc1nc2ccccc2n1CCCNC(=O)N[C@H](Cc1ccccc1)CN(C)C ZINC000057205221 222029906 /nfs/dbraw/zinc/02/99/06/222029906.db2.gz AVIZDJPHEASQCB-HXUWFJFHSA-N 0 3 393.535 3.207 10 0 GGAEHN O=C(NC1CCN(C2CC2)CC1)C1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000053213513 222007637 /nfs/dbraw/zinc/00/76/37/222007637.db2.gz SYDCSLNNLCEMTA-UHFFFAOYSA-N 0 3 396.453 3.497 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000054817062 222014227 /nfs/dbraw/zinc/01/42/27/222014227.db2.gz IATCLQRMOITSCY-CZUORRHYSA-N 0 3 396.329 3.446 10 0 GGAEHN Cc1ccc(CN(CCN(C)C)C(=O)c2cc(=O)[nH]c3ccc(C)cc32)s1 ZINC000055195484 222019043 /nfs/dbraw/zinc/01/90/43/222019043.db2.gz OZBOBXUNOLGYLC-UHFFFAOYSA-N 0 3 383.517 3.410 10 0 GGAEHN Cc1ccc(NC(=O)N2CCC[C@H](CCC(=O)NCCN3CCCC3)C2)cc1 ZINC000065136302 222104045 /nfs/dbraw/zinc/10/40/45/222104045.db2.gz GXWSDFAWGUBVCU-LJQANCHMSA-N 0 3 386.540 3.231 10 0 GGAEHN O=C(NCCN1CCCC1)c1ccc(NC(=O)C2CC2)cc1N1CCCCCC1 ZINC000065166046 222104564 /nfs/dbraw/zinc/10/45/64/222104564.db2.gz ZDVBQJFTEKXYIQ-UHFFFAOYSA-N 0 3 398.551 3.241 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1csc(-c2ccc(N3CCCC3)nc2)n1 ZINC000065165324 222105116 /nfs/dbraw/zinc/10/51/16/222105116.db2.gz GZMJOUKDHWIJQK-INIZCTEOSA-N 0 3 399.564 3.410 10 0 GGAEHN CCOC(=O)COc1cccc(C(=O)NC[C@@H](c2ccc(CC)cc2)N(C)C)c1 ZINC000058028914 222037426 /nfs/dbraw/zinc/03/74/26/222037426.db2.gz XDPGEUODKREWND-NRFANRHFSA-N 0 3 398.503 3.224 10 0 GGAEHN CC(C)S(=O)(=O)C(C)C(=O)NCc1ccccc1COc1ccccc1 ZINC000058060589 222040028 /nfs/dbraw/zinc/04/00/28/222040028.db2.gz OSHRHKYDFTWQED-INIZCTEOSA-N 0 3 375.490 3.094 10 0 GGAEHN CN(C)CCN(Cc1cccnc1)C(=O)Nc1cc2c(cc1Cl)OCCO2 ZINC000058147421 222041190 /nfs/dbraw/zinc/04/11/90/222041190.db2.gz IRXGCJJOMAIPAF-UHFFFAOYSA-N 0 3 390.871 3.102 10 0 GGAEHN Cc1cc(NC(=O)[C@@H](C)NCC2(c3ccc(Cl)cc3)CCOCC2)no1 ZINC000058191304 222044537 /nfs/dbraw/zinc/04/45/37/222044537.db2.gz WAVOWIRLBPWLBL-CQSZACIVSA-N 0 3 377.872 3.301 10 0 GGAEHN O=C(Nc1ccn(Cc2cccnc2)n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000058246858 222046988 /nfs/dbraw/zinc/04/69/88/222046988.db2.gz BFANZUBTSPJXBF-FQEVSTJZSA-N 0 3 375.476 3.177 10 0 GGAEHN COc1ccc([C@H](CNC(=O)N[C@H](C)c2c(C)nn(C)c2C)N2CCCC2)cc1 ZINC000063069348 222065085 /nfs/dbraw/zinc/06/50/85/222065085.db2.gz LDDXLUZZZSDHDF-QRWLVFNGSA-N 0 3 399.539 3.243 10 0 GGAEHN COc1ccc2[nH]cc(C3=CCN(Cc4cccc(OCC(N)=O)c4)CC3)c2c1 ZINC000063994649 222069471 /nfs/dbraw/zinc/06/94/71/222069471.db2.gz MQVPGXKYKIVYFX-UHFFFAOYSA-N 0 3 391.471 3.330 10 0 GGAEHN CCN1CCN(CCNC(=O)Cn2c(-c3cccs3)cc3ccccc32)CC1 ZINC000064816489 222083063 /nfs/dbraw/zinc/08/30/63/222083063.db2.gz WQMHJCUHZLRLCC-UHFFFAOYSA-N 0 3 396.560 3.124 10 0 GGAEHN CN(CCNC(=O)c1cc2c(c3ccccc3oc2=O)n1C)Cc1ccccc1 ZINC000064838958 222083358 /nfs/dbraw/zinc/08/33/58/222083358.db2.gz ANHFGEIQBNVQSY-UHFFFAOYSA-N 0 3 389.455 3.147 10 0 GGAEHN COc1cccc(CNC(=O)C2=CCN(Cc3ccc(C)cc3)CC2)c1OC ZINC000064817972 222083590 /nfs/dbraw/zinc/08/35/90/222083590.db2.gz XTNHFDZCWMCVML-UHFFFAOYSA-N 0 3 380.488 3.461 10 0 GGAEHN CCOc1ccccc1CN1CC[C@@H](c2nc3cccnc3n2CCOC)C1 ZINC000065285381 222120929 /nfs/dbraw/zinc/12/09/29/222120929.db2.gz YZYREXNIORKJGM-GOSISDBHSA-N 0 3 380.492 3.466 10 0 GGAEHN CN(Cc1ccc(C(=O)Nc2ccc3c(c2)CC(=O)N3)cc1)C[C@H]1CCCO1 ZINC000065376523 222126958 /nfs/dbraw/zinc/12/69/58/222126958.db2.gz JMOSEVRZKVZPTN-LJQANCHMSA-N 0 3 379.460 3.044 10 0 GGAEHN COc1ncc(CN2CC[C@@H](c3ccnc(-c4ccc(CO)cc4)c3)C2)cn1 ZINC000065426665 222129602 /nfs/dbraw/zinc/12/96/02/222129602.db2.gz DNAXJXKXSQXTHP-HXUWFJFHSA-N 0 3 376.460 3.029 10 0 GGAEHN CCN1CCc2c(cccc2-n2nnc(C(=O)NC3CCC(C)CC3)c2C)C1 ZINC000069582439 222174062 /nfs/dbraw/zinc/17/40/62/222174062.db2.gz HXCCNNVZIIFXEV-UHFFFAOYSA-N 0 3 381.524 3.262 10 0 GGAEHN COc1cccc(NC(=O)CN(C)C(=O)CN2CCC[C@H]2C2CCCCC2)c1 ZINC000070004442 222175729 /nfs/dbraw/zinc/17/57/29/222175729.db2.gz DRTKLJBHQHBQBS-FQEVSTJZSA-N 0 3 387.524 3.137 10 0 GGAEHN CCN1CCc2c(cccc2-n2nnc(C(=O)Nc3ccccc3F)c2C)C1 ZINC000071889513 222199438 /nfs/dbraw/zinc/19/94/38/222199438.db2.gz VQZBDJCPDLHPFT-UHFFFAOYSA-N 0 3 379.439 3.345 10 0 GGAEHN Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)N[C@H](CC(C)C)CN(C)C)C2)c1 ZINC000072012954 222204433 /nfs/dbraw/zinc/20/44/33/222204433.db2.gz KNQLECWJJCTWGT-PZJWPPBQSA-N 0 3 387.568 3.248 10 0 GGAEHN Cn1ncc2c1nc(-c1cccnc1)nc2N[C@H]1CCN(Cc2ccccc2)C1 ZINC000072165882 222214226 /nfs/dbraw/zinc/21/42/26/222214226.db2.gz JFIZUHDLGUQWJX-SFHVURJKSA-N 0 3 385.475 3.112 10 0 GGAEHN COc1cc(C(=O)N[C@@H]2COc3ccccc32)ccc1OC1CCN(C)CC1 ZINC000095496856 222331824 /nfs/dbraw/zinc/33/18/24/222331824.db2.gz OEGDPPCDITUYOY-GOSISDBHSA-N 0 3 382.460 3.032 10 0 GGAEHN CC(C)NC(=O)O[C@@H]1CCCN(CC2CCN(C(=O)OC(C)(C)C)CC2)C1 ZINC000095929884 222361391 /nfs/dbraw/zinc/36/13/91/222361391.db2.gz FLBIJCZXYAFYKW-QGZVFWFLSA-N 0 3 383.533 3.233 10 0 GGAEHN CCOC(=O)C1=C(CN(C)C2CCCCCC2)NC(=O)N[C@H]1c1ccc(C)o1 ZINC000095948205 222362781 /nfs/dbraw/zinc/36/27/81/222362781.db2.gz UWJGYRWRHQHFRQ-IBGZPJMESA-N 0 3 389.496 3.414 10 0 GGAEHN COC(=O)[C@H]1CCCCC[C@@H]1NCC(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000095941460 222362993 /nfs/dbraw/zinc/36/29/93/222362993.db2.gz LZGDYCAXOSWHCU-GJZGRUSLSA-N 0 3 388.386 3.235 10 0 GGAEHN CN1CC[C@H]2CCN(Cc3nc(=O)c4cc(-c5ccccc5)sc4[nH]3)[C@@H]2C1 ZINC000095996039 222369808 /nfs/dbraw/zinc/36/98/08/222369808.db2.gz HWCUUHJCJHLCJJ-WMLDXEAASA-N 0 3 380.517 3.178 10 0 GGAEHN CC1CCN(C[C@H](O)CNC(=O)C(C)(C)CC(=O)c2ccc(Cl)cc2)CC1 ZINC000096006259 222371752 /nfs/dbraw/zinc/37/17/52/222371752.db2.gz XBKNQAFYCNOLTC-GOSISDBHSA-N 0 3 394.943 3.148 10 0 GGAEHN COc1ccc(CN2CCC3(C[C@H](N(C)Cc4ccccn4)CO3)CC2)cc1 ZINC000096048057 222374952 /nfs/dbraw/zinc/37/49/52/222374952.db2.gz RISHNLUTQZWKJN-NRFANRHFSA-N 0 3 381.520 3.346 10 0 GGAEHN C[C@@H]1CCCCN1Cc1cccc(NC(=O)NCc2cnn3cccnc23)c1 ZINC000096148109 222389241 /nfs/dbraw/zinc/38/92/41/222389241.db2.gz NKRWDIMZBOLWSN-MRXNPFEDSA-N 0 3 378.480 3.425 10 0 GGAEHN CN1CCC(n2nc(-c3ccccn3)nc2[C@@H]2COc3ccccc3C2)CC1 ZINC000096160660 222394088 /nfs/dbraw/zinc/39/40/88/222394088.db2.gz GZVSSMPEASXUDF-KRWDZBQOSA-N 0 3 375.476 3.326 10 0 GGAEHN CN(Cc1ccoc1)Cc1ccc(-c2nc(C3CC[NH2+]CC3)cc(=O)[n-]2)cc1 ZINC000023153476 523476538 /nfs/dbraw/zinc/47/65/38/523476538.db2.gz OBQIAMJAHRUHKA-UHFFFAOYSA-N 0 3 378.476 3.129 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)N(C)CCc3ccccc3OC)cc2)CC1 ZINC000173139084 529152956 /nfs/dbraw/zinc/15/29/56/529152956.db2.gz YAQKHENWGZJGEQ-UHFFFAOYSA-N 0 3 381.520 3.152 10 0 GGAEHN NC(=O)[C@H]1CCC[C@H](NCc2cc(Br)ccc2OC(F)F)C1 ZINC000120068533 564302978 /nfs/dbraw/zinc/30/29/78/564302978.db2.gz GJJCQXSCWCURHW-CABZTGNLSA-N 0 3 377.229 3.184 10 0 GGAEHN CCN1CCC[C@H](NCc2c(Br)cncc2Br)C1 ZINC000394594864 565572434 /nfs/dbraw/zinc/57/24/34/565572434.db2.gz BRZUEBZABLLMAL-JTQLQIEISA-N 0 3 377.124 3.181 10 0 GGAEHN CN1CCC[C@@H](NC(=O)Nc2ccc(Cl)cc2I)C1 ZINC000610767966 566860828 /nfs/dbraw/zinc/86/08/28/566860828.db2.gz IYXZVXHPSLKIKZ-SNVBAGLBSA-N 0 3 393.656 3.160 10 0 GGAEHN CN(C[C@H]1CCN(C)C1)C(=O)c1cc(Br)sc1Br ZINC000116752107 564216345 /nfs/dbraw/zinc/21/63/45/564216345.db2.gz WROSVQKDYGTIKA-QMMMGPOBSA-N 0 3 396.148 3.297 10 0 GGAEHN C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)N1CCO[C@@H](CN(C)C)C1 ZINC000116783717 564216846 /nfs/dbraw/zinc/21/68/46/564216846.db2.gz JPZIWJLVYQQNFW-YPMHNXCESA-N 0 3 377.337 3.263 10 0 GGAEHN C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)N1CCO[C@H](CN(C)C)C1 ZINC000116783710 564216986 /nfs/dbraw/zinc/21/69/86/564216986.db2.gz JPZIWJLVYQQNFW-WCQYABFASA-N 0 3 377.337 3.263 10 0 GGAEHN CN(C)C[C@@H]1CN(C(=O)c2ccccc2SCc2cccs2)CCO1 ZINC000116794149 564216996 /nfs/dbraw/zinc/21/69/96/564216996.db2.gz PPSFSXDCNLTBGH-OAHLLOKOSA-N 0 3 376.547 3.443 10 0 GGAEHN C[C@H](NC(=O)N1CCO[C@@H](CN(C)C)C1)c1c(Cl)ccc(F)c1Cl ZINC000117036687 564222077 /nfs/dbraw/zinc/22/20/77/564222077.db2.gz BPFCHJPZRDXDHU-QWRGUYRKSA-N 0 3 378.275 3.166 10 0 GGAEHN CN(C)C[C@@H](NC(=O)c1cccc(I)c1)c1ccccc1 ZINC000007816562 564241868 /nfs/dbraw/zinc/24/18/68/564241868.db2.gz RGGCSHDNQSSMJX-MRXNPFEDSA-N 0 3 394.256 3.324 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)c1 ZINC000119253470 564261861 /nfs/dbraw/zinc/26/18/61/564261861.db2.gz FJARZDFSIGWKCV-CJNGLKHVSA-N 0 3 398.288 3.156 10 0 GGAEHN C[C@H]1C[C@@H](NCc2ccc(S(=O)(=O)N3CCOCC3)s2)CC(C)(C)C1 ZINC000119355493 564267271 /nfs/dbraw/zinc/26/72/71/564267271.db2.gz CCIXLWHWPWAQKO-LSDHHAIUSA-N 0 3 386.583 3.073 10 0 GGAEHN CN(C)CCOc1ccc(CNC(=O)Nc2cccnc2Br)cc1 ZINC000119638505 564280944 /nfs/dbraw/zinc/28/09/44/564280944.db2.gz CADWYQYQKNTFNR-UHFFFAOYSA-N 0 3 393.285 3.106 10 0 GGAEHN C[C@@H](C(=O)NC[C@H](O)CN1CCc2ccccc2C1)c1ccc(Cl)s1 ZINC000119683971 564283173 /nfs/dbraw/zinc/28/31/73/564283173.db2.gz ONYBMVDSZVUXLY-CJNGLKHVSA-N 0 3 378.925 3.040 10 0 GGAEHN C[C@@H](CC(=O)c1cccc(Br)c1)C(=O)N1CCC(N(C)C)CC1 ZINC000119698574 564284010 /nfs/dbraw/zinc/28/40/10/564284010.db2.gz UFTHNRFHSRBMEG-ZDUSSCGKSA-N 0 3 381.314 3.211 10 0 GGAEHN NC(=O)[C@@H]1CCC[C@H](NCc2cc(Br)ccc2OC(F)F)C1 ZINC000120068803 564302758 /nfs/dbraw/zinc/30/27/58/564302758.db2.gz GJJCQXSCWCURHW-SKDRFNHKSA-N 0 3 377.229 3.184 10 0 GGAEHN Cc1cc(-c2ccc(CNCCN3CCOCC3)o2)ccc1Br ZINC000020875817 564307960 /nfs/dbraw/zinc/30/79/60/564307960.db2.gz ISJRUAOAFGBKFF-UHFFFAOYSA-N 0 3 379.298 3.439 10 0 GGAEHN COc1sc(CN(C)[C@H]2CCCN(c3cccnn3)C2)cc1Br ZINC000120187841 564309253 /nfs/dbraw/zinc/30/92/53/564309253.db2.gz LOKDECYJXFZKSY-LBPRGKRZSA-N 0 3 397.342 3.410 10 0 GGAEHN Cc1cc(C(=O)C(C(=S)[N-]C[C@@H]2CCCO2)[n+]2ccccc2)c(C)s1 ZINC000022692227 564319026 /nfs/dbraw/zinc/31/90/26/564319026.db2.gz RVRGTJBOUWZPKT-HNNXBMFYSA-O 0 3 375.539 3.360 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)C[C@H](C)c1ccc(Br)cc1 ZINC000120613217 564328802 /nfs/dbraw/zinc/32/88/02/564328802.db2.gz ITHZISLLQZBICB-YOEHRIQHSA-N 0 3 383.330 3.170 10 0 GGAEHN CCCc1nc(CS(=O)(=O)C(C)C(=O)N[C@@H](C)c2ccccc2)cs1 ZINC000120630523 564329490 /nfs/dbraw/zinc/32/94/90/564329490.db2.gz ZQSMQAMOJRUFLL-KBPBESRZSA-N 0 3 380.535 3.276 10 0 GGAEHN CCCCSc1nnc(SCC(=O)NC2CCN(C3CC3)CC2)s1 ZINC000026588448 564347749 /nfs/dbraw/zinc/34/77/49/564347749.db2.gz XYSLCCFMDRQBTL-UHFFFAOYSA-N 0 3 386.612 3.265 10 0 GGAEHN O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1coc(Br)c1 ZINC000121090674 564352292 /nfs/dbraw/zinc/35/22/92/564352292.db2.gz GPKKHGZJZFCSOY-UHFFFAOYSA-N 0 3 393.281 3.499 10 0 GGAEHN Cc1ccc(C(=O)N(C)[C@@H]2CCN(C)C[C@@H]2C)cc1I ZINC000121162228 564357183 /nfs/dbraw/zinc/35/71/83/564357183.db2.gz AGZGVCLLXXIYQC-SWLSCSKDSA-N 0 3 386.277 3.012 10 0 GGAEHN O=C(NCC1(N2CCSCC2)CCCC1)[C@@H]1Cc2cc(Cl)ccc2O1 ZINC000029368726 564370155 /nfs/dbraw/zinc/37/01/55/564370155.db2.gz HGDXBYVVXPGPBQ-KRWDZBQOSA-N 0 3 380.941 3.121 10 0 GGAEHN C[C@H](CC(=O)N(C)CCCN1CCN(C)CC1)c1ccc(Br)cc1 ZINC000121679867 564381467 /nfs/dbraw/zinc/38/14/67/564381467.db2.gz RGGZJEOSJFNQFR-MRXNPFEDSA-N 0 3 396.373 3.039 10 0 GGAEHN COCc1c(Br)cccc1NC(=O)N[C@H]1CN(C(C)C)C[C@H]1C ZINC000121892452 564391201 /nfs/dbraw/zinc/39/12/01/564391201.db2.gz VEJLCQYCBBJVGM-WBMJQRKESA-N 0 3 384.318 3.446 10 0 GGAEHN CC(C)C[C@H](CNS(=O)(=O)c1ccccc1Br)N1CCCC1 ZINC000032916378 564407670 /nfs/dbraw/zinc/40/76/70/564407670.db2.gz URUWBTSTPGWREA-CQSZACIVSA-N 0 3 389.359 3.238 10 0 GGAEHN CCN(CC)CCn1c(N)c(C(=O)Nc2ccccc2OC)sc1=S ZINC000032952398 564408754 /nfs/dbraw/zinc/40/87/54/564408754.db2.gz HFWNCNGYVUJGLO-UHFFFAOYSA-N 0 3 380.539 3.464 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)c2cc(COc3ccc(Cl)cc3Cl)on2)C1 ZINC000122305846 564408776 /nfs/dbraw/zinc/40/87/76/564408776.db2.gz LAAIVSIHAMCNLJ-GFCCVEGCSA-N 0 3 384.263 3.337 10 0 GGAEHN COCCCOC1CCN(C[C@@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000122433221 564413544 /nfs/dbraw/zinc/41/35/44/564413544.db2.gz RZHPOEMUEWBBSL-CQSZACIVSA-N 0 3 392.323 3.251 10 0 GGAEHN Cc1ccc(O[C@H](C)C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c(Br)c1 ZINC000122746880 564425680 /nfs/dbraw/zinc/42/56/80/564425680.db2.gz KRJPFIPKBWKIBN-RBSFLKMASA-N 0 3 383.330 3.466 10 0 GGAEHN COc1c(Br)cc(CN[C@@H]2CCCN(C)C2)cc1Br ZINC000040672958 564428100 /nfs/dbraw/zinc/42/81/00/564428100.db2.gz CNGYLIWDILQLRR-LLVKDONJSA-N 0 3 392.135 3.404 10 0 GGAEHN COc1c(Br)cc(Br)cc1CN[C@@H]1CCCN(C)C1 ZINC000040672894 564428356 /nfs/dbraw/zinc/42/83/56/564428356.db2.gz NFQYRXCUPJEGDI-GFCCVEGCSA-N 0 3 392.135 3.404 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)c2cnn(-c3cccc(Br)c3)c2)CCN1C ZINC000122972997 564434242 /nfs/dbraw/zinc/43/42/42/564434242.db2.gz SHXSRTMPHAQZGU-CJNGLKHVSA-N 0 3 391.313 3.190 10 0 GGAEHN Cc1ccc(I)c(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1 ZINC000122999949 564435152 /nfs/dbraw/zinc/43/51/52/564435152.db2.gz VEILBPBZOMXOOZ-OLZOCXBDSA-N 0 3 386.277 3.154 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)c2cnn(-c3ccc(Br)cc3)c2)CCN1C ZINC000123033567 564436152 /nfs/dbraw/zinc/43/61/52/564436152.db2.gz YGJFZZMXPPDKJN-CXAGYDPISA-N 0 3 391.313 3.190 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)c2cnn(-c3ccc(Br)cc3)c2)CCN1C ZINC000123034058 564436216 /nfs/dbraw/zinc/43/62/16/564436216.db2.gz YGJFZZMXPPDKJN-DYVFJYSZSA-N 0 3 391.313 3.190 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)c2cnn(-c3ccc(Br)cc3)c2)CCN1C ZINC000123033799 564436257 /nfs/dbraw/zinc/43/62/57/564436257.db2.gz YGJFZZMXPPDKJN-SUMWQHHRSA-N 0 3 391.313 3.190 10 0 GGAEHN C[C@@H]1C[C@H](N(C)Cc2nc(-c3cccc(Br)c3)no2)CCN1C ZINC000123224448 564442184 /nfs/dbraw/zinc/44/21/84/564442184.db2.gz VWRPDPOCSYGJAQ-IUODEOHRSA-N 0 3 379.302 3.414 10 0 GGAEHN CN(C)C[C@H](NC(=O)c1ccccc1I)c1ccccc1 ZINC000042301988 564445972 /nfs/dbraw/zinc/44/59/72/564445972.db2.gz CWYXNJBZBOJWHH-INIZCTEOSA-N 0 3 394.256 3.324 10 0 GGAEHN CCN(CC)[C@H](C)CNC(=O)CCC(=O)c1cc(Br)ccc1OC ZINC000042481775 564446653 /nfs/dbraw/zinc/44/66/53/564446653.db2.gz CBLZWISTWDHVLG-CYBMUJFWSA-N 0 3 399.329 3.267 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)c2ccc(-n3cc(Br)cn3)cc2)CCN1C ZINC000123847785 564463468 /nfs/dbraw/zinc/46/34/68/564463468.db2.gz FHBVTSMQCDDYRE-DYVFJYSZSA-N 0 3 391.313 3.190 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1c(F)cccc1I ZINC000123945864 564466630 /nfs/dbraw/zinc/46/66/30/564466630.db2.gz WOZPZQILSNAOKT-NSHDSACASA-N 0 3 390.240 3.035 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)Cc2nc(Cc3cccc(Br)c3)no2)CCN1C ZINC000123926320 564466771 /nfs/dbraw/zinc/46/67/71/564466771.db2.gz PGYJCQMNXFKTIR-CJNGLKHVSA-N 0 3 393.329 3.337 10 0 GGAEHN C[C@H](C(=O)N(CCN(C)C)Cc1ccc(Br)cc1)C1CCOCC1 ZINC000123982465 564468361 /nfs/dbraw/zinc/46/83/61/564468361.db2.gz ANSKRXVADXVZPT-HNNXBMFYSA-N 0 3 397.357 3.402 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)c2ccn(-c3cccc(Br)c3)n2)CCN1C ZINC000124029904 564469183 /nfs/dbraw/zinc/46/91/83/564469183.db2.gz BHXBCEWBQVUHRA-ZFWWWQNUSA-N 0 3 391.313 3.190 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)Cc1c[nH]c2cc(Br)ccc12 ZINC000124194130 564474176 /nfs/dbraw/zinc/47/41/76/564474176.db2.gz NBSLGYYMXMASMW-OAHLLOKOSA-N 0 3 378.314 3.416 10 0 GGAEHN Cc1sc2ncnc(SCC(=O)N(C)[C@H]3CCN(C)[C@H](C)C3)c2c1C ZINC000124224925 564475279 /nfs/dbraw/zinc/47/52/79/564475279.db2.gz SQYSOTWYDDVWBA-RISCZKNCSA-N 0 3 378.567 3.341 10 0 GGAEHN Cn1cc([C@H]2CCCN2CCC(=O)Nc2cccc(Br)c2)cn1 ZINC000124500312 564483448 /nfs/dbraw/zinc/48/34/48/564483448.db2.gz VHOXTSVXMHQSEU-MRXNPFEDSA-N 0 3 377.286 3.348 10 0 GGAEHN Cn1cc([C@@H]2CCCN2CCC(=O)Nc2cccc(Br)c2)cn1 ZINC000124500081 564483851 /nfs/dbraw/zinc/48/38/51/564483851.db2.gz VHOXTSVXMHQSEU-INIZCTEOSA-N 0 3 377.286 3.348 10 0 GGAEHN CN(C)CCOc1ccc(CNC(=O)Cc2cccc(Br)c2)cc1 ZINC000124766060 564492096 /nfs/dbraw/zinc/49/20/96/564492096.db2.gz COWCDVQPINQVOZ-UHFFFAOYSA-N 0 3 391.309 3.248 10 0 GGAEHN CC(C(=O)N[C@@H]1CCCC[C@H]1C)S(=O)(=O)Cc1csc(C(C)(C)C)n1 ZINC000046184791 564497883 /nfs/dbraw/zinc/49/78/83/564497883.db2.gz ALSRLUHUPHEWDQ-UMVBOHGHSA-N 0 3 386.583 3.439 10 0 GGAEHN CC(C(=O)NCc1ccccc1)S(=O)(=O)Cc1csc(C(C)(C)C)n1 ZINC000046184902 564497925 /nfs/dbraw/zinc/49/79/25/564497925.db2.gz JHSRALFOTUYOTP-ZDUSSCGKSA-N 0 3 380.535 3.060 10 0 GGAEHN CC(C(=O)N1C[C@H](C)C[C@@H](C)C1)S(=O)(=O)Cc1csc(C(C)(C)C)n1 ZINC000046184862 564498341 /nfs/dbraw/zinc/49/83/41/564498341.db2.gz XSIKPRNTJNPQNT-MGPQQGTHSA-N 0 3 386.583 3.248 10 0 GGAEHN CC(C(=O)NC1CCC(C)CC1)S(=O)(=O)Cc1csc(C(C)(C)C)n1 ZINC000046185020 564498371 /nfs/dbraw/zinc/49/83/71/564498371.db2.gz UCVUGHIETTVOSV-ROKHWSDSSA-N 0 3 386.583 3.439 10 0 GGAEHN O=C1C[C@@H]([C@@H]2CCCCN2Cc2cc(Br)cc3cccnc32)CN1 ZINC000125203646 564506395 /nfs/dbraw/zinc/50/63/95/564506395.db2.gz RVMYZUBVPZCXJI-PBHICJAKSA-N 0 3 388.309 3.488 10 0 GGAEHN CCOc1c(Br)cc(C(=O)NCCN2CCCC[C@H]2C)cc1OC ZINC000046858550 564508876 /nfs/dbraw/zinc/50/88/76/564508876.db2.gz YLLJBQXLWPELMA-CYBMUJFWSA-N 0 3 399.329 3.461 10 0 GGAEHN COc1ccc(CCC(=O)NCCN2CCCC[C@@H]2C)cc1Br ZINC000046860557 564509059 /nfs/dbraw/zinc/50/90/59/564509059.db2.gz DDLDPKLMIQPFEL-AWEZNQCLSA-N 0 3 383.330 3.381 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1ccc(-n2cc(Br)cn2)cc1 ZINC000047143860 564513871 /nfs/dbraw/zinc/51/38/71/564513871.db2.gz YVCYTOCUMOPOHK-CQSZACIVSA-N 0 3 391.313 3.239 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)NC1CCN(C2CC2)CC1 ZINC000047246657 564515922 /nfs/dbraw/zinc/51/59/22/564515922.db2.gz FZPYKZZSBDPACE-UHFFFAOYSA-N 0 3 390.325 3.455 10 0 GGAEHN CN1CCC[C@@H](NC(=O)Nc2cc(Br)ccc2Br)C1 ZINC000048770458 564545833 /nfs/dbraw/zinc/54/58/33/564545833.db2.gz XYJBJYOQWRHKPM-SNVBAGLBSA-N 0 3 391.107 3.427 10 0 GGAEHN CCN1CCC[C@H](NC(=O)Nc2ccc(I)cc2C)C1 ZINC000048769342 564545939 /nfs/dbraw/zinc/54/59/39/564545939.db2.gz AMWMDFVKDWKEAN-ZDUSSCGKSA-N 0 3 387.265 3.205 10 0 GGAEHN C[C@H](NC(=O)NC[C@H](O)CN1CCCCC1)c1cc(F)c(Cl)cc1Cl ZINC000049174911 564549064 /nfs/dbraw/zinc/54/90/64/564549064.db2.gz KCTINWCDQZHHDT-RYUDHWBXSA-N 0 3 392.302 3.340 10 0 GGAEHN CCOCCN1CCN(CCOc2ccccc2Br)C[C@@H]1CC ZINC000126642282 564555920 /nfs/dbraw/zinc/55/59/20/564555920.db2.gz YRTBKDUFRDVSAO-INIZCTEOSA-N 0 3 385.346 3.261 10 0 GGAEHN C[C@@H](CNC(=O)CSCc1ccc(Br)cc1F)N1CCCC1 ZINC000051342889 564563875 /nfs/dbraw/zinc/56/38/75/564563875.db2.gz BQGVRAKFEDSMMJ-LBPRGKRZSA-N 0 3 389.334 3.422 10 0 GGAEHN CN(C(=O)CSCc1ccc(Br)cc1F)C1CCN(C)CC1 ZINC000051468818 564565134 /nfs/dbraw/zinc/56/51/34/564565134.db2.gz YIPPYNJKFIZLQQ-UHFFFAOYSA-N 0 3 389.334 3.374 10 0 GGAEHN C[C@@H]1CN(CCCNc2ncnc3ccc(Br)cc32)CCCO1 ZINC000519868038 564594175 /nfs/dbraw/zinc/59/41/75/564594175.db2.gz WDBUZJCCVFRPFV-CYBMUJFWSA-N 0 3 379.302 3.305 10 0 GGAEHN CCN1CCC(NC(=O)Cn2c(C)c(Br)c3ccccc32)CC1 ZINC000054000565 564597636 /nfs/dbraw/zinc/59/76/36/564597636.db2.gz DRJIUHMYGUBTMQ-UHFFFAOYSA-N 0 3 378.314 3.313 10 0 GGAEHN CC(C(=O)NCc1ccccc1)S(=O)(=O)Cc1nc(C(C)(C)C)cs1 ZINC000127961967 564602710 /nfs/dbraw/zinc/60/27/10/564602710.db2.gz SZIKAEFCQQXDHY-ZDUSSCGKSA-N 0 3 380.535 3.060 10 0 GGAEHN CC(C(=O)NCC1CCCCC1)S(=O)(=O)Cc1nc(C(C)(C)C)cs1 ZINC000127984691 564603903 /nfs/dbraw/zinc/60/39/03/564603903.db2.gz AHXXBDYLWQCVIT-ZDUSSCGKSA-N 0 3 386.583 3.440 10 0 GGAEHN CC(C(=O)N1C[C@H](C)C[C@@H](C)C1)S(=O)(=O)Cc1nc(C(C)(C)C)cs1 ZINC000128039868 564604439 /nfs/dbraw/zinc/60/44/39/564604439.db2.gz YXNPWONZJUQMHD-MGPQQGTHSA-N 0 3 386.583 3.248 10 0 GGAEHN CC(C(=O)NCc1cccs1)S(=O)(=O)Cc1nc(C(C)(C)C)cs1 ZINC000128031681 564604727 /nfs/dbraw/zinc/60/47/27/564604727.db2.gz AWWZXVNVGGSHSK-NSHDSACASA-N 0 3 386.564 3.122 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)Nc2cc(OC)c(OC)cc2Br)C1 ZINC000054484030 564605622 /nfs/dbraw/zinc/60/56/22/564605622.db2.gz HDZUSHIVWCARRP-LLVKDONJSA-N 0 3 386.290 3.072 10 0 GGAEHN O=C(CN[C@H]1CCCC[C@H]1n1cccn1)Nc1ccccc1Br ZINC000129119696 564638840 /nfs/dbraw/zinc/63/88/40/564638840.db2.gz LATXKGVYBKMDRM-JKSUJKDBSA-N 0 3 377.286 3.358 10 0 GGAEHN C[C@@H](NCc1cc(F)cc(Br)c1)c1cccc(-n2cnnn2)c1 ZINC000129135937 564639950 /nfs/dbraw/zinc/63/99/50/564639950.db2.gz UDQFUFXAGVIZJZ-LLVKDONJSA-N 0 3 376.233 3.415 10 0 GGAEHN C[C@@H](CCNCc1ccc(Br)c(Br)c1)[S@@](C)=O ZINC000129405680 564647018 /nfs/dbraw/zinc/64/70/18/564647018.db2.gz HGORVVZKAVAOHG-XYZCENFISA-N 0 3 383.149 3.458 10 0 GGAEHN CCOc1c(Br)cc(CNCC[C@H](C)[S@](C)=O)cc1OC ZINC000129433863 564648477 /nfs/dbraw/zinc/64/84/77/564648477.db2.gz ASDSJBXOKZWSDB-WIUDPPPLSA-N 0 3 378.332 3.103 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)NCc1csc(Br)c1 ZINC000057202483 564663484 /nfs/dbraw/zinc/66/34/84/564663484.db2.gz KBIJLTYNRXZOQN-OAHLLOKOSA-N 0 3 396.354 3.483 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)NCc1cc(Br)cs1 ZINC000057202597 564663492 /nfs/dbraw/zinc/66/34/92/564663492.db2.gz JBAPNNPKRFLRPD-OAHLLOKOSA-N 0 3 396.354 3.483 10 0 GGAEHN Brc1cc(CNC[C@H]2COc3ccccc3O2)cc2c1OCO2 ZINC000057681579 564671705 /nfs/dbraw/zinc/67/17/05/564671705.db2.gz PRXIQFHTECXRTF-LBPRGKRZSA-N 0 3 378.222 3.107 10 0 GGAEHN CC(C(=O)N[C@@H]1CCCC[C@H]1C)S(=O)(=O)Cc1csc(C(C)(C)C)n1 ZINC000058630249 564686916 /nfs/dbraw/zinc/68/69/16/564686916.db2.gz ALSRLUHUPHEWDQ-VNHYZAJKSA-N 0 3 386.583 3.439 10 0 GGAEHN O=C(NCCc1cc(Cl)ccc1Br)N1CC[C@H](N2CC=CC2)C1 ZINC000130716228 564690012 /nfs/dbraw/zinc/69/00/12/564690012.db2.gz KFRZKDCKTKBETM-HNNXBMFYSA-N 0 3 398.732 3.301 10 0 GGAEHN CS(=O)(=O)N1CCC[C@@H](CN(Cc2cccs2)Cc2cccs2)C1 ZINC000130896223 564695516 /nfs/dbraw/zinc/69/55/16/564695516.db2.gz GAHHIEGEGSHXFQ-HNNXBMFYSA-N 0 3 384.592 3.483 10 0 GGAEHN Brc1csc(-c2noc(CN3CCCN(C4CC4)CC3)n2)c1 ZINC000061040739 564704171 /nfs/dbraw/zinc/70/41/71/564704171.db2.gz LMUVKFGZAILUIK-UHFFFAOYSA-N 0 3 383.315 3.231 10 0 GGAEHN COCCN(C)CCN[C@@H](C)c1ccc(Br)cc1Br ZINC000061376726 564705666 /nfs/dbraw/zinc/70/56/66/564705666.db2.gz KCQMMLKZKXQOKR-NSHDSACASA-N 0 3 394.151 3.440 10 0 GGAEHN CN(C)CCOc1ccccc1C(=O)NCCc1ccccc1Br ZINC000061536743 564706809 /nfs/dbraw/zinc/70/68/09/564706809.db2.gz VVNRZFXATLZFRP-UHFFFAOYSA-N 0 3 391.309 3.362 10 0 GGAEHN CCNc1nc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cs1 ZINC000525966960 564714322 /nfs/dbraw/zinc/71/43/22/564714322.db2.gz HEANANKKUNXHRL-UHFFFAOYSA-N 0 3 376.448 3.110 10 0 GGAEHN CS(=O)(=O)c1cccc(Oc2ncccc2CN[C@@H]2CCCSC2)c1 ZINC000131581339 564716404 /nfs/dbraw/zinc/71/64/04/564716404.db2.gz KZKUOHKXQGFBEX-OAHLLOKOSA-N 0 3 378.519 3.263 10 0 GGAEHN COC1CCN(CCCOc2cccc(I)c2)CC1 ZINC000064139862 564726013 /nfs/dbraw/zinc/72/60/13/564726013.db2.gz RMNPWAMCLYDASZ-UHFFFAOYSA-N 0 3 375.250 3.171 10 0 GGAEHN CC(C)N1C[C@H](NC(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)[C@@H](C)C1 ZINC000132320556 564740758 /nfs/dbraw/zinc/74/07/58/564740758.db2.gz PAODHZHFKVWCCX-QWRGUYRKSA-N 0 3 375.357 3.241 10 0 GGAEHN COC[C@](C)(CCO)NCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000132562514 564747138 /nfs/dbraw/zinc/74/71/38/564747138.db2.gz WWYFKYQHAHDLHF-AEFFLSMTSA-N 0 3 389.323 3.034 10 0 GGAEHN O[C@H](COC[C@@H]1CCCO1)CN1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000132858850 564755289 /nfs/dbraw/zinc/75/52/89/564755289.db2.gz CFGGATKKCTZRGK-IMJJTQAJSA-N 0 3 390.307 3.003 10 0 GGAEHN CN(C)CCn1cc(NC(=O)c2csc(-c3ccccc3Cl)n2)cn1 ZINC000066381971 564764112 /nfs/dbraw/zinc/76/41/12/564764112.db2.gz KHMCTCPDYUSCPC-UHFFFAOYSA-N 0 3 375.885 3.474 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(Br)cc2C)[C@H](C)C1 ZINC000133385331 564771921 /nfs/dbraw/zinc/77/19/21/564771921.db2.gz JXSKASXYGMKWJC-UKRRQHHQSA-N 0 3 389.359 3.108 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(Br)cc2C)[C@H](C)C1 ZINC000133385122 564772121 /nfs/dbraw/zinc/77/21/21/564772121.db2.gz JXSKASXYGMKWJC-HIFRSBDPSA-N 0 3 389.359 3.108 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)c1ccc(CNC(C)=O)s1)c1ccsc1 ZINC000067163606 564785893 /nfs/dbraw/zinc/78/58/93/564785893.db2.gz XVFTYXZYCBLWNA-MRXNPFEDSA-N 0 3 379.551 3.259 10 0 GGAEHN C[C@H](NC[C@@H](O)c1ccc(Cl)cc1Cl)c1ccc(S(N)(=O)=O)cc1 ZINC000134284791 564799166 /nfs/dbraw/zinc/79/91/66/564799166.db2.gz SNKKGGSSBVMTLZ-MGPLVRAMSA-N 0 3 389.304 3.025 10 0 GGAEHN CCN1CCC[C@H](NCc2ncc(Br)cc2Br)C1 ZINC000135296714 564827036 /nfs/dbraw/zinc/82/70/36/564827036.db2.gz SOSNDTRNYBMGSS-NSHDSACASA-N 0 3 377.124 3.181 10 0 GGAEHN O=C(NCCNCc1cc(-c2ccccc2)n[nH]1)c1ccc(Br)cc1 ZINC000135938744 564842862 /nfs/dbraw/zinc/84/28/62/564842862.db2.gz ANOQEWALHOOOLU-UHFFFAOYSA-N 0 3 399.292 3.359 10 0 GGAEHN COCCN(CC(F)F)C(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1 ZINC000074538316 564862950 /nfs/dbraw/zinc/86/29/50/564862950.db2.gz SBXIBEAAVVVPSR-CZUORRHYSA-N 0 3 375.485 3.054 10 0 GGAEHN C[N@H+](CCNC(=O)NCc1ccc([O-])c(Br)c1)C1CCCCC1 ZINC000138151489 564864840 /nfs/dbraw/zinc/86/48/40/564864840.db2.gz JXUPZWVSAYKEHW-UHFFFAOYSA-N 0 3 384.318 3.218 10 0 GGAEHN C[N@@H+](CCNC(=O)NCc1ccc([O-])c(Br)c1)C1CCCCC1 ZINC000138151489 564864841 /nfs/dbraw/zinc/86/48/41/564864841.db2.gz JXUPZWVSAYKEHW-UHFFFAOYSA-N 0 3 384.318 3.218 10 0 GGAEHN COC(=O)CCN(CCOc1c(Cl)cccc1Cl)C[C@@H]1CCCO1 ZINC000079354571 564868090 /nfs/dbraw/zinc/86/80/90/564868090.db2.gz SESHQIWQGQIYNG-ZDUSSCGKSA-N 0 3 376.280 3.416 10 0 GGAEHN O=C(CSCc1cc(-c2cccs2)on1)NC1CCN(C2CC2)CC1 ZINC000139791841 564870074 /nfs/dbraw/zinc/87/00/74/564870074.db2.gz TXRXQJJNARIAOE-UHFFFAOYSA-N 0 3 377.535 3.379 10 0 GGAEHN C[C@@H](c1ccccc1Br)N1CCC[C@H](C(=O)N2CCOCC2)C1 ZINC000139704624 564870352 /nfs/dbraw/zinc/87/03/52/564870352.db2.gz NDADAJDBVKQMPW-GJZGRUSLSA-N 0 3 381.314 3.081 10 0 GGAEHN Brc1ccc2c(c1)C=C(CN1CCC(n3cncn3)CC1)CO2 ZINC000092648077 564879914 /nfs/dbraw/zinc/87/99/14/564879914.db2.gz OVJRWXHEZRSHHA-UHFFFAOYSA-N 0 3 375.270 3.154 10 0 GGAEHN CC[C@@H]1C[C@H](C)CC[C@@H]1NCc1ccc(S(=O)(=O)N2CCOCC2)s1 ZINC000093942244 564894663 /nfs/dbraw/zinc/89/46/63/564894663.db2.gz SVHIWTZTIOZEMJ-INMHGKMJSA-N 0 3 386.583 3.073 10 0 GGAEHN CCC[NH+]1CCC(C[N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2F)CC1 ZINC000097549676 564908714 /nfs/dbraw/zinc/90/87/14/564908714.db2.gz QBVBPYGCZJLHSX-UHFFFAOYSA-N 0 3 382.423 3.245 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)Cc1c[nH]c2cc(Br)ccc12 ZINC000151297029 564913771 /nfs/dbraw/zinc/91/37/71/564913771.db2.gz QXCSKHALEYRSQE-ZDUSSCGKSA-N 0 3 378.314 3.464 10 0 GGAEHN CCCC(=O)N[C@@H]1CCCN(CCC(=O)Nc2ccccc2Br)C1 ZINC000101563573 564917353 /nfs/dbraw/zinc/91/73/53/564917353.db2.gz PQGRVVAPTHPMFV-CQSZACIVSA-N 0 3 396.329 3.158 10 0 GGAEHN CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000102052233 564925242 /nfs/dbraw/zinc/92/52/42/564925242.db2.gz DGQWBPPUQQGECP-HNNXBMFYSA-N 0 3 387.311 3.058 10 0 GGAEHN Cc1cc(S(=O)(=O)NC[C@H]2CCN(CCc3ccccc3)C2)c(C)s1 ZINC000103163937 564944496 /nfs/dbraw/zinc/94/44/96/564944496.db2.gz ZNOIFTMSSAOUPC-GOSISDBHSA-N 0 3 378.563 3.208 10 0 GGAEHN CCc1ccc(S(=O)(=O)NC[C@H]2CCN(CCc3ccccc3)C2)s1 ZINC000103163717 564944570 /nfs/dbraw/zinc/94/45/70/564944570.db2.gz GUXLFYIVSJDLGL-QGZVFWFLSA-N 0 3 378.563 3.153 10 0 GGAEHN CCc1ccc(S(=O)(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)s1 ZINC000103163716 564944889 /nfs/dbraw/zinc/94/48/89/564944889.db2.gz GUXLFYIVSJDLGL-KRWDZBQOSA-N 0 3 378.563 3.153 10 0 GGAEHN CCCC[C@H]1CCC[C@H]1NCc1ccc(S(=O)(=O)N2CCOCC2)s1 ZINC000152145283 564948260 /nfs/dbraw/zinc/94/82/60/564948260.db2.gz OLHPUFJVMHMTPV-DOTOQJQBSA-N 0 3 386.583 3.218 10 0 GGAEHN O=C(CCN1CC[C@H](Oc2cccnc2)C1)Nc1ccc(Br)cc1 ZINC000152421345 564958970 /nfs/dbraw/zinc/95/89/70/564958970.db2.gz AKPAZYFPWTVAQL-KRWDZBQOSA-N 0 3 390.281 3.326 10 0 GGAEHN O=C(CCN1CC[C@@H](Oc2cccnc2)C1)Nc1cccc(Br)c1 ZINC000152511132 564962278 /nfs/dbraw/zinc/96/22/78/564962278.db2.gz KEEYPKNKNQSIPU-QGZVFWFLSA-N 0 3 390.281 3.326 10 0 GGAEHN COCCN(CCN(C)C)C(=O)N[C@@H](C)c1c(Cl)ccc(F)c1Cl ZINC000105167859 564963469 /nfs/dbraw/zinc/96/34/69/564963469.db2.gz BAZHTFRGPPYLGL-NSHDSACASA-N 0 3 380.291 3.413 10 0 GGAEHN C[C@H](Cc1ccccc1Br)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000152610590 564965396 /nfs/dbraw/zinc/96/53/96/564965396.db2.gz VXXDGFYHJAHONZ-GDBMZVCRSA-N 0 3 378.314 3.036 10 0 GGAEHN CCOCCN1CCN(CCC(=O)Nc2c(Cl)cccc2Cl)C[C@@H]1C ZINC000106111427 564978136 /nfs/dbraw/zinc/97/81/36/564978136.db2.gz COAXYPAEFXHFKT-AWEZNQCLSA-N 0 3 388.339 3.365 10 0 GGAEHN CC[C@@H]1CN(CCC(=O)Nc2cc(Cl)ccc2Cl)CCN1CCOC ZINC000106114528 564978422 /nfs/dbraw/zinc/97/84/22/564978422.db2.gz ZXKHHGJOXVAPEE-OAHLLOKOSA-N 0 3 388.339 3.365 10 0 GGAEHN CN(Cc1cc(Br)ccc1F)C1CCN(CCn2cccn2)CC1 ZINC000106128663 564979406 /nfs/dbraw/zinc/97/94/06/564979406.db2.gz PRBBZVRPTRGFJT-UHFFFAOYSA-N 0 3 395.320 3.381 10 0 GGAEHN O[C@H](COc1c(Cl)cccc1Cl)CN1CCC(Cn2cccn2)CC1 ZINC000106184190 564980774 /nfs/dbraw/zinc/98/07/74/564980774.db2.gz MXRSTJJZTLPHAC-HNNXBMFYSA-N 0 3 384.307 3.342 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000106573481 564984854 /nfs/dbraw/zinc/98/48/54/564984854.db2.gz IATCLQRMOITSCY-BBRMVZONSA-N 0 3 396.329 3.446 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)c2cn(-c3ccc(Br)cc3)cn2)CCN1C ZINC000153247138 564988979 /nfs/dbraw/zinc/98/89/79/564988979.db2.gz BABPFJOWGKFYRD-CZUORRHYSA-N 0 3 391.313 3.190 10 0 GGAEHN CC(C)c1n[nH]c(C(=O)N[C@H](Cc2ccccc2)CN(C)C)c1Br ZINC000106909655 564991591 /nfs/dbraw/zinc/99/15/91/564991591.db2.gz HASFKNCQDIEVGB-CQSZACIVSA-N 0 3 393.329 3.198 10 0 GGAEHN O[C@@H](COc1ccc(Br)cc1)CN1CCC(C2CCOCC2)CC1 ZINC000153563364 565000347 /nfs/dbraw/zinc/00/03/47/565000347.db2.gz ZAOCNRRFAYOBMK-GOSISDBHSA-N 0 3 398.341 3.327 10 0 GGAEHN O=S(=O)(c1ccccc1Br)N1CCCC[C@@H](N2CCCC2)C1 ZINC000107707586 565002474 /nfs/dbraw/zinc/00/24/74/565002474.db2.gz FJHPSNWQRIWFLW-CQSZACIVSA-N 0 3 387.343 3.088 10 0 GGAEHN CN1CCC[C@H](CNC(=O)CSCc2ccc(Br)cc2F)C1 ZINC000108333318 565009683 /nfs/dbraw/zinc/00/96/83/565009683.db2.gz AUYXQDQOSMKXCD-GFCCVEGCSA-N 0 3 389.334 3.279 10 0 GGAEHN CN1CCC[C@@H](CNC(=O)CSCc2ccc(Br)cc2F)C1 ZINC000108333322 565010258 /nfs/dbraw/zinc/01/02/58/565010258.db2.gz AUYXQDQOSMKXCD-LBPRGKRZSA-N 0 3 389.334 3.279 10 0 GGAEHN CN(C(=O)c1ccc(Cl)c(Cl)c1)C1CCN(CCn2cccn2)CC1 ZINC000109291590 565024108 /nfs/dbraw/zinc/02/41/08/565024108.db2.gz AKMZCJSSVZZWGL-UHFFFAOYSA-N 0 3 381.307 3.427 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)[C@@H]1CCCN1c1nccs1)c1ccsc1 ZINC000110629043 565043312 /nfs/dbraw/zinc/04/33/12/565043312.db2.gz QBVFMUJBZGXXSA-HOTGVXAUSA-N 0 3 378.567 3.373 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)Nc2cc(Br)ccc2N2CCCC2)C1 ZINC000154610188 565046790 /nfs/dbraw/zinc/04/67/90/565046790.db2.gz CVDMOWXMFDCTKA-CQSZACIVSA-N 0 3 381.318 3.217 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N(C)CCN1CCCC1 ZINC000110909406 565047316 /nfs/dbraw/zinc/04/73/16/565047316.db2.gz SZDJCQDELWLDOP-UHFFFAOYSA-N 0 3 378.314 3.266 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)c1cn(-c2ccc(Br)cc2)cn1 ZINC000154744381 565051612 /nfs/dbraw/zinc/05/16/12/565051612.db2.gz WDCFWDOLMKEOSC-MRXNPFEDSA-N 0 3 391.313 3.191 10 0 GGAEHN C[C@@H](CC(=O)Nc1ccc(Br)cc1)NCc1cccnc1N(C)C ZINC000154796823 565052793 /nfs/dbraw/zinc/05/27/93/565052793.db2.gz YNDXDBCHQKRJIE-ZDUSSCGKSA-N 0 3 391.313 3.417 10 0 GGAEHN C[C@H](CC(=O)Nc1ccc(Br)cc1)NCc1cccnc1N(C)C ZINC000154796930 565053035 /nfs/dbraw/zinc/05/30/35/565053035.db2.gz YNDXDBCHQKRJIE-CYBMUJFWSA-N 0 3 391.313 3.417 10 0 GGAEHN O=C(CCN1CCC(OCCCO)CC1)Nc1c(Cl)cccc1Cl ZINC000155083795 565061389 /nfs/dbraw/zinc/06/13/89/565061389.db2.gz NJNFJNIFTDFZPN-UHFFFAOYSA-N 0 3 375.296 3.185 10 0 GGAEHN C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1[nH]nc(-c2ccccc2)c1Br ZINC000113225470 565068575 /nfs/dbraw/zinc/06/85/75/565068575.db2.gz JCQZNSKVKLHAFE-GXTWGEPZSA-N 0 3 389.297 3.148 10 0 GGAEHN C[C@@H]1CN2CCC[C@@H]2CN1Cc1nc(Cc2cccc(Br)c2)no1 ZINC000113266894 565068797 /nfs/dbraw/zinc/06/87/97/565068797.db2.gz CBERCYMUCLCDIV-CZUORRHYSA-N 0 3 391.313 3.091 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)Cc2c[nH]c3cccc(Br)c23)CCN1C ZINC000155994467 565073769 /nfs/dbraw/zinc/07/37/69/565073769.db2.gz QXOMTPKKFHNTOT-JSGCOSHPSA-N 0 3 378.314 3.414 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)Cc2c[nH]c3cccc(Br)c23)CCN1C ZINC000155994113 565073842 /nfs/dbraw/zinc/07/38/42/565073842.db2.gz QXOMTPKKFHNTOT-TZMCWYRMSA-N 0 3 378.314 3.414 10 0 GGAEHN COc1ccc(Br)c(CC(=O)N[C@@H](CN(C)C)c2ccccc2)c1 ZINC000156519597 565092706 /nfs/dbraw/zinc/09/27/06/565092706.db2.gz SQOQXINNFOUTNH-SFHVURJKSA-N 0 3 391.309 3.419 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CCOc3ccc(Br)cc32)CCN1C ZINC000266833216 565092992 /nfs/dbraw/zinc/09/29/92/565092992.db2.gz ZQFQRFNXAUQALZ-XPKDYRNWSA-N 0 3 396.329 3.397 10 0 GGAEHN CN(C)C[C@@H]1CN(Cc2cc(Br)cc(C(F)(F)F)c2)CCO1 ZINC000156645843 565099746 /nfs/dbraw/zinc/09/97/46/565099746.db2.gz WGOIIJXIXLJGFA-CQSZACIVSA-N 0 3 381.236 3.230 10 0 GGAEHN Cc1ccc(C)c(OC[C@@H](O)CN[C@@H](CO)c2cccc(Br)c2)c1 ZINC000183886008 565101008 /nfs/dbraw/zinc/10/10/08/565101008.db2.gz AJRLHQHTNRKVMZ-ROUUACIJSA-N 0 3 394.309 3.129 10 0 GGAEHN COc1cc(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)sc1Br ZINC000157232922 565124196 /nfs/dbraw/zinc/12/41/96/565124196.db2.gz YMIWDDXBRBSONC-ZDUSSCGKSA-N 0 3 397.338 3.422 10 0 GGAEHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1csc(Br)c1 ZINC000157270425 565125444 /nfs/dbraw/zinc/12/54/44/565125444.db2.gz BZQSVIBUSXSAEG-UHFFFAOYSA-N 0 3 383.311 3.420 10 0 GGAEHN COc1c(Br)cc(Br)cc1CNCC1(CCO)CC1 ZINC000157317510 565128077 /nfs/dbraw/zinc/12/80/77/565128077.db2.gz GICFHGJURGXDGS-UHFFFAOYSA-N 0 3 393.119 3.472 10 0 GGAEHN CN1CC[C@@]2(CCN(C(=O)N[C@@H]3CCOc4c(Br)cccc43)C2)C1 ZINC000292740821 565131989 /nfs/dbraw/zinc/13/19/89/565131989.db2.gz TXEDWNILDYFDIJ-CRAIPNDOSA-N 0 3 394.313 3.010 10 0 GGAEHN COc1ccc([C@@H](C)NC(=O)N2CCN3CCC2CC3)cc1Br ZINC000370212007 565133580 /nfs/dbraw/zinc/13/35/80/565133580.db2.gz GBYLWRDLBLGAIR-GFCCVEGCSA-N 0 3 382.302 3.008 10 0 GGAEHN C[C@H](NC[C@@H]1CCCN(S(C)(=O)=O)C1)c1nc(-c2ccccc2)cs1 ZINC000184516961 565140222 /nfs/dbraw/zinc/14/02/22/565140222.db2.gz FCWDNGKPKXGFRP-GJZGRUSLSA-N 0 3 379.551 3.132 10 0 GGAEHN C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1cccnc1Br ZINC000268255987 565145635 /nfs/dbraw/zinc/14/56/35/565145635.db2.gz XYLFRYVCZIPIHA-WMLDXEAASA-N 0 3 388.309 3.485 10 0 GGAEHN CCN1CCC[C@H](NC(=O)NCc2cc3cc(Br)ccc3[nH]2)C1 ZINC000184738617 565155225 /nfs/dbraw/zinc/15/52/25/565155225.db2.gz ZHBBBRNEWHTKOX-AWEZNQCLSA-N 0 3 379.302 3.214 10 0 GGAEHN C[C@H]1CN(C2CCN(Cc3nc4cc(Br)ccc4[nH]3)CC2)CCO1 ZINC000184953052 565167538 /nfs/dbraw/zinc/16/75/38/565167538.db2.gz PCBSIRQJWSFVSS-ZDUSSCGKSA-N 0 3 393.329 3.011 10 0 GGAEHN C[C@H]1CN(C2CCN(Cc3nc4ccc(Br)cc4[nH]3)CC2)CCO1 ZINC000184953052 565167543 /nfs/dbraw/zinc/16/75/43/565167543.db2.gz PCBSIRQJWSFVSS-ZDUSSCGKSA-N 0 3 393.329 3.011 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)Cc2c[nH]c3cc(Br)ccc23)CCN1C ZINC000158449898 565170089 /nfs/dbraw/zinc/17/00/89/565170089.db2.gz ZDOQPQKSGQWRIG-IUODEOHRSA-N 0 3 378.314 3.414 10 0 GGAEHN C[C@@H](CCN1CCN(C)CC1)NC(=O)N[C@H]1CCCc2sc(Cl)cc21 ZINC000293596988 565176445 /nfs/dbraw/zinc/17/64/45/565176445.db2.gz ZLZRPRDKQMSRKK-ZFWWWQNUSA-N 0 3 384.977 3.104 10 0 GGAEHN C[C@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2cccs2)CC1 ZINC000158742939 565180080 /nfs/dbraw/zinc/18/00/80/565180080.db2.gz YBOCQGUDQYXHNX-MRXNPFEDSA-N 0 3 378.563 3.370 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)Nc2ccnn2Cc2cccc(Cl)c2Cl)C1 ZINC000158765794 565180876 /nfs/dbraw/zinc/18/08/76/565180876.db2.gz NARQNCHCDFJUOW-ZDUSSCGKSA-N 0 3 382.295 3.406 10 0 GGAEHN Brc1cnn(C2CCN(Cc3ccc(-n4cncn4)cc3)CC2)c1 ZINC000371337124 565187826 /nfs/dbraw/zinc/18/78/26/565187826.db2.gz SHIMDYHRRLTBQD-UHFFFAOYSA-N 0 3 387.285 3.063 10 0 GGAEHN C[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1)c1cn[nH]c1 ZINC000270222384 565212530 /nfs/dbraw/zinc/21/25/30/565212530.db2.gz HLKMGDZRFUZZMY-CYBMUJFWSA-N 0 3 394.317 3.007 10 0 GGAEHN Cc1ccc(S(=O)(=O)C[C@H](C)NC2CCN(c3cccs3)CC2)cc1 ZINC000185692827 565217153 /nfs/dbraw/zinc/21/71/53/565217153.db2.gz RIVYIEJWTJLILD-INIZCTEOSA-N 0 3 378.563 3.477 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(SC)c(Cl)c2)[C@H](C)C1 ZINC000185755858 565220772 /nfs/dbraw/zinc/22/07/72/565220772.db2.gz RZSOVZGRCZDKSG-DOMZBBRYSA-N 0 3 376.975 3.413 10 0 GGAEHN O=S1(=O)CCC(CN2CCC[C@@H]2Cc2ccc(Br)cc2)CC1 ZINC000372417830 565236843 /nfs/dbraw/zinc/23/68/43/565236843.db2.gz YCFQSQAGGCAKRG-QGZVFWFLSA-N 0 3 386.355 3.281 10 0 GGAEHN CCN(CCN[C@H](c1ccc(Br)cc1)c1cncnc1)C1CC1 ZINC000186162375 565243861 /nfs/dbraw/zinc/24/38/61/565243861.db2.gz JZQROALXJCGHRM-GOSISDBHSA-N 0 3 375.314 3.402 10 0 GGAEHN C[C@H](CN[C@@H](c1ccc(Br)cc1)c1cncnc1)N(C)C1CC1 ZINC000186177649 565244817 /nfs/dbraw/zinc/24/48/17/565244817.db2.gz YLGDXGHEVCIOCK-ACJLOTCBSA-N 0 3 375.314 3.401 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)c2cc(Br)ccc2Br)C1 ZINC000160454848 565245933 /nfs/dbraw/zinc/24/59/33/565245933.db2.gz NRRQRLDJBLTLAJ-LLVKDONJSA-N 0 3 390.119 3.426 10 0 GGAEHN Brc1ccc([C@H](NCCCO[C@@H]2CCOC2)c2cncnc2)cc1 ZINC000186246012 565250063 /nfs/dbraw/zinc/25/00/63/565250063.db2.gz CRFKYXMHURKUPV-MSOLQXFVSA-N 0 3 392.297 3.114 10 0 GGAEHN CCO[C@@H]1C[C@H](NCc2cc3c(c(Br)c2)OCO3)C12CCOCC2 ZINC000186277934 565250922 /nfs/dbraw/zinc/25/09/22/565250922.db2.gz MEEJCMSOKJZWKI-JKSUJKDBSA-N 0 3 398.297 3.242 10 0 GGAEHN C[C@@H](N[C@@H]1CCOC2(CCSCC2)C1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000271542413 565258131 /nfs/dbraw/zinc/25/81/31/565258131.db2.gz SUNMVNZJMBGKSB-UKRRQHHQSA-N 0 3 387.542 3.325 10 0 GGAEHN C[C@@H](N[C@H]1CCOC2(CCSCC2)C1)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000271542409 565258387 /nfs/dbraw/zinc/25/83/87/565258387.db2.gz SUNMVNZJMBGKSB-HIFRSBDPSA-N 0 3 387.542 3.325 10 0 GGAEHN C[C@H](c1ccc(CN2CCC(CNS(C)(=O)=O)CC2)cc1)C(F)(F)F ZINC000295391635 565263770 /nfs/dbraw/zinc/26/37/70/565263770.db2.gz VCXQWKVMJKMGKE-CYBMUJFWSA-N 0 3 378.460 3.114 10 0 GGAEHN COc1cccc(N2CC[C@H](CNCc3cncc(Br)c3)C2)c1 ZINC000186615953 565272359 /nfs/dbraw/zinc/27/23/59/565272359.db2.gz UNXMDTDDQHMKGN-CQSZACIVSA-N 0 3 376.298 3.469 10 0 GGAEHN COc1c(Br)cc(Br)cc1CNC(C)(C)[C@H](C)O ZINC000161140555 565274915 /nfs/dbraw/zinc/27/49/15/565274915.db2.gz WFTGJHYWEJUEBR-QMMMGPOBSA-N 0 3 381.108 3.469 10 0 GGAEHN CN1CCC(n2ccc(=NC(=O)NCc3ccc(Cl)cc3Cl)[nH]2)CC1 ZINC000373351803 565280103 /nfs/dbraw/zinc/28/01/03/565280103.db2.gz UZUSPVIQTPQNEQ-UHFFFAOYSA-N 0 3 382.295 3.200 10 0 GGAEHN O[C@H](COc1c(Cl)cccc1Cl)CN1CCSC2(CCOCC2)C1 ZINC000186848919 565290063 /nfs/dbraw/zinc/29/00/63/565290063.db2.gz NGXBHGIFNNUICJ-ZDUSSCGKSA-N 0 3 392.348 3.331 10 0 GGAEHN C[C@@H](NC(=O)N1CCc2cccc(Br)c2C1)C1=CCN(C)CC1 ZINC000272904051 565301794 /nfs/dbraw/zinc/30/17/94/565301794.db2.gz IYJYSKSZJUNZFS-CYBMUJFWSA-N 0 3 378.314 3.167 10 0 GGAEHN CCN1CCN(CCCNC(=O)C[C@@H](C)c2ccc(Br)cc2)CC1 ZINC000162068615 565304156 /nfs/dbraw/zinc/30/41/56/565304156.db2.gz XYVJJXXDPYNULY-MRXNPFEDSA-N 0 3 396.373 3.087 10 0 GGAEHN Brc1cnn(C2CCN(Cc3ccc(-c4cc[nH]n4)o3)CC2)c1 ZINC000373843231 565306246 /nfs/dbraw/zinc/30/62/46/565306246.db2.gz DYZCTMBEMXXGNA-UHFFFAOYSA-N 0 3 376.258 3.466 10 0 GGAEHN NC(=O)[C@H](N[C@H]1CCOC2(CCCCC2)C1)c1cccc(Br)c1 ZINC000162286153 565311156 /nfs/dbraw/zinc/31/11/56/565311156.db2.gz QKRSNEBWDSJAQX-JKSUJKDBSA-N 0 3 381.314 3.447 10 0 GGAEHN O=C1CC[C@@H](CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)CCN1 ZINC000296430804 565317344 /nfs/dbraw/zinc/31/73/44/565317344.db2.gz YHMRQPFVPYZRAF-MRXNPFEDSA-N 0 3 384.351 3.070 10 0 GGAEHN COc1cc(C[NH2+]CCc2nn(C)c3ccccc23)cc(Br)c1[O-] ZINC000187387909 565328737 /nfs/dbraw/zinc/32/87/37/565328737.db2.gz BJDOEQIYBCKZBZ-UHFFFAOYSA-N 0 3 390.281 3.382 10 0 GGAEHN Cc1cc(C)c(NC(=O)NC[C@@H](O)CN2CCCCC2)cc1Br ZINC000187552432 565340885 /nfs/dbraw/zinc/34/08/85/565340885.db2.gz BIPVMFKAZIEZJK-CQSZACIVSA-N 0 3 384.318 3.034 10 0 GGAEHN C[C@@H](c1ccc(CN2CCC[C@H](CNS(C)(=O)=O)C2)cc1)C(F)(F)F ZINC000296862261 565341332 /nfs/dbraw/zinc/34/13/32/565341332.db2.gz VEUOVOVJRINQCJ-DZGCQCFKSA-N 0 3 378.460 3.114 10 0 GGAEHN C[C@@H](N[C@@H]1CCCN(c2ncccn2)C1)c1cc(Br)ncc1F ZINC000273915778 565346039 /nfs/dbraw/zinc/34/60/39/565346039.db2.gz YNRUGEUNLHSVKG-VXGBXAGGSA-N 0 3 380.265 3.093 10 0 GGAEHN COc1cc(Br)ccc1CNC[C@H]1CCC2(CCOCC2)[C@H]1O ZINC000374724124 565353284 /nfs/dbraw/zinc/35/32/84/565353284.db2.gz UEOKMMAZDVWIFS-PBHICJAKSA-N 0 3 384.314 3.115 10 0 GGAEHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1c[nH]c2cccc(Br)c12 ZINC000163971036 565353743 /nfs/dbraw/zinc/35/37/43/565353743.db2.gz KEYKPFKICMWKTR-ZDUSSCGKSA-N 0 3 394.313 3.113 10 0 GGAEHN CN(C)CCN(C[C@H]1CCCO1)C(=O)c1c[nH]c2cccc(Br)c12 ZINC000163971132 565353864 /nfs/dbraw/zinc/35/38/64/565353864.db2.gz KEYKPFKICMWKTR-CYBMUJFWSA-N 0 3 394.313 3.113 10 0 GGAEHN C[C@@H](NCC(=O)N1N=C(c2cccs2)C[C@H]1c1cccs1)[C@H](C)CO ZINC000274104639 565357664 /nfs/dbraw/zinc/35/76/64/565357664.db2.gz VCVTWRFKIKNTRO-NFAWXSAZSA-N 0 3 377.535 3.094 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000187843819 565358430 /nfs/dbraw/zinc/35/84/30/565358430.db2.gz ROCPTWWPAWYKHB-SWLSCSKDSA-N 0 3 384.318 3.082 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21 ZINC000187846880 565359100 /nfs/dbraw/zinc/35/91/00/565359100.db2.gz VPOQUHGLIMLZAT-ZBFHGGJFSA-N 0 3 396.329 3.083 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N(CCN(C)C)CC(C)C ZINC000187847561 565359537 /nfs/dbraw/zinc/35/95/37/565359537.db2.gz JHUNUXUMKOJNLW-UHFFFAOYSA-N 0 3 386.334 3.187 10 0 GGAEHN CN(C)[C@@H](CNC(=O)CSc1nnc(C(F)(F)F)s1)c1ccccc1 ZINC000188136007 565381335 /nfs/dbraw/zinc/38/13/35/565381335.db2.gz RVNPKTZPVFKHEP-NSHDSACASA-N 0 3 390.456 3.068 10 0 GGAEHN O=S1(=O)CCC[C@@H](CN2CCC[C@H]2Cc2ccc(Br)cc2)C1 ZINC000375360438 565383256 /nfs/dbraw/zinc/38/32/56/565383256.db2.gz HWJZGGHJMOCHQV-RDJZCZTQSA-N 0 3 386.355 3.281 10 0 GGAEHN CCOc1cc(C[NH2+]CCc2cn3c(n2)SCC3)cc(Br)c1[O-] ZINC000297747745 565383928 /nfs/dbraw/zinc/38/39/28/565383928.db2.gz UCNPQIJYJVXUEX-UHFFFAOYSA-N 0 3 398.326 3.188 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cccn2Cc2cccs2)C[C@@H]1N1CCCC1 ZINC000275075398 565392773 /nfs/dbraw/zinc/39/27/73/565392773.db2.gz CMBDRZNOJWYHTM-ZWKOTPCHSA-N 0 3 375.563 3.250 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)CCCc1ccc(Br)s1 ZINC000170809233 565393728 /nfs/dbraw/zinc/39/37/28/565393728.db2.gz UWDMSHJZEDFCOB-CYBMUJFWSA-N 0 3 389.359 3.060 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)NCC2(c3cccc(Br)c3)CCC2)C1 ZINC000170833159 565394287 /nfs/dbraw/zinc/39/42/87/565394287.db2.gz RCTQYXCBDARYTF-INIZCTEOSA-N 0 3 380.330 3.216 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)c2ccc(Oc3ccc(Br)cc3)nc2)C1 ZINC000170865274 565395356 /nfs/dbraw/zinc/39/53/56/565395356.db2.gz YKEVIWPEGJYQPX-OAHLLOKOSA-N 0 3 390.281 3.413 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)c2ccc(COc3ccc(Br)cc3)o2)C1 ZINC000170865474 565395701 /nfs/dbraw/zinc/39/57/01/565395701.db2.gz VRLYGIWDCUIRSU-AWEZNQCLSA-N 0 3 393.281 3.397 10 0 GGAEHN CCCOc1c(Br)cc(C(=O)N2CC[C@H](N(C)C)C2)cc1OC ZINC000170861725 565395947 /nfs/dbraw/zinc/39/59/47/565395947.db2.gz IGVVEAPYWJMWAF-ZDUSSCGKSA-N 0 3 385.302 3.023 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1C(=O)N1CC[C@@H](N(C)C)C1 ZINC000170865469 565395984 /nfs/dbraw/zinc/39/59/84/565395984.db2.gz RWTBKZGVIMRYPD-MRXNPFEDSA-N 0 3 391.313 3.028 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)Cc2csc(COc3ccc(Cl)cc3)n2)C1 ZINC000170857550 565396215 /nfs/dbraw/zinc/39/62/15/565396215.db2.gz ZRGWIVZTSDIQKV-HNNXBMFYSA-N 0 3 379.913 3.081 10 0 GGAEHN Cc1nn(-c2ccc(C(=O)N3CC[C@H](N(C)C)C3)cc2)c(C)c1Br ZINC000170866967 565397473 /nfs/dbraw/zinc/39/74/73/565397473.db2.gz LWARZUKVHPWPME-INIZCTEOSA-N 0 3 391.313 3.028 10 0 GGAEHN CN(C)[C@@H]1CCN(C(=O)Nc2cc(Br)ccc2Br)C1 ZINC000171074917 565407726 /nfs/dbraw/zinc/40/77/26/565407726.db2.gz IVSSUQUBMXJCOW-SNVBAGLBSA-N 0 3 391.107 3.379 10 0 GGAEHN CCOc1cc(C[NH2+][C@@H]2CCC[C@H](C(=O)N(C)C)C2)cc(Br)c1[O-] ZINC000298327293 565409940 /nfs/dbraw/zinc/40/99/40/565409940.db2.gz IQHJBQZTPCMXRR-UONOGXRCSA-N 0 3 399.329 3.290 10 0 GGAEHN CCOc1cc(C[NH2+][C@H]2CCC[C@@H](C(=O)N(C)C)C2)cc(Br)c1[O-] ZINC000298327284 565409956 /nfs/dbraw/zinc/40/99/56/565409956.db2.gz IQHJBQZTPCMXRR-KGLIPLIRSA-N 0 3 399.329 3.290 10 0 GGAEHN COCCCN1CCC(NC(=O)N[C@@H](C)c2ccccc2Br)CC1 ZINC000171191106 565416444 /nfs/dbraw/zinc/41/64/44/565416444.db2.gz DPWLTZREESGISJ-AWEZNQCLSA-N 0 3 398.345 3.310 10 0 GGAEHN CCOc1cc(C[NH2+]CCC(=O)N2CCCCC2)cc(Br)c1[O-] ZINC000298685600 565424901 /nfs/dbraw/zinc/42/49/01/565424901.db2.gz IDMOUXBCJVIRHU-UHFFFAOYSA-N 0 3 385.302 3.046 10 0 GGAEHN CCOc1cc(C[NH2+]C2CCC3(CC2)OCCO3)cc(Br)c1[O-] ZINC000298676167 565424908 /nfs/dbraw/zinc/42/49/08/565424908.db2.gz BUOZECUDOROGQX-UHFFFAOYSA-N 0 3 386.286 3.329 10 0 GGAEHN COc1cc(C[NH2+][C@@H](CO)Cc2ccccc2C)cc(Br)c1[O-] ZINC000188940800 565434009 /nfs/dbraw/zinc/43/40/09/565434009.db2.gz XHTUCULOWFEOKX-OAHLLOKOSA-N 0 3 380.282 3.165 10 0 GGAEHN Cc1cnn([C@@H]2CCCN(C[C@H](O)COc3cccc(Br)c3)C2)c1 ZINC000171529488 565436198 /nfs/dbraw/zinc/43/61/98/565436198.db2.gz BEOQJFBOKBVMGO-SJORKVTESA-N 0 3 394.313 3.031 10 0 GGAEHN O=S(=O)(c1ccc(Cl)nc1Cl)N1CCCC[C@@H](N2CCCC2)C1 ZINC000171645374 565441688 /nfs/dbraw/zinc/44/16/88/565441688.db2.gz FYLUIUQXLDWEDE-GFCCVEGCSA-N 0 3 378.325 3.027 10 0 GGAEHN O=S(=O)(CCO)c1ccc(CN[C@H](c2ccc(Cl)cc2)C2CC2)cc1 ZINC000189169735 565449352 /nfs/dbraw/zinc/44/93/52/565449352.db2.gz YGOUSDXQABPXMK-IBGZPJMESA-N 0 3 379.909 3.347 10 0 GGAEHN O=C(c1n[nH]c2ccc(Br)cc21)N1CCC[C@H]1CN1CCCC1 ZINC000171797683 565452151 /nfs/dbraw/zinc/45/21/51/565452151.db2.gz RIMPQLNONOLUPA-ZDUSSCGKSA-N 0 3 377.286 3.026 10 0 GGAEHN O=C(Nc1ccc(N2CCSCC2)c(Cl)c1)N1CCN2CCC[C@H]2C1 ZINC000171892289 565456106 /nfs/dbraw/zinc/45/61/06/565456106.db2.gz XQNZWMBUOKBFES-HNNXBMFYSA-N 0 3 380.945 3.205 10 0 GGAEHN O=c1c(Cl)c(N2CCN3CCC[C@@H]3C2)cnn1-c1ccc(Cl)cc1Cl ZINC000171939439 565457717 /nfs/dbraw/zinc/45/77/17/565457717.db2.gz WDPDVQVZTNLZGW-GFCCVEGCSA-N 0 3 399.709 3.477 10 0 GGAEHN C[C@H](NC[C@@]1(O)CCO[C@H]1C)c1ccc(Br)cc1Br ZINC000300423533 565461227 /nfs/dbraw/zinc/46/12/27/565461227.db2.gz GSWYOPIIHMTTJZ-BHDSKKPTSA-N 0 3 393.119 3.402 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)NC[C@H](C)N(C)C1CC1 ZINC000189362296 565461691 /nfs/dbraw/zinc/46/16/91/565461691.db2.gz WOAJKCRQZWPEFI-RYUDHWBXSA-N 0 3 384.318 3.301 10 0 GGAEHN O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C[C@@H](O)CC(F)(F)F)CC1 ZINC000189379101 565462934 /nfs/dbraw/zinc/46/29/34/565462934.db2.gz SJXOGRCWGBJPOR-LBPRGKRZSA-N 0 3 382.785 3.443 10 0 GGAEHN C[C@H](NC(=O)N1CCO[C@H](CN(C)C)C1)c1cc(F)c(Cl)cc1Cl ZINC000172115577 565467452 /nfs/dbraw/zinc/46/74/52/565467452.db2.gz WPOMSYXQVVLWPK-WDEREUQCSA-N 0 3 378.275 3.166 10 0 GGAEHN O=C(NCCCc1ccc(Br)cc1F)N1CCN2CCC[C@H]2C1 ZINC000172195220 565471596 /nfs/dbraw/zinc/47/15/96/565471596.db2.gz OGGWFGVRMSQVAB-HNNXBMFYSA-N 0 3 384.293 3.010 10 0 GGAEHN O=C(c1cc(Br)sc1Br)N1CCN2CCC[C@H]2C1 ZINC000172291288 565476748 /nfs/dbraw/zinc/47/67/48/565476748.db2.gz AHUASYHRTAYKHU-QMMMGPOBSA-N 0 3 394.132 3.193 10 0 GGAEHN O=C(CN1CCCN(C2CC2)CC1)Nc1ccc(Cl)cc1C(F)(F)F ZINC000172346952 565480592 /nfs/dbraw/zinc/48/05/92/565480592.db2.gz YAPAMEBMIWVKAS-UHFFFAOYSA-N 0 3 375.822 3.467 10 0 GGAEHN CN1CCC[C@@H](CNc2cnn(C)c(=O)c2Br)[C@@H]1c1cccs1 ZINC000301403119 565483791 /nfs/dbraw/zinc/48/37/91/565483791.db2.gz DORNWIBWOYNBJL-XHDPSFHLSA-N 0 3 397.342 3.099 10 0 GGAEHN CCN(CC)C(=O)[C@H]1CCCN1CCC(=O)Nc1cccc(Br)c1 ZINC000172418975 565484538 /nfs/dbraw/zinc/48/45/38/565484538.db2.gz YNPAAQUIWNOZGX-MRXNPFEDSA-N 0 3 396.329 3.111 10 0 GGAEHN O=C(c1n[nH]c2ccc(Br)cc21)N1CCCN(C2CCCC2)CC1 ZINC000172418770 565484916 /nfs/dbraw/zinc/48/49/16/565484916.db2.gz KQCCPVRZNVLSRC-UHFFFAOYSA-N 0 3 391.313 3.416 10 0 GGAEHN O=C(NC1CCN(C2CC2)CC1)N1CCc2cccc(Br)c2C1 ZINC000172425368 565485137 /nfs/dbraw/zinc/48/51/37/565485137.db2.gz YLVXKDVPDCGNMR-UHFFFAOYSA-N 0 3 378.314 3.144 10 0 GGAEHN C[C@@H]1COCC[C@H]1NCc1coc(-c2ccc(I)cc2)n1 ZINC000277302077 565488018 /nfs/dbraw/zinc/48/80/18/565488018.db2.gz CLPJAIHTPJMHJJ-IAQYHMDHSA-N 0 3 398.244 3.461 10 0 GGAEHN CC(C)S(=O)(=O)CCCN[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000377663780 565491680 /nfs/dbraw/zinc/49/16/80/565491680.db2.gz COJINOBBVBFXKM-IAGOWNOFSA-N 0 3 376.925 3.027 10 0 GGAEHN CC(C)S(=O)(=O)CCCN[C@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000377663775 565491751 /nfs/dbraw/zinc/49/17/51/565491751.db2.gz COJINOBBVBFXKM-DLBZAZTESA-N 0 3 376.925 3.027 10 0 GGAEHN CCN1CCC[C@H]1CN(Cc1ccncc1)c1ncc(Br)cn1 ZINC000301540755 565493369 /nfs/dbraw/zinc/49/33/69/565493369.db2.gz JWZUFDASKNISRB-INIZCTEOSA-N 0 3 376.302 3.125 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000189887146 565494519 /nfs/dbraw/zinc/49/45/19/565494519.db2.gz YJGBZAHXJACVNS-MBNYWOFBSA-N 0 3 396.329 3.443 10 0 GGAEHN C[C@H]1C[C@@H](N(C)c2ncnc3ccc(I)cc32)CCN1C ZINC000172765340 565504133 /nfs/dbraw/zinc/50/41/33/565504133.db2.gz BHBNHBRJHABPEW-AAEUAGOBSA-N 0 3 396.276 3.153 10 0 GGAEHN Cc1nc2ccc(Br)cc2c(N2CCN(CCCO)CC2)c1C ZINC000301841486 565513331 /nfs/dbraw/zinc/51/33/31/565513331.db2.gz YYVDORFQDCVSOD-UHFFFAOYSA-N 0 3 378.314 3.119 10 0 GGAEHN C[C@@H]1CN(C(=O)c2cc(Cl)sc2Cl)CC[C@@H]1N1CCN(C)CC1 ZINC000378322011 565521005 /nfs/dbraw/zinc/52/10/05/565521005.db2.gz ZPEQVGMOUUQHIC-YPMHNXCESA-N 0 3 376.353 3.153 10 0 GGAEHN CSc1nc2ncnc(Nc3cnn(CCN4CCCCC4)c3)c2s1 ZINC000301964018 565521115 /nfs/dbraw/zinc/52/11/15/565521115.db2.gz VMUAKHFOGGCYTM-UHFFFAOYSA-N 0 3 375.527 3.234 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CCCC23CCN(C)CC3)c1 ZINC000378335581 565522502 /nfs/dbraw/zinc/52/25/02/565522502.db2.gz QHIVZWGZWLTZNV-UHFFFAOYSA-N 0 3 398.288 3.300 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2cc(Br)ccc2OC)n1 ZINC000190341116 565523544 /nfs/dbraw/zinc/52/35/44/565523544.db2.gz DUVKRLFCRRMCRF-UHFFFAOYSA-N 0 3 399.310 3.423 10 0 GGAEHN CCOC(=O)c1csc(CCNCc2ccc(OC)c(Br)c2)n1 ZINC000190344723 565524547 /nfs/dbraw/zinc/52/45/47/565524547.db2.gz QFBBCWOTCZUCCW-UHFFFAOYSA-N 0 3 399.310 3.423 10 0 GGAEHN CC[C@H](CN(C)C[C@H](O)CN1CCCC1=O)Oc1ccc(Cl)c(Cl)c1 ZINC000190385037 565528116 /nfs/dbraw/zinc/52/81/16/565528116.db2.gz LINMJVSKQWFXLO-UONOGXRCSA-N 0 3 389.323 3.066 10 0 GGAEHN CO[C@H]1CC[C@@H](NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)C1 ZINC000190393061 565528929 /nfs/dbraw/zinc/52/89/29/565528929.db2.gz MPJXEYUQUFRTRI-SJORKVTESA-N 0 3 398.345 3.090 10 0 GGAEHN CO[C@H]1CC[C@H](NC(=O)N(CCN(C)C)Cc2ccc(Br)cc2)C1 ZINC000190393080 565529011 /nfs/dbraw/zinc/52/90/11/565529011.db2.gz MPJXEYUQUFRTRI-IRXDYDNUSA-N 0 3 398.345 3.090 10 0 GGAEHN O=C(CN[C@@H](c1ccccc1)[C@H]1CCOC1)Nc1ccc(Br)cn1 ZINC000378504950 565531905 /nfs/dbraw/zinc/53/19/05/565531905.db2.gz CLAGEHJUOVYCKL-KSSFIOAISA-N 0 3 390.281 3.150 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)Nc2ccc(Cl)nc2)C1 ZINC000190499149 565536851 /nfs/dbraw/zinc/53/68/51/565536851.db2.gz GNGVDEUDQFDKHE-CYBMUJFWSA-N 0 3 379.917 3.486 10 0 GGAEHN CCc1cnc(NC(=O)N2CC[C@@H](CN(C)Cc3scnc3C)C2)s1 ZINC000190504408 565536864 /nfs/dbraw/zinc/53/68/64/565536864.db2.gz BTCWNLGOBMSRRE-ZDUSSCGKSA-N 0 3 379.555 3.456 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(F)c(C(F)(F)F)c2)[C@H](C)C1 ZINC000173256517 565541716 /nfs/dbraw/zinc/54/17/16/565541716.db2.gz IWTVQPIFOIJHBZ-ABAIWWIYSA-N 0 3 382.423 3.195 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)Cc2ccc(Cl)c(Cl)c2)[C@H](C)C1 ZINC000173258102 565541786 /nfs/dbraw/zinc/54/17/86/565541786.db2.gz ZGRLURAPVCYLLL-WBMJQRKESA-N 0 3 379.353 3.485 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2F)[C@H](C)C1 ZINC000173260078 565541832 /nfs/dbraw/zinc/54/18/32/565541832.db2.gz VEJKOOVXBPVYLT-RISCZKNCSA-N 0 3 382.423 3.195 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(Br)ccc2C)[C@H](C)C1 ZINC000173256785 565542030 /nfs/dbraw/zinc/54/20/30/565542030.db2.gz KEFUTZDGXIOKFV-UKRRQHHQSA-N 0 3 389.359 3.108 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(C)c(Br)c2)[C@H](C)C1 ZINC000173263582 565542066 /nfs/dbraw/zinc/54/20/66/565542066.db2.gz IYCMZUBYFKUCMG-CJNGLKHVSA-N 0 3 389.359 3.108 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(F)c(C(F)(F)F)c2)[C@H](C)C1 ZINC000173256531 565542297 /nfs/dbraw/zinc/54/22/97/565542297.db2.gz IWTVQPIFOIJHBZ-IAQYHMDHSA-N 0 3 382.423 3.195 10 0 GGAEHN C[C@@H]1CN(c2ccc3cccc(Br)c3n2)CCN1CC(C)(C)O ZINC000302465515 565542267 /nfs/dbraw/zinc/54/22/67/565542267.db2.gz BHADXWGVBOHAER-CYBMUJFWSA-N 0 3 378.314 3.279 10 0 GGAEHN Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)CSCC(F)(F)F)C1 ZINC000190572236 565542408 /nfs/dbraw/zinc/54/24/08/565542408.db2.gz DIFCURSRAZWEAU-LBPRGKRZSA-N 0 3 381.489 3.027 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)CSCC(F)(F)F)C1 ZINC000190572257 565542827 /nfs/dbraw/zinc/54/28/27/565542827.db2.gz DIFCURSRAZWEAU-GFCCVEGCSA-N 0 3 381.489 3.027 10 0 GGAEHN CN1CCN([C@H]2CCCCN(C(=O)Cc3ccc(Cl)c(Cl)c3)C2)CC1 ZINC000173288781 565544804 /nfs/dbraw/zinc/54/48/04/565544804.db2.gz NRRNFLLPZNPXJP-INIZCTEOSA-N 0 3 384.351 3.164 10 0 GGAEHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)c2ccc(Br)cc2)C1 ZINC000190598535 565545223 /nfs/dbraw/zinc/54/52/23/565545223.db2.gz YCRKKUQZKWZGSV-INIZCTEOSA-N 0 3 388.309 3.438 10 0 GGAEHN CCN1CCN(C[C@@H](C)CNC(=O)NCc2ccc(Cl)cc2Cl)CC1 ZINC000173304054 565545635 /nfs/dbraw/zinc/54/56/35/565545635.db2.gz YAUZIUBVUROFKD-AWEZNQCLSA-N 0 3 387.355 3.066 10 0 GGAEHN CC(C)N(C)CC(=O)N1CCC[C@@H]1c1ccc(I)cc1 ZINC000173323333 565547894 /nfs/dbraw/zinc/54/78/94/565547894.db2.gz VYOOITWCXMYILZ-OAHLLOKOSA-N 0 3 386.277 3.295 10 0 GGAEHN Cc1ccc(Br)cc1CN[C@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000190699609 565553319 /nfs/dbraw/zinc/55/33/19/565553319.db2.gz HIMQQPXGZAKAGP-GFCCVEGCSA-N 0 3 383.311 3.256 10 0 GGAEHN CCSCC[C@H](C)NC(=O)N1CC[C@@H](CN(C)Cc2scnc2C)C1 ZINC000190721427 565554425 /nfs/dbraw/zinc/55/44/25/565554425.db2.gz ZJTNDOSTPCOXGP-HOCLYGCPSA-N 0 3 384.615 3.447 10 0 GGAEHN COC(=O)c1cc(N2CCN3CCC2CC3)c2cc(Br)ccc2n1 ZINC000302749675 565554697 /nfs/dbraw/zinc/55/46/97/565554697.db2.gz GOXPRQBJQGCJTO-UHFFFAOYSA-N 0 3 390.281 3.068 10 0 GGAEHN CCN1CC[C@@H](NC(=O)c2ccc(Br)cc2Br)C1 ZINC000390029433 565555034 /nfs/dbraw/zinc/55/50/34/565555034.db2.gz YKCUGVJWVRCXMR-SNVBAGLBSA-N 0 3 376.092 3.036 10 0 GGAEHN C[C@@H](CN(C)Cc1ccccc1)Nc1ncc(I)cn1 ZINC000390741609 565557816 /nfs/dbraw/zinc/55/78/16/565557816.db2.gz MLFILZPQXRTXSG-LBPRGKRZSA-N 0 3 382.249 3.014 10 0 GGAEHN C[C@H](CCNCc1cc(Br)cc(Br)c1)[S@@](C)=O ZINC000394524214 565571007 /nfs/dbraw/zinc/57/10/07/565571007.db2.gz JQBIRCNDXYVXDT-VVVCHXIZSA-N 0 3 383.149 3.458 10 0 GGAEHN Cc1cc(N2CCC[C@H](NCc3ccc(Br)c(C)c3)C2=O)n(C)n1 ZINC000173569925 565568602 /nfs/dbraw/zinc/56/86/02/565568602.db2.gz PMCXKNFYRJWKMX-INIZCTEOSA-N 0 3 391.313 3.085 10 0 GGAEHN CCN1CCCC[C@H]1CNC(=O)N1CCN(Cc2ccc(Cl)s2)CC1 ZINC000303425624 565570341 /nfs/dbraw/zinc/57/03/41/565570341.db2.gz AOGKTGBVXMUYQP-HNNXBMFYSA-N 0 3 384.977 3.103 10 0 GGAEHN C[C@@H](CCNCc1cc(Br)cc(Br)c1)[S@@](C)=O ZINC000394524213 565570745 /nfs/dbraw/zinc/57/07/45/565570745.db2.gz JQBIRCNDXYVXDT-HUTHGQBESA-N 0 3 383.149 3.458 10 0 GGAEHN Cc1csc(C(=O)NCC2(O)CCN(Cc3ccccc3)CC2)c1Cl ZINC000397508777 565574947 /nfs/dbraw/zinc/57/49/47/565574947.db2.gz LJOKEKLPULGYNX-UHFFFAOYSA-N 0 3 378.925 3.467 10 0 GGAEHN Cc1nn(C)c(CN(C)[C@H]2CCN(Cc3ccccc3)C2)c1Br ZINC000309752464 565578591 /nfs/dbraw/zinc/57/85/91/565578591.db2.gz ZWSHYBRWDNNYKZ-INIZCTEOSA-N 0 3 377.330 3.197 10 0 GGAEHN C[C@H]1C[C@@H](NCc2c(Br)cnn2C)CCN1C(=O)OC(C)(C)C ZINC000278824100 565580001 /nfs/dbraw/zinc/58/00/01/565580001.db2.gz UGQKFLAJMOUWLX-RYUDHWBXSA-N 0 3 387.322 3.060 10 0 GGAEHN C[NH+]1CCC(CC[N-]S(=O)(=O)c2c(Cl)cccc2Br)CC1 ZINC000313981319 565585621 /nfs/dbraw/zinc/58/56/21/565585621.db2.gz GLJCRQINKPNGQZ-UHFFFAOYSA-N 0 3 395.750 3.113 10 0 GGAEHN O=S(=O)([N-][C@H]1CC[NH2+]C2(CCC2)C1)c1c(Cl)cccc1Br ZINC000314434079 565585737 /nfs/dbraw/zinc/58/57/37/565585737.db2.gz FXOBFHXIPXONPE-JTQLQIEISA-N 0 3 393.734 3.056 10 0 GGAEHN C[C@@H](C[N-]S(=O)(=O)c1c(Cl)cccc1Br)C[NH+]1CCCC1 ZINC000314115513 565586041 /nfs/dbraw/zinc/58/60/41/565586041.db2.gz AMATUIDHOOGYAO-NSHDSACASA-N 0 3 395.750 3.113 10 0 GGAEHN C[C@]1(NC(=O)c2nscc2Br)CCN(Cc2ccccc2)C1 ZINC000406011606 565586773 /nfs/dbraw/zinc/58/67/73/565586773.db2.gz SUBOFNUIBWLKJQ-INIZCTEOSA-N 0 3 380.311 3.300 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)N[C@H]2CCOc3c(Br)cccc32)CN1C1CC1 ZINC000407954838 565588682 /nfs/dbraw/zinc/58/86/82/565588682.db2.gz FNYRGRZATBURLX-WQGACYEGSA-N 0 3 394.313 3.197 10 0 GGAEHN CS(=O)(=O)N1CCC[C@@H](CN(CCC(F)(F)F)Cc2ccccc2)C1 ZINC000191241841 565590252 /nfs/dbraw/zinc/59/02/52/565590252.db2.gz ZHJUUXDNAFPAKF-INIZCTEOSA-N 0 3 378.460 3.113 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1cc(Cl)c(Cl)cc1OC ZINC000191267322 565592532 /nfs/dbraw/zinc/59/25/32/565592532.db2.gz RTDVPPPLDWVTJE-LLVKDONJSA-N 0 3 376.284 3.234 10 0 GGAEHN C[C@H](N[C@@H]1CCCN(c2cnn(C)c2)C1=O)c1cccc(Br)c1 ZINC000173890626 565597018 /nfs/dbraw/zinc/59/70/18/565597018.db2.gz NAADSGOECBMZOD-BLLLJJGKSA-N 0 3 377.286 3.029 10 0 GGAEHN C[C@H](N[C@H]1CCCN(c2cnn(C)c2)C1=O)c1cccc(Br)c1 ZINC000173890652 565597173 /nfs/dbraw/zinc/59/71/73/565597173.db2.gz NAADSGOECBMZOD-LRDDRELGSA-N 0 3 377.286 3.029 10 0 GGAEHN CN1C[C@H](NCc2ccc(OC(F)(F)F)c(Br)c2)CCC1=O ZINC000319474911 565599326 /nfs/dbraw/zinc/59/93/26/565599326.db2.gz RGZWMCOAWBYJPW-SNVBAGLBSA-N 0 3 381.192 3.058 10 0 GGAEHN COCC[C@@H](COC)NCc1ccc(OC(F)(F)F)c(Br)c1 ZINC000320281272 565602074 /nfs/dbraw/zinc/60/20/74/565602074.db2.gz ZODIWOPNTDQNAX-NSHDSACASA-N 0 3 386.208 3.489 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CC[C@H](N2CCCC2)C1 ZINC000191432808 565603709 /nfs/dbraw/zinc/60/37/09/565603709.db2.gz CQMFNHKOFFHLQZ-HIFRSBDPSA-N 0 3 396.329 3.398 10 0 GGAEHN CC(C)(CNC(=O)N1CC[C@@H](N2CC=CC2)C1)c1ccc(Br)cc1 ZINC000174050739 565608801 /nfs/dbraw/zinc/60/88/01/565608801.db2.gz ZYASYICWVYTKQO-QGZVFWFLSA-N 0 3 392.341 3.382 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)Nc2ccccc2I)CCN1C ZINC000174234820 565622461 /nfs/dbraw/zinc/62/24/61/565622461.db2.gz RHPKSNWFVUDEQK-NEPJUHHUSA-N 0 3 387.265 3.238 10 0 GGAEHN Cn1ncc(Br)c1CNCCC1=CCN(C(=O)OC(C)(C)C)CC1 ZINC000279615444 565622956 /nfs/dbraw/zinc/62/29/56/565622956.db2.gz AGGBNWFTOLBDNY-UHFFFAOYSA-N 0 3 399.333 3.230 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)Nc2ccc(I)cc2)CCN1C ZINC000174288795 565627143 /nfs/dbraw/zinc/62/71/43/565627143.db2.gz PFOQJZUAVDHQRB-FZMZJTMJSA-N 0 3 387.265 3.238 10 0 GGAEHN Cc1cc(N2CCC[C@@H](N[C@@H](C)c3ccc(Br)cc3)C2=O)n(C)n1 ZINC000174344413 565630506 /nfs/dbraw/zinc/63/05/06/565630506.db2.gz AGHSOHKOGSPROC-XJKSGUPXSA-N 0 3 391.313 3.337 10 0 GGAEHN COCc1csc(NC(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)n1 ZINC000174388118 565632368 /nfs/dbraw/zinc/63/23/68/565632368.db2.gz WKIJLPAHBZBLOS-ZDUSSCGKSA-N 0 3 380.539 3.385 10 0 GGAEHN C[C@@H]1C[C@H](NC(=O)N[C@@H]2CCOc3c(Br)cccc32)CCN1C ZINC000409697760 565633362 /nfs/dbraw/zinc/63/33/62/565633362.db2.gz NKQZWEVDNCZURU-LALPHHSUSA-N 0 3 382.302 3.055 10 0 GGAEHN CN(C)C1(CN(C)C(=O)N[C@@H]2CCOc3c(Br)cccc32)CCC1 ZINC000409705770 565635527 /nfs/dbraw/zinc/63/55/27/565635527.db2.gz IWNNHFCPZWFEIY-OAHLLOKOSA-N 0 3 396.329 3.398 10 0 GGAEHN COc1ccc(Br)cc1CNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000174458071 565638242 /nfs/dbraw/zinc/63/82/42/565638242.db2.gz OATREGISFQJPFK-SWLSCSKDSA-N 0 3 384.318 3.082 10 0 GGAEHN COc1ccc(CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1Br ZINC000174572378 565644357 /nfs/dbraw/zinc/64/43/57/565644357.db2.gz RXBKNHJNFCRNSD-OCCSQVGLSA-N 0 3 384.318 3.082 10 0 GGAEHN C[C@@H](NCCC(=O)Nc1cccc(Cl)c1)c1ccc(S(C)(=O)=O)cc1 ZINC000174697501 565652622 /nfs/dbraw/zinc/65/26/22/565652622.db2.gz GMXSBPBADSTCSE-CYBMUJFWSA-N 0 3 380.897 3.423 10 0 GGAEHN CN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000409979140 565655196 /nfs/dbraw/zinc/65/51/96/565655196.db2.gz JYSQRCQIFKDYFW-NHYWBVRUSA-N 0 3 387.268 3.213 10 0 GGAEHN C[C@H](NC(=O)c1ccccc1OCCN(C)C)c1ccc(Br)cn1 ZINC000280159187 565655585 /nfs/dbraw/zinc/65/55/85/565655585.db2.gz YKTUUAZYMBWTIB-ZDUSSCGKSA-N 0 3 392.297 3.276 10 0 GGAEHN C[C@H](C1CCN(C)CC1)N(C)C(=O)Cc1c(F)ccc(Br)c1F ZINC000410004748 565657229 /nfs/dbraw/zinc/65/72/29/565657229.db2.gz SJYYWVFCHNIJMG-LLVKDONJSA-N 0 3 389.284 3.459 10 0 GGAEHN CCN1CC[C@H](N(C)CCS(=O)(=O)c2cc(Cl)ccc2Cl)[C@H](C)C1 ZINC000174774049 565657697 /nfs/dbraw/zinc/65/76/97/565657697.db2.gz WNKKKCAEURTFFP-CJNGLKHVSA-N 0 3 393.380 3.429 10 0 GGAEHN CN1CCN([C@@H]2CCCCN(Cc3csc(-c4ccsc4)n3)C2)CC1 ZINC000174903615 565666568 /nfs/dbraw/zinc/66/65/68/565666568.db2.gz ZOCBWBGDXLCCBF-GOSISDBHSA-N 0 3 376.595 3.474 10 0 GGAEHN CC(C)NC(=O)CCN[C@@H](CO)c1ccc(Br)cc1C(F)(F)F ZINC000280349914 565667438 /nfs/dbraw/zinc/66/74/38/565667438.db2.gz IYQIASCWLPYMMD-ZDUSSCGKSA-N 0 3 397.235 3.006 10 0 GGAEHN CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1csc(I)c1 ZINC000174982340 565671210 /nfs/dbraw/zinc/67/12/10/565671210.db2.gz QIDQPZCQUNXJDW-NWDGAFQWSA-N 0 3 390.290 3.052 10 0 GGAEHN COCCN1CCC(NC(=O)c2cc(F)c(Br)cc2Cl)CC1 ZINC000280670904 565688319 /nfs/dbraw/zinc/68/83/19/565688319.db2.gz UEAQHMRDPDGMOO-UHFFFAOYSA-N 0 3 393.684 3.082 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2C[C@H]2c2ccccc2Br)CCN1C ZINC000280743186 565692030 /nfs/dbraw/zinc/69/20/30/565692030.db2.gz PGFAGVJVWWKAHD-LNCBFAARSA-N 0 3 380.330 3.429 10 0 GGAEHN C[C@@H]1C[C@@H](N(C)C(=O)N[C@@H]2C[C@H]2c2ccccc2Br)CCN1C ZINC000280743188 565692922 /nfs/dbraw/zinc/69/29/22/565692922.db2.gz PGFAGVJVWWKAHD-RPCCPQHDSA-N 0 3 380.330 3.429 10 0 GGAEHN CCN1CCC[C@H]1CN(C)Cc1nc(-c2ccc(Br)s2)no1 ZINC000175339260 565693671 /nfs/dbraw/zinc/69/36/71/565693671.db2.gz OFWDQERFRCUMJF-NSHDSACASA-N 0 3 385.331 3.477 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)Cc1nc(Cc2cccc(Br)c2)no1 ZINC000175351794 565695279 /nfs/dbraw/zinc/69/52/79/565695279.db2.gz ROWBATPAFHUQSC-MRXNPFEDSA-N 0 3 393.329 3.339 10 0 GGAEHN CC(C)CSCCN[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000281094624 565711916 /nfs/dbraw/zinc/71/19/16/565711916.db2.gz KKCRHERBSXFZAH-LLVKDONJSA-N 0 3 395.388 3.136 10 0 GGAEHN Cc1cc(S(=O)(=O)N2CC[C@H](CN(C)Cc3scnc3C)C2)c(C)s1 ZINC000192935036 565719455 /nfs/dbraw/zinc/71/94/55/565719455.db2.gz WJPUTDPKFXJLRX-OAHLLOKOSA-N 0 3 399.607 3.272 10 0 GGAEHN CCCCNC(=O)CCNC1(c2ccc(Br)cc2)CCOCC1 ZINC000411333916 565725451 /nfs/dbraw/zinc/72/54/51/565725451.db2.gz BLGOHKHCPJOYBF-UHFFFAOYSA-N 0 3 383.330 3.351 10 0 GGAEHN CCC[NH+]1CCC(C[N-]S(=O)(=O)c2ccc(OC)c(Cl)c2Cl)CC1 ZINC000330889118 565727363 /nfs/dbraw/zinc/72/73/63/565727363.db2.gz ILDXSKMYAPFBRN-UHFFFAOYSA-N 0 3 395.352 3.402 10 0 GGAEHN CCCNC(=O)CCCN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1 ZINC000411418387 565728369 /nfs/dbraw/zinc/72/83/69/565728369.db2.gz FQGGQNYNTWWDST-UHFFFAOYSA-N 0 3 386.367 3.460 10 0 GGAEHN CN(C(=O)CCN[C@H](CO)c1cccc(Br)c1)c1ccccc1 ZINC000411504901 565733224 /nfs/dbraw/zinc/73/32/24/565733224.db2.gz MJFQRBSEZHNLBO-QGZVFWFLSA-N 0 3 377.282 3.125 10 0 GGAEHN Cc1ccsc1[C@@H](CO)NCCC(=O)Nc1cccc(Br)c1 ZINC000411563689 565736854 /nfs/dbraw/zinc/73/68/54/565736854.db2.gz FHVGHVQVHAPAIU-CQSZACIVSA-N 0 3 383.311 3.471 10 0 GGAEHN C[C@H](CNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1)Oc1ccccc1Br ZINC000175975764 565738232 /nfs/dbraw/zinc/73/82/32/565738232.db2.gz NWFJYSOMKJAKIX-RRFJBIMHSA-N 0 3 398.345 3.341 10 0 GGAEHN C[C@H](C(=O)NC[C@@H]1CCCN(C)[C@@H]1c1cccs1)N(C)CC(F)(F)F ZINC000193343125 565746090 /nfs/dbraw/zinc/74/60/90/565746090.db2.gz XPWXTVMAYSDLHP-IPYPFGDCSA-N 0 3 377.476 3.130 10 0 GGAEHN CN(Cc1cccs1)C(=O)CN[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000411749911 565749575 /nfs/dbraw/zinc/74/95/75/565749575.db2.gz PRNPBZWOGOLEBL-IEBWSBKVSA-N 0 3 377.941 3.395 10 0 GGAEHN O=S(=O)(/C=C/c1cccc(Br)c1)NCc1ccc2c(c1)CNC2 ZINC000193431201 565751706 /nfs/dbraw/zinc/75/17/06/565751706.db2.gz FDGMULHSFIHJDJ-VOTSOKGWSA-N 0 3 393.306 3.143 10 0 GGAEHN CN(C)C[C@@H](NC(=O)[C@H]1Cc2cc(Br)ccc2O1)c1ccccc1 ZINC000193472651 565753711 /nfs/dbraw/zinc/75/37/11/565753711.db2.gz QYNREOKQESTWOD-SJLPKXTDSA-N 0 3 389.293 3.172 10 0 GGAEHN O=C1NC(=O)[C@]2(CCCN(Cc3ccc(-c4ccccc4Cl)s3)C2)N1 ZINC000193464752 565754388 /nfs/dbraw/zinc/75/43/88/565754388.db2.gz DCQSFULXRQHBDB-GOSISDBHSA-N 0 3 375.881 3.243 10 0 GGAEHN CN(C)CCN(Cc1ccco1)C(=O)c1n[nH]c2ccc(Br)cc21 ZINC000176171507 565754620 /nfs/dbraw/zinc/75/46/20/565754620.db2.gz CARYVCYFCCTJRM-UHFFFAOYSA-N 0 3 391.269 3.122 10 0 GGAEHN CN(C)C(=O)N1CCC(N[C@@H]2CCOc3c(Br)cccc32)CC1 ZINC000281933244 565756244 /nfs/dbraw/zinc/75/62/44/565756244.db2.gz BCDUFSRPYZBRQI-OAHLLOKOSA-N 0 3 382.302 3.008 10 0 GGAEHN COC(=O)[C@@H]1CSCCN(CCC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000412080749 565769660 /nfs/dbraw/zinc/76/96/60/565769660.db2.gz QGIBKFZNPPFGDC-NSHDSACASA-N 0 3 391.320 3.160 10 0 GGAEHN COC(=O)[C@@]1(C)CCCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000412111385 565771511 /nfs/dbraw/zinc/77/15/11/565771511.db2.gz VWPLUUQCIIWJQS-SJCJKPOMSA-N 0 3 376.280 3.008 10 0 GGAEHN Cc1csc(CS(=O)(=O)C(C)C(=O)N(Cc2ccccc2)C(C)C)n1 ZINC000176445141 565772849 /nfs/dbraw/zinc/77/28/49/565772849.db2.gz LNTOBNFJEYOIQM-OAHLLOKOSA-N 0 3 380.535 3.192 10 0 GGAEHN Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)c2nnc(C(C)C)s2)C1 ZINC000282418619 565778161 /nfs/dbraw/zinc/77/81/61/565778161.db2.gz LPOCSYAVQWYLJL-CYBMUJFWSA-N 0 3 379.555 3.021 10 0 GGAEHN O=C(NC1CCN(C2CC2)CC1)N[C@H]1CCOc2c(Br)cccc21 ZINC000282466881 565780818 /nfs/dbraw/zinc/78/08/18/565780818.db2.gz HNZONOQWFDUEPK-INIZCTEOSA-N 0 3 394.313 3.199 10 0 GGAEHN C[C@H](NC(=O)NC[C@@H](O)CN1CCCCC1)c1c(Cl)ccc(F)c1Cl ZINC000193902015 565781064 /nfs/dbraw/zinc/78/10/64/565781064.db2.gz OXCYXKCVXDPRAW-NWDGAFQWSA-N 0 3 392.302 3.340 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000282497984 565782348 /nfs/dbraw/zinc/78/23/48/565782348.db2.gz OPFGKTMKQNPZLD-KCXAZCMYSA-N 0 3 396.329 3.254 10 0 GGAEHN Cn1cc(Br)c(CNC(=O)c2cccc(CN3CCCCC3)c2)n1 ZINC000412384167 565786425 /nfs/dbraw/zinc/78/64/25/565786425.db2.gz PCDPWHDEVCNXQD-UHFFFAOYSA-N 0 3 391.313 3.099 10 0 GGAEHN COc1sc(CNC[C@H]2CCC3(CCOCC3)[C@@H]2O)cc1Br ZINC000282692926 565793059 /nfs/dbraw/zinc/79/30/59/565793059.db2.gz LIGBDKQRDZBCNL-BXUZGUMPSA-N 0 3 390.343 3.177 10 0 GGAEHN CN(C)CCOc1ccccc1C(=O)NCc1ccccc1Br ZINC000194161144 565797849 /nfs/dbraw/zinc/79/78/49/565797849.db2.gz YPEYIFWZRUIGJT-UHFFFAOYSA-N 0 3 377.282 3.320 10 0 GGAEHN C[C@@H]1CN(C)CC[C@H]1N(C)S(=O)(=O)c1c(Cl)cccc1Br ZINC000282936397 565804305 /nfs/dbraw/zinc/80/43/05/565804305.db2.gz IJELOEHSJZOHJP-ZWNOBZJWSA-N 0 3 395.750 3.063 10 0 GGAEHN CSc1ccsc1C(=O)NCC1(O)CCN(Cc2ccccc2)CC1 ZINC000412769210 565810216 /nfs/dbraw/zinc/81/02/16/565810216.db2.gz DOEMDTSEAFIHGR-UHFFFAOYSA-N 0 3 376.547 3.227 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(C)c(Br)s2)[C@H](C)C1 ZINC000176936205 565816540 /nfs/dbraw/zinc/81/65/40/565816540.db2.gz NKHPCYNRNYXZFV-VXGBXAGGSA-N 0 3 395.388 3.170 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)c1cnn(-c2ccc(Br)cc2)c1 ZINC000176979845 565819494 /nfs/dbraw/zinc/81/94/94/565819494.db2.gz XGZYWRVEBODNNZ-QGZVFWFLSA-N 0 3 391.313 3.191 10 0 GGAEHN CCN1CCC[C@H]1CN(C)C(=O)c1sc(C)c(Br)c1OC ZINC000176973510 565819639 /nfs/dbraw/zinc/81/96/39/565819639.db2.gz DSXHCVCZZHJOTR-NSHDSACASA-N 0 3 375.332 3.384 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O ZINC000176987006 565820934 /nfs/dbraw/zinc/82/09/34/565820934.db2.gz SZEYSGOAMPIJFW-CZUORRHYSA-N 0 3 381.929 3.086 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)N2CCO[C@H](c3cccc(Br)c3)C2)C1 ZINC000194543021 565822069 /nfs/dbraw/zinc/82/20/69/565822069.db2.gz LTOKFVNRXGYZDJ-SJORKVTESA-N 0 3 396.329 3.016 10 0 GGAEHN COc1cc(CN(C)C[C@@H](O)COc2cccc(Br)c2)ccc1O ZINC000177055737 565825143 /nfs/dbraw/zinc/82/51/43/565825143.db2.gz USSPSYGYXCCJJE-OAHLLOKOSA-N 0 3 396.281 3.035 10 0 GGAEHN CC[C@@H](C(=O)N1CCC[C@H]1c1ccccc1I)N(C)C ZINC000413450405 565852546 /nfs/dbraw/zinc/85/25/46/565852546.db2.gz FYRUYEZPVFBSKX-GJZGRUSLSA-N 0 3 386.277 3.295 10 0 GGAEHN C[C@H]1CCN(C(=O)c2[nH]nc3ccc(Br)cc32)C[C@@H]1n1ccnc1 ZINC000177486339 565854994 /nfs/dbraw/zinc/85/49/94/565854994.db2.gz LHYIOEHRZVSJKX-NHYWBVRUSA-N 0 3 388.269 3.245 10 0 GGAEHN CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)N1CCN2CCC[C@@H]2C1 ZINC000177697412 565867426 /nfs/dbraw/zinc/86/74/26/565867426.db2.gz CGSCIDVAWGXZSH-CQSZACIVSA-N 0 3 381.929 3.086 10 0 GGAEHN CN(Cc1cc(F)cc(Br)c1)[C@H]1CCCN(c2cccnn2)C1 ZINC000177708568 565868899 /nfs/dbraw/zinc/86/88/99/565868899.db2.gz QFRVBBCBGJXURD-INIZCTEOSA-N 0 3 379.277 3.479 10 0 GGAEHN CN(Cc1cc(F)cc(Br)c1)[C@@H]1CCCN(c2cccnn2)C1 ZINC000177708552 565869485 /nfs/dbraw/zinc/86/94/85/565869485.db2.gz QFRVBBCBGJXURD-MRXNPFEDSA-N 0 3 379.277 3.479 10 0 GGAEHN COC(=O)c1sccc1CN1CC[C@@H](CN(C)Cc2scnc2C)C1 ZINC000195260941 565870813 /nfs/dbraw/zinc/87/08/13/565870813.db2.gz JAXFNNFWWXYUEF-AWEZNQCLSA-N 0 3 379.551 3.254 10 0 GGAEHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc(Br)ccc1OC ZINC000177824122 565875004 /nfs/dbraw/zinc/87/50/04/565875004.db2.gz UVOMYHAEOOQLIZ-CVEARBPZSA-N 0 3 381.314 3.085 10 0 GGAEHN CCCOc1c(Br)cc(C(=O)N2CCN3CCC[C@H]3C2)cc1OC ZINC000195309411 565875215 /nfs/dbraw/zinc/87/52/15/565875215.db2.gz TTYSIVJDULOTOC-AWEZNQCLSA-N 0 3 397.313 3.167 10 0 GGAEHN O=C(CN1CCN([C@@H]2C[C@H]3CC[C@@H]2C3)CC1)Nc1ccccc1Br ZINC000177960357 565883703 /nfs/dbraw/zinc/88/37/03/565883703.db2.gz HQNKFTKAZBFKEK-HDMKZQKVSA-N 0 3 392.341 3.194 10 0 GGAEHN Brc1ccc(-c2nnc(CN3CCC(c4ccn[nH]4)CC3)o2)o1 ZINC000195505953 565888837 /nfs/dbraw/zinc/88/88/37/565888837.db2.gz WQYSRCQUXDHOBY-UHFFFAOYSA-N 0 3 378.230 3.195 10 0 GGAEHN O=C(CN1CCC(c2ccn[nH]2)CC1)Nc1ccc(Br)cc1F ZINC000195506859 565888938 /nfs/dbraw/zinc/88/89/38/565888938.db2.gz ZLTBZBKNOMKGID-UHFFFAOYSA-N 0 3 381.249 3.129 10 0 GGAEHN CN(Cc1ccccc1Br)C(=O)CN1CCC(c2ccn[nH]2)CC1 ZINC000195506213 565889492 /nfs/dbraw/zinc/88/94/92/565889492.db2.gz URAPVLXLJWWXGO-UHFFFAOYSA-N 0 3 391.313 3.010 10 0 GGAEHN COc1ccc(OC)c([C@@H](C)N[C@@H](C)Cn2cc(Br)ccc2=O)c1 ZINC000414058282 565891236 /nfs/dbraw/zinc/89/12/36/565891236.db2.gz GXHGYERRLKSAHB-QWHCGFSZSA-N 0 3 395.297 3.367 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)NCCOc1ccc(Cl)cc1 ZINC000414070989 565892538 /nfs/dbraw/zinc/89/25/38/565892538.db2.gz LMYVCIPOCHBYBJ-GFCCVEGCSA-N 0 3 385.689 3.321 10 0 GGAEHN Cc1ccc2c(c1C)OC[C@H]2N[C@@H](C)Cn1cc(Br)ccc1=O ZINC000414068561 565892653 /nfs/dbraw/zinc/89/26/53/565892653.db2.gz BFZOPLZFIBHALN-BLLLJJGKSA-N 0 3 377.282 3.339 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@H](C)c1ccc2c(c1)OCO2 ZINC000414059816 565892754 /nfs/dbraw/zinc/89/27/54/565892754.db2.gz IUOBADUMBHLYAS-VXGBXAGGSA-N 0 3 379.254 3.079 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@@H]1CCOc2ccc(F)cc21 ZINC000414093068 565894206 /nfs/dbraw/zinc/89/42/06/565894206.db2.gz LXYDSXWMXUPGIL-XHDPSFHLSA-N 0 3 381.245 3.252 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)Nc1cccc(OCCN(C)C)c1 ZINC000414106829 565895233 /nfs/dbraw/zinc/89/52/33/565895233.db2.gz JAXGKFKJHNEOOC-AWEZNQCLSA-N 0 3 394.313 3.052 10 0 GGAEHN Cc1cccc2oc(CCN[C@H](C)Cn3cc(Br)ccc3=O)nc21 ZINC000414110023 565895317 /nfs/dbraw/zinc/89/53/17/565895317.db2.gz LIWWSOTWGOMYFG-CYBMUJFWSA-N 0 3 390.281 3.281 10 0 GGAEHN C[C@H](Cn1cc(Br)ccc1=O)N[C@@H]1CCOc2c(F)cccc21 ZINC000414127435 565898142 /nfs/dbraw/zinc/89/81/42/565898142.db2.gz FZSWTFHRQXDFDE-IAQYHMDHSA-N 0 3 381.245 3.252 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@H](CN(C)C)c1ccc(F)cc1 ZINC000414162905 565900385 /nfs/dbraw/zinc/90/03/85/565900385.db2.gz MKUQNOVDZITWKO-SUMWQHHRSA-N 0 3 396.304 3.031 10 0 GGAEHN Cc1cc([C@H](Cc2ccccc2Cl)NC[C@H](O)Cn2ccnn2)cs1 ZINC000414190549 565903350 /nfs/dbraw/zinc/90/33/50/565903350.db2.gz RIGWUJBAYWPSKK-WMZOPIPTSA-N 0 3 376.913 3.236 10 0 GGAEHN C[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cccs1 ZINC000178178546 565904186 /nfs/dbraw/zinc/90/41/86/565904186.db2.gz LQYDCKBLMPMRLE-LSDHHAIUSA-N 0 3 380.535 3.181 10 0 GGAEHN C[C@@H](N[C@H](C)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cccs1 ZINC000178178557 565904453 /nfs/dbraw/zinc/90/44/53/565904453.db2.gz LQYDCKBLMPMRLE-HUUCEWRRSA-N 0 3 380.535 3.181 10 0 GGAEHN C[C@H](NC[C@]1(O)CCOC1)c1ccc(Br)cc1Br ZINC000222427535 565904882 /nfs/dbraw/zinc/90/48/82/565904882.db2.gz ODGFYOWWHPGYML-TVQRCGJNSA-N 0 3 379.092 3.014 10 0 GGAEHN COC[C@H](O)CCN[C@@H](C)c1ccc(Br)cc1Br ZINC000222709025 565906432 /nfs/dbraw/zinc/90/64/32/565906432.db2.gz KWXHHCNWBBEOHZ-GXSJLCMTSA-N 0 3 381.108 3.260 10 0 GGAEHN C[C@@H]1CN(CCC2CCN(C(=O)[C@]3(C)CC3(Cl)Cl)CC2)C[C@H](C)O1 ZINC000178234676 565906504 /nfs/dbraw/zinc/90/65/04/565906504.db2.gz NFUFTEMLIXUFID-VBQJREDUSA-N 0 3 377.356 3.308 10 0 GGAEHN NS(=O)(=O)c1ccc(CN[C@@H]2CCc3cc(F)ccc32)cc1Br ZINC000414311251 565909984 /nfs/dbraw/zinc/90/99/84/565909984.db2.gz YDCUOZAMZZLAJE-OAHLLOKOSA-N 0 3 399.285 3.013 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1C[C@H](O)COc1cc(Cl)ccc1Cl ZINC000178285829 565910700 /nfs/dbraw/zinc/91/07/00/565910700.db2.gz SSWARQJNBDKYHL-HOTGVXAUSA-N 0 3 384.307 3.403 10 0 GGAEHN Cc1nccn1C[C@H]1CCCN1Cc1cc2c(c(Br)c1)OCO2 ZINC000178290283 565911162 /nfs/dbraw/zinc/91/11/62/565911162.db2.gz FCHUMQWQJDVLMQ-CQSZACIVSA-N 0 3 378.270 3.347 10 0 GGAEHN Cc1cc(CNCCNS(=O)(=O)c2cccs2)ccc1C(F)(F)F ZINC000414357287 565915005 /nfs/dbraw/zinc/91/50/05/565915005.db2.gz CAXHPZOJINTESV-UHFFFAOYSA-N 0 3 378.441 3.143 10 0 GGAEHN O=C(Nc1cc(Br)ccc1N1CCCC1)N1CCN2CCC[C@H]2C1 ZINC000178404110 565916965 /nfs/dbraw/zinc/91/69/65/565916965.db2.gz NQCFJEUOYPIWNB-HNNXBMFYSA-N 0 3 393.329 3.361 10 0 GGAEHN O=C(NCCN[C@@H]1CCCOc2ccc(Br)cc21)c1ccco1 ZINC000178488356 565922271 /nfs/dbraw/zinc/92/22/71/565922271.db2.gz CKAWXKDRAVHZEI-CQSZACIVSA-N 0 3 379.254 3.275 10 0 GGAEHN Cc1nc2n(n1)C[C@H](N[C@@H]1CCCOc3ccc(Br)cc31)CC2 ZINC000178506337 565922818 /nfs/dbraw/zinc/92/28/18/565922818.db2.gz ZDYSJIWSTQOAAB-UKRRQHHQSA-N 0 3 377.286 3.167 10 0 GGAEHN CC(C)(C)OC(=O)[C@@H]1CCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000178512202 565922848 /nfs/dbraw/zinc/92/28/48/565922848.db2.gz AAVAYYITOYWBRJ-OLZOCXBDSA-N 0 3 390.307 3.397 10 0 GGAEHN CC(C)(NCc1ccc(S(N)(=O)=O)c(Br)c1)c1cccs1 ZINC000414395266 565923642 /nfs/dbraw/zinc/92/36/42/565923642.db2.gz QFTOVQLPRBXETD-UHFFFAOYSA-N 0 3 389.340 3.183 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)c1ccc(I)c(Cl)c1 ZINC000229043755 565926265 /nfs/dbraw/zinc/92/62/65/565926265.db2.gz ZBPRIGYICAQLIF-LLVKDONJSA-N 0 3 392.668 3.111 10 0 GGAEHN CSc1ccc(Cl)cc1NC(=O)C(=O)NC[C@H]1CCCN1CC(C)C ZINC000178624636 565930228 /nfs/dbraw/zinc/93/02/28/565930228.db2.gz ZKWDETVANOKSCJ-CQSZACIVSA-N 0 3 383.945 3.237 10 0 GGAEHN C[C@@H](C(=O)Nc1ccc(Cl)cc1C(F)(F)F)N1CCN2CCC[C@@H]2C1 ZINC000178640280 565931297 /nfs/dbraw/zinc/93/12/97/565931297.db2.gz CTHZPUNCFMFULI-WCQYABFASA-N 0 3 375.822 3.466 10 0 GGAEHN CC(C)(CNC(=O)N1CCN2CCC[C@H]2C1)c1ccccc1Br ZINC000178739201 565935652 /nfs/dbraw/zinc/93/56/52/565935652.db2.gz NKEFGGLAQCKMSB-AWEZNQCLSA-N 0 3 380.330 3.216 10 0 GGAEHN OC1(CNCc2ncc(Br)s2)CCN(Cc2ccccc2)CC1 ZINC000414528053 565945132 /nfs/dbraw/zinc/94/51/32/565945132.db2.gz SJBKTBFEDJDXAU-UHFFFAOYSA-N 0 3 396.354 3.022 10 0 GGAEHN CCCC1CCC(NCc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1 ZINC000236806436 565945679 /nfs/dbraw/zinc/94/56/79/565945679.db2.gz KBEMZCRFLYDIKL-UHFFFAOYSA-N 0 3 386.583 3.218 10 0 GGAEHN OC[C@@H]1CCC[C@H](NCc2c(F)ccc(I)c2F)C1 ZINC000414579920 565951548 /nfs/dbraw/zinc/95/15/48/565951548.db2.gz QGTYKXCBOLEMKR-ZJUUUORDSA-N 0 3 381.204 3.210 10 0 GGAEHN Cc1ccc(NC(=O)NCCCNCc2cccnc2)c(Br)c1 ZINC000414695770 565955308 /nfs/dbraw/zinc/95/53/08/565955308.db2.gz OVWMFKOLZCWRAF-UHFFFAOYSA-N 0 3 377.286 3.454 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)NCCc1csc(-c2ccc(Cl)cc2)n1 ZINC000179072684 565956259 /nfs/dbraw/zinc/95/62/59/565956259.db2.gz FTSBDHQFHCIVAF-INIZCTEOSA-N 0 3 378.929 3.399 10 0 GGAEHN O=C(Nc1cc(Cl)ccc1OCC(F)(F)F)N[C@@H]1CNCCC1(F)F ZINC000414792773 565961078 /nfs/dbraw/zinc/96/10/78/565961078.db2.gz SGMISESMWVUOLN-LLVKDONJSA-N 0 3 387.736 3.400 10 0 GGAEHN COc1cc(Br)c(CNCCCNCc2cccnc2)cc1OC ZINC000414882132 565964146 /nfs/dbraw/zinc/96/41/46/565964146.db2.gz RQJAOTVMAFLCAU-UHFFFAOYSA-N 0 3 394.313 3.131 10 0 GGAEHN FC1(F)CCNC[C@@H]1NC1CCN(Cc2ccccc2Br)CC1 ZINC000414992783 565968572 /nfs/dbraw/zinc/96/85/72/565968572.db2.gz BSVPWXAHQOEYBZ-INIZCTEOSA-N 0 3 388.300 3.000 10 0 GGAEHN CCCOc1c(Br)cc(CN[C@H]2CNCCC2(F)F)cc1OC ZINC000415005188 565969291 /nfs/dbraw/zinc/96/92/91/565969291.db2.gz RFKOMHVTFHFQJD-AWEZNQCLSA-N 0 3 393.272 3.333 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN[C@@H]1CNCCC1(F)F ZINC000415007980 565969599 /nfs/dbraw/zinc/96/95/99/565969599.db2.gz VGBSHPNBPCKVPH-OAHLLOKOSA-N 0 3 385.256 3.030 10 0 GGAEHN COc1ccc(NC(=O)NCCCNCc2cccnc2)c(Br)c1 ZINC000415102480 565973573 /nfs/dbraw/zinc/97/35/73/565973573.db2.gz DSSMKSJHGKCPDR-UHFFFAOYSA-N 0 3 393.285 3.154 10 0 GGAEHN CC(C)OC(=O)c1ccc(Cl)c(NC(=O)N[C@@H]2CNCCC2(F)F)c1 ZINC000415118009 565974583 /nfs/dbraw/zinc/97/45/83/565974583.db2.gz DNDFTVHMKHJIRO-CYBMUJFWSA-N 0 3 375.803 3.024 10 0 GGAEHN COc1ccc(Br)cc1C1(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)CC1 ZINC000415206098 565977949 /nfs/dbraw/zinc/97/79/49/565977949.db2.gz AWXCFOKEGSAQCP-DZGCQCFKSA-N 0 3 395.341 3.430 10 0 GGAEHN COC(=O)[C@H](C)CN(C[C@@H](O)COc1c(Cl)cccc1Cl)C1CC1 ZINC000245385462 565987513 /nfs/dbraw/zinc/98/75/13/565987513.db2.gz CVLJGVPGYPZZAL-DGCLKSJQSA-N 0 3 376.280 3.007 10 0 GGAEHN CCN(C(=O)CSc1nncs1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000363034902 565988639 /nfs/dbraw/zinc/98/86/39/565988639.db2.gz BNZXVLFEKXOKCI-GDBMZVCRSA-N 0 3 376.551 3.314 10 0 GGAEHN CCN(C(=O)CSc1nncs1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000363034904 565988683 /nfs/dbraw/zinc/98/86/83/565988683.db2.gz BNZXVLFEKXOKCI-HOCLYGCPSA-N 0 3 376.551 3.314 10 0 GGAEHN CCN1CC[C@H](N(C)C(=O)CSCC(=O)c2ccc(Cl)cc2)[C@@H](C)C1 ZINC000245415802 565988981 /nfs/dbraw/zinc/98/89/81/565988981.db2.gz GYZMJNPDEFOWMX-YOEHRIQHSA-N 0 3 382.957 3.445 10 0 GGAEHN CCN1CCC[C@@H]1CN(C)C(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O ZINC000245435661 565990518 /nfs/dbraw/zinc/99/05/18/565990518.db2.gz SZEYSGOAMPIJFW-CJNGLKHVSA-N 0 3 381.929 3.086 10 0 GGAEHN O=S1(=O)CCC[C@@H](CN[C@H]2CCCOc3ccc(Br)cc32)C1 ZINC000287043203 565994693 /nfs/dbraw/zinc/99/46/93/565994693.db2.gz MKGWVSWATRDOPK-WFASDCNBSA-N 0 3 388.327 3.077 10 0 GGAEHN CC(C)N1CC[C@H](N[C@H]2CCCS(=O)(=O)C2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000245564881 565995470 /nfs/dbraw/zinc/99/54/70/565995470.db2.gz OMBGDBYPASADQM-WBAXXEDZSA-N 0 3 388.936 3.170 10 0 GGAEHN Cc1n[nH]c(C)c1[C@@H]1CCCN1C[C@@H](O)COc1cccc(Br)c1 ZINC000245571845 565997707 /nfs/dbraw/zinc/99/77/07/565997707.db2.gz BYGYMAYPWJMXKV-WBVHZDCISA-N 0 3 394.313 3.366 10 0 GGAEHN CN1CC[C@@H](NC(=O)COc2ccccc2Br)[C@H]1c1ccccc1 ZINC000245678426 566001688 /nfs/dbraw/zinc/00/16/88/566001688.db2.gz LVJSTNOBKNTOTQ-VQIMIIECSA-N 0 3 389.293 3.390 10 0 GGAEHN O[C@H](CN1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1)c1cccc(Br)c1 ZINC000245717485 566002890 /nfs/dbraw/zinc/00/28/90/566002890.db2.gz GWSAQKOWNZXYIJ-GDBMZVCRSA-N 0 3 391.313 3.358 10 0 GGAEHN O[C@H](CN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1cccc(Br)c1 ZINC000245717485 566002895 /nfs/dbraw/zinc/00/28/95/566002895.db2.gz GWSAQKOWNZXYIJ-GDBMZVCRSA-N 0 3 391.313 3.358 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)Cc2ccc(Cl)cc2Cl)[C@@H](C)C1 ZINC000245741318 566005011 /nfs/dbraw/zinc/00/50/11/566005011.db2.gz RQJQZDCGVPQCOO-LRDDRELGSA-N 0 3 379.353 3.485 10 0 GGAEHN CN1CCC[C@@H]2CN(S(=O)(=O)Cc3ccc(Cl)cc3Cl)CC[C@H]21 ZINC000245782624 566006384 /nfs/dbraw/zinc/00/63/84/566006384.db2.gz YZXLVNSGTVNFNL-MLGOLLRUSA-N 0 3 377.337 3.239 10 0 GGAEHN O=C(N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F)N[C@@H]1CNCCC1(F)F ZINC000415618852 566008445 /nfs/dbraw/zinc/00/84/45/566008445.db2.gz RSVCYPSHVFCNEC-GHMZBOCLSA-N 0 3 389.727 3.379 10 0 GGAEHN CC(C(=O)N1C[C@H](C)C[C@@H](C)C1)S(=O)(=O)Cc1nc(C(C)(C)C)cs1 ZINC000245888759 566009353 /nfs/dbraw/zinc/00/93/53/566009353.db2.gz YXNPWONZJUQMHD-MCIONIFRSA-N 0 3 386.583 3.248 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)N1CCOC[C@H]1CC(F)F)c1ccsc1 ZINC000287280321 566009305 /nfs/dbraw/zinc/00/93/05/566009305.db2.gz VCWRVMRHWNXWHQ-HUUCEWRRSA-N 0 3 375.485 3.197 10 0 GGAEHN CC[C@@H]1CN(Cc2ccc(Br)c3cccnc23)CCN1C[C@H](C)O ZINC000245951845 566011675 /nfs/dbraw/zinc/01/16/75/566011675.db2.gz LFWPUHKTRAUEIH-GOEBONIOSA-N 0 3 392.341 3.274 10 0 GGAEHN O=C(Nc1cc(F)c(Br)cc1Cl)N[C@@H]1CNCCC1(F)F ZINC000415666986 566011911 /nfs/dbraw/zinc/01/19/11/566011911.db2.gz XNTHHMNIGNHTHU-SNVBAGLBSA-N 0 3 386.599 3.360 10 0 GGAEHN C[C@H]1CN(Cc2ccc(Br)c3cccnc23)C[C@H]1N1CCOCC1 ZINC000245963197 566012348 /nfs/dbraw/zinc/01/23/48/566012348.db2.gz MXHBDSCRJJZMSQ-KBXCAEBGSA-N 0 3 390.325 3.150 10 0 GGAEHN Cc1nccn1C[C@@H]1CCCN1[C@H](C)C(=O)Nc1ccc(Br)cc1 ZINC000245953207 566012405 /nfs/dbraw/zinc/01/24/05/566012405.db2.gz PTTFGFTXXSWINK-DYVFJYSZSA-N 0 3 391.313 3.446 10 0 GGAEHN CS(=O)(=O)N1CCC[C@@H](CN[C@H](CC(F)(F)F)c2ccc(F)cc2)C1 ZINC000246009925 566013258 /nfs/dbraw/zinc/01/32/58/566013258.db2.gz HZCDPCHVWXIDIP-SWLSCSKDSA-N 0 3 382.423 3.080 10 0 GGAEHN Cc1c(I)cccc1C(=O)N[C@@H]1CN(C(C)C)C[C@H]1C ZINC000245995471 566013446 /nfs/dbraw/zinc/01/34/46/566013446.db2.gz HLXIUKPSFSSZJH-IAQYHMDHSA-N 0 3 386.277 3.058 10 0 GGAEHN O=C(Nc1nc2c(cccc2Br)s1)N[C@@H]1CNCCC1(F)F ZINC000415712494 566014484 /nfs/dbraw/zinc/01/44/84/566014484.db2.gz VCZDMWXBMMSDDV-SECBINFHSA-N 0 3 391.241 3.178 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)Cc2cccc(C(F)(F)F)c2)[C@@H](C)C1 ZINC000246056849 566014928 /nfs/dbraw/zinc/01/49/28/566014928.db2.gz CZVXRUXVEDRKOA-BBRMVZONSA-N 0 3 378.460 3.197 10 0 GGAEHN O=C(Nc1cccc2cc(Br)cnc21)N[C@@H]1CNCCC1(F)F ZINC000415721157 566015362 /nfs/dbraw/zinc/01/53/62/566015362.db2.gz JKTCXPLXIGSPMC-GFCCVEGCSA-N 0 3 385.212 3.116 10 0 GGAEHN C[C@H](CN1CCC[C@H](C(=O)N2CCOCC2)C1)c1cccc(Br)c1 ZINC000179894504 566015881 /nfs/dbraw/zinc/01/58/81/566015881.db2.gz DFAXTLVOPIQQQU-WBVHZDCISA-N 0 3 395.341 3.123 10 0 GGAEHN CCOc1cc(Br)c(F)cc1NC(=O)N[C@H]1CNCCC1(F)F ZINC000415743749 566016792 /nfs/dbraw/zinc/01/67/92/566016792.db2.gz KSAKIOFBXHCGFT-LBPRGKRZSA-N 0 3 396.207 3.106 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(C)cc2Br)[C@@H](C)C1 ZINC000246135562 566018438 /nfs/dbraw/zinc/01/84/38/566018438.db2.gz JWLTUQQSKAVLQR-DZGCQCFKSA-N 0 3 389.359 3.108 10 0 GGAEHN CC[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc(F)cc1C(F)(F)F ZINC000246135460 566018572 /nfs/dbraw/zinc/01/85/72/566018572.db2.gz JVPMVFVTJLLXMY-OLZOCXBDSA-N 0 3 380.407 3.092 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(C)cc2Br)[C@@H](C)C1 ZINC000246135574 566018908 /nfs/dbraw/zinc/01/89/08/566018908.db2.gz JWLTUQQSKAVLQR-ZFWWWQNUSA-N 0 3 389.359 3.108 10 0 GGAEHN CNCc1ccccc1NC(=O)N1CCC(n2cc(Br)cn2)CC1 ZINC000415903536 566021124 /nfs/dbraw/zinc/02/11/24/566021124.db2.gz ADRQVGXUAMBETB-UHFFFAOYSA-N 0 3 392.301 3.234 10 0 GGAEHN Brc1ccc2c(c1)[C@H](NC[C@@H]1COC3(CCOCC3)O1)CCCO2 ZINC000179979237 566023220 /nfs/dbraw/zinc/02/32/20/566023220.db2.gz ABBYXFDYDFKYOL-GDBMZVCRSA-N 0 3 398.297 3.175 10 0 GGAEHN Cc1cc(S(=O)(=O)N2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)c(Cl)cc1F ZINC000246256256 566023719 /nfs/dbraw/zinc/02/37/19/566023719.db2.gz FVMKKDVETITROC-SUMWQHHRSA-N 0 3 386.920 3.425 10 0 GGAEHN Cc1cc(S(=O)(=O)N2CC[C@H]3[C@@H](CCCN3C3CC3)C2)c(Cl)cc1F ZINC000246256249 566024389 /nfs/dbraw/zinc/02/43/89/566024389.db2.gz FVMKKDVETITROC-GUYCJALGSA-N 0 3 386.920 3.425 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(Br)sc2C)[C@@H](C)C1 ZINC000246312518 566025178 /nfs/dbraw/zinc/02/51/78/566025178.db2.gz WHYQOXWYKLQIEJ-CMPLNLGQSA-N 0 3 395.388 3.170 10 0 GGAEHN C[C@H]1CN2CCC[C@H]2CN1Cc1nc(-c2ccc(Br)s2)no1 ZINC000246303642 566025263 /nfs/dbraw/zinc/02/52/63/566025263.db2.gz CKEGYXGSNHRKAD-QWRGUYRKSA-N 0 3 383.315 3.229 10 0 GGAEHN CCN(CC)[C@@H](CN[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccsc1 ZINC000180014877 566025489 /nfs/dbraw/zinc/02/54/89/566025489.db2.gz LRRINLOMSCYALP-KSSFIOAISA-N 0 3 381.567 3.129 10 0 GGAEHN CC[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1cccc(C)c1Br ZINC000246366150 566027280 /nfs/dbraw/zinc/02/72/80/566027280.db2.gz YTKGOBDUQSAKGN-KBPBESRZSA-N 0 3 387.343 3.005 10 0 GGAEHN C[C@H](NC[C@H](O)c1cc(Cl)cc(Cl)c1)c1ccc(S(N)(=O)=O)cc1 ZINC000180123217 566034024 /nfs/dbraw/zinc/03/40/24/566034024.db2.gz JDRGJUNHDVRVFI-QFYYESIMSA-N 0 3 389.304 3.025 10 0 GGAEHN CN(Cc1cc(Br)ccc1F)C(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C ZINC000364123106 566035820 /nfs/dbraw/zinc/03/58/20/566035820.db2.gz VRIKEWORJQFTOT-DHSIGJKJSA-N 0 3 399.304 3.079 10 0 GGAEHN CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)N1CCc2cc(Cl)cc(Cl)c2C1 ZINC000364221982 566039345 /nfs/dbraw/zinc/03/93/45/566039345.db2.gz QKVRVQFGSBIDKD-OGWOLHLISA-N 0 3 383.319 3.411 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N(C)[C@H]1CCN(C)C[C@H]1C ZINC000246753294 566040222 /nfs/dbraw/zinc/04/02/22/566040222.db2.gz ZOFCRKUNBCOGQP-CPUCHLNUSA-N 0 3 382.346 3.362 10 0 GGAEHN COc1c(Br)c(C)sc1C(=O)N[C@@H]1CN(C(C)C)C[C@H]1C ZINC000246782257 566040764 /nfs/dbraw/zinc/04/07/64/566040764.db2.gz CLFPIGZHGZMRTP-MWLCHTKSSA-N 0 3 375.332 3.286 10 0 GGAEHN O=C(CC[N@@H+]1CCc2ccccc2C1)NCc1ccc([O-])c(Br)c1 ZINC000416176996 566041367 /nfs/dbraw/zinc/04/13/67/566041367.db2.gz KSMNBPQUZZPPAX-UHFFFAOYSA-N 0 3 389.293 3.219 10 0 GGAEHN O=C(CC[N@H+]1CCc2ccccc2C1)NCc1ccc([O-])c(Br)c1 ZINC000416176996 566041370 /nfs/dbraw/zinc/04/13/70/566041370.db2.gz KSMNBPQUZZPPAX-UHFFFAOYSA-N 0 3 389.293 3.219 10 0 GGAEHN CN(C)[C@@H](CC(=O)N[C@H](CO)c1cccc(Br)c1)c1ccccc1 ZINC000416189546 566042545 /nfs/dbraw/zinc/04/25/45/566042545.db2.gz KWBVGDQGUBNZBB-MSOLQXFVSA-N 0 3 391.309 3.292 10 0 GGAEHN C[C@@H]1CN2CCC[C@H]2CN1Cc1nc(Cc2cccc(Br)c2)no1 ZINC000246809606 566043187 /nfs/dbraw/zinc/04/31/87/566043187.db2.gz CBERCYMUCLCDIV-CJNGLKHVSA-N 0 3 391.313 3.091 10 0 GGAEHN O=S(=O)(C[C@H](O)CN[C@H](c1ccc(Cl)cc1)C1CC1)c1cccs1 ZINC000180201882 566044156 /nfs/dbraw/zinc/04/41/56/566044156.db2.gz YGDJDSKVFKYERK-WBVHZDCISA-N 0 3 385.938 3.277 10 0 GGAEHN C[C@@H](NC[C@@](C)(O)c1ccc(S(C)(=O)=O)cc1)c1ccc(F)c(Cl)c1 ZINC000180246159 566048051 /nfs/dbraw/zinc/04/80/51/566048051.db2.gz XNDKPJPUYZVNFF-KZULUSFZSA-N 0 3 385.888 3.441 10 0 GGAEHN C[C@H](NC(=O)C[C@H](c1ccccc1)N(C)C)c1ncc(Br)cn1 ZINC000416240291 566048453 /nfs/dbraw/zinc/04/84/53/566048453.db2.gz NAFJBZKSKKTDIT-SWLSCSKDSA-N 0 3 377.286 3.109 10 0 GGAEHN COc1cc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)cc(OC)c1Br ZINC000246976786 566048758 /nfs/dbraw/zinc/04/87/58/566048758.db2.gz XYZHGJGKJSOPAE-GXTWGEPZSA-N 0 3 397.313 3.023 10 0 GGAEHN COc1cc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)cc(OC)c1Br ZINC000246976822 566048885 /nfs/dbraw/zinc/04/88/85/566048885.db2.gz XYZHGJGKJSOPAE-JSGCOSHPSA-N 0 3 397.313 3.023 10 0 GGAEHN Cc1ccc(I)c(C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c1 ZINC000247086499 566051260 /nfs/dbraw/zinc/05/12/60/566051260.db2.gz JJCHVKNNXYBQII-IUODEOHRSA-N 0 3 386.277 3.058 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)NCc2cc(F)c(F)cc2Br)CCN1C ZINC000288010073 566052472 /nfs/dbraw/zinc/05/24/72/566052472.db2.gz BPXVUMWLTDFLHA-CMPLNLGQSA-N 0 3 390.272 3.351 10 0 GGAEHN Cc1ccc(C(=O)N(C)[C@H]2CCN(C)C[C@H]2C)cc1I ZINC000247155935 566052973 /nfs/dbraw/zinc/05/29/73/566052973.db2.gz AGZGVCLLXXIYQC-DOMZBBRYSA-N 0 3 386.277 3.012 10 0 GGAEHN CN1CCC(N(Cc2ccco2)C(=O)c2ncsc2Br)CC1 ZINC000288095434 566056801 /nfs/dbraw/zinc/05/68/01/566056801.db2.gz UCGYXRFYKSWHJR-UHFFFAOYSA-N 0 3 384.299 3.235 10 0 GGAEHN Cc1sc2ncnc(SCC(=O)N[C@H]3CN(C(C)C)C[C@H]3C)c2c1C ZINC000247438658 566059949 /nfs/dbraw/zinc/05/99/49/566059949.db2.gz RVJFBDKGOSWQJS-RISCZKNCSA-N 0 3 378.567 3.245 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1OC ZINC000247392114 566060075 /nfs/dbraw/zinc/06/00/75/566060075.db2.gz MBDMBVRVLOKSRX-GXTWGEPZSA-N 0 3 399.329 3.411 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)cc1OC ZINC000247474008 566061835 /nfs/dbraw/zinc/06/18/35/566061835.db2.gz RYNLRVLATSQIOL-OCCSQVGLSA-N 0 3 397.313 3.165 10 0 GGAEHN COc1ccc([C@H](C)NC(=O)N2CCN3CCC[C@H]3C2)cc1Br ZINC000247505803 566061889 /nfs/dbraw/zinc/06/18/89/566061889.db2.gz OMTOZPUJDZYZQI-JSGCOSHPSA-N 0 3 382.302 3.008 10 0 GGAEHN O=C(c1ccc(Br)cc1C(F)(F)F)N1CCN2CCC[C@@H]2C1 ZINC000180449186 566062658 /nfs/dbraw/zinc/06/26/58/566062658.db2.gz HWXMBHYPMUNJIB-LLVKDONJSA-N 0 3 377.204 3.388 10 0 GGAEHN C[C@H](CS(C)(=O)=O)N[C@@H]1CCN(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000180447980 566062989 /nfs/dbraw/zinc/06/29/89/566062989.db2.gz KEXKPFKOZJSZAL-CSMYWGQOSA-N 0 3 390.952 3.416 10 0 GGAEHN Cc1cc(C(=O)N2CCN3CCC[C@@H]3C2)nn1-c1ccc(Cl)cc1Cl ZINC000180449309 566063114 /nfs/dbraw/zinc/06/31/14/566063114.db2.gz QPXSKAUQVPZLOW-CQSZACIVSA-N 0 3 379.291 3.408 10 0 GGAEHN C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000247566030 566064470 /nfs/dbraw/zinc/06/44/70/566064470.db2.gz ZZJGXVAUTUJCQS-AVGNSLFASA-N 0 3 386.323 3.053 10 0 GGAEHN CC[C@@H]1CN(CCC(=O)Nc2cc(Cl)ccc2Cl)CCN1C[C@H](C)O ZINC000247806776 566066815 /nfs/dbraw/zinc/06/68/15/566066815.db2.gz SVWNYZDULMDBGR-DZGCQCFKSA-N 0 3 388.339 3.099 10 0 GGAEHN CC[C@H]1CN(CCC(=O)Nc2cc(Cl)ccc2Cl)CCN1C[C@H](C)O ZINC000247806778 566066852 /nfs/dbraw/zinc/06/68/52/566066852.db2.gz SVWNYZDULMDBGR-ZFWWWQNUSA-N 0 3 388.339 3.099 10 0 GGAEHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cc(Br)cc2nc[nH]c21 ZINC000288302160 566067456 /nfs/dbraw/zinc/06/74/56/566067456.db2.gz IDUMSTBEQPYTPE-DGCLKSJQSA-N 0 3 377.286 3.024 10 0 GGAEHN Cc1n[nH]c(C)c1[C@H]1CCCN1C[C@H](O)COc1cccc(Br)c1 ZINC000180526933 566070151 /nfs/dbraw/zinc/07/01/51/566070151.db2.gz BYGYMAYPWJMXKV-DOTOQJQBSA-N 0 3 394.313 3.366 10 0 GGAEHN C[C@H](c1cccc(Br)c1)N1CCC[C@@H](C(=O)N2CCOCC2)C1 ZINC000248005383 566071006 /nfs/dbraw/zinc/07/10/06/566071006.db2.gz KUAVDWKLEVNGQI-GDBMZVCRSA-N 0 3 381.314 3.081 10 0 GGAEHN C[C@H](CS(C)(=O)=O)N[C@H]1CCN(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000248385850 566076056 /nfs/dbraw/zinc/07/60/56/566076056.db2.gz KEXKPFKOZJSZAL-DQYPLSBCSA-N 0 3 390.952 3.416 10 0 GGAEHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)c1n[nH]c2ccc(Br)cc21 ZINC000288511449 566078028 /nfs/dbraw/zinc/07/80/28/566078028.db2.gz STDXVWRAQDADEW-AAEUAGOBSA-N 0 3 377.286 3.024 10 0 GGAEHN C[C@H](CN(C)C[C@@H](O)COc1cccc(Br)c1)c1nccs1 ZINC000248473997 566079807 /nfs/dbraw/zinc/07/98/07/566079807.db2.gz WYBUTTGURGLTNM-TZMCWYRMSA-N 0 3 385.327 3.381 10 0 GGAEHN O=C1[C@H]2CN(Cc3ccccc3)C[C@H]2C(=O)N1Cc1cccc(Br)c1 ZINC000180731061 566083580 /nfs/dbraw/zinc/08/35/80/566083580.db2.gz GUKHMMXJWLZBBO-HDICACEKSA-N 0 3 399.288 3.066 10 0 GGAEHN COCCN(C)CCNC(=O)[C@@H]1CCCO[C@H]1c1ccc(Cl)cc1Cl ZINC000248612872 566083864 /nfs/dbraw/zinc/08/38/64/566083864.db2.gz YCHNSJLWRADJRE-WBVHZDCISA-N 0 3 389.323 3.156 10 0 GGAEHN Cn1nc(Br)cc1C(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1 ZINC000248672717 566084858 /nfs/dbraw/zinc/08/48/58/566084858.db2.gz RHRZJZSPLGWJTI-XHDPSFHLSA-N 0 3 397.342 3.057 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(SC)c(Cl)c2)[C@@H](C)C1 ZINC000248650174 566085041 /nfs/dbraw/zinc/08/50/41/566085041.db2.gz RZSOVZGRCZDKSG-SWLSCSKDSA-N 0 3 376.975 3.413 10 0 GGAEHN O=C(NCCCN1CCc2ccccc2C1)c1ncsc1Br ZINC000288698952 566086097 /nfs/dbraw/zinc/08/60/97/566086097.db2.gz RMWODEBZRRYROL-UHFFFAOYSA-N 0 3 380.311 3.084 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CCN2CCC[C@H]2C1 ZINC000248698533 566086528 /nfs/dbraw/zinc/08/65/28/566086528.db2.gz LYWFAOVMUXHARM-JSGCOSHPSA-N 0 3 382.302 3.008 10 0 GGAEHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1ncsc1Br ZINC000288687625 566087004 /nfs/dbraw/zinc/08/70/04/566087004.db2.gz QVSMNIGIGRVFSR-ZDUSSCGKSA-N 0 3 380.311 3.473 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CCN2CCC[C@H]2C1 ZINC000248698536 566087047 /nfs/dbraw/zinc/08/70/47/566087047.db2.gz LYWFAOVMUXHARM-OCCSQVGLSA-N 0 3 382.302 3.008 10 0 GGAEHN O=C(NC1CCN(CCc2ccccc2)CC1)c1ncsc1Br ZINC000288761163 566090227 /nfs/dbraw/zinc/09/02/27/566090227.db2.gz WXKYPVGLYJNYAK-UHFFFAOYSA-N 0 3 394.338 3.343 10 0 GGAEHN CC(C(=O)N1C[C@H](C)C[C@H](C)C1)S(=O)(=O)Cc1csc(C(C)(C)C)n1 ZINC000248863551 566091892 /nfs/dbraw/zinc/09/18/92/566091892.db2.gz XSIKPRNTJNPQNT-MJBXVCDLSA-N 0 3 386.583 3.248 10 0 GGAEHN COC(=O)c1cccc(NC(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c1Br ZINC000248981443 566094684 /nfs/dbraw/zinc/09/46/84/566094684.db2.gz FPKIBFWUBVLPIY-BXUZGUMPSA-N 0 3 398.301 3.086 10 0 GGAEHN C[C@H](C(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1)N(C)CC(F)(F)F ZINC000249158029 566097928 /nfs/dbraw/zinc/09/79/28/566097928.db2.gz XPWXTVMAYSDLHP-UMVBOHGHSA-N 0 3 377.476 3.130 10 0 GGAEHN CC[C@@H](CN(C)C[C@@H](O)CN1CCCC1=O)Oc1ccc(Cl)c(Cl)c1 ZINC000249284320 566099945 /nfs/dbraw/zinc/09/99/45/566099945.db2.gz LINMJVSKQWFXLO-KGLIPLIRSA-N 0 3 389.323 3.066 10 0 GGAEHN Cc1csc(C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c1I ZINC000249390903 566101229 /nfs/dbraw/zinc/10/12/29/566101229.db2.gz RWVGXHOVADWOBP-MWLCHTKSSA-N 0 3 392.306 3.120 10 0 GGAEHN CC[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc(CC(F)(F)F)cc1 ZINC000249395447 566101254 /nfs/dbraw/zinc/10/12/54/566101254.db2.gz GUAAHRZCNRELMQ-CABCVRRESA-N 0 3 376.444 3.039 10 0 GGAEHN COCc1nc2n(n1)C[C@@H](N[C@H](C)c1ccc(Br)c(C)c1)CC2 ZINC000180940129 566101503 /nfs/dbraw/zinc/10/15/03/566101503.db2.gz CGUNUODRRCZRGM-OCCSQVGLSA-N 0 3 379.302 3.161 10 0 GGAEHN CN1CCO[C@H](CN[C@H](c2ccccc2)c2ccc(Br)cc2)C1 ZINC000249428102 566101603 /nfs/dbraw/zinc/10/16/03/566101603.db2.gz ICRTYELWIXRIGJ-RTBURBONSA-N 0 3 375.310 3.459 10 0 GGAEHN CN1CCO[C@@H](CN[C@H](c2ccccc2)c2ccc(Br)cc2)C1 ZINC000249428098 566101903 /nfs/dbraw/zinc/10/19/03/566101903.db2.gz ICRTYELWIXRIGJ-RBUKOAKNSA-N 0 3 375.310 3.459 10 0 GGAEHN CC[C@@H](Cc1ccccc1Br)N(C)C[C@H](C)CS(C)(=O)=O ZINC000249443470 566102431 /nfs/dbraw/zinc/10/24/31/566102431.db2.gz MRMBECHRMDQNHJ-ZFWWWQNUSA-N 0 3 376.360 3.383 10 0 GGAEHN C[C@H]1SCCN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)[C@@H]1C ZINC000365547435 566107593 /nfs/dbraw/zinc/10/75/93/566107593.db2.gz OKLCNFXOCOGBDH-HGWMRPEMSA-N 0 3 379.492 3.327 10 0 GGAEHN CN1CCC(Cc2nc(CC(=O)Nc3cc(Cl)ccc3Cl)no2)CC1 ZINC000289140580 566107768 /nfs/dbraw/zinc/10/77/68/566107768.db2.gz MQWXYZLTXHBPAN-UHFFFAOYSA-N 0 3 383.279 3.442 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N1CCC[C@H]2CN(C)CC[C@@H]21 ZINC000251994919 566113068 /nfs/dbraw/zinc/11/30/68/566113068.db2.gz VPOQUHGLIMLZAT-HOCLYGCPSA-N 0 3 396.329 3.083 10 0 GGAEHN CCN1CCC[C@H]1CNC(=S)N[C@H]1CCOc2ccc(Br)cc21 ZINC000252458627 566114008 /nfs/dbraw/zinc/11/40/08/566114008.db2.gz YAULMRJFSSUCQG-ZFWWWQNUSA-N 0 3 398.370 3.221 10 0 GGAEHN C[C@H]1CCCN(CCNC(=O)N[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000252475207 566114211 /nfs/dbraw/zinc/11/42/11/566114211.db2.gz VXXVKZPHPGHKPV-BBRMVZONSA-N 0 3 396.329 3.304 10 0 GGAEHN CCN1CCC[C@@H](NC(=O)N[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000252474549 566114290 /nfs/dbraw/zinc/11/42/90/566114290.db2.gz HKNPPRQEXQHMAO-HIFRSBDPSA-N 0 3 382.302 3.056 10 0 GGAEHN CCN1CCC[C@H](NC(=O)N[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000252474550 566114652 /nfs/dbraw/zinc/11/46/52/566114652.db2.gz HKNPPRQEXQHMAO-ZFWWWQNUSA-N 0 3 382.302 3.056 10 0 GGAEHN CC[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1cc(C)ccc1Br ZINC000252736264 566117435 /nfs/dbraw/zinc/11/74/35/566117435.db2.gz TVIFIIWCXLNIJZ-KGLIPLIRSA-N 0 3 387.343 3.005 10 0 GGAEHN CC(C)N1C[C@H](C)[C@H](NC(=O)c2cc(=O)[nH]c3ccc(Br)cc32)C1 ZINC000253552296 566119879 /nfs/dbraw/zinc/11/98/79/566119879.db2.gz BHVJGQGSFKWGOP-MEDUHNTESA-N 0 3 392.297 3.161 10 0 GGAEHN CCN1CCC[C@@H]1CN(Cc1c(Br)cnn1C)Cc1ccncc1 ZINC000289373981 566120293 /nfs/dbraw/zinc/12/02/93/566120293.db2.gz BOINRHNUKOXKLB-MRXNPFEDSA-N 0 3 392.345 3.064 10 0 GGAEHN Cc1nc2ccccn2c(=O)c1CCN[C@H](C)c1ccc(Br)cn1 ZINC000289406445 566121729 /nfs/dbraw/zinc/12/17/29/566121729.db2.gz OTSJDPWLQGGCDW-CYBMUJFWSA-N 0 3 387.281 3.054 10 0 GGAEHN O=C(c1coc(-c2ccc(Br)cc2F)n1)N1CCN2CCC[C@@H]2C1 ZINC000181215130 566124741 /nfs/dbraw/zinc/12/47/41/566124741.db2.gz AZGYSNZAPLVPEK-GFCCVEGCSA-N 0 3 394.244 3.163 10 0 GGAEHN O=C(c1coc(-c2ccc(Br)cc2F)n1)N1CCN2CCC[C@H]2C1 ZINC000181215152 566125127 /nfs/dbraw/zinc/12/51/27/566125127.db2.gz AZGYSNZAPLVPEK-LBPRGKRZSA-N 0 3 394.244 3.163 10 0 GGAEHN [NH3+]C1(C[N-]S(=O)(=O)c2c(Cl)cccc2Br)CCCCC1 ZINC000261621511 566126246 /nfs/dbraw/zinc/12/62/46/566126246.db2.gz AEGHQDMDXKANDA-UHFFFAOYSA-N 0 3 381.723 3.042 10 0 GGAEHN C[C@H](NC(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C)c1ccccc1Br ZINC000261644744 566127194 /nfs/dbraw/zinc/12/71/94/566127194.db2.gz FFIWZLGWGPELPR-MCTKYDIJSA-N 0 3 381.314 3.159 10 0 GGAEHN NC1(C(=O)Nc2ccc(Oc3cccc(Br)c3)nc2)CCOCC1 ZINC000261665518 566127253 /nfs/dbraw/zinc/12/72/53/566127253.db2.gz BKKRPNWVMAHGPY-UHFFFAOYSA-N 0 3 392.253 3.083 10 0 GGAEHN CCNC(=O)N1CC[C@H](N[C@H]2CCCOc3ccc(Br)cc32)C1 ZINC000181329414 566132237 /nfs/dbraw/zinc/13/22/37/566132237.db2.gz FBAGAHCBUSOUNR-ZFWWWQNUSA-N 0 3 382.302 3.056 10 0 GGAEHN C[C@](N)(C(=O)Nc1ccc2c(c1F)CCNC2)c1ccc(Br)cc1 ZINC000261748200 566132705 /nfs/dbraw/zinc/13/27/05/566132705.db2.gz IVQFHFIGDUWAJI-GOSISDBHSA-N 0 3 392.272 3.047 10 0 GGAEHN CCNC(=O)N1CC[C@@H](N[C@H]2CCSc3ccc(Br)cc32)C1 ZINC000181335283 566133777 /nfs/dbraw/zinc/13/37/77/566133777.db2.gz YBVXGEOSGREYFO-OCCSQVGLSA-N 0 3 384.343 3.379 10 0 GGAEHN CO[C@@H](c1noc(CC2CCN(C)CC2)n1)c1ccc(Br)cc1 ZINC000289663480 566134331 /nfs/dbraw/zinc/13/43/31/566134331.db2.gz KLALXCCXSJTGMF-MRXNPFEDSA-N 0 3 380.286 3.452 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C ZINC000261786752 566134750 /nfs/dbraw/zinc/13/47/50/566134750.db2.gz YLMJXUOGQWKQMO-ZSKVKKPNSA-N 0 3 395.341 3.029 10 0 GGAEHN COCCOc1c(Cl)cc(NC(=O)N2CCN3CCC[C@H]3C2)cc1Cl ZINC000181457691 566142019 /nfs/dbraw/zinc/14/20/19/566142019.db2.gz DEQPNCANBWFBKG-ZDUSSCGKSA-N 0 3 388.295 3.331 10 0 GGAEHN CSC[C@H]1CCCN1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 ZINC000366228837 566143199 /nfs/dbraw/zinc/14/31/99/566143199.db2.gz HQHJYHSAHZNUBR-SHARSMKWSA-N 0 3 379.492 3.329 10 0 GGAEHN Fc1cc(Br)cc(OCCN2CCNC[C@@H]2c2cccnc2)c1 ZINC000262114644 566147316 /nfs/dbraw/zinc/14/73/16/566147316.db2.gz KYAVGQSAYLMGQT-QGZVFWFLSA-N 0 3 380.261 3.009 10 0 GGAEHN C[C@@H](NCCNS(=O)(=O)c1cccs1)[C@@H](C)c1nc2ccccc2s1 ZINC000181532436 566147602 /nfs/dbraw/zinc/14/76/02/566147602.db2.gz ALMVPOZTUMHUAZ-CHWSQXEVSA-N 0 3 395.575 3.418 10 0 GGAEHN O=C(CCN1CCNC[C@H]1c1cccnc1)Nc1cc(Cl)ccc1Cl ZINC000262314036 566149535 /nfs/dbraw/zinc/14/95/35/566149535.db2.gz ZJRTUWREZDJYFY-KRWDZBQOSA-N 0 3 379.291 3.364 10 0 GGAEHN CN(Cc1cc(Br)cs1)C(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C ZINC000262401695 566152108 /nfs/dbraw/zinc/15/21/08/566152108.db2.gz CHGFFOQJBAQSSY-DVOMOZLQSA-N 0 3 387.343 3.002 10 0 GGAEHN COc1cc(-c2noc(-c3nc(Cl)cs3)n2)ccc1OCCN(C)C ZINC000290002608 566152757 /nfs/dbraw/zinc/15/27/57/566152757.db2.gz FUDGVJJUGRSABH-UHFFFAOYSA-N 0 3 380.857 3.463 10 0 GGAEHN CN(Cc1csc(Br)c1)C(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C ZINC000262451196 566153446 /nfs/dbraw/zinc/15/34/46/566153446.db2.gz HVYUUHWCVOJLOQ-PVXIVEMSSA-N 0 3 387.343 3.002 10 0 GGAEHN C[C@@H](NCCC(=O)N1CCN(C)CC1)c1cc2cc(Br)ccc2o1 ZINC000181686756 566157947 /nfs/dbraw/zinc/15/79/47/566157947.db2.gz VJYGFZOTLUSFPM-CYBMUJFWSA-N 0 3 394.313 3.010 10 0 GGAEHN C[C@H](CN[C@@H](C)c1cc2cc(Br)ccc2o1)N1CCN(C)CC1 ZINC000181702940 566159276 /nfs/dbraw/zinc/15/92/76/566159276.db2.gz SUAPOYCTEKDWAA-KGLIPLIRSA-N 0 3 380.330 3.482 10 0 GGAEHN CN1CC[C@@H]2[C@H](CCCN2S(=O)(=O)Cc2ccc(Cl)cc2Cl)C1 ZINC000181708282 566160488 /nfs/dbraw/zinc/16/04/88/566160488.db2.gz REFNORMFFJJEJS-MLGOLLRUSA-N 0 3 377.337 3.239 10 0 GGAEHN Cc1cc(Br)ccc1CNC(=O)NCCCNCc1cccnc1 ZINC000417575493 566161305 /nfs/dbraw/zinc/16/13/05/566161305.db2.gz FXXZAOPQKDLHFN-UHFFFAOYSA-N 0 3 391.313 3.132 10 0 GGAEHN O=C(Nc1n[nH]c2c1cccc2Cl)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000612703845 566171372 /nfs/dbraw/zinc/17/13/72/566171372.db2.gz CZYZWMUYYBMIPB-SCZZXKLOSA-N 0 3 377.750 3.139 10 0 GGAEHN N[C@H](CNC(=O)NCC1(c2ccccc2Br)CC1)c1ccccc1 ZINC000417723774 566173263 /nfs/dbraw/zinc/17/32/63/566173263.db2.gz CIGWBFSGZDPGLP-QGZVFWFLSA-N 0 3 388.309 3.480 10 0 GGAEHN FC(F)(F)C1CCN(C2CC(Nc3ncc(Br)cn3)C2)CC1 ZINC000366859830 566174182 /nfs/dbraw/zinc/17/41/82/566174182.db2.gz WIGVBJAHMGNBBH-UHFFFAOYSA-N 0 3 379.224 3.456 10 0 GGAEHN C[C@@H](N[C@@H](CC(N)=O)C1CCCCC1)C(=O)Nc1ccccc1Br ZINC000182070807 566180691 /nfs/dbraw/zinc/18/06/91/566180691.db2.gz AVWIWAYXZYQPKT-WBMJQRKESA-N 0 3 396.329 3.190 10 0 GGAEHN OC[C@@H](CNCc1ccc(F)cc1I)c1ccccc1 ZINC000417921689 566181703 /nfs/dbraw/zinc/18/17/03/566181703.db2.gz BLFPAHMAWGSHLK-CQSZACIVSA-N 0 3 385.220 3.296 10 0 GGAEHN Cc1cc(N2CCC[C@H](N[C@H](C)c3ccc(Br)nc3)C2)n(C)n1 ZINC000290628365 566182338 /nfs/dbraw/zinc/18/23/38/566182338.db2.gz IWPGVNBPPMCCRD-HIFRSBDPSA-N 0 3 378.318 3.206 10 0 GGAEHN CC(C)[C@H](NC[C@@H](O)CS(=O)(=O)c1cccs1)c1ccc(F)c(F)c1 ZINC000182164432 566186293 /nfs/dbraw/zinc/18/62/93/566186293.db2.gz BEJNOHVEFAWACO-DYVFJYSZSA-N 0 3 389.489 3.148 10 0 GGAEHN CN1CCN([C@H]2CCCCN(CCCc3ccccc3Br)C2)CC1 ZINC000182211056 566189720 /nfs/dbraw/zinc/18/97/20/566189720.db2.gz XMTHAOQUFIGCMD-IBGZPJMESA-N 0 3 394.401 3.484 10 0 GGAEHN Cc1ccc(Br)cc1CNC(=O)NCCCNCc1cccnc1 ZINC000418052663 566193416 /nfs/dbraw/zinc/19/34/16/566193416.db2.gz XHSSSPIMZMNXCC-UHFFFAOYSA-N 0 3 391.313 3.132 10 0 GGAEHN C[C@@H](NC(=O)N1CC[C@@H](N2CC=CC2)C1)c1ccc(Br)cc1F ZINC000291001043 566200685 /nfs/dbraw/zinc/20/06/85/566200685.db2.gz SVLSKRKAZZXTGM-TZMCWYRMSA-N 0 3 382.277 3.305 10 0 GGAEHN COCC[C@@H](NC(=O)N[C@@H]1CNCCC1(F)F)c1ccc(Cl)c(Cl)c1 ZINC000418172411 566202744 /nfs/dbraw/zinc/20/27/44/566202744.db2.gz RPHJVADHQTWUOQ-ZIAGYGMSSA-N 0 3 396.265 3.367 10 0 GGAEHN OC[C@H](NC1CCN(CCC(F)(F)F)CC1)c1cccc(Br)c1 ZINC000291068750 566203882 /nfs/dbraw/zinc/20/38/82/566203882.db2.gz DXFQKTQIMDNGGW-HNNXBMFYSA-N 0 3 395.263 3.489 10 0 GGAEHN CN(CCc1ccc(Br)cc1)C(=O)NC[C@@H](N)c1ccccc1 ZINC000418406126 566212119 /nfs/dbraw/zinc/21/21/19/566212119.db2.gz BSKYEQTVKZCBCU-QGZVFWFLSA-N 0 3 376.298 3.333 10 0 GGAEHN N[C@H](CNC(=O)N1CCc2c(F)ccc(Br)c2C1)c1ccccc1 ZINC000418453818 566212932 /nfs/dbraw/zinc/21/29/32/566212932.db2.gz PQGMAOCQKACWEL-QGZVFWFLSA-N 0 3 392.272 3.356 10 0 GGAEHN CN(CCOc1ccc(Br)cc1)C(=O)NC[C@@H](N)c1ccccc1 ZINC000418427730 566213100 /nfs/dbraw/zinc/21/31/00/566213100.db2.gz LQNWGSRSWUNQFG-QGZVFWFLSA-N 0 3 392.297 3.169 10 0 GGAEHN N[C@H](CNC(=O)N[C@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000418425325 566213188 /nfs/dbraw/zinc/21/31/88/566213188.db2.gz HYWWEPZHGWUOEZ-IAGOWNOFSA-N 0 3 382.291 3.416 10 0 GGAEHN N[C@@H](CNC(=O)N1CCc2c(Br)ccc(F)c2C1)c1ccccc1 ZINC000418434426 566213373 /nfs/dbraw/zinc/21/33/73/566213373.db2.gz VKEPECHLSCTVQD-KRWDZBQOSA-N 0 3 392.272 3.356 10 0 GGAEHN N[C@@H](CNC(=O)N[C@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000418425324 566213569 /nfs/dbraw/zinc/21/35/69/566213569.db2.gz HYWWEPZHGWUOEZ-DLBZAZTESA-N 0 3 382.291 3.416 10 0 GGAEHN COC(=O)c1cc(NC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)ccc1Br ZINC000182626720 566215882 /nfs/dbraw/zinc/21/58/82/566215882.db2.gz WWHIVYRJQZQCGW-DGCLKSJQSA-N 0 3 398.301 3.182 10 0 GGAEHN COC(=O)c1cc(NC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)ccc1Br ZINC000182626760 566216142 /nfs/dbraw/zinc/21/61/42/566216142.db2.gz WWHIVYRJQZQCGW-YPMHNXCESA-N 0 3 398.301 3.182 10 0 GGAEHN COCCCN(C(=O)c1csc(Br)c1)C1CCN(C)CC1 ZINC000291362767 566216840 /nfs/dbraw/zinc/21/68/40/566216840.db2.gz YVCDLCISOSVOIQ-UHFFFAOYSA-N 0 3 375.332 3.084 10 0 GGAEHN COc1ccc([C@@H](C)C[NH2+]CC[N-]S(=O)(=O)c2ccc(Cl)s2)cc1 ZINC000182651878 566217450 /nfs/dbraw/zinc/21/74/50/566217450.db2.gz YZHQPDNQWKZRSY-LBPRGKRZSA-N 0 3 388.942 3.082 10 0 GGAEHN Cn1cnnc1Sc1ccc(NC(=O)CC2CCN(C)CC2)cc1Cl ZINC000291455344 566220687 /nfs/dbraw/zinc/22/06/87/566220687.db2.gz HNXRMJJAPWDHNY-UHFFFAOYSA-N 0 3 379.917 3.290 10 0 GGAEHN OC[C@@H](CN[C@H]1CCCOc2cc(Br)ccc21)c1cccnc1 ZINC000367896491 566222424 /nfs/dbraw/zinc/22/24/24/566222424.db2.gz AZSDUGNUHNEPCA-PBHICJAKSA-N 0 3 377.282 3.424 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)N1CCc2sccc2[C@@H]1c1cccs1 ZINC000418749202 566222501 /nfs/dbraw/zinc/22/25/01/566222501.db2.gz LYKCWOLOKCEJIE-LSDHHAIUSA-N 0 3 383.489 3.464 10 0 GGAEHN C[C@H](c1ccccc1Br)N(C)C(=O)N[C@H]1CNCCC1(F)F ZINC000418775931 566223214 /nfs/dbraw/zinc/22/32/14/566223214.db2.gz WQVBSRZDBUIUNQ-MFKMUULPSA-N 0 3 376.245 3.149 10 0 GGAEHN Clc1ccc2c(c1)nccc2SCCN1CC[C@H](N2CCOCC2)C1 ZINC000182811652 566225418 /nfs/dbraw/zinc/22/54/18/566225418.db2.gz FFGBMASCTUGJPM-INIZCTEOSA-N 0 3 377.941 3.387 10 0 GGAEHN CN1CC[C@H](NCC(=O)Nc2cccnc2Cl)[C@H]1c1ccc(Cl)cc1 ZINC000368064168 566228694 /nfs/dbraw/zinc/22/86/94/566228694.db2.gz OWOIRDPZZXWSEN-WMLDXEAASA-N 0 3 379.291 3.362 10 0 GGAEHN C[C@H](NC(=O)N1CC[C@@H](N2CC=CC2)C1)c1ccc(Br)cc1F ZINC000291751972 566233091 /nfs/dbraw/zinc/23/30/91/566233091.db2.gz SVLSKRKAZZXTGM-GXTWGEPZSA-N 0 3 382.277 3.305 10 0 GGAEHN CN1CCN(c2ncc(CN[C@H]3CCCc4sc(Cl)cc43)cn2)CC1 ZINC000291779511 566234460 /nfs/dbraw/zinc/23/44/60/566234460.db2.gz UQZWNXSIIBMNSJ-HNNXBMFYSA-N 0 3 377.945 3.111 10 0 GGAEHN Cn1ccnc1CN(Cc1ccccc1Br)C1CCN(C)CC1 ZINC000368665731 566243885 /nfs/dbraw/zinc/24/38/85/566243885.db2.gz ICOHPIZDJJJTBY-UHFFFAOYSA-N 0 3 377.330 3.279 10 0 GGAEHN CN1CCC[C@H](CNC(=O)N2CCc3ncsc3C2)[C@H]1c1cccs1 ZINC000368680285 566244390 /nfs/dbraw/zinc/24/43/90/566244390.db2.gz KYGPBDNJRFHOIB-DYVFJYSZSA-N 0 3 376.551 3.355 10 0 GGAEHN O=C(CN1CCCC12CCC2)N1CCN(c2ncc(Cl)cc2Cl)CC1 ZINC000444787184 566251261 /nfs/dbraw/zinc/25/12/61/566251261.db2.gz QGEBWLAUZCANKF-UHFFFAOYSA-N 0 3 383.323 3.056 10 0 GGAEHN CN(C)[C@]1(CNC(=O)Nc2cccc(OCC(F)(F)F)c2)CCSC1 ZINC000481777370 566252645 /nfs/dbraw/zinc/25/26/45/566252645.db2.gz JLZZVCDXFMKOSN-HNNXBMFYSA-N 0 3 377.432 3.187 10 0 GGAEHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)c1[nH]nc2ccc(Br)cc21 ZINC000599352003 566255400 /nfs/dbraw/zinc/25/54/00/566255400.db2.gz HXAPGNYLYOWFOZ-NWDGAFQWSA-N 0 3 379.302 3.176 10 0 GGAEHN OCC1(CO)CCN(Cc2ccc(Oc3cccc(Br)c3)cc2)C1 ZINC000668665140 566255748 /nfs/dbraw/zinc/25/57/48/566255748.db2.gz GGAMNEGTOQFMJU-UHFFFAOYSA-N 0 3 392.293 3.418 10 0 GGAEHN CN(C)S(=O)(=O)CCN(C)[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000509028326 566256363 /nfs/dbraw/zinc/25/63/63/566256363.db2.gz GCQNPUCKAFDPNP-HOTGVXAUSA-N 0 3 378.460 3.165 10 0 GGAEHN CC[C@@H](Cc1ccccc1Br)N(C)Cc1cnc(C(=O)OC)cn1 ZINC000599370636 566256727 /nfs/dbraw/zinc/25/67/27/566256727.db2.gz HJVIAUCBWXJXNO-HNNXBMFYSA-N 0 3 392.297 3.479 10 0 GGAEHN CCOCCOc1ccc(Br)cc1CN1CC[C@@H]2COC[C@H]2C1 ZINC000668706251 566258197 /nfs/dbraw/zinc/25/81/97/566258197.db2.gz REWORSKVBBDEAO-GDBMZVCRSA-N 0 3 384.314 3.333 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1CC[C@@H]2COC[C@H]2C1 ZINC000668704053 566258232 /nfs/dbraw/zinc/25/82/32/566258232.db2.gz BORNWUMBMIPFPQ-GDBMZVCRSA-N 0 3 376.298 3.412 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)c1cc2c(cncc2Br)s1 ZINC000648299221 566259447 /nfs/dbraw/zinc/25/94/47/566259447.db2.gz HWNPAQOZNQLULZ-MFKMUULPSA-N 0 3 382.327 3.471 10 0 GGAEHN CCOc1cc(C[NH2+]CC2(CC(N)=O)CCCCC2)cc(Br)c1[O-] ZINC000668756721 566264405 /nfs/dbraw/zinc/26/44/05/566264405.db2.gz GIIOLSYZCCQNRE-UHFFFAOYSA-N 0 3 399.329 3.469 10 0 GGAEHN O[C@H](CN[C@H](c1cccnc1)C1CC1)COc1cccc(Br)c1 ZINC000556019372 566264744 /nfs/dbraw/zinc/26/47/44/566264744.db2.gz JLYWCXVPYBEKSS-AEFFLSMTSA-N 0 3 377.282 3.325 10 0 GGAEHN O=S(=O)(Cc1ccc(Cl)cc1Cl)NCC1CCN(C2CC2)CC1 ZINC000445068515 566266302 /nfs/dbraw/zinc/26/63/02/566266302.db2.gz XHUNNVVPWIBWFK-UHFFFAOYSA-N 0 3 377.337 3.287 10 0 GGAEHN O[C@@H](CN[C@H](c1cccnc1)C1CC1)COc1cccc(Br)c1 ZINC000556019375 566267108 /nfs/dbraw/zinc/26/71/08/566267108.db2.gz JLYWCXVPYBEKSS-WMZOPIPTSA-N 0 3 377.282 3.325 10 0 GGAEHN CSC[C@H](C)NC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1nccs1 ZINC000599535893 566272245 /nfs/dbraw/zinc/27/22/45/566272245.db2.gz RVFPMTZTSKWKQG-USXIJHARSA-N 0 3 375.563 3.226 10 0 GGAEHN COC(=O)[C@@]1(OC)CCN(CCSc2ccnc3cc(Cl)ccc32)C1 ZINC000599562571 566275770 /nfs/dbraw/zinc/27/57/70/566275770.db2.gz FXHGIPBJHGJCOX-GOSISDBHSA-N 0 3 380.897 3.244 10 0 GGAEHN COC(=O)[C@]1(OC)CCN(CCSc2ccnc3cc(Cl)ccc32)C1 ZINC000599562572 566275872 /nfs/dbraw/zinc/27/58/72/566275872.db2.gz FXHGIPBJHGJCOX-SFHVURJKSA-N 0 3 380.897 3.244 10 0 GGAEHN CCc1ccccc1[C@@H](N)CNS(=O)(=O)Cc1ccc(Br)cc1 ZINC000420457790 566278355 /nfs/dbraw/zinc/27/83/55/566278355.db2.gz IFRGLBXMWNTUFV-KRWDZBQOSA-N 0 3 397.338 3.131 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2sc(C)cc2Br)[C@H](C)C1 ZINC000462317642 566281068 /nfs/dbraw/zinc/28/10/68/566281068.db2.gz VRLWXPWMVRRNQH-ZWNOBZJWSA-N 0 3 395.388 3.170 10 0 GGAEHN O=C([C@@H]1CCCN(CCCc2c(Cl)cccc2Cl)C1)N1CCOCC1 ZINC000482078682 566281638 /nfs/dbraw/zinc/28/16/38/566281638.db2.gz GSUTUZAVLSKLTN-OAHLLOKOSA-N 0 3 385.335 3.497 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2sc(C)cc2Br)[C@H](C)C1 ZINC000462317639 566281683 /nfs/dbraw/zinc/28/16/83/566281683.db2.gz VRLWXPWMVRRNQH-MFKMUULPSA-N 0 3 395.388 3.170 10 0 GGAEHN COC(=O)c1cnc(CN2C[C@H](c3ccc(Br)cc3)C[C@@H]2C)cn1 ZINC000599651919 566282813 /nfs/dbraw/zinc/28/28/13/566282813.db2.gz IIGDQJCSVXXJGZ-GXTWGEPZSA-N 0 3 390.281 3.404 10 0 GGAEHN OCCn1ncc2c1CCC[C@@H]2N[C@@H]1CCc2c1ccc(F)c2Br ZINC000648434167 566284648 /nfs/dbraw/zinc/28/46/48/566284648.db2.gz VARYXAYJBMMYEF-JKSUJKDBSA-N 0 3 394.288 3.432 10 0 GGAEHN CC[NH+](CC)[C@H](C)C[N-]S(=O)(=O)c1c(Cl)cccc1Br ZINC000509264722 566284828 /nfs/dbraw/zinc/28/48/28/566284828.db2.gz RWRJJCVDPMRESZ-SNVBAGLBSA-N 0 3 383.739 3.111 10 0 GGAEHN OCCn1ncc2c1CCC[C@H]2N[C@H]1CCc2c1ccc(F)c2Br ZINC000648434164 566285160 /nfs/dbraw/zinc/28/51/60/566285160.db2.gz VARYXAYJBMMYEF-CVEARBPZSA-N 0 3 394.288 3.432 10 0 GGAEHN COC(=O)[C@@H]1C[C@@H](C)N(C[C@H](O)COc2c(Cl)cccc2Cl)[C@@H](C)C1 ZINC000599705788 566288014 /nfs/dbraw/zinc/28/80/14/566288014.db2.gz HQVLWPGJWAHYKY-CRWXNKLISA-N 0 3 390.307 3.395 10 0 GGAEHN COC(=O)C1C[C@@H](C)N(CCC(=O)Nc2cccc(Br)c2)[C@H](C)C1 ZINC000599699717 566288046 /nfs/dbraw/zinc/28/80/46/566288046.db2.gz YMUXWDWHPZPYCT-CHWSQXEVSA-N 0 3 397.313 3.440 10 0 GGAEHN COc1ccc(CCC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c(Br)c1 ZINC000669128361 566288394 /nfs/dbraw/zinc/28/83/94/566288394.db2.gz HFRSOOJOVQVNJZ-HIFRSBDPSA-N 0 3 383.330 3.331 10 0 GGAEHN COc1ccc(-c2nnc(N3C[C@@H](N4CCCC4)[C@@H](SC)C3)s2)cc1 ZINC000420609078 566288649 /nfs/dbraw/zinc/28/86/49/566288649.db2.gz GKZAFBARKAEPKJ-CVEARBPZSA-N 0 3 376.551 3.230 10 0 GGAEHN COC(=O)C1C[C@H](C)N(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)[C@@H](C)C1 ZINC000599703535 566288629 /nfs/dbraw/zinc/28/86/29/566288629.db2.gz CLVZCSZLLZXWMA-SGMGOOAPSA-N 0 3 390.307 3.395 10 0 GGAEHN C[C@H](Cc1ccc(F)c(Br)c1)C(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000482173247 566288849 /nfs/dbraw/zinc/28/88/49/566288849.db2.gz DTFUOOZIKGFQHM-IUODEOHRSA-N 0 3 383.305 3.462 10 0 GGAEHN COC(=O)[C@@H]1C[C@@H](C)N(CCC(=O)Nc2ccccc2Br)[C@@H](C)C1 ZINC000599695401 566288783 /nfs/dbraw/zinc/28/87/83/566288783.db2.gz LWCPHLZJINIBRV-BTTYYORXSA-N 0 3 397.313 3.440 10 0 GGAEHN COc1ccc(CCC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c(Br)c1 ZINC000669128363 566288955 /nfs/dbraw/zinc/28/89/55/566288955.db2.gz HFRSOOJOVQVNJZ-ZFWWWQNUSA-N 0 3 383.330 3.331 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cc(C)cc(Br)c2F)C[C@H]1N(C)C ZINC000599721695 566289575 /nfs/dbraw/zinc/28/95/75/566289575.db2.gz PXPXFSWPHQZVRJ-OLZOCXBDSA-N 0 3 375.307 3.014 10 0 GGAEHN CS[C@@H](C)CNC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1nccs1 ZINC000599716453 566289725 /nfs/dbraw/zinc/28/97/25/566289725.db2.gz DAJNMKNFXXSYII-USXIJHARSA-N 0 3 375.563 3.226 10 0 GGAEHN C[C@@H]1C[C@@H](NC(=O)c2cc(Br)cc(N3CCCC3)c2)CCN1C ZINC000669184436 566290050 /nfs/dbraw/zinc/29/00/50/566290050.db2.gz ZFLQPRGJEOLIRK-CJNGLKHVSA-N 0 3 380.330 3.262 10 0 GGAEHN COC(=O)[C@@H]1C[C@@H](C)N(C[C@H](O)COc2ccc(Cl)cc2Cl)[C@@H](C)C1 ZINC000599710366 566290151 /nfs/dbraw/zinc/29/01/51/566290151.db2.gz QTJWHXQYOWBYKM-XFMPKHEZSA-N 0 3 390.307 3.395 10 0 GGAEHN COC(=O)[C@@H]1C[C@@H](C)N(C[C@H](O)COc2cc(Cl)ccc2Cl)[C@@H](C)C1 ZINC000599711585 566290378 /nfs/dbraw/zinc/29/03/78/566290378.db2.gz UOJAAEGIKUJXCR-XFMPKHEZSA-N 0 3 390.307 3.395 10 0 GGAEHN C[C@H]1C[C@H](NC(=O)c2c(F)c(F)c(Br)c(F)c2F)CCN1C ZINC000669182253 566290776 /nfs/dbraw/zinc/29/07/76/566290776.db2.gz KDPLTWDINATAHK-NKWVEPMBSA-N 0 3 383.183 3.218 10 0 GGAEHN CN(C(=O)Cc1c[nH]c2cc(Br)ccc12)[C@@H]1CCN(C2CC2)C1 ZINC000482181259 566290913 /nfs/dbraw/zinc/29/09/13/566290913.db2.gz QGTYDAKWSCUODO-OAHLLOKOSA-N 0 3 376.298 3.168 10 0 GGAEHN C[C@H](Cc1ccc(F)c(Br)c1)C(=O)N(C)[C@@H]1CN2CCC1CC2 ZINC000482181315 566290960 /nfs/dbraw/zinc/29/09/60/566290960.db2.gz QYEDNGNRIXOLEV-SJKOYZFVSA-N 0 3 383.305 3.319 10 0 GGAEHN CN1CCC[C@@H]1C(=O)N1CCC[C@@H]1c1ccc(I)cc1 ZINC000535283455 566291890 /nfs/dbraw/zinc/29/18/90/566291890.db2.gz KNQURHPLMPZPDA-HUUCEWRRSA-N 0 3 384.261 3.049 10 0 GGAEHN COc1cc(C(=O)N2C[C@@H](N3CCCC3)[C@@H](SC)C2)ccc1Br ZINC000599759826 566292789 /nfs/dbraw/zinc/29/27/89/566292789.db2.gz DNHOQYKQMNWORN-ZBFHGGJFSA-N 0 3 399.354 3.110 10 0 GGAEHN CCC[NH+]1CCC(C[N-]S(=O)(=O)c2cc(Cl)ccc2OC(F)F)CC1 ZINC000420658506 566292778 /nfs/dbraw/zinc/29/27/78/566292778.db2.gz CIABWOQBHFMMCS-UHFFFAOYSA-N 0 3 396.887 3.342 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)NC(C)(C)c1ccccc1Br ZINC000535308095 566293937 /nfs/dbraw/zinc/29/39/37/566293937.db2.gz MLAUNNCXARNEBM-AWEZNQCLSA-N 0 3 398.345 3.094 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)NC(C)(C)c1ccccc1Br ZINC000535308099 566294841 /nfs/dbraw/zinc/29/48/41/566294841.db2.gz MLAUNNCXARNEBM-CQSZACIVSA-N 0 3 398.345 3.094 10 0 GGAEHN CC[NH+]1CCC(CC[N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2F)CC1 ZINC000462391152 566294994 /nfs/dbraw/zinc/29/49/94/566294994.db2.gz CHTDKJDKCUVAIN-UHFFFAOYSA-N 0 3 382.423 3.245 10 0 GGAEHN Brc1cccc(C2(NCCOC3CCOCC3)CCOCC2)c1 ZINC000625236772 566295135 /nfs/dbraw/zinc/29/51/35/566295135.db2.gz SMUVTBLPQGGDFN-UHFFFAOYSA-N 0 3 384.314 3.240 10 0 GGAEHN COCCN1CCC[C@H]1CN[C@H]1CCCOc2cc(Br)ccc21 ZINC000482236238 566296054 /nfs/dbraw/zinc/29/60/54/566296054.db2.gz GOKXTAXMAPAGLC-RDJZCZTQSA-N 0 3 383.330 3.363 10 0 GGAEHN COCCN1CCC[C@@H]1CN[C@H]1CCCOc2cc(Br)ccc21 ZINC000482236239 566296128 /nfs/dbraw/zinc/29/61/28/566296128.db2.gz GOKXTAXMAPAGLC-WBVHZDCISA-N 0 3 383.330 3.363 10 0 GGAEHN NC(=O)Cc1ccc(CN[C@@H]2CCc3c2ccc(F)c3Br)cc1 ZINC000648590149 566296803 /nfs/dbraw/zinc/29/68/03/566296803.db2.gz DELRWUAYPNETQV-MRXNPFEDSA-N 0 3 377.257 3.393 10 0 GGAEHN CN(C)C[C@@H]1CCCCN1C(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000625243882 566296928 /nfs/dbraw/zinc/29/69/28/566296928.db2.gz HHIDXDZFLDVTTC-LGRHPFTQSA-N 0 3 377.326 3.278 10 0 GGAEHN COCCN1CCC[C@H]1CN[C@@H]1CCCOc2ccc(Br)cc21 ZINC000482247087 566297126 /nfs/dbraw/zinc/29/71/26/566297126.db2.gz RIEHRKBHRZXAIF-DOTOQJQBSA-N 0 3 383.330 3.363 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(Cl)ccc2OC(F)F)[C@H](C)C1 ZINC000420678502 566298916 /nfs/dbraw/zinc/29/89/16/566298916.db2.gz SXTXMEPGFSRKMT-DGCLKSJQSA-N 0 3 396.887 3.292 10 0 GGAEHN CCN1CC[C@H](N(C)S(=O)(=O)c2cc(Cl)ccc2OC(F)F)[C@H](C)C1 ZINC000420678506 566298972 /nfs/dbraw/zinc/29/89/72/566298972.db2.gz SXTXMEPGFSRKMT-YPMHNXCESA-N 0 3 396.887 3.292 10 0 GGAEHN O=C1Nc2ccc(Br)cc2CC[C@@H]1N1CCC[C@H]([C@H]2CCOC2)C1 ZINC000625261585 566299409 /nfs/dbraw/zinc/29/94/09/566299409.db2.gz HRHDRRXNBSDTLO-MPGHIAIKSA-N 0 3 393.325 3.451 10 0 GGAEHN O=C1Nc2ccc(Br)cc2CC[C@@H]1N1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000625261586 566300381 /nfs/dbraw/zinc/30/03/81/566300381.db2.gz HRHDRRXNBSDTLO-RKVPGOIHSA-N 0 3 393.325 3.451 10 0 GGAEHN Cc1ccc(O[C@@H](C)C(=O)N(C)[C@H]2CCN(C3CC3)C2)c(Br)c1 ZINC000599868022 566301904 /nfs/dbraw/zinc/30/19/04/566301904.db2.gz YLFOULHYXMTZKR-ZFWWWQNUSA-N 0 3 381.314 3.220 10 0 GGAEHN O=C([C@@H]1CCCN(CCOc2cc(F)cc(Br)c2)C1)N1CCCC1 ZINC000575981836 566303689 /nfs/dbraw/zinc/30/36/89/566303689.db2.gz QLDNOVYZGYMNNL-CQSZACIVSA-N 0 3 399.304 3.301 10 0 GGAEHN Ic1ccc(OCCNCc2ccc3c[nH]nc3c2)cc1 ZINC000509428381 566303728 /nfs/dbraw/zinc/30/37/28/566303728.db2.gz FGTAYFNMRRNACK-UHFFFAOYSA-N 0 3 393.228 3.336 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)c1cc2cc[nH]c(=O)c2s1)c1ccsc1 ZINC000648733302 566305095 /nfs/dbraw/zinc/30/50/95/566305095.db2.gz MLOFNJSKNQEWFI-AWEZNQCLSA-N 0 3 375.519 3.464 10 0 GGAEHN CSC1(CNC(=O)c2ccc(Br)c(F)c2F)CCN(C)CC1 ZINC000599961010 566306194 /nfs/dbraw/zinc/30/61/94/566306194.db2.gz RSHRWWWXPURNEG-UHFFFAOYSA-N 0 3 393.297 3.285 10 0 GGAEHN Cc1cnn(CCN2CCC(C(=O)Nc3cccc(Br)c3)CC2)c1 ZINC000556497442 566308749 /nfs/dbraw/zinc/30/87/49/566308749.db2.gz OOCBUBBERUYELH-UHFFFAOYSA-N 0 3 391.313 3.305 10 0 GGAEHN O=C(c1cc2c(cncc2Br)s1)N1CC[C@@H](N2CCCC2)C1 ZINC000648763840 566309719 /nfs/dbraw/zinc/30/97/19/566309719.db2.gz LAMVIXOZFOPJFZ-LLVKDONJSA-N 0 3 380.311 3.369 10 0 GGAEHN CCNC(=O)C[C@H]1CCCCN1C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000556522363 566309766 /nfs/dbraw/zinc/30/97/66/566309766.db2.gz ZRRVRGHNIHZPFH-CABCVRRESA-N 0 3 389.323 3.114 10 0 GGAEHN CCNC(=O)C[C@H]1CCCCN1C[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000556522366 566310496 /nfs/dbraw/zinc/31/04/96/566310496.db2.gz ZRRVRGHNIHZPFH-HUUCEWRRSA-N 0 3 389.323 3.114 10 0 GGAEHN CCNC(=O)C[C@@H]1CCCCN1C[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000556522367 566310773 /nfs/dbraw/zinc/31/07/73/566310773.db2.gz ZRRVRGHNIHZPFH-LSDHHAIUSA-N 0 3 389.323 3.114 10 0 GGAEHN O=C(N[C@H]1CCN(CC2CC2)C1)c1cc2c(cncc2Br)s1 ZINC000648776736 566311424 /nfs/dbraw/zinc/31/14/24/566311424.db2.gz QGJRLFFQEOREHN-NSHDSACASA-N 0 3 380.311 3.273 10 0 GGAEHN O[C@@H](CN[C@@H](c1cccnc1)C1CC1)COc1ccc(Br)cc1 ZINC000445766360 566312096 /nfs/dbraw/zinc/31/20/96/566312096.db2.gz IWZISIULQWVFLJ-FUHWJXTLSA-N 0 3 377.282 3.325 10 0 GGAEHN C[NH+](C)C1CCC([N-]S(=O)(=O)c2c(Cl)cccc2Br)CC1 ZINC000420740532 566313121 /nfs/dbraw/zinc/31/31/21/566313121.db2.gz GRHHCDKBPXFKIS-UHFFFAOYSA-N 0 3 395.750 3.254 10 0 GGAEHN CN(C[C@H]1CCCN(C)C1)C(=O)c1cc2c(cncc2Br)s1 ZINC000648786278 566313694 /nfs/dbraw/zinc/31/36/94/566313694.db2.gz XUMRPJDGHYNVJD-NSHDSACASA-N 0 3 382.327 3.473 10 0 GGAEHN O=C(N[C@H]1CCN(CC2CC2)C1)N[C@H]1CCOc2c(Br)cccc21 ZINC000669649751 566317081 /nfs/dbraw/zinc/31/70/81/566317081.db2.gz YQNFQVUVESVLKN-BBRMVZONSA-N 0 3 394.313 3.056 10 0 GGAEHN O=C1Nc2ccc(Br)cc2CC[C@@H]1N1CC[C@]2(C1)CCCOC2 ZINC000625402088 566318254 /nfs/dbraw/zinc/31/82/54/566318254.db2.gz DCYBAAIJLQVMLO-WMZOPIPTSA-N 0 3 379.298 3.205 10 0 GGAEHN CC1(C)CN(CCN[C@H]2CCCOc3ccc(Br)cc32)CCO1 ZINC000482556221 566318326 /nfs/dbraw/zinc/31/83/26/566318326.db2.gz IRQPQVOWCNKSOE-INIZCTEOSA-N 0 3 383.330 3.363 10 0 GGAEHN CS(=O)(=O)NC[C@H]1CCC[C@H]1NCc1c(Cl)ccc(Cl)c1Cl ZINC000669686510 566320410 /nfs/dbraw/zinc/32/04/10/566320410.db2.gz HXGNWJCKXJHANU-NOZJJQNGSA-N 0 3 385.744 3.454 10 0 GGAEHN Brc1cnc(NCc2cccc3cnccc32)cc1N1CCOCC1 ZINC000648860817 566324233 /nfs/dbraw/zinc/32/42/33/566324233.db2.gz DZUBCLNOVMBFKW-UHFFFAOYSA-N 0 3 399.292 3.263 10 0 GGAEHN O=C1Nc2ccc(Br)cc2CC[C@@H]1N1CCC[C@@]2(CCOC2)C1 ZINC000625461667 566325636 /nfs/dbraw/zinc/32/56/36/566325636.db2.gz KZOLYNOZBDBBMD-FUHWJXTLSA-N 0 3 379.298 3.205 10 0 GGAEHN CC[C@@H](CN1CCCC1)NC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000669766279 566326124 /nfs/dbraw/zinc/32/61/24/566326124.db2.gz PUGNKXOPUFJZBR-XJKSGUPXSA-N 0 3 396.329 3.446 10 0 GGAEHN O=C1Nc2ccc(Br)cc2CC[C@H]1N1CCC[C@@]2(CCOC2)C1 ZINC000625461670 566326082 /nfs/dbraw/zinc/32/60/82/566326082.db2.gz KZOLYNOZBDBBMD-SJLPKXTDSA-N 0 3 379.298 3.205 10 0 GGAEHN CN(C[C@H]1CCCN1C)C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000420875530 566326911 /nfs/dbraw/zinc/32/69/11/566326911.db2.gz ZTFWBCXLDOYXAK-IUODEOHRSA-N 0 3 382.302 3.008 10 0 GGAEHN C[C@H](NC(C)(C)CNC(=O)c1cc[nH]c(=O)c1Br)c1ccccc1 ZINC000446076186 566327469 /nfs/dbraw/zinc/32/74/69/566327469.db2.gz FPDUAENOZPYVLL-LBPRGKRZSA-N 0 3 392.297 3.409 10 0 GGAEHN CN(C)CCn1cc(NC(=O)c2c(Cl)cc(F)cc2Br)cn1 ZINC000648899834 566327864 /nfs/dbraw/zinc/32/78/64/566327864.db2.gz ODKIFEHUQGQSST-UHFFFAOYSA-N 0 3 389.656 3.252 10 0 GGAEHN CN(C)C[C@@H]1CCCN1C(=O)CCCC(=O)c1ccc(Br)cc1 ZINC000446094843 566329529 /nfs/dbraw/zinc/32/95/29/566329529.db2.gz KPAHXLSIIBODNA-INIZCTEOSA-N 0 3 381.314 3.355 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CNC1CCC(C(N)=O)CC1 ZINC000482789717 566333010 /nfs/dbraw/zinc/33/30/10/566333010.db2.gz OEANKRLHZWWRFG-UHFFFAOYSA-N 0 3 391.313 3.077 10 0 GGAEHN C[C@@]12COC[C@]1(C)CN([C@H]1CCc3cc(Br)ccc3NC1=O)C2 ZINC000625537973 566333334 /nfs/dbraw/zinc/33/33/34/566333334.db2.gz UNVQFZDHDIQPRM-RYQLBKOJSA-N 0 3 379.298 3.061 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)c1c(F)ccc(C(F)(F)F)c1Br ZINC000625566432 566337258 /nfs/dbraw/zinc/33/72/58/566337258.db2.gz MKEVYUALWOUWFO-QMMMGPOBSA-N 0 3 383.183 3.431 10 0 GGAEHN CCCN(C(=O)c1cc(=O)[nH]c2ccc(Br)cc21)[C@@H]1CCN(C)C1 ZINC000649000131 566338125 /nfs/dbraw/zinc/33/81/25/566338125.db2.gz PFDSMGPQBNQZOJ-CYBMUJFWSA-N 0 3 392.297 3.259 10 0 GGAEHN CCCN(C(=O)Cc1noc2ccc(Br)cc21)[C@@H]1CCN(C)C1 ZINC000648994856 566338243 /nfs/dbraw/zinc/33/82/43/566338243.db2.gz GKMWDAVJFRCKLB-CYBMUJFWSA-N 0 3 380.286 3.076 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCC1)c1csc(I)c1 ZINC000600469635 566340566 /nfs/dbraw/zinc/34/05/66/566340566.db2.gz CVTJEEYKDALSIP-LBPRGKRZSA-N 0 3 390.290 3.099 10 0 GGAEHN CCOc1cc(C[NH2+]C[C@@H](CO)Cc2ccccc2)cc(Br)c1[O-] ZINC000556892309 566341408 /nfs/dbraw/zinc/34/14/08/566341408.db2.gz JPMJIOCZMFUXIX-INIZCTEOSA-N 0 3 394.309 3.494 10 0 GGAEHN CC1(C)NC(=O)CC[C@@H]1NCc1ccc(Br)c(Br)c1 ZINC000669998683 566341779 /nfs/dbraw/zinc/34/17/79/566341779.db2.gz LOPXNHOXTODLQH-LBPRGKRZSA-N 0 3 390.119 3.358 10 0 GGAEHN C[C@@H](NCCn1ccc2cc(Cl)ccc21)c1ccc(S(N)(=O)=O)cc1 ZINC000556914105 566342388 /nfs/dbraw/zinc/34/23/88/566342388.db2.gz DNQIGJOHXOZCPZ-CYBMUJFWSA-N 0 3 377.897 3.293 10 0 GGAEHN CN(C(=O)COc1ccc(Br)cc1Cl)[C@@H]1CN2CCC1CC2 ZINC000600516774 566343048 /nfs/dbraw/zinc/34/30/48/566343048.db2.gz NPTBMSNMUXHJDZ-CQSZACIVSA-N 0 3 387.705 3.034 10 0 GGAEHN Cc1[nH]c2ccc(Br)cc2c1CC(=O)N(C)[C@@H]1CN2CCC1CC2 ZINC000600516926 566343460 /nfs/dbraw/zinc/34/34/60/566343460.db2.gz SZKVJNZWVPZMIE-GOSISDBHSA-N 0 3 390.325 3.334 10 0 GGAEHN C[C@@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1cccc(OC(F)(F)F)c1 ZINC000556921578 566344562 /nfs/dbraw/zinc/34/45/62/566344562.db2.gz PSRJIFWIEHSRMU-OCCSQVGLSA-N 0 3 380.432 3.050 10 0 GGAEHN CCCN1CCC[C@@H]1C(=O)N[C@H]1CCN(c2ccccc2Br)C1 ZINC000600577711 566346922 /nfs/dbraw/zinc/34/69/22/566346922.db2.gz KSOFXBZLXDENJS-WMLDXEAASA-N 0 3 380.330 3.018 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)CSc1cc(Cl)ccc1Cl)CCO2 ZINC000649136626 566347226 /nfs/dbraw/zinc/34/72/26/566347226.db2.gz RLOBDTRQWBAUJZ-UHFFFAOYSA-N 0 3 389.348 3.409 10 0 GGAEHN CCCN1CCC[C@H]1C(=O)N[C@H]1CCN(c2ccccc2Br)C1 ZINC000600577712 566347219 /nfs/dbraw/zinc/34/72/19/566347219.db2.gz KSOFXBZLXDENJS-YOEHRIQHSA-N 0 3 380.330 3.018 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)C(C)(C)c1cccc(Br)c1)CCO2 ZINC000649132870 566347615 /nfs/dbraw/zinc/34/76/15/566347615.db2.gz RYSJCMRNDAZAKP-UHFFFAOYSA-N 0 3 395.341 3.050 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)[C@@H]1COc2ccc(Br)cc21 ZINC000576467120 566348630 /nfs/dbraw/zinc/34/86/30/566348630.db2.gz ZVFFEBDGDITPAJ-SJORKVTESA-N 0 3 387.277 3.010 10 0 GGAEHN COC(=O)[C@@H](NC[C@H]1CCN1C1CCCC1)c1ccccc1Br ZINC000600614147 566350308 /nfs/dbraw/zinc/35/03/08/566350308.db2.gz MCGLDPJNJBBIQZ-PBHICJAKSA-N 0 3 381.314 3.270 10 0 GGAEHN O[C@H](CN1CC[C@@H](Sc2ccc(Br)cc2)C1)CC1(O)CCC1 ZINC000625701159 566351716 /nfs/dbraw/zinc/35/17/16/566351716.db2.gz NQPSEFFWMAFAFH-GOEBONIOSA-N 0 3 386.355 3.282 10 0 GGAEHN CN(C)C1(CN(C)C(=O)N[C@H]2CCOc3ccc(Br)cc32)CCC1 ZINC000446496198 566352344 /nfs/dbraw/zinc/35/23/44/566352344.db2.gz GZDXGYDJOPADEJ-HNNXBMFYSA-N 0 3 396.329 3.398 10 0 GGAEHN O[C@@H](CN1CC[C@@H](Sc2ccc(Br)cc2)C1)CC1(O)CCC1 ZINC000625701157 566352818 /nfs/dbraw/zinc/35/28/18/566352818.db2.gz NQPSEFFWMAFAFH-GDBMZVCRSA-N 0 3 386.355 3.282 10 0 GGAEHN Brc1ccc(CNCCOCC2CCC2)c(N2CCOCC2)c1 ZINC000576519638 566354121 /nfs/dbraw/zinc/35/41/21/566354121.db2.gz WRSKMJLPQWXKNM-UHFFFAOYSA-N 0 3 383.330 3.192 10 0 GGAEHN CCn1c(CNC(=O)[C@H](C(C)C)N(C)C)nc2cc(Br)ccc21 ZINC000483053096 566355988 /nfs/dbraw/zinc/35/59/88/566355988.db2.gz UJUZSNKSMJHULD-INIZCTEOSA-N 0 3 381.318 3.021 10 0 GGAEHN CCn1c(CNC(=O)CN2[C@@H](C)CC[C@@H]2C)nc2cc(Br)ccc21 ZINC000483063557 566357156 /nfs/dbraw/zinc/35/71/56/566357156.db2.gz OEKUAOKENNYDPN-STQMWFEESA-N 0 3 393.329 3.308 10 0 GGAEHN CCn1c(CNC(=O)CN2[C@H](C)CC[C@@H]2C)nc2cc(Br)ccc21 ZINC000483063553 566357344 /nfs/dbraw/zinc/35/73/44/566357344.db2.gz OEKUAOKENNYDPN-BETUJISGSA-N 0 3 393.329 3.308 10 0 GGAEHN CCCC[C@](C)(NC[C@@H](O)CN1CCOCC1)c1cccc(Br)c1 ZINC000483064713 566357510 /nfs/dbraw/zinc/35/75/10/566357510.db2.gz YZILBTOIBIOGEP-MOPGFXCFSA-N 0 3 399.373 3.137 10 0 GGAEHN O[C@H](COc1cc(F)cc(Br)c1)CN1CC[C@H]2CC[C@@H](C1)S2 ZINC000625777184 566357849 /nfs/dbraw/zinc/35/78/49/566357849.db2.gz BVZNZHVYUHJESH-IMJJTQAJSA-N 0 3 390.318 3.298 10 0 GGAEHN COc1ccc(CNC(=O)NCCN2CCCC[C@@H]2C)cc1Br ZINC000510044215 566359338 /nfs/dbraw/zinc/35/93/38/566359338.db2.gz WFWVSXVFMSABOB-ZDUSSCGKSA-N 0 3 384.318 3.131 10 0 GGAEHN COc1cc(Br)ccc1[C@H]1CCCN1C[C@@H](O)CN(C)C1CC1 ZINC000625794389 566360016 /nfs/dbraw/zinc/36/00/16/566360016.db2.gz JJCMKUZSPSNYMJ-DOTOQJQBSA-N 0 3 383.330 3.050 10 0 GGAEHN OC[C@@]1(NCc2cc(C3CC3)no2)CCc2cc(Br)ccc2C1 ZINC000625796312 566360775 /nfs/dbraw/zinc/36/07/75/566360775.db2.gz JODAIZGKNYFGPO-GOSISDBHSA-N 0 3 377.282 3.324 10 0 GGAEHN CCOC(=O)c1nn(C)cc1CN[C@H]1C[C@H](c2ccc(Br)cc2)C1 ZINC000462870403 566363145 /nfs/dbraw/zinc/36/31/45/566363145.db2.gz DBUFMQFXJUFJFM-SAZUREKKSA-N 0 3 392.297 3.395 10 0 GGAEHN C[C@H](Oc1cccc(Br)c1)C(=O)N1CCc2ccccc2[C@H]1CN ZINC000576637991 566365935 /nfs/dbraw/zinc/36/59/35/566365935.db2.gz NDNNDERWMYSEME-SCLBCKFNSA-N 0 3 389.293 3.301 10 0 GGAEHN O=C(NCc1cc(F)c(Br)cc1F)Nc1cnc2c(c1)CNCC2 ZINC000625896121 566367075 /nfs/dbraw/zinc/36/70/75/566367075.db2.gz SJLOGJUKPRSYQY-UHFFFAOYSA-N 0 3 397.223 3.090 10 0 GGAEHN NC[C@@H](NC(=O)NCC/C=C/c1ccc(Br)cc1)C(F)(F)F ZINC000625899545 566368318 /nfs/dbraw/zinc/36/83/18/566368318.db2.gz WKWWZJIXOCOIDL-DPXBUVRWSA-N 0 3 380.208 3.041 10 0 GGAEHN CNC(=O)[C@@H]1CCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000421373224 566368976 /nfs/dbraw/zinc/36/89/76/566368976.db2.gz DSEMMGVOTPNXGI-GFCCVEGCSA-N 0 3 380.311 3.141 10 0 GGAEHN C[C@H](NC(=O)c1ccc(CN2CCCC2)cc1)c1ncc(Br)cn1 ZINC000557150477 566369097 /nfs/dbraw/zinc/36/90/97/566369097.db2.gz QOPCTYYWPBXGOP-ZDUSSCGKSA-N 0 3 389.297 3.326 10 0 GGAEHN C[C@H](N[C@H]1CN(C2CC2)C[C@@H]1C)c1ccc(Br)cc1OCCCO ZINC000462951976 566370274 /nfs/dbraw/zinc/37/02/74/566370274.db2.gz HOIPLXUXUQMBAJ-DEYYWGMASA-N 0 3 397.357 3.344 10 0 GGAEHN C[C@H](N[C@H]1CN(C2CC2)C[C@H]1C)c1ccc(Br)cc1OCCCO ZINC000462951977 566370406 /nfs/dbraw/zinc/37/04/06/566370406.db2.gz HOIPLXUXUQMBAJ-GLJUWKHASA-N 0 3 397.357 3.344 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)c2cc(OCc3ccccc3)cs2)CCSC1 ZINC000625985500 566371928 /nfs/dbraw/zinc/37/19/28/566371928.db2.gz QVSOIAMPYFBGPQ-LJQANCHMSA-N 0 3 376.547 3.494 10 0 GGAEHN CN(C)C[C@H](NCCc1nnn(C(C)(C)C)n1)c1ccc(Cl)c(Cl)c1 ZINC000625982648 566373201 /nfs/dbraw/zinc/37/32/01/566373201.db2.gz KQFQIMTYTYGKEA-HNNXBMFYSA-N 0 3 385.343 3.170 10 0 GGAEHN CN1CCC(N(Cc2ccco2)C(=O)c2nscc2Br)CC1 ZINC000649570279 566375386 /nfs/dbraw/zinc/37/53/86/566375386.db2.gz VDWWTBVDNPZAMM-UHFFFAOYSA-N 0 3 384.299 3.235 10 0 GGAEHN O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1nscc1Br ZINC000649578059 566375563 /nfs/dbraw/zinc/37/55/63/566375563.db2.gz DVAKSTVOEAKUDN-AWEZNQCLSA-N 0 3 380.311 3.473 10 0 GGAEHN CCOC(=O)COCCN(C)[C@@H]1CCSc2ccc(Br)cc21 ZINC000576791506 566377446 /nfs/dbraw/zinc/37/74/46/566377446.db2.gz CFVMVZXWCSKCPW-CQSZACIVSA-N 0 3 388.327 3.498 10 0 GGAEHN C[C@@H]1C[C@@H](c2ccc(Br)cc2)CN1Cc1cc(=O)n2nccc2[nH]1 ZINC000626040729 566378675 /nfs/dbraw/zinc/37/86/75/566378675.db2.gz KVLCFIYLSAWGGT-TZMCWYRMSA-N 0 3 387.281 3.163 10 0 GGAEHN C[C@@H]1C[C@H](c2ccc(Br)cc2)CN1CC[C@H]1CCS(=O)(=O)C1 ZINC000626041002 566378852 /nfs/dbraw/zinc/37/88/52/566378852.db2.gz PHNFSOCKEDICML-YCPHGPKFSA-N 0 3 386.355 3.452 10 0 GGAEHN Ic1cccc(OCCCN2CC[C@H](n3cccn3)C2)c1 ZINC000463034260 566378893 /nfs/dbraw/zinc/37/88/93/566378893.db2.gz MRSVSBBSRALROT-HNNXBMFYSA-N 0 3 397.260 3.204 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cccc(C)c2Br)C[C@@H]1N1CCCC1 ZINC000483400135 566379334 /nfs/dbraw/zinc/37/93/34/566379334.db2.gz CSJJGPNBQADFMI-GJZGRUSLSA-N 0 3 383.355 3.409 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cc(C)sc2Br)C[C@@H]1N1CCCC1 ZINC000483391004 566379392 /nfs/dbraw/zinc/37/93/92/566379392.db2.gz FHJZWVVXNMSOSY-QWHCGFSZSA-N 0 3 389.384 3.471 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cc(C)sc2Br)C[C@H]1N1CCCC1 ZINC000483391002 566379510 /nfs/dbraw/zinc/37/95/10/566379510.db2.gz FHJZWVVXNMSOSY-CHWSQXEVSA-N 0 3 389.384 3.471 10 0 GGAEHN C[C@@H]1C[C@H](c2ccc(Br)cc2)CN1C[C@H]1CCCS(=O)(=O)C1 ZINC000626041333 566380064 /nfs/dbraw/zinc/38/00/64/566380064.db2.gz VRIPBHBCYSMMSY-FMKPAKJESA-N 0 3 386.355 3.452 10 0 GGAEHN CN(C)CCn1cc(NC(=O)c2cc(Cl)cc(F)c2Br)cn1 ZINC000670779823 566380417 /nfs/dbraw/zinc/38/04/17/566380417.db2.gz BEOFGAZYFLTDLL-UHFFFAOYSA-N 0 3 389.656 3.252 10 0 GGAEHN C[C@@H]1C[C@@H](c2ccc(Br)cc2)CN1C[C@@H]1CCCS(=O)(=O)C1 ZINC000626041335 566380379 /nfs/dbraw/zinc/38/03/79/566380379.db2.gz VRIPBHBCYSMMSY-IJEWVQPXSA-N 0 3 386.355 3.452 10 0 GGAEHN CC1(C)NC(=O)N(CCCNC2(c3ccccc3Br)CCC2)C1=O ZINC000649646646 566382043 /nfs/dbraw/zinc/38/20/43/566382043.db2.gz LCWLABXDFVRQOS-UHFFFAOYSA-N 0 3 394.313 3.138 10 0 GGAEHN CC[C@@H]1C[C@@H](CN[C@@H]2CCN(c3cccc(Br)c3)C2=O)CCO1 ZINC000447066887 566382774 /nfs/dbraw/zinc/38/27/74/566382774.db2.gz HRTDFSOTLUBAJK-IAOVAPTHSA-N 0 3 381.314 3.349 10 0 GGAEHN CC[C@@H]1C[C@H](CN[C@@H]2CCN(c3cccc(Br)c3)C2=O)CCO1 ZINC000447066889 566382807 /nfs/dbraw/zinc/38/28/07/566382807.db2.gz HRTDFSOTLUBAJK-KBRIMQKVSA-N 0 3 381.314 3.349 10 0 GGAEHN OCC[C@]1(NCc2cnc(-c3ccc(Br)cc3)s2)CCOC1 ZINC000447062574 566382934 /nfs/dbraw/zinc/38/29/34/566382934.db2.gz BNXHTMWEDGRQFX-INIZCTEOSA-N 0 3 383.311 3.204 10 0 GGAEHN CC[C@@H]1C[C@@H](CN[C@H]2CCN(c3cccc(Br)c3)C2=O)CCO1 ZINC000447066890 566383472 /nfs/dbraw/zinc/38/34/72/566383472.db2.gz HRTDFSOTLUBAJK-XKQJLSEDSA-N 0 3 381.314 3.349 10 0 GGAEHN Cc1cccc(CN(CCN(C)C)C(=O)c2nscc2Br)c1 ZINC000649687790 566385700 /nfs/dbraw/zinc/38/57/00/566385700.db2.gz FUCYZFQCBCSCQK-UHFFFAOYSA-N 0 3 382.327 3.418 10 0 GGAEHN C[C@@H](NC(=O)N[C@@H](C)Cc1ccc(Br)cc1)C1=CCN(C)CC1 ZINC000510478192 566386069 /nfs/dbraw/zinc/38/60/69/566386069.db2.gz GCTHFUSRHHUGQM-UONOGXRCSA-N 0 3 380.330 3.330 10 0 GGAEHN C[C@H](NC(=O)C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1)c1cc(Cl)ccc1Cl ZINC000670925272 566388425 /nfs/dbraw/zinc/38/84/25/566388425.db2.gz NWJZYEZWEUTNCA-OBJOEFQTSA-N 0 3 386.323 3.112 10 0 GGAEHN Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(C[C@H]1CCCO1)C(F)(F)F ZINC000649730488 566388857 /nfs/dbraw/zinc/38/88/57/566388857.db2.gz SCZAQLACSWXMPG-DGCLKSJQSA-N 0 3 379.400 3.085 10 0 GGAEHN CN(C(=O)[C@@H]1CCOc2ccc(Br)cc21)[C@@H]1CCN(C2CC2)C1 ZINC000649723349 566389349 /nfs/dbraw/zinc/38/93/49/566389349.db2.gz IJBTXHANJIIMGA-HUUCEWRRSA-N 0 3 379.298 3.010 10 0 GGAEHN CN(C)CCN(Cc1ccccc1F)C(=O)c1nscc1Br ZINC000649726212 566389542 /nfs/dbraw/zinc/38/95/42/566389542.db2.gz VGQKIZDIUXJOOE-UHFFFAOYSA-N 0 3 386.290 3.249 10 0 GGAEHN CCOC(=O)C1(C[NH2+]Cc2cc(Br)c([O-])c(OCC)c2)CCC1 ZINC000576921727 566389632 /nfs/dbraw/zinc/38/96/32/566389632.db2.gz BODJRLMQMPLHJK-UHFFFAOYSA-N 0 3 386.286 3.376 10 0 GGAEHN CNS(=O)(=O)C[C@H]1CCCN(CCCSc2ccccc2Cl)C1 ZINC000626169757 566391623 /nfs/dbraw/zinc/39/16/23/566391623.db2.gz RJLWZCBJWOGTRO-AWEZNQCLSA-N 0 3 376.975 3.083 10 0 GGAEHN CNS(=O)(=O)C[C@@H]1CCCN(CCCSc2ccccc2Cl)C1 ZINC000626169758 566392114 /nfs/dbraw/zinc/39/21/14/566392114.db2.gz RJLWZCBJWOGTRO-CQSZACIVSA-N 0 3 376.975 3.083 10 0 GGAEHN O=C(Cc1csc(-c2ccc(Cl)s2)n1)N[C@@H]1CNCCC1(F)F ZINC000576941641 566392972 /nfs/dbraw/zinc/39/29/72/566392972.db2.gz GIRJIIJQSJFGDB-SNVBAGLBSA-N 0 3 377.869 3.181 10 0 GGAEHN CC(C)N(C[C@H](O)COc1ccc(Cl)cc1Br)[C@H]1CCOC1 ZINC000463228588 566393555 /nfs/dbraw/zinc/39/35/55/566393555.db2.gz CULMLHBCWRYSLM-KBPBESRZSA-N 0 3 392.721 3.342 10 0 GGAEHN CN(CCCOc1cccc(I)c1)CCc1cnccn1 ZINC000536707638 566396449 /nfs/dbraw/zinc/39/64/49/566396449.db2.gz IXGGZSQRWYAHMM-UHFFFAOYSA-N 0 3 397.260 3.025 10 0 GGAEHN CN(C(=O)NCCCc1cccc(Br)c1)[C@H]1CCN(C2CC2)C1 ZINC000601324232 566400184 /nfs/dbraw/zinc/40/01/84/566400184.db2.gz VCLRQSWKDMSECE-KRWDZBQOSA-N 0 3 380.330 3.260 10 0 GGAEHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000649849032 566400325 /nfs/dbraw/zinc/40/03/25/566400325.db2.gz KVFHDAPJKCFRQT-JLJPHGGASA-N 0 3 393.325 3.258 10 0 GGAEHN CN(CCC(=O)N[C@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccncc1 ZINC000557598821 566400618 /nfs/dbraw/zinc/40/06/18/566400618.db2.gz BYTDCORHRDUCPJ-QGZVFWFLSA-N 0 3 382.291 3.455 10 0 GGAEHN Cc1ccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cc1S(C)(=O)=O ZINC000649871272 566400975 /nfs/dbraw/zinc/40/09/75/566400975.db2.gz WRDRMHYAROTGBZ-QWHCGFSZSA-N 0 3 379.400 3.085 10 0 GGAEHN C[C@@H]1CN(C2CCOCC2)CCN1c1ncnc2ccc(Br)cc21 ZINC000557594890 566400868 /nfs/dbraw/zinc/40/08/68/566400868.db2.gz ZUDWSOXBTLIWLT-CYBMUJFWSA-N 0 3 391.313 3.082 10 0 GGAEHN C[C@@H](Cn1cc(Br)ccc1=O)N[C@@H](C)c1ccc2c(c1)OCCO2 ZINC000671117090 566401550 /nfs/dbraw/zinc/40/15/50/566401550.db2.gz MQYCMPJHHXXINP-STQMWFEESA-N 0 3 393.281 3.121 10 0 GGAEHN Cc1ccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cc1S(C)(=O)=O ZINC000649871273 566402045 /nfs/dbraw/zinc/40/20/45/566402045.db2.gz WRDRMHYAROTGBZ-STQMWFEESA-N 0 3 379.400 3.085 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2C[C@H](N3CCCC3)C[C@H]2C)c1 ZINC000557640575 566404344 /nfs/dbraw/zinc/40/43/44/566404344.db2.gz KNVVRRWQILFNBI-ZIAGYGMSSA-N 0 3 398.288 3.298 10 0 GGAEHN O=C(c1n[nH]c2ccc(Br)cc21)N1CCN(C2CCCCC2)CC1 ZINC000483864450 566404750 /nfs/dbraw/zinc/40/47/50/566404750.db2.gz SCRPYFOCRIWCMQ-UHFFFAOYSA-N 0 3 391.313 3.416 10 0 GGAEHN Cc1nccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)c1Br ZINC000649949056 566407917 /nfs/dbraw/zinc/40/79/17/566407917.db2.gz NGOGUNXFVHWTCJ-ZJUUUORDSA-N 0 3 381.192 3.261 10 0 GGAEHN C[C@H](NC(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)C1=CCN(C)CC1 ZINC000626408858 566408898 /nfs/dbraw/zinc/40/88/98/566408898.db2.gz MEEWRNQWFFJVNC-PHTTXTFCSA-N 0 3 375.310 3.101 10 0 GGAEHN CC(C(=O)NCC(F)(F)F)S(=O)(=O)Cc1ccc(Cl)c2ccccc12 ZINC000421816453 566410205 /nfs/dbraw/zinc/41/02/05/566410205.db2.gz XRAOQZUNXYNATR-JTQLQIEISA-N 0 3 393.814 3.475 10 0 GGAEHN O=C(N[C@H]1CNCCC1(F)F)c1ccc(Br)c(C(F)(F)F)c1 ZINC000577181518 566412325 /nfs/dbraw/zinc/41/23/25/566412325.db2.gz FLYOIHQHOALJRA-JTQLQIEISA-N 0 3 387.146 3.195 10 0 GGAEHN C[C@H](NC(=O)CN1CC[C@]2(C1)CCCOC2)c1ccc(Br)cc1 ZINC000671254515 566412701 /nfs/dbraw/zinc/41/27/01/566412701.db2.gz APMLRMNRNIBVFM-KSSFIOAISA-N 0 3 381.314 3.129 10 0 GGAEHN C[C@@H](NC(=O)CN1CC[C@]2(C1)CCCOC2)c1ccc(Br)cc1 ZINC000671254512 566412793 /nfs/dbraw/zinc/41/27/93/566412793.db2.gz APMLRMNRNIBVFM-KDOFPFPSSA-N 0 3 381.314 3.129 10 0 GGAEHN CCNC(=O)C[C@@H]1CCCCN1C[C@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000671248953 566413404 /nfs/dbraw/zinc/41/34/04/566413404.db2.gz SGMZDNVMEHUFOH-KBPBESRZSA-N 0 3 389.323 3.114 10 0 GGAEHN C[C@H](NC(=O)c1cc(=O)[nH]c2ccc(Br)cc21)C1=CCN(C)CC1 ZINC000510795807 566413887 /nfs/dbraw/zinc/41/38/87/566413887.db2.gz SEFSAQZWOZJPMR-NSHDSACASA-N 0 3 390.281 3.083 10 0 GGAEHN COCC1(CCN[C@@H](C)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)CC1 ZINC000577220867 566416032 /nfs/dbraw/zinc/41/60/32/566416032.db2.gz ZGCLZBKQRRXAAR-JTQLQIEISA-N 0 3 381.325 3.108 10 0 GGAEHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000650024282 566416037 /nfs/dbraw/zinc/41/60/37/566416037.db2.gz GQGXXBBTGFVFLN-KBMXLJTQSA-N 0 3 393.325 3.400 10 0 GGAEHN CN(C)C[C@H]1CCc2ccccc2N1C(=O)c1nscc1Br ZINC000650046688 566417447 /nfs/dbraw/zinc/41/74/47/566417447.db2.gz MKIXVMXQMLDKNU-GFCCVEGCSA-N 0 3 380.311 3.429 10 0 GGAEHN O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCOc2cccc(Cl)c2)C1 ZINC000510903745 566418472 /nfs/dbraw/zinc/41/84/72/566418472.db2.gz TWOSJTKQKIAQLR-ZDUSSCGKSA-N 0 3 378.822 3.499 10 0 GGAEHN CCO[C@@H]1C[C@@H](NCc2ccc(S(=O)(=O)N(C)C)s2)C12CCCCC2 ZINC000557792532 566420027 /nfs/dbraw/zinc/42/00/27/566420027.db2.gz UYGUQWLUBDGFGL-HZPDHXFCSA-N 0 3 386.583 3.216 10 0 GGAEHN Cc1cc(Br)cc(C)c1N1CCC[C@@H](N(CCO)CC2CC2)C1=O ZINC000510935199 566420619 /nfs/dbraw/zinc/42/06/19/566420619.db2.gz ISMATXRQZZYBEH-QGZVFWFLSA-N 0 3 395.341 3.266 10 0 GGAEHN CC[C@@H](N[C@@H](CO)CC1CCCC1)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000510945237 566423089 /nfs/dbraw/zinc/42/30/89/566423089.db2.gz LZZGSEVWLUTPAN-NVXWUHKLSA-N 0 3 388.961 3.230 10 0 GGAEHN C[C@H]1CN(C(=O)Cc2ccc(Br)cc2[O-])CC[N@@H+](C2CCC2)C1 ZINC000557838231 566426006 /nfs/dbraw/zinc/42/60/06/566426006.db2.gz WTZOLUMYDNCYNQ-CYBMUJFWSA-N 0 3 381.314 3.030 10 0 GGAEHN C[C@H]1CN(C(=O)Cc2ccc(Br)cc2[O-])CC[N@H+](C2CCC2)C1 ZINC000557838231 566426015 /nfs/dbraw/zinc/42/60/15/566426015.db2.gz WTZOLUMYDNCYNQ-CYBMUJFWSA-N 0 3 381.314 3.030 10 0 GGAEHN CN(C)C1(CN(C)C(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)CCC1 ZINC000626598051 566428492 /nfs/dbraw/zinc/42/84/92/566428492.db2.gz JGAWNLCBPDLKQM-USXIJHARSA-N 0 3 377.326 3.278 10 0 GGAEHN CN(C)C1(CN(C)C(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)CCC1 ZINC000626598050 566428883 /nfs/dbraw/zinc/42/88/83/566428883.db2.gz JGAWNLCBPDLKQM-HYVNUMGLSA-N 0 3 377.326 3.278 10 0 GGAEHN CC(C)C[N@@H+]1CCC[C@H](CNC(=O)Cc2ccc(Br)cc2[O-])C1 ZINC000484494804 566432680 /nfs/dbraw/zinc/43/26/80/566432680.db2.gz ZGJISKZKIMNFOK-CQSZACIVSA-N 0 3 383.330 3.181 10 0 GGAEHN CC(C)C[N@H+]1CCC[C@H](CNC(=O)Cc2ccc(Br)cc2[O-])C1 ZINC000484494804 566432685 /nfs/dbraw/zinc/43/26/85/566432685.db2.gz ZGJISKZKIMNFOK-CQSZACIVSA-N 0 3 383.330 3.181 10 0 GGAEHN C[C@H](CN1CCC[C@@H](S(=O)(=O)N(C)C)C1)c1ccc(C(F)(F)F)cc1 ZINC000511127269 566438521 /nfs/dbraw/zinc/43/85/21/566438521.db2.gz SNSHGIORLMWUHI-CZUORRHYSA-N 0 3 378.460 3.165 10 0 GGAEHN CS[C@@H]1CN([C@@H](C)C(=O)Nc2ccc(F)cc2Cl)C[C@@H]1N1CCCC1 ZINC000484609903 566440217 /nfs/dbraw/zinc/44/02/17/566440217.db2.gz BAMMWMAETIDDHZ-AFAVFJNCSA-N 0 3 385.936 3.318 10 0 GGAEHN COC(=O)[C@H](c1c(F)cccc1Cl)N1C[C@@H](N2CCCC2)[C@@H](SC)C1 ZINC000484609447 566440247 /nfs/dbraw/zinc/44/02/47/566440247.db2.gz APOHTXLDLUBQCP-VYDXJSESSA-N 0 3 386.920 3.205 10 0 GGAEHN Cn1nccc1[C@@H]1CCCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000511134559 566440647 /nfs/dbraw/zinc/44/06/47/566440647.db2.gz GBCHCFFPWGSVCU-ZIAGYGMSSA-N 0 3 384.307 3.346 10 0 GGAEHN Cn1nccc1[C@H]1CCCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000511134554 566440932 /nfs/dbraw/zinc/44/09/32/566440932.db2.gz GBCHCFFPWGSVCU-KBPBESRZSA-N 0 3 384.307 3.346 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1cccc2cccc(Br)c21 ZINC000511210547 566445616 /nfs/dbraw/zinc/44/56/16/566445616.db2.gz YDAJJEKVLIUCPY-OAHLLOKOSA-N 0 3 391.309 3.443 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000484699264 566447553 /nfs/dbraw/zinc/44/75/53/566447553.db2.gz ZPQXEQAQUUVCED-PBHICJAKSA-N 0 3 393.325 3.173 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000484699264 566447559 /nfs/dbraw/zinc/44/75/59/566447559.db2.gz ZPQXEQAQUUVCED-PBHICJAKSA-N 0 3 393.325 3.173 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000484699266 566447747 /nfs/dbraw/zinc/44/77/47/566447747.db2.gz ZPQXEQAQUUVCED-WMLDXEAASA-N 0 3 393.325 3.173 10 0 GGAEHN O=C(Cc1ccc(Br)cc1[O-])N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000484699266 566447753 /nfs/dbraw/zinc/44/77/53/566447753.db2.gz ZPQXEQAQUUVCED-WMLDXEAASA-N 0 3 393.325 3.173 10 0 GGAEHN C[C@@H](NC(=O)N1CCc2cc(Br)cc(F)c21)C1=CCN(C)CC1 ZINC000511247900 566448151 /nfs/dbraw/zinc/44/81/51/566448151.db2.gz KZZCHKWKNQDRJW-LLVKDONJSA-N 0 3 382.277 3.311 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@H]1CN[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000671769483 566449130 /nfs/dbraw/zinc/44/91/30/566449130.db2.gz ZYTNDQWVXFLYSE-NHYWBVRUSA-N 0 3 377.337 3.384 10 0 GGAEHN Cc1nc([C@@H](C)NC[C@@H]2CCN(S(=O)(=O)c3cccs3)C2)c(C)s1 ZINC000671765132 566449299 /nfs/dbraw/zinc/44/92/99/566449299.db2.gz UPHZZPFVBQLFKW-RISCZKNCSA-N 0 3 385.580 3.183 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@H]1CN[C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000671769484 566449517 /nfs/dbraw/zinc/44/95/17/566449517.db2.gz ZYTNDQWVXFLYSE-XHDPSFHLSA-N 0 3 377.337 3.384 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@@H]1CN[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000671769481 566449705 /nfs/dbraw/zinc/44/97/05/566449705.db2.gz ZYTNDQWVXFLYSE-ABAIWWIYSA-N 0 3 377.337 3.384 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000511364109 566458293 /nfs/dbraw/zinc/45/82/93/566458293.db2.gz TYEUYMMUARRDBV-ZDUSSCGKSA-N 0 3 390.325 3.479 10 0 GGAEHN CN(C)[C@@H](CNC(=O)CN1CCc2sc(Cl)cc2C1)c1ccccc1 ZINC000577726124 566459355 /nfs/dbraw/zinc/45/93/55/566459355.db2.gz NJHCTMAJSHOZMU-INIZCTEOSA-N 0 3 377.941 3.179 10 0 GGAEHN CN(C(=O)NCc1cc(F)c(F)cc1Br)[C@@H]1CCN(C2CC2)C1 ZINC000511384929 566460175 /nfs/dbraw/zinc/46/01/75/566460175.db2.gz VTYZZHKTLMIQPE-GFCCVEGCSA-N 0 3 388.256 3.105 10 0 GGAEHN COCC1(CCN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)CC1 ZINC000577750842 566461695 /nfs/dbraw/zinc/46/16/95/566461695.db2.gz ZZFIRUSMUMBQKN-AWEZNQCLSA-N 0 3 388.327 3.074 10 0 GGAEHN FC(F)Oc1c(Cl)cc(Cl)cc1CN[C@H](C1CC1)[C@H]1CNCCO1 ZINC000422876883 566464842 /nfs/dbraw/zinc/46/48/42/566464842.db2.gz QVXSFRBIJGVUNW-ZIAGYGMSSA-N 0 3 381.250 3.451 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1ccc(Br)c(Cl)c1 ZINC000448334461 566468701 /nfs/dbraw/zinc/46/87/01/566468701.db2.gz ZHXALCPSNOMMBR-LBPRGKRZSA-N 0 3 390.709 3.335 10 0 GGAEHN O=S(=O)(c1ccc(CNCCC2CCCCCC2)s1)N1CCOCC1 ZINC000558404650 566468756 /nfs/dbraw/zinc/46/87/56/566468756.db2.gz GLZFRHPKVCNOIR-UHFFFAOYSA-N 0 3 386.583 3.219 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(Br)c(Cl)c1 ZINC000448334460 566469484 /nfs/dbraw/zinc/46/94/84/566469484.db2.gz ZHXALCPSNOMMBR-GFCCVEGCSA-N 0 3 390.709 3.335 10 0 GGAEHN Cc1cc(Br)cn2cc(CN[C@H](C)c3ccc(CN)nc3C)nc12 ZINC000423031778 566469842 /nfs/dbraw/zinc/46/98/42/566469842.db2.gz DOFKYEBHXNCGTF-GFCCVEGCSA-N 0 3 388.313 3.418 10 0 GGAEHN Cc1nc(CN)ccc1[C@H](C)N[C@H](CCO)c1ccccc1Br ZINC000423026158 566469900 /nfs/dbraw/zinc/46/99/00/566469900.db2.gz ARZPODZQAPBEDE-SCLBCKFNSA-N 0 3 378.314 3.386 10 0 GGAEHN Cc1ccc(S(=O)(=O)C[C@@H](C)NC[C@H]2CSc3ccccc3O2)cc1 ZINC000577849853 566470763 /nfs/dbraw/zinc/47/07/63/566470763.db2.gz JQIUGIXIJGSGSG-CVEARBPZSA-N 0 3 377.531 3.300 10 0 GGAEHN CCS(=O)(=O)N1CCC([C@@H](C)N(C)Cc2cnc(CC(C)C)s2)CC1 ZINC000558424727 566470829 /nfs/dbraw/zinc/47/08/29/566470829.db2.gz BCWGLKJEPSQKHU-OAHLLOKOSA-N 0 3 387.615 3.224 10 0 GGAEHN COc1ccc(OCCN[C@](C)(CO)c2ccc(Br)cc2)cc1 ZINC000511551707 566471437 /nfs/dbraw/zinc/47/14/37/566471437.db2.gz DWSRZYKGTCVGEQ-GOSISDBHSA-N 0 3 380.282 3.334 10 0 GGAEHN C[C@H]1CCC[C@](CNC(=O)C(=O)c2ccc(Br)cc2)(N(C)C)C1 ZINC000511560617 566471468 /nfs/dbraw/zinc/47/14/68/566471468.db2.gz OYSHUGJUTZXBOY-UGSOOPFHSA-N 0 3 381.314 3.259 10 0 GGAEHN Cc1nccc(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c1Br ZINC000558425357 566471552 /nfs/dbraw/zinc/47/15/52/566471552.db2.gz BECRYCJCHKPGDP-DYVFJYSZSA-N 0 3 391.313 3.387 10 0 GGAEHN C[C@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)C(=O)c1ccc(Br)cc1 ZINC000511554927 566471516 /nfs/dbraw/zinc/47/15/16/566471516.db2.gz ASWKALLKGXNEHN-MGPQQGTHSA-N 0 3 381.314 3.114 10 0 GGAEHN CC1(C)CCCN[C@H]1C(=O)N1CCO[C@@H](c2ccc(Br)cc2)C1 ZINC000423073181 566472565 /nfs/dbraw/zinc/47/25/65/566472565.db2.gz QWNKSYAVDKZLHR-CVEARBPZSA-N 0 3 381.314 3.127 10 0 GGAEHN CN(Cc1nc(-c2ccc(Br)s2)no1)[C@@H]1CCN(C2CC2)C1 ZINC000511569898 566473392 /nfs/dbraw/zinc/47/33/92/566473392.db2.gz GNTFBZRCMOOVGB-LLVKDONJSA-N 0 3 383.315 3.229 10 0 GGAEHN COc1ccc(CN2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)c(Br)c1[O-] ZINC000650723293 566473600 /nfs/dbraw/zinc/47/36/00/566473600.db2.gz KUZOUIGNHDOARZ-SQWLQELKSA-N 0 3 399.329 3.024 10 0 GGAEHN COc1ccc(CN2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)c(Br)c1[O-] ZINC000650723290 566474163 /nfs/dbraw/zinc/47/41/63/566474163.db2.gz KUZOUIGNHDOARZ-FMKPAKJESA-N 0 3 399.329 3.024 10 0 GGAEHN COc1ccc(CN2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)c(Br)c1[O-] ZINC000650723292 566474197 /nfs/dbraw/zinc/47/41/97/566474197.db2.gz KUZOUIGNHDOARZ-LZWOXQAQSA-N 0 3 399.329 3.024 10 0 GGAEHN C[C@@H]1[C@H](C)N(C)CCN1CCCOc1cccc(I)c1 ZINC000537851713 566475546 /nfs/dbraw/zinc/47/55/46/566475546.db2.gz QGIUFQKOXNXZCO-UONOGXRCSA-N 0 3 388.293 3.085 10 0 GGAEHN CCN(CC)CCN(C(=O)c1ncoc1C)c1ccc(Br)cn1 ZINC000577931439 566477522 /nfs/dbraw/zinc/47/75/22/566477522.db2.gz JLBYWALIYFIFDR-UHFFFAOYSA-N 0 3 381.274 3.129 10 0 GGAEHN COc1ccc(Br)c(CN2CCN(c3ccncc3OC)CC2)c1 ZINC000558481146 566478156 /nfs/dbraw/zinc/47/81/56/566478156.db2.gz BCMHDMFLIXPUCB-UHFFFAOYSA-N 0 3 392.297 3.184 10 0 GGAEHN O=C(N[C@H]1C[C@H](c2ccc(Br)cc2)C1)N1CC[C@H](N2CC=CC2)C1 ZINC000464471609 566478589 /nfs/dbraw/zinc/47/85/89/566478589.db2.gz YNVJECCHVOGDJL-SZMVWBNQSA-N 0 3 390.325 3.351 10 0 GGAEHN CSC1(CNC(=O)Nc2cc(-c3ccsc3)nn2C)CCN(C)CC1 ZINC000577959836 566479028 /nfs/dbraw/zinc/47/90/28/566479028.db2.gz SJTCYCGLTCNNSP-UHFFFAOYSA-N 0 3 379.555 3.098 10 0 GGAEHN Cc1c(Br)cccc1C[C@@H](CO)CN[C@H](C)c1cnccc1N ZINC000423149044 566479276 /nfs/dbraw/zinc/47/92/76/566479276.db2.gz AESRZJSPQTZSNG-ZIAGYGMSSA-N 0 3 378.314 3.067 10 0 GGAEHN OC[C@H]1CN(CCCc2nc(-c3cccs3)no2)CC[C@H]1C(F)(F)F ZINC000511681174 566481409 /nfs/dbraw/zinc/48/14/09/566481409.db2.gz KZAWNLVZBSKTEM-VXGBXAGGSA-N 0 3 375.416 3.223 10 0 GGAEHN Fc1ccc(Br)c2c1CC[C@@H]2Nc1ccc(N2CCNCC2)cn1 ZINC000423233090 566482100 /nfs/dbraw/zinc/48/21/00/566482100.db2.gz NWYOPXGKLXSJHH-INIZCTEOSA-N 0 3 391.288 3.492 10 0 GGAEHN C[C@@H](CC(=O)Nc1cccc(Br)c1)NCCOc1ncccc1F ZINC000537950093 566482819 /nfs/dbraw/zinc/48/28/19/566482819.db2.gz IEYCQMXZXGASBY-LBPRGKRZSA-N 0 3 396.260 3.369 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3cc(C(F)(F)F)ccc3Cl)[C@H]2C1 ZINC000627531761 566487114 /nfs/dbraw/zinc/48/71/14/566487114.db2.gz IBMBJMFYHAGTDO-LSDHHAIUSA-N 0 3 376.806 3.294 10 0 GGAEHN CCN1CCC[C@H](NC(=O)c2cc(Br)ccc2OC(F)F)C1 ZINC000578071806 566489102 /nfs/dbraw/zinc/48/91/02/566489102.db2.gz KOCZGDIBPIAAMC-NSHDSACASA-N 0 3 377.229 3.265 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)c1ccc(I)cc1F ZINC000448709587 566489413 /nfs/dbraw/zinc/48/94/13/566489413.db2.gz RXRKOCQERUQFEU-NSHDSACASA-N 0 3 390.240 3.035 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)c1ccc(I)cc1F ZINC000448709586 566490420 /nfs/dbraw/zinc/49/04/20/566490420.db2.gz RXRKOCQERUQFEU-LLVKDONJSA-N 0 3 390.240 3.035 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)N[C@H]1C[C@@H](C)N(C3CC3)C1)CC2 ZINC000538126629 566493431 /nfs/dbraw/zinc/49/34/31/566493431.db2.gz NEYQJCQQRFNXNP-CJNGLKHVSA-N 0 3 392.341 3.450 10 0 GGAEHN Cc1cc([C@@H](NC[C@H](O)CS(=O)(=O)c2cccs2)C2CC2)ccc1F ZINC000538116643 566494035 /nfs/dbraw/zinc/49/40/35/566494035.db2.gz LQVWHWIFMWVCCC-YJBOKZPZSA-N 0 3 383.510 3.071 10 0 GGAEHN CN(CCN1CCCCC1)C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000651081128 566495574 /nfs/dbraw/zinc/49/55/74/566495574.db2.gz YUBVNXXFAFESMJ-MRXNPFEDSA-N 0 3 396.329 3.400 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000651108673 566496423 /nfs/dbraw/zinc/49/64/23/566496423.db2.gz UMWLFOMMBUFMAV-HIFRSBDPSA-N 0 3 381.314 3.306 10 0 GGAEHN C[C@H]1CCCN(CCNC(=O)[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000651108817 566496446 /nfs/dbraw/zinc/49/64/46/566496446.db2.gz XNLGSVSSUAWJKJ-ZFWWWQNUSA-N 0 3 381.314 3.163 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651108674 566496493 /nfs/dbraw/zinc/49/64/93/566496493.db2.gz UMWLFOMMBUFMAV-UKRRQHHQSA-N 0 3 381.314 3.306 10 0 GGAEHN C[C@@H]1CCCN(CCNC(=O)[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000651108816 566496572 /nfs/dbraw/zinc/49/65/72/566496572.db2.gz XNLGSVSSUAWJKJ-UKRRQHHQSA-N 0 3 381.314 3.163 10 0 GGAEHN C[C@H]1CCCN(CCNC(=O)[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000651108814 566496643 /nfs/dbraw/zinc/49/66/43/566496643.db2.gz XNLGSVSSUAWJKJ-DZGCQCFKSA-N 0 3 381.314 3.163 10 0 GGAEHN CCc1ccccc1[C@@H](N)CNC(=O)c1[nH]nc(C(C)C)c1Br ZINC000423970940 566499610 /nfs/dbraw/zinc/49/96/10/566499610.db2.gz GQPYDMFAEXYGCB-ZDUSSCGKSA-N 0 3 379.302 3.288 10 0 GGAEHN COCCCN(C(=O)COc1ccc(Cl)c(Cl)c1)C1CCN(C)CC1 ZINC000464720001 566501771 /nfs/dbraw/zinc/50/17/71/566501771.db2.gz NSSJTCCTSRGICP-UHFFFAOYSA-N 0 3 389.323 3.332 10 0 GGAEHN O=C(CCc1ccc(Br)cc1)N1CCC(N2CCCOCC2)CC1 ZINC000627740125 566502551 /nfs/dbraw/zinc/50/25/51/566502551.db2.gz CLSQQSAQVOCIKQ-UHFFFAOYSA-N 0 3 395.341 3.095 10 0 GGAEHN Cn1cc([C@H](NC[C@H](O)COc2ccc(Br)cc2)C(C)(C)C)cn1 ZINC000538277034 566502913 /nfs/dbraw/zinc/50/29/13/566502913.db2.gz MEZJIBXNXGHZRJ-RDJZCZTQSA-N 0 3 396.329 3.299 10 0 GGAEHN O=C(COc1cc(Cl)cc(Cl)c1)N1CCC(N2CCCOCC2)CC1 ZINC000627740379 566502891 /nfs/dbraw/zinc/50/28/91/566502891.db2.gz NWRHNNXTZMDDMY-UHFFFAOYSA-N 0 3 387.307 3.086 10 0 GGAEHN Cc1cc(C)c(Br)c(C(=O)N2CCC(N3CCCOCC3)CC2)c1 ZINC000627740994 566503215 /nfs/dbraw/zinc/50/32/15/566503215.db2.gz NCGFAZYACPGWQL-UHFFFAOYSA-N 0 3 395.341 3.393 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNCc1ncc(I)s1 ZINC000512003781 566503924 /nfs/dbraw/zinc/50/39/24/566503924.db2.gz ANHVLCWVVANGTN-GHMZBOCLSA-N 0 3 379.311 3.100 10 0 GGAEHN Cc1cc(Br)cc(C(=O)N2CCC(N3CCCOCC3)CC2)c1 ZINC000627741221 566503629 /nfs/dbraw/zinc/50/36/29/566503629.db2.gz XMKQJHJFROBKMA-UHFFFAOYSA-N 0 3 381.314 3.084 10 0 GGAEHN Cc1cc(C(=O)N2CCC(N3CCCOCC3)CC2)c(Br)s1 ZINC000627740316 566503739 /nfs/dbraw/zinc/50/37/39/566503739.db2.gz KYEPEACMUIOCAT-UHFFFAOYSA-N 0 3 387.343 3.146 10 0 GGAEHN C[C@H](C(=O)N1CCC(N2CCCOCC2)CC1)c1cccc(Br)c1 ZINC000627742479 566503771 /nfs/dbraw/zinc/50/37/71/566503771.db2.gz YCCIBBGDJGZAFI-HNNXBMFYSA-N 0 3 395.341 3.266 10 0 GGAEHN Cc1ccc(Br)cc1CC(=O)N1CCC(N2CCCOCC2)CC1 ZINC000627742321 566503883 /nfs/dbraw/zinc/50/38/83/566503883.db2.gz QWGSTYLKNDHSLN-UHFFFAOYSA-N 0 3 395.341 3.013 10 0 GGAEHN O=C([C@H]1CCOc2ccc(Br)cc21)N1CC[C@@H](N2CCCC2)C1 ZINC000651235962 566504454 /nfs/dbraw/zinc/50/44/54/566504454.db2.gz QDFYSKLJFRDYSD-CABCVRRESA-N 0 3 379.298 3.012 10 0 GGAEHN CCN1CCC(n2nccc2NC(=O)c2nscc2Br)CC1 ZINC000651235945 566504623 /nfs/dbraw/zinc/50/46/23/566504623.db2.gz PKDFNNQWKHUSFM-UHFFFAOYSA-N 0 3 384.303 3.011 10 0 GGAEHN C[C@H](NC(=O)CN1CCC[C@H]2COCC[C@H]21)c1ccc(Br)cc1 ZINC000464848544 566506456 /nfs/dbraw/zinc/50/64/56/566506456.db2.gz GKUWHJKLLSZKBZ-JLJPHGGASA-N 0 3 381.314 3.127 10 0 GGAEHN CN(C)C1(CNC(=O)c2c(F)ccc(C(F)(F)F)c2Br)CC1 ZINC000627777699 566506470 /nfs/dbraw/zinc/50/64/70/566506470.db2.gz MMRJOHJRWZTQTJ-UHFFFAOYSA-N 0 3 383.183 3.431 10 0 GGAEHN C[C@H](NC(=O)CN1CCC[C@@H]2COCC[C@@H]21)c1ccc(Br)cc1 ZINC000464848545 566507338 /nfs/dbraw/zinc/50/73/38/566507338.db2.gz GKUWHJKLLSZKBZ-LXZKKBNFSA-N 0 3 381.314 3.127 10 0 GGAEHN CCN1CCCC[C@H]1CNC(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651305609 566509019 /nfs/dbraw/zinc/50/90/19/566509019.db2.gz PVGNATCGWCHVBE-LSDHHAIUSA-N 0 3 381.314 3.306 10 0 GGAEHN O=C(CCN1CCC[C@H]2COCC[C@@H]21)Nc1ccc(Br)cc1F ZINC000464859891 566509135 /nfs/dbraw/zinc/50/91/35/566509135.db2.gz RJCDJVPREYMXCP-LRDDRELGSA-N 0 3 385.277 3.418 10 0 GGAEHN Cc1c(C(=O)N2CCC[C@H]2CN(C)C)cnn1-c1cccc(Br)c1 ZINC000464921368 566509801 /nfs/dbraw/zinc/50/98/01/566509801.db2.gz NTLCDIJQVFKJNU-INIZCTEOSA-N 0 3 391.313 3.109 10 0 GGAEHN COCC[C@@H](Cc1cccc(Br)c1)C(=O)N1CCC[C@@H]1CN(C)C ZINC000464930700 566510135 /nfs/dbraw/zinc/51/01/35/566510135.db2.gz FBAFZTHLUMOHSR-FUHWJXTLSA-N 0 3 397.357 3.197 10 0 GGAEHN CN(C)C[C@H]1CCCN1C(=O)CCOc1ccc(Cl)cc1Br ZINC000464933281 566510283 /nfs/dbraw/zinc/51/02/83/566510283.db2.gz GLRQDYCZZVHNCK-CYBMUJFWSA-N 0 3 389.721 3.424 10 0 GGAEHN C[C@H](O)CN1CCN(c2ncc(Br)c3ccc(F)cc32)[C@H](C)C1 ZINC000651342834 566513938 /nfs/dbraw/zinc/51/39/38/566513938.db2.gz QKRGVIRWEWZASD-NEPJUHHUSA-N 0 3 382.277 3.028 10 0 GGAEHN CC(C)n1cncc1CNCCC(=O)N(C)Cc1ccccc1Br ZINC000424145671 566514562 /nfs/dbraw/zinc/51/45/62/566514562.db2.gz OAGPTMKLLWJMLR-UHFFFAOYSA-N 0 3 393.329 3.365 10 0 GGAEHN CN(C[C@@H]1CCCN(C)C1)C(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651347175 566514812 /nfs/dbraw/zinc/51/48/12/566514812.db2.gz ZYADSNWTGRDTIK-UKRRQHHQSA-N 0 3 381.314 3.115 10 0 GGAEHN CN(C[C@@H]1CCCN(C)C1)C(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000651347174 566515522 /nfs/dbraw/zinc/51/55/22/566515522.db2.gz ZYADSNWTGRDTIK-HIFRSBDPSA-N 0 3 381.314 3.115 10 0 GGAEHN Cc1c(Br)cccc1C[C@@H](CO)CNCc1cncn1C(C)C ZINC000424166075 566516558 /nfs/dbraw/zinc/51/65/58/566516558.db2.gz CDDGSKUWZTYCCO-OAHLLOKOSA-N 0 3 380.330 3.476 10 0 GGAEHN Cc1ccc(C[C@@H](CO)CNCc2cncn2C(C)C)cc1Br ZINC000424170501 566517412 /nfs/dbraw/zinc/51/74/12/566517412.db2.gz IDSGXPKBQFIPCE-MRXNPFEDSA-N 0 3 380.330 3.476 10 0 GGAEHN CN1CC[C@H](CNCc2cccc(Br)c2OC(F)F)CC1=O ZINC000424193950 566518278 /nfs/dbraw/zinc/51/82/78/566518278.db2.gz WSHFZGPXQLKQEM-JTQLQIEISA-N 0 3 377.229 3.009 10 0 GGAEHN CN1CC[C@@H](CNCc2cc(C(F)(F)F)ccc2Br)CC1=O ZINC000424192714 566518469 /nfs/dbraw/zinc/51/84/69/566518469.db2.gz UKGMKNFVHJZYHN-SNVBAGLBSA-N 0 3 379.220 3.426 10 0 GGAEHN C[N@@H+]1C[C@@H](CNC(=O)c2cc([O-])cc(Br)c2)[C@H](c2ccccc2)C1 ZINC000627924496 566518904 /nfs/dbraw/zinc/51/89/04/566518904.db2.gz FSRKCRHKQFNKTJ-QAPCUYQASA-N 0 3 389.293 3.230 10 0 GGAEHN C[N@H+]1C[C@@H](CNC(=O)c2cc([O-])cc(Br)c2)[C@H](c2ccccc2)C1 ZINC000627924496 566518910 /nfs/dbraw/zinc/51/89/10/566518910.db2.gz FSRKCRHKQFNKTJ-QAPCUYQASA-N 0 3 389.293 3.230 10 0 GGAEHN OCCN1CCCC[C@@H]1CN[C@H](c1ccc(Br)cc1)[C@@H]1CCCO1 ZINC000651379972 566519810 /nfs/dbraw/zinc/51/98/10/566519810.db2.gz IUJRJOGDMIKJPY-CEXWTWQISA-N 0 3 397.357 3.106 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)c2cnc(-c3c(F)cccc3F)s2)CCSC1 ZINC000651434769 566523607 /nfs/dbraw/zinc/52/36/07/566523607.db2.gz LGZSQNITDRRHNQ-QGZVFWFLSA-N 0 3 383.489 3.255 10 0 GGAEHN O=C1NC2(CCCC2)C(=O)N1CCCNCc1cc(Cl)sc1Cl ZINC000449064385 566525122 /nfs/dbraw/zinc/52/51/22/566525122.db2.gz UJHUNBUQPHOKLH-UHFFFAOYSA-N 0 3 376.309 3.399 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000628037278 566525880 /nfs/dbraw/zinc/52/58/80/566525880.db2.gz VSQVGVCTPXSSAS-IPALMDDQSA-N 0 3 377.326 3.324 10 0 GGAEHN CC(C)(C)N1CC[C@H](NC(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)C1 ZINC000628045708 566527753 /nfs/dbraw/zinc/52/77/53/566527753.db2.gz LINZVVLIYMQHFN-WGHIXYSZSA-N 0 3 377.326 3.324 10 0 GGAEHN Clc1cc(CNCCCN2CCN(c3ncccn3)CC2)c(Cl)s1 ZINC000449078585 566528214 /nfs/dbraw/zinc/52/82/14/566528214.db2.gz VREATWNMUMBSOU-UHFFFAOYSA-N 0 3 386.352 3.147 10 0 GGAEHN C[C@@H](NCCOc1ccc(S(C)(=O)=O)cc1)c1ccc2ncsc2c1 ZINC000485810882 566528964 /nfs/dbraw/zinc/52/89/64/566528964.db2.gz BJRVVMOOQBDPHW-CYBMUJFWSA-N 0 3 376.503 3.429 10 0 GGAEHN CCN1CCCN(c2nnc([C@@H]3CCCS3)n2Cc2cccs2)CC1 ZINC000424354489 566529048 /nfs/dbraw/zinc/52/90/48/566529048.db2.gz IDHPILUHORNAPL-INIZCTEOSA-N 0 3 377.583 3.488 10 0 GGAEHN CC[C@H](CO)N1CCN(Cc2cc(Br)cc(C(F)(F)F)c2)CC1 ZINC000538721454 566529276 /nfs/dbraw/zinc/52/92/76/566529276.db2.gz LYPNTYLEFLNRIE-OAHLLOKOSA-N 0 3 395.263 3.356 10 0 GGAEHN Cc1cc(CN)cc(NC(=O)N[C@](C)(CO)c2ccc(Br)cc2)c1 ZINC000424424550 566533770 /nfs/dbraw/zinc/53/37/70/566533770.db2.gz ICLSRWZIENQDOH-GOSISDBHSA-N 0 3 392.297 3.245 10 0 GGAEHN CNC(=O)[C@@H](C)Oc1ccc(Br)cc1CNCCCCSC ZINC000449157802 566533568 /nfs/dbraw/zinc/53/35/68/566533568.db2.gz RIHOCRZNCHWDLX-GFCCVEGCSA-N 0 3 389.359 3.195 10 0 GGAEHN Cc1cc(CN)cc(NC(=O)N[C@@](C)(CO)c2ccc(Br)cc2)c1 ZINC000424424551 566534697 /nfs/dbraw/zinc/53/46/97/566534697.db2.gz ICLSRWZIENQDOH-SFHVURJKSA-N 0 3 392.297 3.245 10 0 GGAEHN O=S(=O)(C[C@H](O)CN[C@H]1CC[C@@H](c2ccc(Cl)cc2)C1)c1cccs1 ZINC000449195744 566535297 /nfs/dbraw/zinc/53/52/97/566535297.db2.gz VQGXOUUJCGNZJL-HYVNUMGLSA-N 0 3 399.965 3.462 10 0 GGAEHN NC(=O)N[C@@H]1CCN(Cc2ccc(-c3cccc(Br)c3)s2)C1 ZINC000538795245 566536460 /nfs/dbraw/zinc/53/64/60/566536460.db2.gz PAKJIHOZZXSHSC-CYBMUJFWSA-N 0 3 380.311 3.420 10 0 GGAEHN CN1CCC(CC(=O)NC2(c3ccc(Br)cc3)CCOCC2)CC1 ZINC000485892668 566536597 /nfs/dbraw/zinc/53/65/97/566536597.db2.gz YVZBHKSFWRIIRV-UHFFFAOYSA-N 0 3 395.341 3.303 10 0 GGAEHN CN1CC[C@H](NCc2cccc(S(C)(=O)=O)c2)[C@@H]1c1ccc(Cl)cc1 ZINC000449212992 566537639 /nfs/dbraw/zinc/53/76/39/566537639.db2.gz JSGZONPRYDVRGI-OALUTQOASA-N 0 3 378.925 3.279 10 0 GGAEHN COc1ccc(Br)c(CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1 ZINC000465657381 566539496 /nfs/dbraw/zinc/53/94/96/566539496.db2.gz IUDMUQZOYATRIW-GXTWGEPZSA-N 0 3 384.318 3.082 10 0 GGAEHN O=C(Nc1ccc(CN2CCC(O)CC2)cc1)c1nscc1Br ZINC000651605547 566540019 /nfs/dbraw/zinc/54/00/19/566540019.db2.gz KPWFAWQHYHJENE-UHFFFAOYSA-N 0 3 396.310 3.115 10 0 GGAEHN CN1CC[C@H]2[C@@H](CCCN2S(=O)(=O)Cc2cc(Cl)sc2Cl)C1 ZINC000651607162 566540984 /nfs/dbraw/zinc/54/09/84/566540984.db2.gz FUHGVAXREVVCFW-JQWIXIFHSA-N 0 3 383.366 3.301 10 0 GGAEHN C[C@@H](CN1CCCCC1)NC(=O)Cc1noc2ccc(Br)cc21 ZINC000424582563 566541940 /nfs/dbraw/zinc/54/19/40/566541940.db2.gz JEYMCNWXYSVCGQ-LBPRGKRZSA-N 0 3 380.286 3.123 10 0 GGAEHN COc1ccc(CN(C)CCn2cc(Br)cn2)cc1OC1CC1 ZINC000628283976 566542087 /nfs/dbraw/zinc/54/20/87/566542087.db2.gz UHDPHUQEEIRWHF-UHFFFAOYSA-N 0 3 380.286 3.327 10 0 GGAEHN Cc1cc(Br)cc(C)c1S(=O)(=O)NCC1(N(C)C)CCCC1 ZINC000512559380 566543251 /nfs/dbraw/zinc/54/32/51/566543251.db2.gz KOYXBLLQXAGEFZ-UHFFFAOYSA-N 0 3 389.359 3.219 10 0 GGAEHN CN1CCC2(CCCN2S(=O)(=O)Cc2cc(Cl)sc2Cl)CC1 ZINC000651625214 566543688 /nfs/dbraw/zinc/54/36/88/566543688.db2.gz XPVQUBHMEQQIBK-UHFFFAOYSA-N 0 3 383.366 3.445 10 0 GGAEHN COc1ccc(Br)cc1C[C@H](CO)CNCc1oc(C)nc1C ZINC000628302311 566544530 /nfs/dbraw/zinc/54/45/30/566544530.db2.gz YPELPSVFTAUOFV-ZDUSSCGKSA-N 0 3 383.286 3.003 10 0 GGAEHN Cc1cc(N2CCC[C@H](NCc3cccc(F)c3Br)C2)n(C)n1 ZINC000449288210 566544728 /nfs/dbraw/zinc/54/47/28/566544728.db2.gz YFTAHUQSLCRLRG-AWEZNQCLSA-N 0 3 381.293 3.389 10 0 GGAEHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)Cc1noc2ccc(Br)cc21 ZINC000424604060 566545783 /nfs/dbraw/zinc/54/57/83/566545783.db2.gz GVEINKNFYFYXTP-STQMWFEESA-N 0 3 394.313 3.369 10 0 GGAEHN COc1nccnc1CN[C@H](C)CCc1ccc(I)cc1 ZINC000449300549 566546794 /nfs/dbraw/zinc/54/67/94/566546794.db2.gz PGRPIPHIGCEMEJ-GFCCVEGCSA-N 0 3 397.260 3.201 10 0 GGAEHN O=C(Cc1noc2ccc(Br)cc21)N1CCC[C@H]1CN1CCCC1 ZINC000424622636 566548227 /nfs/dbraw/zinc/54/82/27/566548227.db2.gz GRWOZVYPQZYNSV-AWEZNQCLSA-N 0 3 392.297 3.220 10 0 GGAEHN CC(C)(C)[C@H](O)C[C@H](CO)NCc1ccnc2c(Br)cccc12 ZINC000449309700 566549229 /nfs/dbraw/zinc/54/92/29/566549229.db2.gz FDQCXWYBNUPVDG-CZUORRHYSA-N 0 3 381.314 3.245 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)NCCc1nc(C(F)(F)F)cs1 ZINC000465907530 566551384 /nfs/dbraw/zinc/55/13/84/566551384.db2.gz SUVFLVURYPRUJY-TXEJJXNPSA-N 0 3 378.464 3.267 10 0 GGAEHN Cc1cc(CNC[C@@H]2CS(=O)(=O)c3ccccc32)ccc1Br ZINC000449361155 566552650 /nfs/dbraw/zinc/55/26/50/566552650.db2.gz WVLPMGHWFNCUBA-CQSZACIVSA-N 0 3 380.307 3.418 10 0 GGAEHN O=S1(=O)C[C@H](CNCc2ccc(Br)c(F)c2)c2ccccc21 ZINC000449355646 566553199 /nfs/dbraw/zinc/55/31/99/566553199.db2.gz BUDBYZCQXKGTMV-LBPRGKRZSA-N 0 3 384.270 3.249 10 0 GGAEHN C[C@H]1[C@@H](N2CCCC2)CCN1S(=O)(=O)Cc1cc(Cl)sc1Cl ZINC000651705028 566553627 /nfs/dbraw/zinc/55/36/27/566553627.db2.gz DTBRPXSSNRORAU-JQWIXIFHSA-N 0 3 383.366 3.443 10 0 GGAEHN CSC1(CNC(=O)N[C@H](C)c2ccc3ncsc3c2)CCN(C)CC1 ZINC000578810298 566555394 /nfs/dbraw/zinc/55/53/94/566555394.db2.gz AABFHDDZMBJRAF-CYBMUJFWSA-N 0 3 378.567 3.484 10 0 GGAEHN Cc1c[nH]nc1CN1CC[C@H](Cc2cccc(I)c2)C1 ZINC000449391091 566555730 /nfs/dbraw/zinc/55/57/30/566555730.db2.gz HRAOWAVATVAXFW-CQSZACIVSA-N 0 3 381.261 3.387 10 0 GGAEHN COc1c(Br)ccc(C)c1C(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000424670191 566555609 /nfs/dbraw/zinc/55/56/09/566555609.db2.gz ZDKMXZJVGCWLSX-AWEZNQCLSA-N 0 3 381.314 3.467 10 0 GGAEHN Cn1cncc1CN1CC[C@@H](Cc2cccc(I)c2)C1 ZINC000449392579 566555794 /nfs/dbraw/zinc/55/57/94/566555794.db2.gz KLEHVEYRZFSVPG-AWEZNQCLSA-N 0 3 381.261 3.089 10 0 GGAEHN Cc1ncc(CN2CC[C@@H](Cc3cccc(I)c3)C2)cn1 ZINC000449388710 566556346 /nfs/dbraw/zinc/55/63/46/566556346.db2.gz AWNLOKXRTAQCIW-HNNXBMFYSA-N 0 3 393.272 3.454 10 0 GGAEHN COc1cc(OC)c([C@@H](C)NCCC2CCS(=O)(=O)CC2)cc1Cl ZINC000539048716 566556399 /nfs/dbraw/zinc/55/63/99/566556399.db2.gz SJYOUEIHGTVYLY-GFCCVEGCSA-N 0 3 375.918 3.223 10 0 GGAEHN Cn1cc(CN2CC[C@@H](Cc3cccc(I)c3)C2)cn1 ZINC000449395353 566556443 /nfs/dbraw/zinc/55/64/43/566556443.db2.gz POPFIXAYQVBOHS-AWEZNQCLSA-N 0 3 381.261 3.089 10 0 GGAEHN COC[C@@](C)(O)CCNCc1c(C)nn(-c2ccc(Br)cc2)c1C ZINC000449383411 566556455 /nfs/dbraw/zinc/55/64/55/566556455.db2.gz HAOKZVJIFAWMNS-SFHVURJKSA-N 0 3 396.329 3.129 10 0 GGAEHN COC[C@@](C)(O)CCNCc1ccc(Br)c(Br)c1 ZINC000449386328 566556630 /nfs/dbraw/zinc/55/66/30/566556630.db2.gz TVBWHBSEPBXHJL-ZDUSSCGKSA-N 0 3 381.108 3.089 10 0 GGAEHN CCC1(N2CCOCC2)CCN(Cc2ncc(Br)cc2F)CC1 ZINC000628476453 566557301 /nfs/dbraw/zinc/55/73/01/566557301.db2.gz KNIKPAWHUMNUGT-UHFFFAOYSA-N 0 3 386.309 3.060 10 0 GGAEHN CCC1(N2CCOCC2)CCN(Cc2cc(O)ccc2Br)CC1 ZINC000628476276 566557719 /nfs/dbraw/zinc/55/77/19/566557719.db2.gz QJADJRJDARVSBC-UHFFFAOYSA-N 0 3 383.330 3.232 10 0 GGAEHN CCC1(N2CCOCC2)CCN(Cc2cc(C)c(Br)cn2)CC1 ZINC000628476498 566557986 /nfs/dbraw/zinc/55/79/86/566557986.db2.gz RMRLLKZZZSVAFS-UHFFFAOYSA-N 0 3 382.346 3.229 10 0 GGAEHN CN(C)S(=O)(=O)CCCN1CCC(c2ccc(C(F)(F)F)cc2)CC1 ZINC000539097516 566558295 /nfs/dbraw/zinc/55/82/95/566558295.db2.gz XONUUCMLELYVPF-UHFFFAOYSA-N 0 3 378.460 3.166 10 0 GGAEHN CC[C@H](N[C@H](C)CC(=O)Nc1cccc(Br)c1)[C@@H](O)C(F)F ZINC000449422937 566561011 /nfs/dbraw/zinc/56/10/11/566561011.db2.gz MZPYCMORERGWSD-LJWDBELGSA-N 0 3 379.245 3.160 10 0 GGAEHN CC[C@H](NCc1cc(Br)c2c(c1)OCCCO2)[C@@H](O)C(F)F ZINC000449429450 566562011 /nfs/dbraw/zinc/56/20/11/566562011.db2.gz ZZZUHACFMFKTIZ-WCQYABFASA-N 0 3 380.229 3.105 10 0 GGAEHN O[C@@H]1C[C@H]([C@@H]2CCCOC2)N(Cc2ccc(Br)c3cccnc23)C1 ZINC000449431189 566562179 /nfs/dbraw/zinc/56/21/79/566562179.db2.gz CYQPZTSXDSIKCJ-IIDMSEBBSA-N 0 3 391.309 3.359 10 0 GGAEHN O[C@@H]1C[C@@H]([C@H]2CCCOC2)N(Cc2ccnc3c(Br)cccc23)C1 ZINC000449433575 566562497 /nfs/dbraw/zinc/56/24/97/566562497.db2.gz MXJSXROGGVIUKO-DAYGRLMNSA-N 0 3 391.309 3.359 10 0 GGAEHN Cc1cc(Br)cc(C)c1CNC(=O)N[C@H]1CN(C2CC2)C[C@@H]1C ZINC000466293877 566563299 /nfs/dbraw/zinc/56/32/99/566563299.db2.gz RUVZVRWQUPOHJK-GUYCJALGSA-N 0 3 380.330 3.348 10 0 GGAEHN CN(C)CCn1cc(NC(=O)N2CCc3c(Cl)c(Cl)ccc3C2)cn1 ZINC000673868019 566563597 /nfs/dbraw/zinc/56/35/97/566563597.db2.gz VLLAOKZFBFCSSS-UHFFFAOYSA-N 0 3 382.295 3.342 10 0 GGAEHN Cc1cc(Br)cc(C)c1CNC(=O)Nc1cnn(CCN(C)C)c1 ZINC000673869731 566563678 /nfs/dbraw/zinc/56/36/78/566563678.db2.gz UAXBXMZVKNTSBQ-UHFFFAOYSA-N 0 3 394.317 3.146 10 0 GGAEHN CN(C)CCn1cc(NC(=O)N[C@H]2CCSc3ccc(Cl)cc32)cn1 ZINC000673871751 566563794 /nfs/dbraw/zinc/56/37/94/566563794.db2.gz PGPRAMAYZLLXAQ-HNNXBMFYSA-N 0 3 379.917 3.457 10 0 GGAEHN CCN(Cc1ccccc1Br)C(=O)Nc1cnn(CCN(C)C)c1 ZINC000673870129 566564260 /nfs/dbraw/zinc/56/42/60/566564260.db2.gz VLJWQQJZXAJEBB-UHFFFAOYSA-N 0 3 394.317 3.261 10 0 GGAEHN C[C@@H](CNC(=O)N(C)[C@@H]1CCN(C2CC2)C1)Oc1cccc(Br)c1 ZINC000466303071 566564633 /nfs/dbraw/zinc/56/46/33/566564633.db2.gz OAIIFEOITNWNAA-XJKSGUPXSA-N 0 3 396.329 3.095 10 0 GGAEHN CN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2noc3ccc(Br)cc32)C1 ZINC000424737959 566564816 /nfs/dbraw/zinc/56/48/16/566564816.db2.gz LZBFAIZVVNINIP-MLGOLLRUSA-N 0 3 392.297 3.076 10 0 GGAEHN O=C1c2ccccc2C(=O)N1CCCNCc1ccc(Br)c(F)c1 ZINC000512874608 566565661 /nfs/dbraw/zinc/56/56/61/566565661.db2.gz QSPLHWBVXBQIMY-UHFFFAOYSA-N 0 3 391.240 3.364 10 0 GGAEHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)Cc1noc2ccc(Br)cc21 ZINC000424745420 566566706 /nfs/dbraw/zinc/56/67/06/566566706.db2.gz KCGNNHLCXDSAAY-LBPRGKRZSA-N 0 3 394.313 3.322 10 0 GGAEHN CC[C@@H]1C[C@@H](C[NH2+]CC[N-]S(=O)(=O)c2cccc(Cl)c2Cl)CCO1 ZINC000512903530 566567842 /nfs/dbraw/zinc/56/78/42/566567842.db2.gz AIWWCSQJYSRSRO-QWHCGFSZSA-N 0 3 395.352 3.067 10 0 GGAEHN CC[C@H]1C[C@H](C[NH2+]CC[N-]S(=O)(=O)c2cccc(Cl)c2Cl)CCO1 ZINC000512903529 566568218 /nfs/dbraw/zinc/56/82/18/566568218.db2.gz AIWWCSQJYSRSRO-OLZOCXBDSA-N 0 3 395.352 3.067 10 0 GGAEHN CC(C)c1nnc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)s1 ZINC000559772574 566568528 /nfs/dbraw/zinc/56/85/28/566568528.db2.gz FUBKGBAYSGADBW-UHFFFAOYSA-N 0 3 376.448 3.197 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)N[C@H]1CCN(C)[C@H](C)C1)CC2 ZINC000539227825 566569102 /nfs/dbraw/zinc/56/91/02/566569102.db2.gz ZIACMAHRVSRNDW-CJNGLKHVSA-N 0 3 380.330 3.308 10 0 GGAEHN Cn1cc(N2CCC[C@H](N[C@@H]3CCc4sc(Br)cc43)C2)cn1 ZINC000559767262 566569335 /nfs/dbraw/zinc/56/93/35/566569335.db2.gz QMFZRJWLAOKCPR-SMDDNHRTSA-N 0 3 381.343 3.490 10 0 GGAEHN CC(C)N1CCC[C@H](NC(=O)Cc2noc3ccc(Br)cc32)C1 ZINC000424775072 566569660 /nfs/dbraw/zinc/56/96/60/566569660.db2.gz HVAFCFHEHLMFBB-ZDUSSCGKSA-N 0 3 380.286 3.122 10 0 GGAEHN FCC1(CNCc2cnn(-c3ccc(Br)cc3)c2)CCOCC1 ZINC000449485030 566569852 /nfs/dbraw/zinc/56/98/52/566569852.db2.gz KGUGLWSZGHAABX-UHFFFAOYSA-N 0 3 382.277 3.491 10 0 GGAEHN CC(C)[C@@H]1C[C@H](CNCc2ncc(I)s2)CCO1 ZINC000449491447 566569916 /nfs/dbraw/zinc/56/99/16/566569916.db2.gz GWXUFLXJRSSQCA-MNOVXSKESA-N 0 3 380.295 3.289 10 0 GGAEHN COC(=O)[C@@H]1CCCC[C@@H]1NCc1cnc2c(C)cc(Br)cn12 ZINC000449510129 566571599 /nfs/dbraw/zinc/57/15/99/566571599.db2.gz KKKOUCPXCCOJLK-CABCVRRESA-N 0 3 380.286 3.227 10 0 GGAEHN CN(C[C@H]1CCCN(C)C1)C(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000604644246 566571912 /nfs/dbraw/zinc/57/19/12/566571912.db2.gz ADDWLOQKSSQHBX-XJKSGUPXSA-N 0 3 396.329 3.256 10 0 GGAEHN OC[C@@]1(CNCc2cn3ccc(Br)cc3n2)CCc2ccccc21 ZINC000651883295 566571888 /nfs/dbraw/zinc/57/18/88/566571888.db2.gz AMZQVUMHIBKYEX-IBGZPJMESA-N 0 3 386.293 3.063 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@H]1CNCc1ccc(-c2cccc(F)c2)s1 ZINC000512992605 566571999 /nfs/dbraw/zinc/57/19/99/566571999.db2.gz MINPGSPQYLWNCK-INIZCTEOSA-N 0 3 382.526 3.458 10 0 GGAEHN CS(=O)(=O)N1CCCC[C@H]1CNCc1cc(Cl)cc(C(F)(F)F)c1 ZINC000512995606 566572472 /nfs/dbraw/zinc/57/24/72/566572472.db2.gz FNYQCIAJORAUBG-AWEZNQCLSA-N 0 3 384.851 3.263 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)N[C@H]1CN(C3CC3)C[C@@H]1C)CC2 ZINC000539285389 566572482 /nfs/dbraw/zinc/57/24/82/566572482.db2.gz PJHWKYIDYIYIRG-UGSOOPFHSA-N 0 3 392.341 3.308 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)N[C@H]1CN(C3CC3)C[C@H]1C)CC2 ZINC000539285381 566572682 /nfs/dbraw/zinc/57/26/82/566572682.db2.gz PJHWKYIDYIYIRG-ACJLOTCBSA-N 0 3 392.341 3.308 10 0 GGAEHN O=C(c1cc(Cl)c[nH]1)N1CCC(NCc2ccc(Br)cn2)CC1 ZINC000512992056 566572797 /nfs/dbraw/zinc/57/27/97/566572797.db2.gz IRNMCRBHSRFRKL-UHFFFAOYSA-N 0 3 397.704 3.220 10 0 GGAEHN O=C(NC[C@@H]1CCCCN1C1CC1)[C@H]1CCOc2ccc(Br)cc21 ZINC000651897175 566573182 /nfs/dbraw/zinc/57/31/82/566573182.db2.gz QPFXXFUMUACWSY-HOTGVXAUSA-N 0 3 393.325 3.448 10 0 GGAEHN COc1sc(CNC[C@]2(CO)CCc3ccccc32)cc1Br ZINC000651884518 566573531 /nfs/dbraw/zinc/57/35/31/566573531.db2.gz KAKZQMUOGSTLRS-KRWDZBQOSA-N 0 3 382.323 3.485 10 0 GGAEHN COc1c(Br)ccc(C)c1C(=O)N1C[C@H](N2CCCC2)C[C@H]1C ZINC000424833269 566576477 /nfs/dbraw/zinc/57/64/77/566576477.db2.gz JQKHVETUNFRBMY-ZIAGYGMSSA-N 0 3 381.314 3.465 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)c1ccc(Br)c(OC(F)(F)F)c1 ZINC000513071549 566577163 /nfs/dbraw/zinc/57/71/63/566577163.db2.gz UQOYOVRJVWGXQM-JTQLQIEISA-N 0 3 381.192 3.172 10 0 GGAEHN COc1cc(Br)ccc1CN[C@@H]1CCO[C@@H](c2ccnn2C)C1 ZINC000449589303 566577294 /nfs/dbraw/zinc/57/72/94/566577294.db2.gz JTCCLFRBSYHCBG-RHSMWYFYSA-N 0 3 380.286 3.201 10 0 GGAEHN COc1cc(Br)ccc1CN[C@H]1CCO[C@H](c2ccnn2C)C1 ZINC000449589305 566577318 /nfs/dbraw/zinc/57/73/18/566577318.db2.gz JTCCLFRBSYHCBG-YOEHRIQHSA-N 0 3 380.286 3.201 10 0 GGAEHN Brc1ccccc1-n1cc(CN[C@@H](C2CC2)C2CCOCC2)nn1 ZINC000651930633 566577746 /nfs/dbraw/zinc/57/77/46/566577746.db2.gz YVWUDHVRXQTNKM-SFHVURJKSA-N 0 3 391.313 3.325 10 0 GGAEHN Brc1ccccc1-n1cc(CN[C@H](C2CC2)C2CCOCC2)nn1 ZINC000651930632 566577841 /nfs/dbraw/zinc/57/78/41/566577841.db2.gz YVWUDHVRXQTNKM-GOSISDBHSA-N 0 3 391.313 3.325 10 0 GGAEHN CCCn1cc(CNC[C@@H](CO)Cc2ccc(C)c(Br)c2)cn1 ZINC000449597513 566578850 /nfs/dbraw/zinc/57/88/50/566578850.db2.gz FHQOYYISLIHGJL-INIZCTEOSA-N 0 3 380.330 3.305 10 0 GGAEHN Cc1ccc([O-])c(C[NH2+]C[C@H](CO)Cc2ccc(C)c(Br)c2)n1 ZINC000449596417 566579207 /nfs/dbraw/zinc/57/92/07/566579207.db2.gz AZEKDZREAXDQRZ-OAHLLOKOSA-N 0 3 379.298 3.107 10 0 GGAEHN Cc1c(Br)cc(CNCC[C@@]2(O)CCOC2)cc1Br ZINC000651944642 566579505 /nfs/dbraw/zinc/57/95/05/566579505.db2.gz BJFDUIIORUJOAI-CQSZACIVSA-N 0 3 393.119 3.151 10 0 GGAEHN Brc1ccc2c(c1)C=C(CN1CCC(Cn3cnnc3)CC1)CO2 ZINC000651955678 566580108 /nfs/dbraw/zinc/58/01/08/566580108.db2.gz VNBYYRCMHRTQKZ-UHFFFAOYSA-N 0 3 389.297 3.229 10 0 GGAEHN Cc1ccc(C[C@H](CO)CNCc2cnn3ccccc23)cc1Br ZINC000449601203 566580444 /nfs/dbraw/zinc/58/04/44/566580444.db2.gz QXWVEMNUIDJWMD-INIZCTEOSA-N 0 3 388.309 3.346 10 0 GGAEHN CC[C@H](OCCNCc1ccc(S(N)(=O)=O)c(Cl)c1)c1ccccc1 ZINC000651978535 566581438 /nfs/dbraw/zinc/58/14/38/566581438.db2.gz QLKNNDVFXNTAEH-KRWDZBQOSA-N 0 3 382.913 3.245 10 0 GGAEHN CCn1nccc1CCN[C@](C)(CC(=O)OC)c1ccc(Br)cc1 ZINC000513121697 566581853 /nfs/dbraw/zinc/58/18/53/566581853.db2.gz HTHSJASTKLSQMY-GOSISDBHSA-N 0 3 394.313 3.276 10 0 GGAEHN COc1ncc(C(=O)Nc2ccc(CN(C)C)cc2F)cc1Br ZINC000424877238 566583702 /nfs/dbraw/zinc/58/37/02/566583702.db2.gz IPTKVPXFFOWOGR-UHFFFAOYSA-N 0 3 382.233 3.306 10 0 GGAEHN CCOc1cc(CNC[C@@H](CO)c2cccnc2)cc(Br)c1OC ZINC000579156594 566584926 /nfs/dbraw/zinc/58/49/26/566584926.db2.gz FELYXQNAMHGHPG-HNNXBMFYSA-N 0 3 395.297 3.117 10 0 GGAEHN Cc1nc2ccccn2c(=O)c1CCN1CCc2cc(Br)ccc2C1 ZINC000579166998 566585013 /nfs/dbraw/zinc/58/50/13/566585013.db2.gz RNBLHDDILYGSGB-UHFFFAOYSA-N 0 3 398.304 3.366 10 0 GGAEHN COC(=O)C[C@](C)(NCCn1ccnc1C)c1ccc(Br)cc1 ZINC000513158989 566585689 /nfs/dbraw/zinc/58/56/89/566585689.db2.gz JLSUZNVFAUDIMK-KRWDZBQOSA-N 0 3 380.286 3.022 10 0 GGAEHN CN(C)CC1(NC(=O)CSCc2ccc(Br)cc2F)CCC1 ZINC000466583259 566587724 /nfs/dbraw/zinc/58/77/24/566587724.db2.gz CPBKYDBQCBBVJM-UHFFFAOYSA-N 0 3 389.334 3.422 10 0 GGAEHN COc1c(Br)cccc1CN[C@H]1CCCc2c1ccc(=O)n2C ZINC000652049377 566587858 /nfs/dbraw/zinc/58/78/58/566587858.db2.gz GKBGCAOYFKXZKC-HNNXBMFYSA-N 0 3 377.282 3.324 10 0 GGAEHN COc1cc(Br)ccc1CN[C@H]1CCCc2c1ccc(=O)n2C ZINC000652049597 566588050 /nfs/dbraw/zinc/58/80/50/566588050.db2.gz KIGYJLVXDIDFKK-HNNXBMFYSA-N 0 3 377.282 3.324 10 0 GGAEHN COc1ccc(Br)cc1C[C@H](CO)CNCc1cnccc1C ZINC000449678642 566588770 /nfs/dbraw/zinc/58/87/70/566588770.db2.gz FYKUJONOJAECCN-AWEZNQCLSA-N 0 3 379.298 3.102 10 0 GGAEHN CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)NCCN1CCCC[C@H]1C ZINC000513191389 566589480 /nfs/dbraw/zinc/58/94/80/566589480.db2.gz LKMPNHRBMBWLDW-CZUORRHYSA-N 0 3 385.961 3.147 10 0 GGAEHN COC[C@](C)(CCO)NCc1cc(Br)cc(Br)c1 ZINC000579220592 566589493 /nfs/dbraw/zinc/58/94/93/566589493.db2.gz FRGAQHMRMVGJMG-ZDUSSCGKSA-N 0 3 381.108 3.089 10 0 GGAEHN O[C@H](CNCCOc1ncccc1Cl)COc1c(Cl)cccc1Cl ZINC000579222867 566591331 /nfs/dbraw/zinc/59/13/31/566591331.db2.gz GYFORWICZFRLKI-LLVKDONJSA-N 0 3 391.682 3.450 10 0 GGAEHN COc1cc(C)nc(CNC[C@H](CO)Cc2ccc(F)c(Br)c2)c1 ZINC000449685275 566592730 /nfs/dbraw/zinc/59/27/30/566592730.db2.gz RWDPWOCHKCNZDZ-CQSZACIVSA-N 0 3 397.288 3.241 10 0 GGAEHN CCCn1cc(CNC[C@@H](CO)Cc2cccc(Br)c2C)cn1 ZINC000449686964 566593012 /nfs/dbraw/zinc/59/30/12/566593012.db2.gz ZIRALEQESZHQQT-HNNXBMFYSA-N 0 3 380.330 3.305 10 0 GGAEHN CCCn1cc(CNC[C@H](CO)Cc2cc(Br)ccc2OC)cn1 ZINC000449685717 566593084 /nfs/dbraw/zinc/59/30/84/566593084.db2.gz VOLZJUIJLQBKCN-CQSZACIVSA-N 0 3 396.329 3.005 10 0 GGAEHN CN(C)CCOc1cc(CNC(=O)Nc2cc(Cl)c(Cl)cn2)ccn1 ZINC000466714222 566593517 /nfs/dbraw/zinc/59/35/17/566593517.db2.gz VQMMZYPFKRPICU-UHFFFAOYSA-N 0 3 384.267 3.046 10 0 GGAEHN CN(CCC(F)(F)F)[C@H](CNCc1cnnn1C)c1ccc(Cl)cc1 ZINC000560077052 566594789 /nfs/dbraw/zinc/59/47/89/566594789.db2.gz OJAXZHVVHCTTOC-OAHLLOKOSA-N 0 3 375.826 3.184 10 0 GGAEHN CC[C@@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1cccc(Br)c1 ZINC000579264208 566595541 /nfs/dbraw/zinc/59/55/41/566595541.db2.gz BFMZKJXAAFYSSG-JKSUJKDBSA-N 0 3 389.359 3.304 10 0 GGAEHN CNC(=O)[C@@H](C)Oc1ccc(Br)cc1CNC[C@@H]1C[C@H]1C1CC1 ZINC000449740470 566597258 /nfs/dbraw/zinc/59/72/58/566597258.db2.gz GLRMEDXVUYILIZ-FFSVYQOJSA-N 0 3 381.314 3.098 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCC1)[C@H]1CCOc2ccc(Br)cc21 ZINC000628966373 566598564 /nfs/dbraw/zinc/59/85/64/566598564.db2.gz QZXCFJMYBHSSJO-CVEARBPZSA-N 0 3 393.325 3.448 10 0 GGAEHN O=C(CCOc1ccccc1Br)NC[C@@H]1CCN1C1CCCC1 ZINC000628966711 566598934 /nfs/dbraw/zinc/59/89/34/566598934.db2.gz MJDPCJYWUGIGSQ-HNNXBMFYSA-N 0 3 381.314 3.351 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCC1)[C@@H]1CCOc2ccc(Br)cc21 ZINC000628966376 566599143 /nfs/dbraw/zinc/59/91/43/566599143.db2.gz QZXCFJMYBHSSJO-JKSUJKDBSA-N 0 3 393.325 3.448 10 0 GGAEHN COc1cc(Br)ccc1CN[C@@H]1CCO[C@H](c2nccn2C)C1 ZINC000449773358 566601034 /nfs/dbraw/zinc/60/10/34/566601034.db2.gz MSZYQUYIEXASJP-ZBFHGGJFSA-N 0 3 380.286 3.201 10 0 GGAEHN CN(C)C[C@H](NC(=O)CN(C)[C@H]1CCSC1)c1ccc(Cl)c(Cl)c1 ZINC000628969841 566601951 /nfs/dbraw/zinc/60/19/51/566601951.db2.gz ZNEPRKYFVZPFQN-BBRMVZONSA-N 0 3 390.380 3.150 10 0 GGAEHN CCc1ccc(S(=O)(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)s1 ZINC000486602516 566602500 /nfs/dbraw/zinc/60/25/00/566602500.db2.gz YLKVHKVFFPWKDK-RDJZCZTQSA-N 0 3 378.563 3.499 10 0 GGAEHN C[C@@H]1COCC[C@@H]1C(=O)Nc1cc(Br)ccc1N(C)CCN(C)C ZINC000425097549 566603737 /nfs/dbraw/zinc/60/37/37/566603737.db2.gz IHHNCXWKPBZNBV-HIFRSBDPSA-N 0 3 398.345 3.058 10 0 GGAEHN CN(C)CCN(C)c1ccc(Br)cc1NC(=O)[C@H]1CCCOCC1 ZINC000425095241 566603804 /nfs/dbraw/zinc/60/38/04/566603804.db2.gz ASPUCPOESABHBB-AWEZNQCLSA-N 0 3 398.345 3.202 10 0 GGAEHN CN(C)CCN(C)c1ccc(Br)cc1NC(=O)[C@H]1C[C@@H]1C(F)F ZINC000425096767 566603843 /nfs/dbraw/zinc/60/38/43/566603843.db2.gz FXDVTUFGJCEXFE-RYUDHWBXSA-N 0 3 390.272 3.287 10 0 GGAEHN CN1CCC[C@@]2(CCN(C(=O)[C@@H]3CCOc4ccc(Br)cc43)C2)C1 ZINC000652362143 566605524 /nfs/dbraw/zinc/60/55/24/566605524.db2.gz ZBGJHAYOICLENF-DNVCBOLYSA-N 0 3 393.325 3.260 10 0 GGAEHN COc1c(Br)cc(CN(C)[C@@H]2CCOC2)cc1Br ZINC000539839492 566606144 /nfs/dbraw/zinc/60/61/44/566606144.db2.gz BKAKXZUQQFLPRH-SNVBAGLBSA-N 0 3 379.092 3.441 10 0 GGAEHN C/C(=C\c1ccc(Cl)cc1)CNC[C@H](O)CS(=O)(=O)c1cccs1 ZINC000513539976 566608409 /nfs/dbraw/zinc/60/84/09/566608409.db2.gz TXTFFEAESUFVGX-WQMJKPAKSA-N 0 3 385.938 3.229 10 0 GGAEHN COC(=O)c1ccc(CN2CCC[C@@H]([C@@H]3CCOC3)C2)c(Br)c1 ZINC000560261163 566611133 /nfs/dbraw/zinc/61/11/33/566611133.db2.gz PXLHRQDRYZBOJE-GDBMZVCRSA-N 0 3 382.298 3.484 10 0 GGAEHN NC(=O)N[C@@H]1CCN(Cc2ccc(-c3ccc(Br)cc3)s2)C1 ZINC000539894780 566612054 /nfs/dbraw/zinc/61/20/54/566612054.db2.gz NBYBTYIQOVUTES-CYBMUJFWSA-N 0 3 380.311 3.420 10 0 GGAEHN O=C(NCCN[C@@H]1CCN(c2ccccc2)C1)c1ccc(Br)cc1 ZINC000674879198 566614042 /nfs/dbraw/zinc/61/40/42/566614042.db2.gz BGBBWJVKYHJCLC-QGZVFWFLSA-N 0 3 388.309 3.047 10 0 GGAEHN CCCN(C(=O)[C@@H]1CCOc2ccc(Br)cc21)[C@@H]1CCN(C)C1 ZINC000652489964 566615007 /nfs/dbraw/zinc/61/50/07/566615007.db2.gz QADYXKNYXFOBER-HUUCEWRRSA-N 0 3 381.314 3.258 10 0 GGAEHN O[C@H](COC[C@H]1CCCO1)CN1CCC[C@H]1c1ccccc1Br ZINC000674875776 566615080 /nfs/dbraw/zinc/61/50/80/566615080.db2.gz SLLQXEGZVAELDV-DAYGRLMNSA-N 0 3 384.314 3.143 10 0 GGAEHN O=C(NCCN[C@H]1CCN(c2ccccc2)C1)c1cccc(Br)c1 ZINC000674882338 566615104 /nfs/dbraw/zinc/61/51/04/566615104.db2.gz IUDCGQQHBJPSHE-KRWDZBQOSA-N 0 3 388.309 3.047 10 0 GGAEHN O=C(NCCCN1CCC(O)CC1)c1ccc2scc(Br)c2c1 ZINC000449935616 566618266 /nfs/dbraw/zinc/61/82/66/566618266.db2.gz RYHSQKLVONNNEQ-UHFFFAOYSA-N 0 3 397.338 3.240 10 0 GGAEHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)CSCc1cc(-c2cccs2)on1 ZINC000467037747 566620282 /nfs/dbraw/zinc/62/02/82/566620282.db2.gz ZDVYALOPDGQNJL-WFASDCNBSA-N 0 3 377.535 3.235 10 0 GGAEHN CC(C(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1)S(C)(=O)=O ZINC000629182765 566621727 /nfs/dbraw/zinc/62/17/27/566621727.db2.gz BNPHFFDRHBDFAW-IAQYHMDHSA-N 0 3 380.853 3.044 10 0 GGAEHN CN(C(=O)Cc1c[nH]c2cccc(Br)c12)[C@H]1CN2CCC1CC2 ZINC000513777087 566622083 /nfs/dbraw/zinc/62/20/83/566622083.db2.gz PGXXUWQZNWSVEM-INIZCTEOSA-N 0 3 376.298 3.026 10 0 GGAEHN CC1(C)NC(=O)CC[C@@H]1NCc1cc(Br)ccc1OC(F)F ZINC000579619415 566624787 /nfs/dbraw/zinc/62/47/87/566624787.db2.gz MDOSCEVXNUKOAN-LBPRGKRZSA-N 0 3 377.229 3.197 10 0 GGAEHN CC[C@H](Cc1ccccc1Br)C(=O)NC[C@@H]1CCCN1CCOC ZINC000467097934 566626194 /nfs/dbraw/zinc/62/61/94/566626194.db2.gz TVDRZCKZKPTQEE-WBVHZDCISA-N 0 3 397.357 3.245 10 0 GGAEHN CN1C[C@@H]2CCCN(c3ccc(-c4ccc(Br)s4)nn3)[C@@H]2C1 ZINC000425277128 566628124 /nfs/dbraw/zinc/62/81/24/566628124.db2.gz CGBMKFQHUSNOAU-WCQYABFASA-N 0 3 379.327 3.498 10 0 GGAEHN CC[C@@H](CN1CCCC1)NC(=O)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000606372884 566629048 /nfs/dbraw/zinc/62/90/48/566629048.db2.gz HDLUAPYZVOARGJ-ZDUSSCGKSA-N 0 3 392.297 3.307 10 0 GGAEHN CC[C@@H](C)N[C@H](CNC(=O)c1cnc(OC)c(Br)c1)c1ccco1 ZINC000425300267 566628954 /nfs/dbraw/zinc/62/89/54/566628954.db2.gz HASYAAXNWHDEFQ-BXUZGUMPSA-N 0 3 396.285 3.305 10 0 GGAEHN O=C1c2ccccc2C(=O)N1CCN[C@@H]1CCc2c1cccc2Br ZINC000513870313 566630941 /nfs/dbraw/zinc/63/09/41/566630941.db2.gz XRPKDHYVZAUUEN-QGZVFWFLSA-N 0 3 385.261 3.322 10 0 GGAEHN C[C@H](C(=O)Nc1ccc(Cl)cc1C(F)(F)F)N1CCNC[C@](C)(F)C1 ZINC000579713029 566631795 /nfs/dbraw/zinc/63/17/95/566631795.db2.gz YGPJWOQZCWYJIT-BMIGLBTASA-N 0 3 381.801 3.319 10 0 GGAEHN CS[C@@H]1CC[C@@H]1NCc1cccnc1Oc1cccc(S(C)(=O)=O)c1 ZINC000425345685 566632710 /nfs/dbraw/zinc/63/27/10/566632710.db2.gz JVBRRRRCYIPGGE-DLBZAZTESA-N 0 3 378.519 3.261 10 0 GGAEHN C[C@H](C(=O)Nc1ccc(Cl)cc1C(F)(F)F)N1CCNC[C@@](C)(F)C1 ZINC000579713031 566632645 /nfs/dbraw/zinc/63/26/45/566632645.db2.gz YGPJWOQZCWYJIT-MEBBXXQBSA-N 0 3 381.801 3.319 10 0 GGAEHN Brc1ccc(CN2CC[C@H](c3nc[nH]n3)C2)cc1Br ZINC000425351965 566633221 /nfs/dbraw/zinc/63/32/21/566633221.db2.gz HDLCBSXRPSFAGU-JTQLQIEISA-N 0 3 386.091 3.319 10 0 GGAEHN COC(=O)[C@@H]1CN(Cc2conc2C)C[C@H]1c1ccc(Br)cc1 ZINC000425344184 566633275 /nfs/dbraw/zinc/63/32/75/566633275.db2.gz CACGRIHPZVJJND-JKSUJKDBSA-N 0 3 379.254 3.134 10 0 GGAEHN Brc1cc(Br)cc(CN2CC[C@@H](c3nc[nH]n3)C2)c1 ZINC000425350637 566633450 /nfs/dbraw/zinc/63/34/50/566633450.db2.gz FNDZCDZISSYCMM-SNVBAGLBSA-N 0 3 386.091 3.319 10 0 GGAEHN Brc1cc(Br)cc(CN2CC[C@H](c3nc[nH]n3)C2)c1 ZINC000425350634 566633728 /nfs/dbraw/zinc/63/37/28/566633728.db2.gz FNDZCDZISSYCMM-JTQLQIEISA-N 0 3 386.091 3.319 10 0 GGAEHN CS[C@H]1CC[C@H]1NCc1cccnc1Oc1cccc(S(C)(=O)=O)c1 ZINC000425345698 566633956 /nfs/dbraw/zinc/63/39/56/566633956.db2.gz JVBRRRRCYIPGGE-SJORKVTESA-N 0 3 378.519 3.261 10 0 GGAEHN COc1ccc([C@@H](CNCc2c(Br)cnn2C)N2CCCC2)cc1 ZINC000486934649 566635969 /nfs/dbraw/zinc/63/59/69/566635969.db2.gz ZAFOEPTXPSRCIP-QGZVFWFLSA-N 0 3 393.329 3.118 10 0 GGAEHN CN1CCC[C@H]1CNC(=O)Nc1cc(I)ccc1Cl ZINC000467929462 566676016 /nfs/dbraw/zinc/67/60/16/566676016.db2.gz IIPYFWXDHJNDBC-JTQLQIEISA-N 0 3 393.656 3.160 10 0 GGAEHN O=[S@@](CCNC1(CO)Cc2ccccc2C1)c1cc(Cl)ccc1Cl ZINC000579758604 566637385 /nfs/dbraw/zinc/63/73/85/566637385.db2.gz KCGBAKOHAGIOEP-DEOSSOPVSA-N 0 3 384.328 3.221 10 0 GGAEHN O[C@H](CCNCc1cc(Br)ccc1OC(F)F)C(F)(F)F ZINC000579776479 566638328 /nfs/dbraw/zinc/63/83/28/566638328.db2.gz OQVCNCQNTRTDMJ-SNVBAGLBSA-N 0 3 378.135 3.453 10 0 GGAEHN COC1(C[C@@H](C)[NH2+]CC[N-]S(=O)(=O)c2cccc(Cl)c2Cl)CCC1 ZINC000560570393 566638593 /nfs/dbraw/zinc/63/85/93/566638593.db2.gz BSGWADXMBOZNCX-GFCCVEGCSA-N 0 3 395.352 3.209 10 0 GGAEHN CO[C@@H]1CN(C[C@@H](O)COc2ccc(Cl)cc2Br)CC[C@H]1C ZINC000467294104 566638766 /nfs/dbraw/zinc/63/87/66/566638766.db2.gz TXLFGJBUYWGNAJ-AXAPSJFSSA-N 0 3 392.721 3.199 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)N[C@@H](CO)c1cccc(Br)c1 ZINC000486995657 566641700 /nfs/dbraw/zinc/64/17/00/566641700.db2.gz JXFDRAYDJFYOJW-VBQJREDUSA-N 0 3 398.345 3.045 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)N[C@H](CO)c1cccc(Br)c1 ZINC000486995654 566641788 /nfs/dbraw/zinc/64/17/88/566641788.db2.gz JXFDRAYDJFYOJW-JKIFEVAISA-N 0 3 398.345 3.045 10 0 GGAEHN C[C@H](NCc1ccc(S(=O)(=O)N(C)C)s1)[C@@H]1Oc2ccccc2[C@H]1C ZINC000425437670 566643368 /nfs/dbraw/zinc/64/33/68/566643368.db2.gz ZCNQWGFEVUUOMR-FHSNZYRGSA-N 0 3 380.535 3.041 10 0 GGAEHN C[C@H](NCc1ccc(S(=O)(=O)N(C)C)s1)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000425437677 566643695 /nfs/dbraw/zinc/64/36/95/566643695.db2.gz ZCNQWGFEVUUOMR-ZJNRKIDTSA-N 0 3 380.535 3.041 10 0 GGAEHN C[C@H](NCc1ccc(S(=O)(=O)N(C)C)s1)[C@H]1Oc2ccccc2[C@@H]1C ZINC000425437673 566643812 /nfs/dbraw/zinc/64/38/12/566643812.db2.gz ZCNQWGFEVUUOMR-LXIYXOSZSA-N 0 3 380.535 3.041 10 0 GGAEHN C[C@@H]1CCN(CC(=O)N2CCC[C@@H]2c2ccc(I)cc2)C1 ZINC000579851484 566645340 /nfs/dbraw/zinc/64/53/40/566645340.db2.gz PBURIBVEKWVBPS-CZUORRHYSA-N 0 3 398.288 3.297 10 0 GGAEHN O=C(NC[C@H](O)CN1CCCCC1)c1ccc2scc(Br)c2c1 ZINC000450228304 566646394 /nfs/dbraw/zinc/64/63/94/566646394.db2.gz AYHNDLDBNYITJG-ZDUSSCGKSA-N 0 3 397.338 3.240 10 0 GGAEHN N[C@H](CNC(=O)[C@@H]1CCOc2ccc(Br)cc21)c1ccccc1 ZINC000653049044 566647388 /nfs/dbraw/zinc/64/73/88/566647388.db2.gz OEBISCLYPNBOGB-GDBMZVCRSA-N 0 3 375.266 3.131 10 0 GGAEHN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)COc1ccc(Cl)c(Cl)c1 ZINC000487102017 566648204 /nfs/dbraw/zinc/64/82/04/566648204.db2.gz IGAVXHCOGSAWRC-CYBMUJFWSA-N 0 3 387.307 3.084 10 0 GGAEHN N[C@@H](CNC(=O)[C@H]1CCOc2ccc(Br)cc21)c1ccccc1 ZINC000653049046 566648392 /nfs/dbraw/zinc/64/83/92/566648392.db2.gz OEBISCLYPNBOGB-HOCLYGCPSA-N 0 3 375.266 3.131 10 0 GGAEHN C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccc(Br)cn2)CC1 ZINC000450246642 566648655 /nfs/dbraw/zinc/64/86/55/566648655.db2.gz VJQRZBOCOCEYCZ-QAPCUYQASA-N 0 3 390.325 3.131 10 0 GGAEHN CN(C)C[C@H]1CN(C(=O)c2csc(Br)c2)c2ccccc2O1 ZINC000675490008 566649096 /nfs/dbraw/zinc/64/90/96/566649096.db2.gz FBELATDPEGPBIN-LBPRGKRZSA-N 0 3 381.295 3.480 10 0 GGAEHN C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccc(Br)cn2)CC1 ZINC000450246643 566649723 /nfs/dbraw/zinc/64/97/23/566649723.db2.gz VJQRZBOCOCEYCZ-YJBOKZPZSA-N 0 3 390.325 3.131 10 0 GGAEHN COCCN1CCC(Nc2ncc(Br)cc2C(F)(F)F)CC1 ZINC000450278459 566652803 /nfs/dbraw/zinc/65/28/03/566652803.db2.gz RVLUUSWCCUIRBI-UHFFFAOYSA-N 0 3 382.224 3.386 10 0 GGAEHN CC[C@@H](Cc1ccccc1Br)C(=O)NCCNc1ccncc1 ZINC000467548860 566653926 /nfs/dbraw/zinc/65/39/26/566653926.db2.gz RQEGMPFONKVTLW-AWEZNQCLSA-N 0 3 376.298 3.063 10 0 GGAEHN CC[C@H](Cc1ccccc1Br)C(=O)NCCNc1ccncc1 ZINC000467548861 566654076 /nfs/dbraw/zinc/65/40/76/566654076.db2.gz RQEGMPFONKVTLW-CQSZACIVSA-N 0 3 376.298 3.063 10 0 GGAEHN CCC1(N2CCOCC2)CCN(C(=O)Cc2cccc(Br)c2)CC1 ZINC000629417563 566654507 /nfs/dbraw/zinc/65/45/07/566654507.db2.gz GGAKCURVXCALDC-UHFFFAOYSA-N 0 3 395.341 3.095 10 0 GGAEHN CCN1CCN(CCC(=O)N[C@@H](c2ccc(Cl)cc2)C(F)(F)F)CC1 ZINC000467551597 566654412 /nfs/dbraw/zinc/65/44/12/566654412.db2.gz SXDLSQFZIUYVEE-INIZCTEOSA-N 0 3 377.838 3.087 10 0 GGAEHN CN(C)[C@]1(CNC(=O)N[C@H]2CCCOc3c(Cl)cccc32)CCSC1 ZINC000540486259 566654859 /nfs/dbraw/zinc/65/48/59/566654859.db2.gz XMRHGVMKAWNCRK-YJBOKZPZSA-N 0 3 383.945 3.290 10 0 GGAEHN CNS(=O)(=O)CCCN[C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 ZINC000540519025 566656681 /nfs/dbraw/zinc/65/66/81/566656681.db2.gz AMKCYNVOEXZDSV-AWEZNQCLSA-N 0 3 384.851 3.339 10 0 GGAEHN Cc1cc(Br)cc(C(=O)N2CC[C@H](OCCN3CCCCC3)C2)c1 ZINC000467647665 566657870 /nfs/dbraw/zinc/65/78/70/566657870.db2.gz RRZXIUJBIUUHGG-SFHVURJKSA-N 0 3 395.341 3.475 10 0 GGAEHN CN1CC=C(CNC(=O)CSCc2ccc(Br)cc2F)CC1 ZINC000540543827 566657930 /nfs/dbraw/zinc/65/79/30/566657930.db2.gz YPHUFOMNRCCNLU-UHFFFAOYSA-N 0 3 387.318 3.200 10 0 GGAEHN CN1CCC[C@@H](NC(=O)Nc2cc(Br)ccc2N2CCCC2)C1 ZINC000675697937 566659353 /nfs/dbraw/zinc/65/93/53/566659353.db2.gz AENLAUQDUUROEC-CQSZACIVSA-N 0 3 381.318 3.265 10 0 GGAEHN CCCN1CCC[C@@H]1C(=O)N[C@@H]1CCN(c2ccc(Br)cc2)C1 ZINC000487261462 566659410 /nfs/dbraw/zinc/65/94/10/566659410.db2.gz MKEJZZIQRGBUNE-NVXWUHKLSA-N 0 3 380.330 3.018 10 0 GGAEHN CN(C)C[C@@H]1CCc2ccccc2N1C(=O)c1ncsc1Br ZINC000425615640 566659792 /nfs/dbraw/zinc/65/97/92/566659792.db2.gz ZQBSYSJUGGTCQC-LBPRGKRZSA-N 0 3 380.311 3.429 10 0 GGAEHN O=C1N[C@@H](c2ccccc2Br)C(=O)N1C[C@@H]1CCN1C1CCCC1 ZINC000629488276 566661977 /nfs/dbraw/zinc/66/19/77/566661977.db2.gz YWYZEVYFXCVHNN-BBRMVZONSA-N 0 3 392.297 3.059 10 0 GGAEHN CN(C)C[C@@H](c1ccc(Cl)c(Cl)c1)N1C(=O)N[C@](C)(CCF)C1=O ZINC000629487224 566662619 /nfs/dbraw/zinc/66/26/19/566662619.db2.gz KEVMJMMOZMQZEJ-XJKSGUPXSA-N 0 3 376.259 3.266 10 0 GGAEHN C[C@H]1C[C@H](N(C)C(=O)Nc2cnc3c(Br)cccn23)CCN1C ZINC000425669868 566664135 /nfs/dbraw/zinc/66/41/35/566664135.db2.gz DGEHWDYBXQYGHB-NWDGAFQWSA-N 0 3 380.290 3.043 10 0 GGAEHN CCc1noc(-c2ccc(CCNCc3c(Br)cnn3C)cc2)n1 ZINC000487314170 566664294 /nfs/dbraw/zinc/66/42/94/566664294.db2.gz CNKZIODVWNLQLK-UHFFFAOYSA-N 0 3 390.285 3.127 10 0 GGAEHN Cc1c([C@@H](C)N[C@@H]2CCCN(C)C2)nnn1-c1cccc(Br)c1 ZINC000675767777 566664219 /nfs/dbraw/zinc/66/42/19/566664219.db2.gz UMNIGTNJQZJLQY-IUODEOHRSA-N 0 3 378.318 3.083 10 0 GGAEHN CCCN(CC(F)(F)F)C(=O)CN1CCNC[C@H]1c1ccccc1Cl ZINC000629530017 566664398 /nfs/dbraw/zinc/66/43/98/566664398.db2.gz SUNGFOLGARFVJG-HNNXBMFYSA-N 0 3 377.838 3.087 10 0 GGAEHN O[C@@H](CN[C@H]1CCN(c2ccccc2)C1)COc1ccccc1Br ZINC000675762988 566664602 /nfs/dbraw/zinc/66/46/02/566664602.db2.gz AMZMSNPNBKDKGB-RDJZCZTQSA-N 0 3 391.309 3.057 10 0 GGAEHN O[C@H](CN[C@@H]1CCN(c2ccccc2)C1)COc1ccccc1Br ZINC000675762986 566664735 /nfs/dbraw/zinc/66/47/35/566664735.db2.gz AMZMSNPNBKDKGB-NVXWUHKLSA-N 0 3 391.309 3.057 10 0 GGAEHN CCS(=O)(=O)NCCN(C)[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000540675502 566665194 /nfs/dbraw/zinc/66/51/94/566665194.db2.gz KKDWZUVXWNNWCC-HZPDHXFCSA-N 0 3 378.460 3.213 10 0 GGAEHN C[C@H](C1CCN(C)CC1)N(C)C(=O)Nc1cnc2c(Br)cccn12 ZINC000425672698 566665320 /nfs/dbraw/zinc/66/53/20/566665320.db2.gz LFPFIBSBFDIRNM-GFCCVEGCSA-N 0 3 394.317 3.291 10 0 GGAEHN CCS(=O)(=O)NCCN(C)[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000540675501 566666042 /nfs/dbraw/zinc/66/60/42/566666042.db2.gz KKDWZUVXWNNWCC-HOTGVXAUSA-N 0 3 378.460 3.213 10 0 GGAEHN C[C@@H]1C[C@H](c2ccc(Br)cc2)CN1Cc1nc(C(C)(C)N)no1 ZINC000629581684 566667168 /nfs/dbraw/zinc/66/71/68/566667168.db2.gz FVHQVFWJBQBYPM-YPMHNXCESA-N 0 3 379.302 3.404 10 0 GGAEHN COC(=O)C1(CN2CCC[C@@H]2c2ccccc2I)CC1 ZINC000450410403 566668666 /nfs/dbraw/zinc/66/86/66/566668666.db2.gz YWAFBRFICZGJMH-CQSZACIVSA-N 0 3 385.245 3.381 10 0 GGAEHN CS(=O)(=O)N(CC(F)(F)F)C1CCN(C[C@H]2CCCCC2(F)F)CC1 ZINC000450410187 566669064 /nfs/dbraw/zinc/66/90/64/566669064.db2.gz XPHQZGGGWHBCJG-GFCCVEGCSA-N 0 3 392.434 3.100 10 0 GGAEHN CS(=O)(=O)N(CC(F)(F)F)C1CCN(C[C@@H]2CCCCC2(F)F)CC1 ZINC000450410194 566669309 /nfs/dbraw/zinc/66/93/09/566669309.db2.gz XPHQZGGGWHBCJG-LBPRGKRZSA-N 0 3 392.434 3.100 10 0 GGAEHN CN(Cc1ccccc1)C[C@@H](O)CNCc1ccc(Br)c(F)c1F ZINC000629598176 566670468 /nfs/dbraw/zinc/67/04/68/566670468.db2.gz VGUMMSHGPYRRBY-HNNXBMFYSA-N 0 3 399.279 3.310 10 0 GGAEHN O[C@H](CNC[C@@H](n1cccn1)C(F)(F)F)COc1ccc(Cl)c(Cl)c1 ZINC000629599094 566670707 /nfs/dbraw/zinc/67/07/07/566670707.db2.gz NBDCTYVDXXEJLB-QMTHXVAHSA-N 0 3 398.212 3.323 10 0 GGAEHN COC1CCN(CCN[C@@H]2CCCOc3ccc(Br)cc32)CC1 ZINC000675929491 566670770 /nfs/dbraw/zinc/67/07/70/566670770.db2.gz IGLXYWWVYUBXRS-QGZVFWFLSA-N 0 3 383.330 3.363 10 0 GGAEHN O[C@@H](CN[C@H]1CCCSc2ccc(Br)cc21)Cn1cccn1 ZINC000629593086 566671140 /nfs/dbraw/zinc/67/11/40/566671140.db2.gz DLEZOVZEXJTBNX-ZFWWWQNUSA-N 0 3 382.327 3.223 10 0 GGAEHN O[C@H](CNC[C@H](n1cccn1)C(F)(F)F)COc1cc(Cl)ccc1Cl ZINC000629601762 566672959 /nfs/dbraw/zinc/67/29/59/566672959.db2.gz VAEMTLCERWCTMT-RISCZKNCSA-N 0 3 398.212 3.323 10 0 GGAEHN O=S1(=O)C[C@H](CNC2CC(c3ccc(Cl)cc3)C2)Oc2ccccc21 ZINC000580193680 566673400 /nfs/dbraw/zinc/67/34/00/566673400.db2.gz OUOBWGPJUDJTAZ-PREGVCBESA-N 0 3 377.893 3.411 10 0 GGAEHN O=C1CC[C@H](CN2CCC[C@H]2c2ccc(I)cc2)CCN1 ZINC000450457335 566673966 /nfs/dbraw/zinc/67/39/66/566673966.db2.gz RPXFAMILTBZUCF-BBRMVZONSA-N 0 3 398.288 3.344 10 0 GGAEHN CN(C)C1(CNC(=O)Cc2ccc(Br)s2)Cc2ccccc2C1 ZINC000607534900 566675045 /nfs/dbraw/zinc/67/50/45/566675045.db2.gz PWYVMLJUAZGSAA-UHFFFAOYSA-N 0 3 393.350 3.269 10 0 GGAEHN CC(C(=O)N(Cc1cccs1)Cc1ccc2[nH]ccc2c1)S(C)(=O)=O ZINC000629643027 566676048 /nfs/dbraw/zinc/67/60/48/566676048.db2.gz XBCSHQQZPZRCGI-CYBMUJFWSA-N 0 3 376.503 3.191 10 0 GGAEHN COCCCN(C)CCNC(=O)c1cc(Br)cc2ccccc21 ZINC000607701674 566678581 /nfs/dbraw/zinc/67/85/81/566678581.db2.gz WDFSVHLVIIPRFM-UHFFFAOYSA-N 0 3 379.298 3.300 10 0 GGAEHN O=C(NCc1ccccc1CN1CC[C@H](O)C1)c1ccsc1Br ZINC000450516093 566679465 /nfs/dbraw/zinc/67/94/65/566679465.db2.gz ATMRRHTUNJWXQZ-AWEZNQCLSA-N 0 3 395.322 3.007 10 0 GGAEHN COc1ccc(C[C@@H](C)CNCc2c(Br)cnn2C)cc1OC ZINC000487552769 566680317 /nfs/dbraw/zinc/68/03/17/566680317.db2.gz BEYASLTUMUCGBY-GFCCVEGCSA-N 0 3 382.302 3.168 10 0 GGAEHN CCC1(CC)CN(C(=O)[C@@H](N)CCC(=O)OC)c2ccc(Br)cc21 ZINC000514936559 566680289 /nfs/dbraw/zinc/68/02/89/566680289.db2.gz UPVCUMOZSDYNHX-AWEZNQCLSA-N 0 3 397.313 3.134 10 0 GGAEHN CN(Cc1ccccc1)[C@@H](CNCc1c(Br)cnn1C)C1CC1 ZINC000487577937 566680774 /nfs/dbraw/zinc/68/07/74/566680774.db2.gz WWVFOFKQNOPMJY-KRWDZBQOSA-N 0 3 377.330 3.183 10 0 GGAEHN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)N[C@@H]1C[C@H]2C[C@H]2C1 ZINC000425863378 566680819 /nfs/dbraw/zinc/68/08/19/566680819.db2.gz DZVTUOVXUMPUJW-SCAQPMJSSA-N 0 3 380.330 3.321 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)CCN(C)c1ccncc1 ZINC000540929236 566681703 /nfs/dbraw/zinc/68/17/03/566681703.db2.gz VESGCULJVLVWOJ-CQSZACIVSA-N 0 3 376.298 3.418 10 0 GGAEHN COc1cc(Br)c(NC(=O)CCN(C)c2ccncc2)cc1OC ZINC000540926697 566681965 /nfs/dbraw/zinc/68/19/65/566681965.db2.gz YFGJVKPUEBQFNI-UHFFFAOYSA-N 0 3 394.269 3.326 10 0 GGAEHN CC(=O)Nc1ccc(Br)cc1NC(=O)CCN(C)c1ccncc1 ZINC000540926861 566682113 /nfs/dbraw/zinc/68/21/13/566682113.db2.gz LXIPPGOZVVGLDI-UHFFFAOYSA-N 0 3 391.269 3.268 10 0 GGAEHN COCCN1CCC[C@@H](NC(=O)C[C@H](C)c2ccc(Br)cc2)C1 ZINC000676275893 566683579 /nfs/dbraw/zinc/68/35/79/566683579.db2.gz USOHLEAIYUAWIB-WMLDXEAASA-N 0 3 383.330 3.170 10 0 GGAEHN CN(C)CCOC1CCN(C(=O)c2c[nH]c3cccc(Br)c23)CC1 ZINC000487660071 566686010 /nfs/dbraw/zinc/68/60/10/566686010.db2.gz SDDMSWBZZJETMF-UHFFFAOYSA-N 0 3 394.313 3.113 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2ccsc2Br)C[C@H]1N1CCCC1 ZINC000450576488 566686709 /nfs/dbraw/zinc/68/67/09/566686709.db2.gz CHEYDRPRSHCGKU-VXGBXAGGSA-N 0 3 375.357 3.162 10 0 GGAEHN NC(=O)[C@H](N[C@H]1CCOC2(CCSCC2)C1)c1ccc(Br)cc1 ZINC000676349014 566686840 /nfs/dbraw/zinc/68/68/40/566686840.db2.gz NRNYJULCGFLOGG-LSDHHAIUSA-N 0 3 399.354 3.010 10 0 GGAEHN C/C(=C/c1cccc(C(F)(F)F)c1)CN[C@@H]1CCCN(S(C)(=O)=O)C1 ZINC000580371768 566687432 /nfs/dbraw/zinc/68/74/32/566687432.db2.gz WEIZJHVOWZTFTQ-RCBBPTIPSA-N 0 3 376.444 3.122 10 0 GGAEHN CN(C)[C@]1(CNC(=O)NC23CCC(C(F)(F)F)(CC2)CC3)CCSC1 ZINC000426030069 566687738 /nfs/dbraw/zinc/68/77/38/566687738.db2.gz NFJUZBAZYDVMGH-GPANFISMSA-N 0 3 379.492 3.378 10 0 GGAEHN O=C(CCOc1cccc(Cl)c1Cl)NC1CCN([C@H]2CCOC2)CC1 ZINC000676393859 566689674 /nfs/dbraw/zinc/68/96/74/566689674.db2.gz VJSDONIDVWAFRA-AWEZNQCLSA-N 0 3 387.307 3.132 10 0 GGAEHN CN(C)[C@]1(CNc2ccc(Br)c(C(F)(F)F)n2)CCSC1 ZINC000561263099 566690860 /nfs/dbraw/zinc/69/08/60/566690860.db2.gz PJNUTUFSCDXTKJ-LBPRGKRZSA-N 0 3 384.265 3.134 10 0 GGAEHN C[C@@H](c1ncc(-c2ccc(Cl)cc2Cl)o1)N1CCN2C[C@H](O)C[C@H]2C1 ZINC000653829208 566695949 /nfs/dbraw/zinc/69/59/49/566695949.db2.gz CYNXCJALBCNLGH-FPMFFAJLSA-N 0 3 382.291 3.460 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)Nc2nc3ccsc3s2)CC1 ZINC000515198838 566697090 /nfs/dbraw/zinc/69/70/90/566697090.db2.gz JGCMNWKANPOFSF-UHFFFAOYSA-N 0 3 375.479 3.116 10 0 GGAEHN CC(C)(C)OC(=O)[C@H]1CCN(CCC(=O)Nc2cccc(Br)c2)C1 ZINC000426180618 566697409 /nfs/dbraw/zinc/69/74/09/566697409.db2.gz PQZPKFFMTCRJQT-ZDUSSCGKSA-N 0 3 397.313 3.441 10 0 GGAEHN C[C@@H](CS(=O)(=O)c1ccccc1)NCCc1ccccc1Br ZINC000580498968 566698041 /nfs/dbraw/zinc/69/80/41/566698041.db2.gz INWLFUZFIZLNMS-AWEZNQCLSA-N 0 3 382.323 3.444 10 0 GGAEHN COc1cc(Br)ccc1CCC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000541151297 566700312 /nfs/dbraw/zinc/70/03/12/566700312.db2.gz VVMAHAKUISQDDP-INIZCTEOSA-N 0 3 381.314 3.085 10 0 GGAEHN CC[C@@H](NCCS(=O)(=O)c1ccc(Br)cc1)[C@H]1CCCCO1 ZINC000653881962 566700968 /nfs/dbraw/zinc/70/09/68/566700968.db2.gz WYZNXBMBOOUMDR-HZPDHXFCSA-N 0 3 390.343 3.160 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)NCCN1CCCCC1 ZINC000468447110 566701105 /nfs/dbraw/zinc/70/11/05/566701105.db2.gz XGFIXKSOTXEGNS-ZDUSSCGKSA-N 0 3 384.318 3.304 10 0 GGAEHN CC[C@@H](NCCS(=O)(=O)c1cccc(Br)c1)[C@@H]1CCCCO1 ZINC000653877335 566701043 /nfs/dbraw/zinc/70/10/43/566701043.db2.gz NJQJNARPFABINE-CVEARBPZSA-N 0 3 390.343 3.160 10 0 GGAEHN CO[C@@H](CCNC(=O)NC[C@@H](c1cccs1)N1CCCC1)C(F)(F)F ZINC000468428207 566701202 /nfs/dbraw/zinc/70/12/02/566701202.db2.gz PJVZTCZSFRBLHN-JSGCOSHPSA-N 0 3 379.448 3.152 10 0 GGAEHN CC[C@@H](NCC(=O)N(C)Cc1cc(Br)cs1)[C@@H]1CCCCO1 ZINC000653876864 566701515 /nfs/dbraw/zinc/70/15/15/566701515.db2.gz JAAHMEZRKXIZFS-CABCVRRESA-N 0 3 389.359 3.406 10 0 GGAEHN CC[C@H](NCC(=O)N(C)Cc1ccccc1Br)[C@@H]1CCCCO1 ZINC000653881771 566701630 /nfs/dbraw/zinc/70/16/30/566701630.db2.gz QJKZQNIFIRZCIV-IRXDYDNUSA-N 0 3 383.330 3.345 10 0 GGAEHN CCCN1CCC[C@H]1CNC(=O)c1cc(C)ccc1I ZINC000561425046 566702644 /nfs/dbraw/zinc/70/26/44/566702644.db2.gz UBHFTNLBZLYMHO-ZDUSSCGKSA-N 0 3 386.277 3.204 10 0 GGAEHN CC[C@@H](CO)N1CCN(c2cc(C)nc3c(F)cc(Br)cc23)CC1 ZINC000608093565 566702907 /nfs/dbraw/zinc/70/29/07/566702907.db2.gz MKSUOCYKRAQRHX-AWEZNQCLSA-N 0 3 396.304 3.338 10 0 GGAEHN Cc1nc(S(=O)(=O)C(C)C(=O)N(Cc2ccccc2)C(C)C)sc1C ZINC000608098650 566703261 /nfs/dbraw/zinc/70/32/61/566703261.db2.gz FQQKXZFMJRGATQ-OAHLLOKOSA-N 0 3 380.535 3.359 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NC[C@@H]1N(C)CCCC1(C)C ZINC000468471001 566703273 /nfs/dbraw/zinc/70/32/73/566703273.db2.gz TUFNIRJAPHUHJR-INIZCTEOSA-N 0 3 383.330 3.237 10 0 GGAEHN C[C@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1cccc(Br)c1 ZINC000541229076 566704389 /nfs/dbraw/zinc/70/43/89/566704389.db2.gz KIVNUBZSFDZXQQ-XJKSGUPXSA-N 0 3 391.313 3.024 10 0 GGAEHN C[C@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1cccc(Br)c1 ZINC000541229073 566704952 /nfs/dbraw/zinc/70/49/52/566704952.db2.gz KIVNUBZSFDZXQQ-BBRMVZONSA-N 0 3 391.313 3.024 10 0 GGAEHN C[C@H]1[C@H](c2ccccc2)C[C@@H]1[NH2+]CC[N-]S(=O)(=O)c1ccc(Cl)s1 ZINC000541239294 566706196 /nfs/dbraw/zinc/70/61/96/566706196.db2.gz CTAOJSLZHZTMPG-CFVMTHIKSA-N 0 3 384.954 3.462 10 0 GGAEHN Brc1ccc2[nH]c(CN[C@@H]3CCCC[C@@H]3N3CCOCC3)nc2c1 ZINC000580615911 566708485 /nfs/dbraw/zinc/70/84/85/566708485.db2.gz TXCQLWNRKJGPQK-WBVHZDCISA-N 0 3 393.329 3.058 10 0 GGAEHN Brc1ccc2nc(CN[C@@H]3CCCC[C@@H]3N3CCOCC3)[nH]c2c1 ZINC000580615911 566708487 /nfs/dbraw/zinc/70/84/87/566708487.db2.gz TXCQLWNRKJGPQK-WBVHZDCISA-N 0 3 393.329 3.058 10 0 GGAEHN CS[C@H]1CN(C(=O)Cc2sccc2Br)C[C@@H]1N1CCCC1 ZINC000450837333 566710382 /nfs/dbraw/zinc/71/03/82/566710382.db2.gz CDTWMYQTBMTFMU-JSGCOSHPSA-N 0 3 389.384 3.091 10 0 GGAEHN Cc1cccc2c1ncc(C)c2NCc1nn(C)cc1I ZINC000450841912 566712720 /nfs/dbraw/zinc/71/27/20/566712720.db2.gz DUXPLQHHSUSKNT-UHFFFAOYSA-N 0 3 392.244 3.224 10 0 GGAEHN CC(C)S(=O)(=O)c1c(Cl)cccc1NC(=O)N1CCC(N(C)C)CC1 ZINC000654069774 566714117 /nfs/dbraw/zinc/71/41/17/566714117.db2.gz LNJJUDMYWCRNJZ-UHFFFAOYSA-N 0 3 387.933 3.080 10 0 GGAEHN O=S(=O)(CCNCCCC1CCOCC1)c1cccc(Br)c1 ZINC000515467657 566714757 /nfs/dbraw/zinc/71/47/57/566714757.db2.gz IAJTVWMEIRDOTJ-UHFFFAOYSA-N 0 3 390.343 3.019 10 0 GGAEHN Fc1ccc2nc(NCc3cn(-c4ccccc4Br)nn3)[nH]c2c1 ZINC000580747457 566719346 /nfs/dbraw/zinc/71/93/46/566719346.db2.gz PILVHRIEZNEJFL-UHFFFAOYSA-N 0 3 387.216 3.079 10 0 GGAEHN CSc1nnc(CNC(=O)N2CCN(C(C)(C)CC(C)(C)C)CC2)s1 ZINC000580757143 566720960 /nfs/dbraw/zinc/72/09/60/566720960.db2.gz DMZQMCJQLSUZMJ-UHFFFAOYSA-N 0 3 385.603 3.302 10 0 GGAEHN Cc1ccc(Br)cc1CNC[C@@H](O)COc1ccc2c(c1)OCO2 ZINC000580770220 566721107 /nfs/dbraw/zinc/72/11/07/566721107.db2.gz UEXLSUQQPICIAH-OAHLLOKOSA-N 0 3 394.265 3.016 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C ZINC000468694351 566721723 /nfs/dbraw/zinc/72/17/23/566721723.db2.gz OXTHEMHNOSVLCV-MQIPJXDCSA-N 0 3 396.329 3.301 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000468745913 566725346 /nfs/dbraw/zinc/72/53/46/566725346.db2.gz WNUOSGDGTZRIQT-QWHCGFSZSA-N 0 3 396.329 3.468 10 0 GGAEHN Cc1csc(CCNC(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)n1 ZINC000608638883 566726624 /nfs/dbraw/zinc/72/66/24/566726624.db2.gz HLEFUJRQLYRWBC-WMLDXEAASA-N 0 3 378.567 3.438 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000654312057 566727621 /nfs/dbraw/zinc/72/76/21/566727621.db2.gz MQCQLDIKBSEEDU-HZPDHXFCSA-N 0 3 381.314 3.133 10 0 GGAEHN O=C(Cc1noc2ccc(Br)cc12)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000654313608 566727690 /nfs/dbraw/zinc/72/76/90/566727690.db2.gz ATDYAONYIUJHEA-GDBMZVCRSA-N 0 3 392.297 3.266 10 0 GGAEHN Cc1c(Br)ccc(C(=O)N(CCN(C)C)Cc2ccccn2)c1F ZINC000468790254 566730098 /nfs/dbraw/zinc/73/00/98/566730098.db2.gz CBUFWIXXOPPTHF-UHFFFAOYSA-N 0 3 394.288 3.496 10 0 GGAEHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc[nH]c(=O)c2Br)C1 ZINC000468800616 566731610 /nfs/dbraw/zinc/73/16/10/566731610.db2.gz CMESOLJTJVAQEP-GXTWGEPZSA-N 0 3 390.281 3.115 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000488522918 566731776 /nfs/dbraw/zinc/73/17/76/566731776.db2.gz VACRBOSOKPUWFW-INIZCTEOSA-N 0 3 396.329 3.228 10 0 GGAEHN CCC[C@@H](NC(=O)N1CCN2C[C@H](O)C[C@H]2C1)c1ccc(Cl)c(Cl)c1 ZINC000654411553 566732132 /nfs/dbraw/zinc/73/21/32/566732132.db2.gz JPBCNPRFOGBILI-JJRVBVJISA-N 0 3 386.323 3.295 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N[C@@H](C)CN1CCCCC1 ZINC000488546065 566732966 /nfs/dbraw/zinc/73/29/66/566732966.db2.gz QDAKFUZFNDBGFB-ZDUSSCGKSA-N 0 3 384.318 3.131 10 0 GGAEHN CCCN1CCC[C@H]1C(=O)NCCc1c[nH]c2cccc(Br)c12 ZINC000426843583 566734474 /nfs/dbraw/zinc/73/44/74/566734474.db2.gz RCZKGFMQBBDJGO-INIZCTEOSA-N 0 3 378.314 3.464 10 0 GGAEHN O=C(N[C@@H]1CSc2ccc(Br)cc21)N1CC[C@@H](N2CC=CC2)C1 ZINC000426842651 566734581 /nfs/dbraw/zinc/73/45/81/566734581.db2.gz ICDUCYWOWJYSBU-UKRRQHHQSA-N 0 3 394.338 3.252 10 0 GGAEHN CO[C@H](CCN[C@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1)C(F)(F)F ZINC000468840314 566735651 /nfs/dbraw/zinc/73/56/51/566735651.db2.gz DBZQCVHEWCVIHC-BZUAXINKSA-N 0 3 380.838 3.269 10 0 GGAEHN CCSc1cccc(CN[C@H]2CCN(S(=O)(=O)c3ccccc3)C2)c1 ZINC000561750365 566735982 /nfs/dbraw/zinc/73/59/82/566735982.db2.gz YCLZCCYSRCUCPT-KRWDZBQOSA-N 0 3 376.547 3.351 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CC[C@@H](N3CCCC3)[C@@H]2C)c1 ZINC000561755825 566736152 /nfs/dbraw/zinc/73/61/52/566736152.db2.gz VOOOOLZPBFVRKV-XJKSGUPXSA-N 0 3 398.288 3.298 10 0 GGAEHN Cc1c(Br)ccc(C(=O)NCCCN2CCCO[C@H](C)C2)c1F ZINC000468831080 566736072 /nfs/dbraw/zinc/73/60/72/566736072.db2.gz FITONXYKRNXGKP-GFCCVEGCSA-N 0 3 387.293 3.127 10 0 GGAEHN CN1CC[C@@]2(CCN(C(=O)CSCc3cc(-c4cccs4)on3)C2)C1 ZINC000561774410 566738943 /nfs/dbraw/zinc/73/89/43/566738943.db2.gz YXRFSLRBOATYLJ-GOSISDBHSA-N 0 3 377.535 3.191 10 0 GGAEHN C[C@@H](c1ccc(F)c(Br)c1)n1cc([C@H](N)C2CCOCC2)nn1 ZINC000630592984 566742257 /nfs/dbraw/zinc/74/22/57/566742257.db2.gz CCQFDFYYSJSQQP-MGPLVRAMSA-N 0 3 383.265 3.215 10 0 GGAEHN C[C@@H](c1ccc(F)c(Br)c1)n1cc([C@@H](N)C2CCOCC2)nn1 ZINC000630592985 566742271 /nfs/dbraw/zinc/74/22/71/566742271.db2.gz CCQFDFYYSJSQQP-QFYYESIMSA-N 0 3 383.265 3.215 10 0 GGAEHN CN(CCC(=O)N1CCc2c(Br)ccc(F)c2C1)c1ccncc1 ZINC000541765404 566745758 /nfs/dbraw/zinc/74/57/58/566745758.db2.gz IIEWBKFCPGVTFR-UHFFFAOYSA-N 0 3 392.272 3.394 10 0 GGAEHN C[C@@](CO)(NCCOc1cc(F)cc(Br)c1)c1cccc(O)c1 ZINC000581038480 566746347 /nfs/dbraw/zinc/74/63/47/566746347.db2.gz LFVAHVTZENXSBP-KRWDZBQOSA-N 0 3 384.245 3.170 10 0 GGAEHN C[C@@H](CNC(=O)CSCc1ccc(Br)cc1F)N(C)C1CC1 ZINC000609025406 566746940 /nfs/dbraw/zinc/74/69/40/566746940.db2.gz HIUAEGRMTXYCFK-NSHDSACASA-N 0 3 389.334 3.420 10 0 GGAEHN Cc1cc(Cl)ccc1S(=O)(=O)NCCN[C@@H](c1cccnc1)C(C)C ZINC000581062484 566747037 /nfs/dbraw/zinc/74/70/37/566747037.db2.gz GUSPAPSOEDPWKK-GOSISDBHSA-N 0 3 381.929 3.309 10 0 GGAEHN O=C(NCCCN1CCc2ccccc2C1)c1c(F)cncc1Br ZINC000630715665 566748224 /nfs/dbraw/zinc/74/82/24/566748224.db2.gz XXDJSBVTWMEUOA-UHFFFAOYSA-N 0 3 392.272 3.161 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@@H]1CCN(C2CC2)C1 ZINC000468967609 566748396 /nfs/dbraw/zinc/74/83/96/566748396.db2.gz KALAZKLSUZHUOZ-WCQYABFASA-N 0 3 382.302 3.055 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N[C@@H]1CCN(C2CC2)C1 ZINC000468967607 566748967 /nfs/dbraw/zinc/74/89/67/566748967.db2.gz KALAZKLSUZHUOZ-DGCLKSJQSA-N 0 3 382.302 3.055 10 0 GGAEHN C[C@@H](CNC(=O)Cc1csc(CCC(F)(F)F)n1)N1CCC[C@@H](C)C1 ZINC000630741412 566749399 /nfs/dbraw/zinc/74/93/99/566749399.db2.gz WXNHSHJCLIAHSI-OLZOCXBDSA-N 0 3 377.476 3.417 10 0 GGAEHN Cc1ccc(C(=O)N2CC[C@H](OCCN3CCCCC3)C2)cc1Br ZINC000427148124 566750110 /nfs/dbraw/zinc/75/01/10/566750110.db2.gz SYNDIQHDFVNBLD-KRWDZBQOSA-N 0 3 395.341 3.475 10 0 GGAEHN CN(C)CCOc1ccc(NC(=O)c2c(F)cncc2Br)cc1 ZINC000630772844 566751179 /nfs/dbraw/zinc/75/11/79/566751179.db2.gz SSGUCSOISJWZJT-UHFFFAOYSA-N 0 3 382.233 3.176 10 0 GGAEHN Cc1ccc(Br)c(C(=O)N2CC[C@H](OCCN3CCCCC3)C2)c1 ZINC000427157862 566751765 /nfs/dbraw/zinc/75/17/65/566751765.db2.gz NSEBEKJBICHRGX-INIZCTEOSA-N 0 3 395.341 3.475 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)c1cccc(Br)c1F ZINC000469007175 566753146 /nfs/dbraw/zinc/75/31/46/566753146.db2.gz PYCWOBBPUOURJQ-AWEZNQCLSA-N 0 3 379.273 3.491 10 0 GGAEHN CS[C@@H]1CN(C(=O)COc2cc(Cl)ccc2Cl)C[C@@H]1N1CCCC1 ZINC000541843633 566753724 /nfs/dbraw/zinc/75/37/24/566753724.db2.gz GUBWZYGHOWQMQU-GOEBONIOSA-N 0 3 389.348 3.410 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2c(F)cccc2Br)C[C@H]1N1CCCC1 ZINC000541840514 566754130 /nfs/dbraw/zinc/75/41/30/566754130.db2.gz DIIXBWNUSQEHMG-ZIAGYGMSSA-N 0 3 387.318 3.240 10 0 GGAEHN Cc1cc(NC(=O)Cc2sccc2Br)n(C2CCN(C)CC2)n1 ZINC000516243587 566754891 /nfs/dbraw/zinc/75/48/91/566754891.db2.gz IVUZSGSNWDGRNQ-UHFFFAOYSA-N 0 3 397.342 3.463 10 0 GGAEHN COc1cc(NC(=O)CCN(C)c2ccncc2)cc(OC)c1Br ZINC000541854308 566756170 /nfs/dbraw/zinc/75/61/70/566756170.db2.gz DIVKROGTHXZWGY-UHFFFAOYSA-N 0 3 394.269 3.326 10 0 GGAEHN CC(C)(COCC(F)F)C(=O)NCC1(N2CCSCC2)CCCCC1 ZINC000469049545 566756417 /nfs/dbraw/zinc/75/64/17/566756417.db2.gz OAYWXSICODRMPF-UHFFFAOYSA-N 0 3 378.529 3.162 10 0 GGAEHN Cc1ccc(NC(=O)CCN(C)c2ccncc2)cc1I ZINC000541858222 566756457 /nfs/dbraw/zinc/75/64/57/566756457.db2.gz IXOMPSDDYRBGDZ-UHFFFAOYSA-N 0 3 395.244 3.460 10 0 GGAEHN C[C@H](N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1)C(=O)NCc1cccs1 ZINC000562049515 566759382 /nfs/dbraw/zinc/75/93/82/566759382.db2.gz URWABGXYPGMRGM-DOPJRALCSA-N 0 3 377.941 3.441 10 0 GGAEHN C[C@@H]1CC[C@]2(CCN(Cc3cc(=O)n4cc(Br)ccc4n3)C2)C1 ZINC000541953841 566762470 /nfs/dbraw/zinc/76/24/70/566762470.db2.gz SUQNBJBSAQMASQ-ACJLOTCBSA-N 0 3 376.298 3.469 10 0 GGAEHN Cc1[nH]c(=O)c(Br)cc1C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000581266687 566762528 /nfs/dbraw/zinc/76/25/28/566762528.db2.gz GKMWNJGVEUKHRA-JKSUJKDBSA-N 0 3 390.281 3.033 10 0 GGAEHN O=S(=O)(C[C@@H]1CCCC1(F)F)NCC1CCN(Cc2cccs2)CC1 ZINC000451135139 566764345 /nfs/dbraw/zinc/76/43/45/566764345.db2.gz KSUQDSCYISHYAA-HNNXBMFYSA-N 0 3 392.537 3.315 10 0 GGAEHN Cc1cc(C)cc(OC[C@H](O)CN[C@H](CO)c2cccc(Br)c2)c1 ZINC000541981259 566765211 /nfs/dbraw/zinc/76/52/11/566765211.db2.gz OVDRHSXFGXGCBO-IEBWSBKVSA-N 0 3 394.309 3.129 10 0 GGAEHN CN(CCSc1ccnc2cc(Cl)ccc21)[C@@H]1CCN2CCO[C@H]1C2 ZINC000451142195 566765543 /nfs/dbraw/zinc/76/55/43/566765543.db2.gz WAGWYZUUGFINFZ-MSOLQXFVSA-N 0 3 377.941 3.385 10 0 GGAEHN Cc1cc(C)cc(OC[C@@H](O)CN[C@@H](CO)c2cccc(Br)c2)c1 ZINC000541981258 566765987 /nfs/dbraw/zinc/76/59/87/566765987.db2.gz OVDRHSXFGXGCBO-HKUYNNGSSA-N 0 3 394.309 3.129 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N(C)CCN(C)C1CC1 ZINC000469152322 566766386 /nfs/dbraw/zinc/76/63/86/566766386.db2.gz ZGXLRONSYVMHHM-LBPRGKRZSA-N 0 3 384.318 3.254 10 0 GGAEHN NC(C(=O)NCCCCSc1ccccc1Br)C(F)(F)F ZINC000581308402 566767795 /nfs/dbraw/zinc/76/77/95/566767795.db2.gz MNXVAZKYKXAGOA-LLVKDONJSA-N 0 3 385.249 3.327 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)COc1cccc(Br)c1 ZINC000516537253 566768101 /nfs/dbraw/zinc/76/81/01/566768101.db2.gz LKRGJMMSFXILKM-QGZVFWFLSA-N 0 3 391.309 3.117 10 0 GGAEHN CN(C)CCn1ccc(C(=O)N2CCC[C@H]2c2ccc(Br)s2)n1 ZINC000654996807 566769692 /nfs/dbraw/zinc/76/96/92/566769692.db2.gz AMIAHTFXNXPMLJ-ZDUSSCGKSA-N 0 3 397.342 3.246 10 0 GGAEHN Ic1cccc(OCCCN2CCOCC3(CC3)C2)c1 ZINC000542057952 566771811 /nfs/dbraw/zinc/77/18/11/566771811.db2.gz YYWOGGMLBOYSNP-UHFFFAOYSA-N 0 3 387.261 3.173 10 0 GGAEHN O=C(NCCNCc1ccc(C(F)F)nc1)c1ccc(Br)cc1 ZINC000631049523 566774115 /nfs/dbraw/zinc/77/41/15/566774115.db2.gz ZOCSOUNQICFGPQ-UHFFFAOYSA-N 0 3 384.224 3.301 10 0 GGAEHN CCN(C[C@H]1CCCN1CC)C(=O)c1cc(Br)cc(C(=O)OC)c1 ZINC000562279256 566776581 /nfs/dbraw/zinc/77/65/81/566776581.db2.gz AEYFUMRZUVYANA-MRXNPFEDSA-N 0 3 397.313 3.182 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)NCC1=CCN(C)CC1 ZINC000469259054 566776578 /nfs/dbraw/zinc/77/65/78/566776578.db2.gz QJSNROKMAOJNAT-GFCCVEGCSA-N 0 3 382.302 3.080 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)NCC1=CCN(C)CC1 ZINC000469259090 566776655 /nfs/dbraw/zinc/77/66/55/566776655.db2.gz QJSNROKMAOJNAT-LBPRGKRZSA-N 0 3 382.302 3.080 10 0 GGAEHN Clc1cc(Br)cnc1CN[C@@H]1CCOC2(CCOCC2)C1 ZINC000631093145 566777846 /nfs/dbraw/zinc/77/78/46/566777846.db2.gz IMHFNXMYVCVZAP-GFCCVEGCSA-N 0 3 375.694 3.315 10 0 GGAEHN CC[C@H](Cc1ccccc1Br)NCc1cn(C[C@@H]2CCOC2)nn1 ZINC000631091563 566778375 /nfs/dbraw/zinc/77/83/75/566778375.db2.gz RWBBAFQWWWAINI-GOEBONIOSA-N 0 3 393.329 3.188 10 0 GGAEHN C[C@H](C(=O)N(CCO)Cc1cc(Br)cs1)N1[C@H](C)CC[C@@H]1C ZINC000427555804 566778791 /nfs/dbraw/zinc/77/87/91/566778791.db2.gz LZNYFRRZDHZVNL-FRRDWIJNSA-N 0 3 389.359 3.093 10 0 GGAEHN Cc1c(Br)ccc(C(=O)NC[C@@]2(N(C)C)CCSC2)c1F ZINC000469286278 566779183 /nfs/dbraw/zinc/77/91/83/566779183.db2.gz OTBKXJKBLPBILX-HNNXBMFYSA-N 0 3 375.307 3.064 10 0 GGAEHN CN(C[C@@H]1CCCN(C)C1)C(=O)CSCc1cc(-c2cccs2)on1 ZINC000609664535 566780818 /nfs/dbraw/zinc/78/08/18/566780818.db2.gz NSZIGVRRKFTOKF-CQSZACIVSA-N 0 3 379.551 3.437 10 0 GGAEHN Cc1nc2ccc(S(=O)(=O)N3CCCC[C@@H](N4CCCC4)C3)cc2s1 ZINC000562333433 566782109 /nfs/dbraw/zinc/78/21/09/566782109.db2.gz DNKRSXUUUSWYRA-OAHLLOKOSA-N 0 3 379.551 3.244 10 0 GGAEHN CSc1cc(Br)ccc1C(=O)N1CCOC2(CCN(C)CC2)C1 ZINC000655159886 566782965 /nfs/dbraw/zinc/78/29/65/566782965.db2.gz RYBOZDLYNDORGR-UHFFFAOYSA-N 0 3 399.354 3.108 10 0 GGAEHN Cc1ccc(CC(=O)N2CCN(C3CCOCC3)C[C@H]2C)c(Br)c1 ZINC000451251795 566783218 /nfs/dbraw/zinc/78/32/18/566783218.db2.gz WMUZZMIDNIBVLA-OAHLLOKOSA-N 0 3 395.341 3.012 10 0 GGAEHN CS[C@@H]1CN(C(=O)Nc2cc(F)cc(Br)c2F)C[C@@H]1N(C)C ZINC000562359072 566783275 /nfs/dbraw/zinc/78/32/75/566783275.db2.gz WEZYWCFBIYAJAV-NWDGAFQWSA-N 0 3 394.285 3.237 10 0 GGAEHN CC[C@H]1[C@H](CO)CCN1Cc1ccnc(-c2ccc(Br)cc2)n1 ZINC000451247840 566783917 /nfs/dbraw/zinc/78/39/17/566783917.db2.gz AJPKGJRRTYHODB-YOEHRIQHSA-N 0 3 376.298 3.499 10 0 GGAEHN Cc1ccsc1CNC(=O)CN[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000581517556 566784480 /nfs/dbraw/zinc/78/44/80/566784480.db2.gz LDJOREOAYHXXCY-VQIMIIECSA-N 0 3 377.941 3.361 10 0 GGAEHN Cc1ccsc1CNC(=O)CN[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000581517554 566785554 /nfs/dbraw/zinc/78/55/54/566785554.db2.gz LDJOREOAYHXXCY-LPHOPBHVSA-N 0 3 377.941 3.361 10 0 GGAEHN COC1CCN(C(C)(C)CNC(=O)c2scc(Br)c2C)CC1 ZINC000631147411 566785913 /nfs/dbraw/zinc/78/59/13/566785913.db2.gz DZRSLWSKTQWCTD-UHFFFAOYSA-N 0 3 389.359 3.438 10 0 GGAEHN COC[C@H](NCc1cc(OC)c(Br)cc1F)C1CCOCC1 ZINC000631171494 566787264 /nfs/dbraw/zinc/78/72/64/566787264.db2.gz XVKXHCSZCLENMN-HNNXBMFYSA-N 0 3 376.266 3.128 10 0 GGAEHN COC[C@@H](NCc1cc(OC)c(Br)cc1F)C1CCOCC1 ZINC000631171497 566787798 /nfs/dbraw/zinc/78/77/98/566787798.db2.gz XVKXHCSZCLENMN-OAHLLOKOSA-N 0 3 376.266 3.128 10 0 GGAEHN CC[C@@H](CN1CCCC1)NC(=O)c1cc(C)ccc1I ZINC000609833652 566789775 /nfs/dbraw/zinc/78/97/75/566789775.db2.gz RDSUADJSGIUUAM-ZDUSSCGKSA-N 0 3 386.277 3.204 10 0 GGAEHN C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(Br)c2c1OCCC2 ZINC000469437814 566789892 /nfs/dbraw/zinc/78/98/92/566789892.db2.gz CQUVLUVRIRUTIZ-STQMWFEESA-N 0 3 379.298 3.083 10 0 GGAEHN OC1(CCNCc2cncc(Br)c2)CCN(c2ccccc2)CC1 ZINC000631219516 566792539 /nfs/dbraw/zinc/79/25/39/566792539.db2.gz WAYSXZAUELXFCZ-UHFFFAOYSA-N 0 3 390.325 3.355 10 0 GGAEHN COCCCn1nccc1CN[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]12 ZINC000631222739 566793402 /nfs/dbraw/zinc/79/34/02/566793402.db2.gz TXHXXHFZOLDQTF-RCCFBDPRSA-N 0 3 376.298 3.110 10 0 GGAEHN COc1cc(C[NH2+]C[C@@H](O)CCc2ccccc2)cc(Br)c1[O-] ZINC000542314383 566793575 /nfs/dbraw/zinc/79/35/75/566793575.db2.gz FWSXJMKQAUBOJY-HNNXBMFYSA-N 0 3 380.282 3.247 10 0 GGAEHN O=C(N[C@H]1CCCN2CCCC[C@H]12)c1cc(Br)cc2[nH]cnc21 ZINC000655347812 566795187 /nfs/dbraw/zinc/79/51/87/566795187.db2.gz CJVBTMQZJIDOFH-DZGCQCFKSA-N 0 3 377.286 3.072 10 0 GGAEHN O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1cscc1Cl ZINC000631271837 566795893 /nfs/dbraw/zinc/79/58/93/566795893.db2.gz KHFCYIYMXYDQMZ-UHFFFAOYSA-N 0 3 377.897 3.479 10 0 GGAEHN COc1cc(C(=O)N[C@H]2CNCCC2(F)F)cc(Cl)c1OCC(C)C ZINC000516969530 566796221 /nfs/dbraw/zinc/79/62/21/566796221.db2.gz LBOKWQMMWYBZDR-AWEZNQCLSA-N 0 3 376.831 3.110 10 0 GGAEHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)c1[nH]nc2ccc(Br)cc21 ZINC000655349302 566796561 /nfs/dbraw/zinc/79/65/61/566796561.db2.gz FRABAWRHCVWOKJ-HUUCEWRRSA-N 0 3 377.286 3.072 10 0 GGAEHN COc1cc(C(=O)N[C@@H]2CNCCC2(F)F)cc(Cl)c1OCC(C)C ZINC000516969531 566796542 /nfs/dbraw/zinc/79/65/42/566796542.db2.gz LBOKWQMMWYBZDR-CQSZACIVSA-N 0 3 376.831 3.110 10 0 GGAEHN O=C(N[C@H]1CCCN2CCCC[C@@H]12)c1[nH]nc2ccc(Br)cc21 ZINC000655349301 566797113 /nfs/dbraw/zinc/79/71/13/566797113.db2.gz FRABAWRHCVWOKJ-GJZGRUSLSA-N 0 3 377.286 3.072 10 0 GGAEHN CN(C)[C@H](CNc1ncncc1Br)c1cccc(C(F)(F)F)c1 ZINC000469547525 566797890 /nfs/dbraw/zinc/79/78/90/566797890.db2.gz QSDYPTXZPCJOJT-CYBMUJFWSA-N 0 3 389.219 3.395 10 0 GGAEHN O=C(NC1CC(N2CCC(C(F)(F)F)CC2)C1)[C@@H]1CC12CCSCC2 ZINC000451327074 566798116 /nfs/dbraw/zinc/79/81/16/566798116.db2.gz FUKSGRDQURJIIM-NRXISQOPSA-N 0 3 376.488 3.441 10 0 GGAEHN CN(C)[C@@H](CNc1ncncc1Br)c1cccc(C(F)(F)F)c1 ZINC000469547526 566798684 /nfs/dbraw/zinc/79/86/84/566798684.db2.gz QSDYPTXZPCJOJT-ZDUSSCGKSA-N 0 3 389.219 3.395 10 0 GGAEHN Cc1ccc(S(=O)(=O)N2CCc3ccccc3[C@@H]2CN)c(Br)c1 ZINC000581726054 566802623 /nfs/dbraw/zinc/80/26/23/566802623.db2.gz XHEVIUKCEMDISF-INIZCTEOSA-N 0 3 395.322 3.004 10 0 GGAEHN CN(C)C[C@]1(O)CCCN(C(=O)Nc2ccc(Br)cc2Cl)C1 ZINC000631471019 566805396 /nfs/dbraw/zinc/80/53/96/566805396.db2.gz AOQLKCVVYNYDAG-OAHLLOKOSA-N 0 3 390.709 3.023 10 0 GGAEHN NC[C@@H](NC(=O)C1(c2cccc(Br)c2)CCCC1)C(F)(F)F ZINC000655509085 566806591 /nfs/dbraw/zinc/80/65/91/566806591.db2.gz JQLIVKRAUJNHBZ-GFCCVEGCSA-N 0 3 379.220 3.267 10 0 GGAEHN NC[C@@H](NC(=O)c1cc(COc2c(Cl)cccc2Cl)on1)C(F)(F)F ZINC000655513128 566806654 /nfs/dbraw/zinc/80/66/54/566806654.db2.gz QBTLJYRHKMQASE-LLVKDONJSA-N 0 3 398.168 3.180 10 0 GGAEHN CC(C)(C)CC(=O)Nc1ccc(Cl)c(C(=O)N[C@H](CN)C(F)(F)F)c1 ZINC000655512578 566806777 /nfs/dbraw/zinc/80/67/77/566806777.db2.gz HSYVRGHQVHONKD-GFCCVEGCSA-N 0 3 379.810 3.334 10 0 GGAEHN CN(Cc1ccccc1)CC(C)(C)NC(=O)c1cc[nH]c(=O)c1Br ZINC000469670603 566806865 /nfs/dbraw/zinc/80/68/65/566806865.db2.gz FGRHYYZTJWGPHC-UHFFFAOYSA-N 0 3 392.297 3.190 10 0 GGAEHN Cc1cccc(C[C@H](CO)NC[C@@H](O)COc2c(Cl)cccc2Cl)c1 ZINC000581824242 566806982 /nfs/dbraw/zinc/80/69/82/566806982.db2.gz CRCYEWLYFIKLTD-HZPDHXFCSA-N 0 3 384.303 3.235 10 0 GGAEHN Cc1cccc(C[C@@H](CO)NC[C@@H](O)COc2c(Cl)cccc2Cl)c1 ZINC000581824243 566807073 /nfs/dbraw/zinc/80/70/73/566807073.db2.gz CRCYEWLYFIKLTD-JKSUJKDBSA-N 0 3 384.303 3.235 10 0 GGAEHN NC[C@@H](C(=O)N1CCOc2cccc(Br)c2C1)c1ccc(F)cc1 ZINC000655504047 566807150 /nfs/dbraw/zinc/80/71/50/566807150.db2.gz KWFGJXLBQDGJDV-CQSZACIVSA-N 0 3 393.256 3.052 10 0 GGAEHN OC[C@H](N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1 ZINC000678609927 566807850 /nfs/dbraw/zinc/80/78/50/566807850.db2.gz ATCKYNBGGNGUAE-OALUTQOASA-N 0 3 375.310 3.347 10 0 GGAEHN CN(Cc1ccccc1)[C@H]1CCN(C(=O)c2c(F)cncc2Br)C1 ZINC000631543957 566809798 /nfs/dbraw/zinc/80/97/98/566809798.db2.gz NTSUBAYDVCDDPR-AWEZNQCLSA-N 0 3 392.272 3.330 10 0 GGAEHN O=S1(=O)CCC(CCNCc2cc3cc(Br)ccc3o2)CC1 ZINC000517176511 566809989 /nfs/dbraw/zinc/80/99/89/566809989.db2.gz NXAOOWZYFIHXDB-UHFFFAOYSA-N 0 3 386.311 3.500 10 0 GGAEHN COCCOc1c(Cl)cc(NC(=O)N[C@H]2CCCN(C)C2)cc1Cl ZINC000678665640 566812001 /nfs/dbraw/zinc/81/20/01/566812001.db2.gz RBLYGUYYFVRCJN-NSHDSACASA-N 0 3 376.284 3.234 10 0 GGAEHN COCCOc1c(Cl)cc(NC(=O)N[C@@H]2CCCN(C)C2)cc1Cl ZINC000678665639 566812384 /nfs/dbraw/zinc/81/23/84/566812384.db2.gz RBLYGUYYFVRCJN-LLVKDONJSA-N 0 3 376.284 3.234 10 0 GGAEHN Cc1cc(Br)cc2c1CN(C(=O)N[C@@H]1CCN(CC3CC3)C1)CC2 ZINC000678720442 566813520 /nfs/dbraw/zinc/81/35/20/566813520.db2.gz SYEOEKPWNSAORS-QGZVFWFLSA-N 0 3 392.341 3.310 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)[NH2+]Cc1nnc(C2CCOCC2)[n-]1 ZINC000631693961 566816010 /nfs/dbraw/zinc/81/60/10/566816010.db2.gz OCQBRWUCDBADNP-GFCCVEGCSA-N 0 3 379.302 3.182 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NCc1nnc(C2CCOCC2)[nH]1 ZINC000631693961 566816015 /nfs/dbraw/zinc/81/60/15/566816015.db2.gz OCQBRWUCDBADNP-GFCCVEGCSA-N 0 3 379.302 3.182 10 0 GGAEHN CS(=O)(=O)[C@H]1CCCC[C@H]1N[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]12 ZINC000631702454 566817959 /nfs/dbraw/zinc/81/79/59/566817959.db2.gz OPPUEFHNVDKMCN-DMRKSPOLSA-N 0 3 384.339 3.033 10 0 GGAEHN Cc1ccsc1[C@@H](CO)NC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000489917551 566817957 /nfs/dbraw/zinc/81/79/57/566817957.db2.gz XNVAOLOYJISPNM-HUUCEWRRSA-N 0 3 379.551 3.288 10 0 GGAEHN CS(=O)(=O)[C@@H]1CCCC[C@@H]1N[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]12 ZINC000631702458 566818691 /nfs/dbraw/zinc/81/86/91/566818691.db2.gz OPPUEFHNVDKMCN-FIDHJVLJSA-N 0 3 384.339 3.033 10 0 GGAEHN COCCN(CCN(C)C)C(=O)c1cc(Br)cc2ccccc21 ZINC000517353194 566821086 /nfs/dbraw/zinc/82/10/86/566821086.db2.gz KNMYQLPRESVPMI-UHFFFAOYSA-N 0 3 379.298 3.253 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@@H]1CCSC1)c1ccc(Br)cn1 ZINC000582006721 566821185 /nfs/dbraw/zinc/82/11/85/566821185.db2.gz STKFLPLDRUWLQC-CYBMUJFWSA-N 0 3 386.359 3.272 10 0 GGAEHN Cc1c(Br)cccc1CS(=O)(=O)N(C)[C@H]1CCN(C(C)C)C1 ZINC000655606743 566821201 /nfs/dbraw/zinc/82/12/01/566821201.db2.gz VBDBFUHTECEUIR-HNNXBMFYSA-N 0 3 389.359 3.002 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@H]1CCSC1)c1ccc(Br)cn1 ZINC000582006722 566821237 /nfs/dbraw/zinc/82/12/37/566821237.db2.gz STKFLPLDRUWLQC-ZDUSSCGKSA-N 0 3 386.359 3.272 10 0 GGAEHN Cc1c(Br)cc(CNC2(CC(N)=O)CCC2)cc1Br ZINC000582018307 566822988 /nfs/dbraw/zinc/82/29/88/566822988.db2.gz GASDBOGZYCQUDL-UHFFFAOYSA-N 0 3 390.119 3.408 10 0 GGAEHN C[NH+](C)[C@H]1C[C@@H](C[N-]S(=O)(=O)c2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000655633111 566823794 /nfs/dbraw/zinc/82/37/94/566823794.db2.gz BFCNLISIAXJDCT-VDISTLRHSA-N 0 3 385.942 3.082 10 0 GGAEHN CCOc1ccc(CN[C@@H](C)Cn2cc(Br)ccc2=O)cc1F ZINC000428217307 566824812 /nfs/dbraw/zinc/82/48/12/566824812.db2.gz JARHYOJNXYHKHB-LBPRGKRZSA-N 0 3 383.261 3.327 10 0 GGAEHN CCOc1ccc(CN[C@H](C)Cn2cc(Br)ccc2=O)cc1F ZINC000428217306 566825679 /nfs/dbraw/zinc/82/56/79/566825679.db2.gz JARHYOJNXYHKHB-GFCCVEGCSA-N 0 3 383.261 3.327 10 0 GGAEHN COC1CCN(C2(CNS(=O)(=O)c3cc(C)sc3C)CCCC2)CC1 ZINC000517413502 566825929 /nfs/dbraw/zinc/82/59/29/566825929.db2.gz CSPLJUWJGQLKTH-UHFFFAOYSA-N 0 3 386.583 3.067 10 0 GGAEHN C[C@H](NCCCN(C)S(C)(=O)=O)c1cc2cc(Br)ccc2o1 ZINC000678923774 566825946 /nfs/dbraw/zinc/82/59/46/566825946.db2.gz CLQGXWWIBHFCMZ-NSHDSACASA-N 0 3 389.315 3.127 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cccc(Br)c2C)C[C@H]1N1CCCC1 ZINC000542772667 566825953 /nfs/dbraw/zinc/82/59/53/566825953.db2.gz AGVLZSCACAHPPJ-CVEARBPZSA-N 0 3 383.355 3.409 10 0 GGAEHN CC(C)N(Cc1cc(Br)cc(Br)c1N)C[C@@H](C)O ZINC000469897708 566826715 /nfs/dbraw/zinc/82/67/15/566826715.db2.gz FYXHXCOBCVLXMM-SECBINFHSA-N 0 3 380.124 3.385 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)c1cc(F)ccc1Br ZINC000517460111 566826693 /nfs/dbraw/zinc/82/66/93/566826693.db2.gz COFURZBHGZTXNX-HNNXBMFYSA-N 0 3 379.273 3.491 10 0 GGAEHN O=C(c1ccc(Br)c(F)c1)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000469919819 566827686 /nfs/dbraw/zinc/82/76/86/566827686.db2.gz XIWJIZZDWVYAMQ-HNNXBMFYSA-N 0 3 399.304 3.305 10 0 GGAEHN Cc1cc(Br)ccc1C(=O)N1CC[C@@H](OCCN2CCCCC2)C1 ZINC000469931707 566828099 /nfs/dbraw/zinc/82/80/99/566828099.db2.gz XDQWBLYWAZLZSA-QGZVFWFLSA-N 0 3 395.341 3.475 10 0 GGAEHN O=C(c1cc(Br)ccc1F)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000469923671 566828116 /nfs/dbraw/zinc/82/81/16/566828116.db2.gz BNFBPXXBYDTFJM-HNNXBMFYSA-N 0 3 399.304 3.305 10 0 GGAEHN O=C(c1sccc1Br)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000469932508 566828947 /nfs/dbraw/zinc/82/89/47/566828947.db2.gz JVMTXTAUDGRSDE-ZDUSSCGKSA-N 0 3 387.343 3.228 10 0 GGAEHN O=C(c1ccc(Br)s1)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000469950208 566830766 /nfs/dbraw/zinc/83/07/66/566830766.db2.gz JPDOLFZTOKRDGU-ZDUSSCGKSA-N 0 3 387.343 3.228 10 0 GGAEHN CN(CC(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1)[C@H]1CCSC1 ZINC000490182811 566834982 /nfs/dbraw/zinc/83/49/82/566834982.db2.gz RKKSQORXZSHEKP-XJKSGUPXSA-N 0 3 378.929 3.317 10 0 GGAEHN CCC(CC)(C[N-]S(=O)(=O)c1c[nH]c(=O)s1)[NH2+][C@H](C)c1ccccc1 ZINC000631941203 566836445 /nfs/dbraw/zinc/83/64/45/566836445.db2.gz QPNYJXRQIPEUFN-CYBMUJFWSA-N 0 3 383.539 3.037 10 0 GGAEHN OC[C@@H](NCCOCCOc1ccccc1)c1ccc(Br)cc1 ZINC000542911413 566837968 /nfs/dbraw/zinc/83/79/68/566837968.db2.gz CZSSMFTXQRGSKG-GOSISDBHSA-N 0 3 380.282 3.168 10 0 GGAEHN CN(C(=O)COc1ccc(Br)cc1Cl)[C@H]1CCN(C2CC2)C1 ZINC000517647985 566838121 /nfs/dbraw/zinc/83/81/21/566838121.db2.gz VNOGNQFCUPRNCB-ZDUSSCGKSA-N 0 3 387.705 3.176 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CNCCCN1CCCC1=O ZINC000655710880 566838312 /nfs/dbraw/zinc/83/83/12/566838312.db2.gz FYPAGLWXZQEJMK-UHFFFAOYSA-N 0 3 391.313 3.045 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN1C[C@H](O)C2(CC2)C1 ZINC000428389645 566838274 /nfs/dbraw/zinc/83/82/74/566838274.db2.gz MEUOLRDJSJCUAV-KRWDZBQOSA-N 0 3 376.298 3.208 10 0 GGAEHN CC(C)(C)OC(=O)[C@@H]1CCN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000610538596 566840581 /nfs/dbraw/zinc/84/05/81/566840581.db2.gz GGGXSQKMVITKJZ-CHWSQXEVSA-N 0 3 390.307 3.397 10 0 GGAEHN Cc1cc(Br)cc(Cl)c1C(=O)Nc1cnn(CCN(C)C)c1 ZINC000679189127 566840707 /nfs/dbraw/zinc/84/07/07/566840707.db2.gz GHKVXVCPZOQJED-UHFFFAOYSA-N 0 3 385.693 3.421 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CNC1CCC(C(N)=O)CC1 ZINC000655738531 566841015 /nfs/dbraw/zinc/84/10/15/566841015.db2.gz WRNMJBMDFPJVKF-UHFFFAOYSA-N 0 3 391.313 3.077 10 0 GGAEHN C[C@H]1CN(CCCNC(=O)CCOc2cccc(Cl)c2Cl)CCCO1 ZINC000470065217 566841473 /nfs/dbraw/zinc/84/14/73/566841473.db2.gz IIRIYJXLBGZUBT-AWEZNQCLSA-N 0 3 389.323 3.379 10 0 GGAEHN CN(C(=O)CCSc1ccc(Br)cc1)[C@H]1CN2CCC1CC2 ZINC000517698039 566842533 /nfs/dbraw/zinc/84/25/33/566842533.db2.gz DMPCPBLCPVRIFZ-INIZCTEOSA-N 0 3 383.355 3.484 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NCCCN1CCCO[C@@H](C)C1 ZINC000470066459 566843179 /nfs/dbraw/zinc/84/31/79/566843179.db2.gz MFSXQKOZEXWJFO-KBPBESRZSA-N 0 3 389.323 3.378 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NCCCN1CCCO[C@H](C)C1 ZINC000470066460 566843743 /nfs/dbraw/zinc/84/37/43/566843743.db2.gz MFSXQKOZEXWJFO-KGLIPLIRSA-N 0 3 389.323 3.378 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC1CCN([C@@H]2CCOC2)CC1 ZINC000655757751 566844407 /nfs/dbraw/zinc/84/44/07/566844407.db2.gz KQIXVLNLYPWJCQ-CZUORRHYSA-N 0 3 383.330 3.362 10 0 GGAEHN COC(=O)[C@@H]1CCCC[C@@H]1N[C@@H](C)C(=O)Nc1ccc(Br)cc1 ZINC000451586363 566845031 /nfs/dbraw/zinc/84/50/31/566845031.db2.gz HQCKZKFLIGXAMD-GLQYFDAESA-N 0 3 383.286 3.098 10 0 GGAEHN CN(C)Cc1ccc(NC2CCN([C@@H]3CCOC3)CC2)cc1Br ZINC000655758271 566845219 /nfs/dbraw/zinc/84/52/19/566845219.db2.gz VBDYHERQWZXIFB-QGZVFWFLSA-N 0 3 382.346 3.176 10 0 GGAEHN COC(=O)[C@@H]1CCCC[C@@H]1NCC[S@](=O)c1cc(Cl)ccc1Cl ZINC000451587605 566845213 /nfs/dbraw/zinc/84/52/13/566845213.db2.gz MPDJIUVSPUBOGU-XTAIUZINSA-N 0 3 378.321 3.422 10 0 GGAEHN COC(=O)[C@@H]1CCCC[C@@H]1N[C@@H](C)C(=O)Nc1ccc(C)cc1Br ZINC000451585496 566845686 /nfs/dbraw/zinc/84/56/86/566845686.db2.gz BWZOWMAUFMHMCP-GUTXKFCHSA-N 0 3 397.313 3.406 10 0 GGAEHN Cc1nn(-c2ccccc2Cl)cc1CNCCC1CCS(=O)(=O)CC1 ZINC000655756617 566846082 /nfs/dbraw/zinc/84/60/82/566846082.db2.gz HVONTYSUOGHCFQ-UHFFFAOYSA-N 0 3 381.929 3.139 10 0 GGAEHN O=C1CCCN1CCCN[C@H](c1ccc(Br)cc1)[C@@H]1CCCO1 ZINC000679330094 566846938 /nfs/dbraw/zinc/84/69/38/566846938.db2.gz YDHFSGGQSXBARV-FUHWJXTLSA-N 0 3 381.314 3.271 10 0 GGAEHN CCOc1cc(C)ccc1CN[C@@H](C)Cn1cc(Br)ccc1=O ZINC000428484250 566846980 /nfs/dbraw/zinc/84/69/80/566846980.db2.gz LDVFGLSSUHQQNF-AWEZNQCLSA-N 0 3 379.298 3.496 10 0 GGAEHN CC[C@H](NCc1cn(-c2cccc(Br)c2)nc1C)[C@@H](O)C(F)F ZINC000655778233 566847417 /nfs/dbraw/zinc/84/74/17/566847417.db2.gz FAYBAWOTLUJDMP-LSDHHAIUSA-N 0 3 388.256 3.437 10 0 GGAEHN OC[C@H](CNCc1cc2n(n1)CCCC2)Cc1ccc(F)c(Br)c1 ZINC000655780296 566849288 /nfs/dbraw/zinc/84/92/88/566849288.db2.gz XFYVQDOQVFGZDU-AWEZNQCLSA-N 0 3 396.304 3.062 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)[NH2+]Cc1nnc([C@@H]2CCCO2)[n-]1 ZINC000655795856 566849642 /nfs/dbraw/zinc/84/96/42/566849642.db2.gz DFKMMHIYCCAAQR-YGRLFVJLSA-N 0 3 383.265 3.279 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)NCc1nc([C@@H]2CCCO2)n[nH]1 ZINC000655795856 566849644 /nfs/dbraw/zinc/84/96/44/566849644.db2.gz DFKMMHIYCCAAQR-YGRLFVJLSA-N 0 3 383.265 3.279 10 0 GGAEHN Cc1ccc(C[C@H](CO)CNCc2cc3n(n2)CCCC3)cc1Br ZINC000655779489 566849841 /nfs/dbraw/zinc/84/98/41/566849841.db2.gz MIRVQPHAWCAFGB-INIZCTEOSA-N 0 3 392.341 3.231 10 0 GGAEHN Cc1c(Br)cccc1C[C@@H](CO)CNCc1cc2n(n1)CCCC2 ZINC000655780214 566850432 /nfs/dbraw/zinc/85/04/32/566850432.db2.gz WMORRCOKQMOJKV-OAHLLOKOSA-N 0 3 392.341 3.231 10 0 GGAEHN O=S1(=O)CCC[C@@H](NCC2(c3cccc(OC(F)(F)F)c3)CCC2)C1 ZINC000655819922 566851368 /nfs/dbraw/zinc/85/13/68/566851368.db2.gz DHKRONBYMORXDU-CQSZACIVSA-N 0 3 377.428 3.174 10 0 GGAEHN OCC[C@]1(CN[C@@H](c2ccc(Br)cc2)[C@@H]2CCCO2)CCOC1 ZINC000679349025 566851245 /nfs/dbraw/zinc/85/12/45/566851245.db2.gz JAWWAAMGKYJWIF-OKZBNKHCSA-N 0 3 384.314 3.048 10 0 GGAEHN Cc1ccc(I)c(C(=O)NC[C@H]2CCCCN2C2CC2)c1 ZINC000470157377 566851926 /nfs/dbraw/zinc/85/19/26/566851926.db2.gz LWRBKIBETWGSDT-CQSZACIVSA-N 0 3 398.288 3.346 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NC[C@@H]1CCCCN1C1CC1 ZINC000470166477 566853437 /nfs/dbraw/zinc/85/34/37/566853437.db2.gz VMTHRFKVRVDAJF-INIZCTEOSA-N 0 3 381.314 3.133 10 0 GGAEHN COc1cc(C)nc(CNC[C@@H](CO)Cc2cccc(Br)c2)c1 ZINC000428538949 566855052 /nfs/dbraw/zinc/85/50/52/566855052.db2.gz ROWWBKSUWLMHID-HNNXBMFYSA-N 0 3 379.298 3.102 10 0 GGAEHN CCCN(CCN1CCCC1)C(=O)c1cc(Br)cc2nc[nH]c21 ZINC000582377477 566856835 /nfs/dbraw/zinc/85/68/35/566856835.db2.gz KAQYBMKSVNNABF-UHFFFAOYSA-N 0 3 379.302 3.273 10 0 GGAEHN CCN(Cc1cc(Br)ccc1F)C(=O)N[C@@H](CN)C(F)(F)F ZINC000655916437 566858562 /nfs/dbraw/zinc/85/85/62/566858562.db2.gz YEVRHKBOQKELKN-NSHDSACASA-N 0 3 386.187 3.009 10 0 GGAEHN CC(C)N(Cc1cccc(Br)c1)C(=O)N[C@@H](CN)C(F)(F)F ZINC000655913818 566858739 /nfs/dbraw/zinc/85/87/39/566858739.db2.gz JTZDCSZUFJAKKT-LBPRGKRZSA-N 0 3 382.224 3.259 10 0 GGAEHN NC[C@@H](NC(=O)N(Cc1csc(Br)c1)C1CC1)C(F)(F)F ZINC000655920437 566858827 /nfs/dbraw/zinc/85/88/27/566858827.db2.gz JSXIXRNNBOATFR-SECBINFHSA-N 0 3 386.237 3.074 10 0 GGAEHN NC[C@H](NC(=O)NCc1cc(Cl)cc(Cl)c1OC(F)F)C(F)(F)F ZINC000655918843 566858853 /nfs/dbraw/zinc/85/88/53/566858853.db2.gz DWLXQIURXOTONC-QMMMGPOBSA-N 0 3 396.143 3.284 10 0 GGAEHN CCCN(Cc1ccccc1Br)C(=O)N[C@@H](CN)C(F)(F)F ZINC000655914590 566859001 /nfs/dbraw/zinc/85/90/01/566859001.db2.gz MRXIUQFFSGRNNQ-LBPRGKRZSA-N 0 3 382.224 3.260 10 0 GGAEHN NC[C@@H](NC(=O)N1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1)C(F)(F)F ZINC000655921643 566859056 /nfs/dbraw/zinc/85/90/56/566859056.db2.gz PQSWECKVFAFAFD-BXKDBHETSA-N 0 3 386.201 3.046 10 0 GGAEHN NC[C@@H](NC(=O)NC1(c2cccc(Br)c2)CCC1)C(F)(F)F ZINC000655913436 566859126 /nfs/dbraw/zinc/85/91/26/566859126.db2.gz HVWFZBBRVBJAMX-LLVKDONJSA-N 0 3 380.208 3.017 10 0 GGAEHN NC[C@H](NC(=O)N(Cc1csc(Br)c1)C1CC1)C(F)(F)F ZINC000655920442 566859237 /nfs/dbraw/zinc/85/92/37/566859237.db2.gz JSXIXRNNBOATFR-VIFPVBQESA-N 0 3 386.237 3.074 10 0 GGAEHN NC[C@H](NC(=O)N1CCC[C@H]1c1cccc(Br)c1)C(F)(F)F ZINC000655912561 566859278 /nfs/dbraw/zinc/85/92/78/566859278.db2.gz VXKGRTVMBGTYJV-RYUDHWBXSA-N 0 3 380.208 3.185 10 0 GGAEHN NC[C@H](NC(=O)NC1(c2cccc(Br)c2)CCC1)C(F)(F)F ZINC000655913437 566859319 /nfs/dbraw/zinc/85/93/19/566859319.db2.gz HVWFZBBRVBJAMX-NSHDSACASA-N 0 3 380.208 3.017 10 0 GGAEHN NC[C@@H](NC(=O)N[C@H](c1cc(F)cc(Br)c1)C1CC1)C(F)(F)F ZINC000655924248 566859380 /nfs/dbraw/zinc/85/93/80/566859380.db2.gz IYPYAWKUKZKMKO-NEPJUHHUSA-N 0 3 398.198 3.228 10 0 GGAEHN NC[C@@H](NC(=O)NCCOc1c(Cl)cc(Cl)cc1Cl)C(F)(F)F ZINC000655922175 566859508 /nfs/dbraw/zinc/85/95/08/566859508.db2.gz QQGFGSRGKNDSON-SECBINFHSA-N 0 3 394.608 3.214 10 0 GGAEHN NC[C@@H](NC(=O)N1CCC[C@H]1c1cccc(Br)c1)C(F)(F)F ZINC000655912560 566859624 /nfs/dbraw/zinc/85/96/24/566859624.db2.gz VXKGRTVMBGTYJV-NWDGAFQWSA-N 0 3 380.208 3.185 10 0 GGAEHN NC[C@H](NC(=O)N1CCC[C@@H]1c1cccc(Br)c1)C(F)(F)F ZINC000655912558 566859641 /nfs/dbraw/zinc/85/96/41/566859641.db2.gz VXKGRTVMBGTYJV-NEPJUHHUSA-N 0 3 380.208 3.185 10 0 GGAEHN NC[C@H](NC(=O)N[C@H](c1ccc(Br)cc1)C1CCC1)C(F)(F)F ZINC000655910750 566859663 /nfs/dbraw/zinc/85/96/63/566859663.db2.gz BMGVKQOEBYKOOD-STQMWFEESA-N 0 3 394.235 3.479 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)c1ccn(-c2cccc(Br)c2)n1 ZINC000518018706 566859811 /nfs/dbraw/zinc/85/98/11/566859811.db2.gz WLBYDXVVHYPKFU-HNNXBMFYSA-N 0 3 393.329 3.341 10 0 GGAEHN CC[C@H](Cc1ccccc1Br)N(C)C(=O)N[C@@H](CN)C(F)(F)F ZINC000655924613 566860658 /nfs/dbraw/zinc/86/06/58/566860658.db2.gz MUMKVARQBFKARW-YPMHNXCESA-N 0 3 396.251 3.301 10 0 GGAEHN NC[C@@H](NC(=O)NC1(c2ccccc2Br)CCC1)C(F)(F)F ZINC000655932104 566860777 /nfs/dbraw/zinc/86/07/77/566860777.db2.gz SGKMDLAZWZMFMB-LLVKDONJSA-N 0 3 380.208 3.017 10 0 GGAEHN NC[C@H](NC(=O)NCc1cnc(-c2ccc(Cl)cc2)s1)C(F)(F)F ZINC000655925756 566861054 /nfs/dbraw/zinc/86/10/54/566861054.db2.gz ASNCAYYYDVPHMK-NSHDSACASA-N 0 3 378.807 3.152 10 0 GGAEHN NC[C@@H](NC(=O)N(Cc1cccc(Br)c1)CC1CC1)C(F)(F)F ZINC000655929929 566861091 /nfs/dbraw/zinc/86/10/91/566861091.db2.gz XUXJPYHBTYOZSQ-CYBMUJFWSA-N 0 3 394.235 3.260 10 0 GGAEHN CN(Cc1cc(Br)ccc1Cl)C(=O)N[C@@H](CN)C(F)(F)F ZINC000655927836 566861141 /nfs/dbraw/zinc/86/11/41/566861141.db2.gz JGLHCAGWGORJLY-JTQLQIEISA-N 0 3 388.615 3.134 10 0 GGAEHN NC[C@@H](NC(=O)N1CCC(F)(Cc2ccc(Cl)cc2)CC1)C(F)(F)F ZINC000655930993 566861474 /nfs/dbraw/zinc/86/14/74/566861474.db2.gz DYNNFGLQZZOLHQ-CYBMUJFWSA-N 0 3 381.801 3.286 10 0 GGAEHN CN(C)CCOc1ccccc1C(=O)N(C)Cc1ccc(Br)o1 ZINC000518054156 566863840 /nfs/dbraw/zinc/86/38/40/566863840.db2.gz PXOIEAWANPVZLF-UHFFFAOYSA-N 0 3 381.270 3.255 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNS(=O)(=O)Cc1cccc(C(F)(F)F)c1 ZINC000518088753 566864676 /nfs/dbraw/zinc/86/46/76/566864676.db2.gz ATPDFQVWHZJLOD-KBPBESRZSA-N 0 3 378.460 3.388 10 0 GGAEHN Cc1nn(-c2ccncc2)cc1CNCCOc1ncc(Cl)cc1Cl ZINC000543237495 566864983 /nfs/dbraw/zinc/86/49/83/566864983.db2.gz DATVERCEWUWGRY-UHFFFAOYSA-N 0 3 378.263 3.446 10 0 GGAEHN O=C(CCN1CCC[C@H](OC(F)F)C1)Nc1cccc(Br)c1 ZINC000679678124 566866100 /nfs/dbraw/zinc/86/61/00/566866100.db2.gz JNSFGYAOJZBWAS-ZDUSSCGKSA-N 0 3 377.229 3.481 10 0 GGAEHN COC[C@H](CN[C@H](Cc1ccccn1)c1ccc(Br)cc1)OC ZINC000679722620 566869850 /nfs/dbraw/zinc/86/98/50/566869850.db2.gz GZSGATBYHPNLJL-ZWKOTPCHSA-N 0 3 379.298 3.379 10 0 GGAEHN C[C@]12CCN(C[C@@H](O)COc3ccc(Br)cc3)C[C@H]1C2(F)F ZINC000428714829 566872717 /nfs/dbraw/zinc/87/27/17/566872717.db2.gz WLCCNCGPCDIQKQ-YUELXQCFSA-N 0 3 376.241 3.166 10 0 GGAEHN C[C@]12CCN(C[C@@H](O)COc3cc(F)cc(Br)c3)C[C@H]1C2(F)F ZINC000428728160 566874507 /nfs/dbraw/zinc/87/45/07/566874507.db2.gz RATBFHKEDMQMAI-YUELXQCFSA-N 0 3 394.231 3.305 10 0 GGAEHN Cc1cc(Br)cc(C)c1NC(=O)CCCN(CC(N)=O)C(C)(C)C ZINC000679821664 566874825 /nfs/dbraw/zinc/87/48/25/566874825.db2.gz PGULPNMKIXBSPN-UHFFFAOYSA-N 0 3 398.345 3.370 10 0 GGAEHN Cc1cccc(C)c1OC[C@@H](O)CN[C@@H](CO)c1cccc(Br)c1 ZINC000679831109 566876455 /nfs/dbraw/zinc/87/64/55/566876455.db2.gz HHTDURIWHSSESR-ROUUACIJSA-N 0 3 394.309 3.129 10 0 GGAEHN COc1ccc(COCCN[C@H](CO)c2cccc(Br)c2)cc1 ZINC000679833612 566876586 /nfs/dbraw/zinc/87/65/86/566876586.db2.gz YESYHUQHFGTUBC-GOSISDBHSA-N 0 3 380.282 3.298 10 0 GGAEHN C[C@H](NC(=O)[C@H]1C[C@]1(C)c1cccc(Br)c1)C1=CCN(C)CC1 ZINC000632367617 566878675 /nfs/dbraw/zinc/87/86/75/566878675.db2.gz RSOZNZMCZNQDSD-BOFPYLFWSA-N 0 3 377.326 3.493 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1S(=O)(=O)c1ccc(C(F)(F)F)s1 ZINC000518373963 566879031 /nfs/dbraw/zinc/87/90/31/566879031.db2.gz KWGTXNSVQARCCY-GFCCVEGCSA-N 0 3 376.425 3.014 10 0 GGAEHN COc1ccc(CCC(=O)N(C)[C@H]2CCN(C3CC3)C2)cc1Br ZINC000518364430 566879613 /nfs/dbraw/zinc/87/96/13/566879613.db2.gz AYVROVFXHCLQPS-HNNXBMFYSA-N 0 3 381.314 3.085 10 0 GGAEHN CN(C)CCn1cc(C(=O)N2CCC[C@@H]2c2ccc(Br)s2)cn1 ZINC000632428753 566883353 /nfs/dbraw/zinc/88/33/53/566883353.db2.gz QSBJLFBSCXEADI-CYBMUJFWSA-N 0 3 397.342 3.246 10 0 GGAEHN CN(C)CCn1cc(C(=O)N2CCC[C@H]2c2ccc(Br)s2)cn1 ZINC000632428754 566883669 /nfs/dbraw/zinc/88/36/69/566883669.db2.gz QSBJLFBSCXEADI-ZDUSSCGKSA-N 0 3 397.342 3.246 10 0 GGAEHN O=C1[C@@H](N[C@H]2CCCc3c(Br)cccc32)CCN1C1CCOCC1 ZINC000679991596 566884813 /nfs/dbraw/zinc/88/48/13/566884813.db2.gz AXSKJUUZMGPNAE-ROUUACIJSA-N 0 3 393.325 3.196 10 0 GGAEHN CN1CCN([C@H]2CC[C@@H](NC(=O)c3cc(Cl)cc(Cl)c3F)CC2)CC1 ZINC000632462965 566886709 /nfs/dbraw/zinc/88/67/09/566886709.db2.gz AMXNEVCJHYXXKD-OKILXGFUSA-N 0 3 388.314 3.421 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN1C[C@H](C(N)=O)CC[C@H]1C ZINC000656249799 566888805 /nfs/dbraw/zinc/88/88/05/566888805.db2.gz CKEVQMODSOUKQF-TZMCWYRMSA-N 0 3 391.313 3.029 10 0 GGAEHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1c(F)cncc1Br ZINC000632482646 566889924 /nfs/dbraw/zinc/88/99/24/566889924.db2.gz HLMSKHRNBIIIAY-LRDDRELGSA-N 0 3 392.272 3.234 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1CCCC[C@H]1CC(N)=O ZINC000656251096 566890264 /nfs/dbraw/zinc/89/02/64/566890264.db2.gz GVYOXCAMKLUEHS-HNNXBMFYSA-N 0 3 391.313 3.173 10 0 GGAEHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1c(F)cncc1Br ZINC000632482648 566890604 /nfs/dbraw/zinc/89/06/04/566890604.db2.gz HLMSKHRNBIIIAY-WBMJQRKESA-N 0 3 392.272 3.234 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1C[C@@H](C(N)=O)CC[C@H]1C ZINC000656250620 566891027 /nfs/dbraw/zinc/89/10/27/566891027.db2.gz WLJMKJQBFBIXFN-OCCSQVGLSA-N 0 3 391.313 3.029 10 0 GGAEHN C[C@H](NC(=O)c1c(F)cncc1Br)[C@H](c1ccccc1)N(C)C ZINC000632517330 566891622 /nfs/dbraw/zinc/89/16/22/566891622.db2.gz IDWRIAFNMKPTPP-MEDUHNTESA-N 0 3 380.261 3.404 10 0 GGAEHN Cc1cc(Br)cc(C)c1CNC(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1 ZINC000428969413 566892789 /nfs/dbraw/zinc/89/27/89/566892789.db2.gz RKJHAOCOOWXASG-DZGCQCFKSA-N 0 3 380.330 3.490 10 0 GGAEHN C[C@H](NCc1cc(Cl)cc(S(N)(=O)=O)c1)[C@@H]1Oc2ccccc2[C@H]1C ZINC000563539779 566893408 /nfs/dbraw/zinc/89/34/08/566893408.db2.gz WSUPNFREJCPKMW-FTLABTOESA-N 0 3 380.897 3.030 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1CC[C@@H]2CN(C)C[C@@H]21 ZINC000656259809 566893682 /nfs/dbraw/zinc/89/36/82/566893682.db2.gz CSJIKCJTNXRLMD-KDOFPFPSSA-N 0 3 375.314 3.079 10 0 GGAEHN O=C(NCc1cc(F)cc(Br)c1)N1CC[C@H](N2CCCCC2)C1 ZINC000518591335 566893819 /nfs/dbraw/zinc/89/38/19/566893819.db2.gz DMYSLPCFGQJTPE-INIZCTEOSA-N 0 3 384.293 3.358 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)c1cccc(I)c1 ZINC000518600881 566893846 /nfs/dbraw/zinc/89/38/46/566893846.db2.gz ZVQKJHZCEKIXRJ-BETUJISGSA-N 0 3 386.277 3.284 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNC(=O)COc1ccc(F)cc1Br ZINC000518596673 566894066 /nfs/dbraw/zinc/89/40/66/566894066.db2.gz JAWHOTCWSVRJOY-STQMWFEESA-N 0 3 387.293 3.346 10 0 GGAEHN CN1CC[C@@H](NC(=O)Cc2ccc(Br)cc2O)[C@H]1c1ccccc1 ZINC000491119291 566895578 /nfs/dbraw/zinc/89/55/78/566895578.db2.gz VPHGBKXBHVTKQR-VQIMIIECSA-N 0 3 389.293 3.259 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CNCC[C@H](O)C(F)(F)F ZINC000656262170 566895845 /nfs/dbraw/zinc/89/58/45/566895845.db2.gz PMJKBFPFNWOALI-AWEZNQCLSA-N 0 3 392.219 3.346 10 0 GGAEHN O[C@@H]1C[C@H]2CN(Cc3ccc(-c4ccccc4Br)s3)CCN2C1 ZINC000656273154 566896437 /nfs/dbraw/zinc/89/64/37/566896437.db2.gz VKPSKZGJIRSMTO-UONOGXRCSA-N 0 3 393.350 3.428 10 0 GGAEHN O=C(CCN1CC[C@@H]([C@H](O)C(F)(F)F)C1)Nc1ccccc1Br ZINC000451881513 566900540 /nfs/dbraw/zinc/90/05/40/566900540.db2.gz BKJHHQSPCLWIHH-YGRLFVJLSA-N 0 3 395.219 3.023 10 0 GGAEHN Cc1ccc(Br)c(S(=O)(=O)N2CCc3ccccc3[C@H]2CN)c1 ZINC000518769412 566902068 /nfs/dbraw/zinc/90/20/68/566902068.db2.gz TYAXCENEGCDXGL-MRXNPFEDSA-N 0 3 395.322 3.004 10 0 GGAEHN Brc1cccc(NCCNCc2cnnn2Cc2ccccc2)c1 ZINC000491312215 566902773 /nfs/dbraw/zinc/90/27/73/566902773.db2.gz ZLFUVBDUHUCVDV-UHFFFAOYSA-N 0 3 386.297 3.291 10 0 GGAEHN O=C(CCN1CC[C@@H]([C@@H](O)C(F)(F)F)C1)Nc1cccc(Br)c1 ZINC000451891951 566903150 /nfs/dbraw/zinc/90/31/50/566903150.db2.gz OXLKSBCLAIZGAR-QMTHXVAHSA-N 0 3 395.219 3.023 10 0 GGAEHN COc1ccc(S[C@H](C)C(=O)N2C[C@@H](N3CCCC3)[C@@H](SC)C2)cc1 ZINC000543701163 566903414 /nfs/dbraw/zinc/90/34/14/566903414.db2.gz AKXJCGRMFTXUOF-OLMNPRSZSA-N 0 3 380.579 3.214 10 0 GGAEHN C[C@@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CCC[C@]2(CCOC2)C1 ZINC000451902672 566905173 /nfs/dbraw/zinc/90/51/73/566905173.db2.gz OPEYTWZBTLMFPH-KXBFYZLASA-N 0 3 395.341 3.299 10 0 GGAEHN C[C@H](OC[C@H](O)CN1CC[C@H]([C@H](O)C(F)(F)F)C1)c1ccc(Cl)cc1 ZINC000451911338 566906445 /nfs/dbraw/zinc/90/64/45/566906445.db2.gz POTRBKCFPOBCKO-YUDUHTQSSA-N 0 3 381.822 3.024 10 0 GGAEHN O[C@@H]([C@H]1CCN(CCc2nc(-c3cccc(Cl)c3)no2)C1)C(F)(F)F ZINC000451915566 566906878 /nfs/dbraw/zinc/90/68/78/566906878.db2.gz VRCPXQRXMJKKTG-FZMZJTMJSA-N 0 3 375.778 3.178 10 0 GGAEHN CCOc1cc(C[NH2+]CCc2ccc(CO)cc2)cc(Br)c1[O-] ZINC000656517718 566907308 /nfs/dbraw/zinc/90/73/08/566907308.db2.gz CSGWWJVIRUNUFU-UHFFFAOYSA-N 0 3 380.282 3.378 10 0 GGAEHN CC[C@@H](c1ccc(Br)cc1)N1CCN([C@H]2CCNC(=O)CC2)CC1 ZINC000451919627 566907786 /nfs/dbraw/zinc/90/77/86/566907786.db2.gz SOYASTSIDXRLOC-MSOLQXFVSA-N 0 3 394.357 3.187 10 0 GGAEHN CCO[C@H]1C[C@](N)(C(=O)N2CCc3cc(Br)cc(C)c3C2)C1(C)C ZINC000518973272 566912470 /nfs/dbraw/zinc/91/24/70/566912470.db2.gz LHLUEIZVCQLYNY-LPHOPBHVSA-N 0 3 395.341 3.175 10 0 GGAEHN OC[C@H](NCCCOc1cccc(I)c1)c1ccccc1 ZINC000543808002 566912851 /nfs/dbraw/zinc/91/28/51/566912851.db2.gz NITGVQNDUMHZCE-KRWDZBQOSA-N 0 3 397.256 3.383 10 0 GGAEHN CCO[C@@H]1C[C@@](N)(C(=O)N2CCc3cc(Br)cc(C)c3C2)C1(C)C ZINC000518973274 566913087 /nfs/dbraw/zinc/91/30/87/566913087.db2.gz LHLUEIZVCQLYNY-VQIMIIECSA-N 0 3 395.341 3.175 10 0 GGAEHN CCO[C@@H]1C[C@](N)(C(=O)N2CCc3cc(Br)cc(C)c3C2)C1(C)C ZINC000518973271 566913248 /nfs/dbraw/zinc/91/32/48/566913248.db2.gz LHLUEIZVCQLYNY-APWZRJJASA-N 0 3 395.341 3.175 10 0 GGAEHN CC(C(=O)NCc1ccccc1F)S(=O)(=O)Cc1ccsc1Cl ZINC000656534017 566913957 /nfs/dbraw/zinc/91/39/57/566913957.db2.gz IUNZDIAFUFNQFI-SNVBAGLBSA-N 0 3 375.874 3.160 10 0 GGAEHN CC(C(=O)N1CCc2ccccc2C1)S(=O)(=O)Cc1ccsc1Cl ZINC000656534405 566914005 /nfs/dbraw/zinc/91/40/05/566914005.db2.gz PKODQMSMJGBRPO-LBPRGKRZSA-N 0 3 383.922 3.290 10 0 GGAEHN O=C(N[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)NC1CCN(C2CC2)CC1 ZINC000632843203 566919270 /nfs/dbraw/zinc/91/92/70/566919270.db2.gz JGBYCBUZBHYAPZ-BPQIPLTHSA-N 0 3 390.325 3.013 10 0 GGAEHN CN1CC[C@@H](Cn2nnnc2Sc2cnc3cc(Cl)c(Cl)cc3n2)C1 ZINC000543901053 566921348 /nfs/dbraw/zinc/92/13/48/566921348.db2.gz CCPMGORZRBRQAV-SECBINFHSA-N 0 3 396.307 3.026 10 0 GGAEHN C[C@H](N[C@@H]1Cc2cccc(O)c2C1)C(=O)Nc1ccccc1Br ZINC000429304563 566922279 /nfs/dbraw/zinc/92/22/79/566922279.db2.gz GZMXPEIVILTWRA-WCQYABFASA-N 0 3 375.266 3.239 10 0 GGAEHN Cc1cc(Br)cc(C)c1S(=O)(=O)NCCN(C)C1CCCC1 ZINC000519150800 566923206 /nfs/dbraw/zinc/92/32/06/566923206.db2.gz PDNUJEQTJVVXPH-UHFFFAOYSA-N 0 3 389.359 3.219 10 0 GGAEHN Cc1ccc(C(=O)N(CCN(C)C)CC(C)C)cc1I ZINC000519148202 566923844 /nfs/dbraw/zinc/92/38/44/566923844.db2.gz BDXFQZPIOWZTDQ-UHFFFAOYSA-N 0 3 388.293 3.259 10 0 GGAEHN C[C@@H](C[N-]S(=O)(=O)c1cccc(Br)c1Cl)C[NH+]1CCCC1 ZINC000563902224 566925799 /nfs/dbraw/zinc/92/57/99/566925799.db2.gz JFHRGZYEAPJGKF-NSHDSACASA-N 0 3 395.750 3.113 10 0 GGAEHN CSC[C@@H](NCCCN1CCCS1(=O)=O)c1ccc(C(F)(F)F)cc1 ZINC000611622054 566931840 /nfs/dbraw/zinc/93/18/40/566931840.db2.gz OFZJTUKLALFRBY-OAHLLOKOSA-N 0 3 396.500 3.125 10 0 GGAEHN COC[C@@H](N[C@@H](C)C(=O)Nc1cc(Cl)ccc1Cl)C1CCOCC1 ZINC000656679444 566932418 /nfs/dbraw/zinc/93/24/18/566932418.db2.gz IKYKVHAJPBSYFV-MEDUHNTESA-N 0 3 375.296 3.352 10 0 GGAEHN COC[C@H]1CCCN(CC(=O)N[C@H](C)c2ccc(Br)cc2)CC1 ZINC000452088704 566932890 /nfs/dbraw/zinc/93/28/90/566932890.db2.gz OZKFQRDAJRELSH-CABCVRRESA-N 0 3 383.330 3.375 10 0 GGAEHN COC[C@@H](N[C@H](C)C(=O)Nc1ccc(Cl)cc1Cl)C1CCOCC1 ZINC000656680901 566933018 /nfs/dbraw/zinc/93/30/18/566933018.db2.gz XEKMGUXXIDXLJE-BDJLRTHQSA-N 0 3 375.296 3.352 10 0 GGAEHN Cc1cc(N2CC[C@@H](N[C@H]3COC4(CCC4)C3)C2=O)ccc1Br ZINC000656683037 566933917 /nfs/dbraw/zinc/93/39/17/566933917.db2.gz DLEHNKGLHZBHTA-CZUORRHYSA-N 0 3 379.298 3.164 10 0 GGAEHN Cc1cc(N2CC[C@H](N[C@@H]3COC4(CCC4)C3)C2=O)ccc1Br ZINC000656683035 566934215 /nfs/dbraw/zinc/93/42/15/566934215.db2.gz DLEHNKGLHZBHTA-BBRMVZONSA-N 0 3 379.298 3.164 10 0 GGAEHN Cc1cc(N2CC[C@@H](N[C@@H]3COC4(CCC4)C3)C2=O)ccc1Br ZINC000656683039 566934255 /nfs/dbraw/zinc/93/42/55/566934255.db2.gz DLEHNKGLHZBHTA-XJKSGUPXSA-N 0 3 379.298 3.164 10 0 GGAEHN CN(C)CCOc1ccccc1C(=O)NCc1ccc(Br)cc1 ZINC000519339337 566934370 /nfs/dbraw/zinc/93/43/70/566934370.db2.gz YGBZMIDSYNYGDJ-UHFFFAOYSA-N 0 3 377.282 3.320 10 0 GGAEHN CC1(C)CCCN[C@H]1C(=O)NC[C@@H]1CCN(c2ccc(Br)cc2)C1 ZINC000563959246 566934332 /nfs/dbraw/zinc/93/43/32/566934332.db2.gz FCEWUKQSUCKSMR-YOEHRIQHSA-N 0 3 394.357 3.170 10 0 GGAEHN COC[C@@H](N[C@@H](C)C(=O)Nc1cccc(Cl)c1Cl)C1CCOCC1 ZINC000656680673 566934517 /nfs/dbraw/zinc/93/45/17/566934517.db2.gz SHLVIONHGISLNV-XHDPSFHLSA-N 0 3 375.296 3.352 10 0 GGAEHN CN1CCN([C@H]2CC[C@@H](NC(=O)Cc3ccc(Cl)c(Cl)c3)CC2)CC1 ZINC000680841971 566935247 /nfs/dbraw/zinc/93/52/47/566935247.db2.gz SCQWOHPGUAPMBD-IYBDPMFKSA-N 0 3 384.351 3.211 10 0 GGAEHN O=S(=O)([N-]CC[NH2+][C@H]1CC[C@H]1C1CCC1)c1cccc(Cl)c1Cl ZINC000583278766 566935915 /nfs/dbraw/zinc/93/59/15/566935915.db2.gz BXDVXTOJMSMJKD-JSGCOSHPSA-N 0 3 377.337 3.440 10 0 GGAEHN Cc1cc(N2CCC[C@H](N[C@H](C)c3ccc(Br)cn3)C2)n(C)n1 ZINC000519505866 566943369 /nfs/dbraw/zinc/94/33/69/566943369.db2.gz SGOPLOMZEUOGSZ-HIFRSBDPSA-N 0 3 378.318 3.206 10 0 GGAEHN Cc1ccc(C(=O)N2CCN(C3CC3)C[C@H](C)C2)cc1I ZINC000452168711 566947200 /nfs/dbraw/zinc/94/72/00/566947200.db2.gz DPTDQCSYXFEXIM-LBPRGKRZSA-N 0 3 398.288 3.156 10 0 GGAEHN Cc1cc(NC(=O)c2cncc(Br)c2C)n(C2CCN(C)CC2)n1 ZINC000612050288 566949824 /nfs/dbraw/zinc/94/98/24/566949824.db2.gz QTEDBNYBCQJMAU-UHFFFAOYSA-N 0 3 392.301 3.176 10 0 GGAEHN CN(Cc1ccc(Br)o1)C(=O)CCN1CCc2ccccc2C1 ZINC000471414080 566951499 /nfs/dbraw/zinc/95/14/99/566951499.db2.gz UVYLQEQKAPDQKU-UHFFFAOYSA-N 0 3 377.282 3.449 10 0 GGAEHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccc(OC)cc1Br ZINC000612063337 566951764 /nfs/dbraw/zinc/95/17/64/566951764.db2.gz UCKFOUYLZWMAKH-CVEARBPZSA-N 0 3 395.341 3.476 10 0 GGAEHN C[C@@H]1C[C@@H](NC(=O)c2cc(Br)cc(N3CCCC3)c2)CN1C1CC1 ZINC000612107405 566954945 /nfs/dbraw/zinc/95/49/45/566954945.db2.gz UOOXAYNDJLHDPZ-CZUORRHYSA-N 0 3 392.341 3.404 10 0 GGAEHN N[C@@H]1CN(S(=O)(=O)Cc2cccc(Cl)c2)CC[C@H]1c1ccc(F)cc1 ZINC000564226636 566957247 /nfs/dbraw/zinc/95/72/47/566957247.db2.gz DOCOXUKSCNIOER-ZWKOTPCHSA-N 0 3 382.888 3.126 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)NC1(c2c(Cl)cccc2Cl)CC1 ZINC000471528125 566957606 /nfs/dbraw/zinc/95/76/06/566957606.db2.gz DKXLSNQARFXVGF-CYBMUJFWSA-N 0 3 386.323 3.393 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)NC1(c2c(Cl)cccc2Cl)CC1 ZINC000471528126 566957998 /nfs/dbraw/zinc/95/79/98/566957998.db2.gz DKXLSNQARFXVGF-ZDUSSCGKSA-N 0 3 386.323 3.393 10 0 GGAEHN C[C@@H](Cc1ccccc1Br)NC(=O)N(C)[C@H]1CCN(C2CC2)C1 ZINC000471561248 566961176 /nfs/dbraw/zinc/96/11/76/566961176.db2.gz XCYVENDMPGRSMX-BBRMVZONSA-N 0 3 380.330 3.258 10 0 GGAEHN C[C@H](CC(F)(F)F)CS(=O)(=O)NCc1ccccc1CN1CCCC1 ZINC000656867848 566961423 /nfs/dbraw/zinc/96/14/23/566961423.db2.gz WCKVQUOCSFOEGY-CQSZACIVSA-N 0 3 378.460 3.290 10 0 GGAEHN O=C(NC[C@H]1CCCN1CCCO)c1ccc2scc(Br)c2c1 ZINC000452347004 566966339 /nfs/dbraw/zinc/96/63/39/566966339.db2.gz YKSGVSAJANDWLS-CYBMUJFWSA-N 0 3 397.338 3.240 10 0 GGAEHN CN1C[C@@H](CNC(=O)c2c(F)cncc2Br)[C@H](c2ccccc2)C1 ZINC000633554848 566969130 /nfs/dbraw/zinc/96/91/30/566969130.db2.gz QXSNBBVBANSDEH-KGLIPLIRSA-N 0 3 392.272 3.058 10 0 GGAEHN CN1CCC[C@@H](NC(=O)N[C@@H](c2cc(F)cc(Br)c2)C2CC2)C1 ZINC000681317126 566969378 /nfs/dbraw/zinc/96/93/78/566969378.db2.gz JGSPMVQTLDNERN-HZPDHXFCSA-N 0 3 384.293 3.433 10 0 GGAEHN Cc1cc(Br)cc(C)c1S(=O)(=O)N(C)CCCN1CCCC1 ZINC000544597785 566970677 /nfs/dbraw/zinc/97/06/77/566970677.db2.gz CAZBDVRDZFRSMM-UHFFFAOYSA-N 0 3 389.359 3.172 10 0 GGAEHN C[C@@H]1CN(C)CC[C@@H]1N(C)S(=O)(=O)c1cc(Cl)cc(Br)c1 ZINC000656915909 566973222 /nfs/dbraw/zinc/97/32/22/566973222.db2.gz OXPXUZSXBHWQST-YGRLFVJLSA-N 0 3 395.750 3.063 10 0 GGAEHN C[C@@H]1CN(C)CC[C@H]1N(C)S(=O)(=O)c1cc(Cl)cc(Br)c1 ZINC000656915907 566973834 /nfs/dbraw/zinc/97/38/34/566973834.db2.gz OXPXUZSXBHWQST-QMTHXVAHSA-N 0 3 395.750 3.063 10 0 GGAEHN CC(C)N1C(=O)C[C@H](NCCOCC(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000494217009 566976051 /nfs/dbraw/zinc/97/60/51/566976051.db2.gz SHLFSNMPYMQBER-WMLDXEAASA-N 0 3 378.822 3.401 10 0 GGAEHN C[C@H](CN1CCC(C)CC1)NC(=O)Cc1csc(CCC(F)(F)F)n1 ZINC000633635117 566976101 /nfs/dbraw/zinc/97/61/01/566976101.db2.gz FJHTWLZBZPGLHO-CYBMUJFWSA-N 0 3 377.476 3.417 10 0 GGAEHN CN(C)CCOc1ccccc1C(=O)NCc1csc(Br)c1 ZINC000519880637 566977481 /nfs/dbraw/zinc/97/74/81/566977481.db2.gz WMDHKHQNXBRABK-UHFFFAOYSA-N 0 3 383.311 3.381 10 0 GGAEHN CCC[C@H](C)[C@@H](CO)NCC(=O)Nc1c(F)cc(F)cc1Br ZINC000583755974 566979425 /nfs/dbraw/zinc/97/94/25/566979425.db2.gz LIDSMQHFSBXCHU-TVQRCGJNSA-N 0 3 379.245 3.053 10 0 GGAEHN CCC[C@@H](C)[C@@H](CO)NCC(=O)Nc1c(F)cc(F)cc1Br ZINC000583755972 566980242 /nfs/dbraw/zinc/98/02/42/566980242.db2.gz LIDSMQHFSBXCHU-NOZJJQNGSA-N 0 3 379.245 3.053 10 0 GGAEHN CS[C@H]1CN(C(=O)c2ccc(F)cc2Br)C[C@H]1N1CCCC1 ZINC000544689558 566981162 /nfs/dbraw/zinc/98/11/62/566981162.db2.gz BUVSHVWNCPUHKU-CABCVRRESA-N 0 3 387.318 3.240 10 0 GGAEHN CS[C@@H]1CN(C(=O)Cc2csc(-c3cccs3)n2)C[C@H]1N1CCCC1 ZINC000544684730 566981298 /nfs/dbraw/zinc/98/12/98/566981298.db2.gz DGOQFBFGUJWQBQ-GDBMZVCRSA-N 0 3 393.603 3.452 10 0 GGAEHN CS[C@H]1CN(C(=O)Cc2csc(-c3cccs3)n2)C[C@@H]1N1CCCC1 ZINC000544684733 566982129 /nfs/dbraw/zinc/98/21/29/566982129.db2.gz DGOQFBFGUJWQBQ-HOCLYGCPSA-N 0 3 393.603 3.452 10 0 GGAEHN COc1ccc(CCC(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c(Br)c1 ZINC000612648800 566986117 /nfs/dbraw/zinc/98/61/17/566986117.db2.gz IWWUERDRDNEEML-CRAIPNDOSA-N 0 3 395.341 3.333 10 0 GGAEHN C[C@H](CC(F)(F)F)CS(=O)(=O)NC[C@@H]1CCN(Cc2ccccc2)C1 ZINC000656976218 566987917 /nfs/dbraw/zinc/98/79/17/566987917.db2.gz IBPZZGKHDFPXBY-ZBFHGGJFSA-N 0 3 378.460 3.016 10 0 GGAEHN Cc1nnc([C@H](C)NC(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)s1 ZINC000544761623 566990330 /nfs/dbraw/zinc/99/03/30/566990330.db2.gz BJAUAWRDHSGXJZ-WHOFXGATSA-N 0 3 379.555 3.351 10 0 GGAEHN C[C@H](NC(=O)[C@H](C)N1CCNC[C@](C)(F)C1)c1ccc(Cl)cc1Cl ZINC000583872618 566991134 /nfs/dbraw/zinc/99/11/34/566991134.db2.gz VZKAOLOCJHPVOB-PRXAMGSTSA-N 0 3 376.303 3.193 10 0 GGAEHN Cc1nc2ccc(CNCc3ccc(S(=O)(=O)N(C)C)cc3)cc2s1 ZINC000494362806 566993159 /nfs/dbraw/zinc/99/31/59/566993159.db2.gz BPKSKEZBLPMSJN-UHFFFAOYSA-N 0 3 375.519 3.145 10 0 GGAEHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc3nc(C)sc3c2)cc1 ZINC000494368112 566993518 /nfs/dbraw/zinc/99/35/18/566993518.db2.gz LULXMGGKJIORAG-GFCCVEGCSA-N 0 3 375.519 3.364 10 0 GGAEHN C[N@H+](CCCC[N-]S(=O)(=O)c1cc(Cl)cc(Br)c1)C1CC1 ZINC000657010008 566997046 /nfs/dbraw/zinc/99/70/46/566997046.db2.gz MRJKMHCSTFMAEV-UHFFFAOYSA-N 0 3 395.750 3.255 10 0 GGAEHN C[N@@H+](CCCC[N-]S(=O)(=O)c1cc(Cl)cc(Br)c1)C1CC1 ZINC000657010008 566997053 /nfs/dbraw/zinc/99/70/53/566997053.db2.gz MRJKMHCSTFMAEV-UHFFFAOYSA-N 0 3 395.750 3.255 10 0 GGAEHN O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@H](C1CC1)N1CCCC1 ZINC000544820891 566997219 /nfs/dbraw/zinc/99/72/19/566997219.db2.gz FRODUIPPBMKKDW-SFHVURJKSA-N 0 3 390.325 3.464 10 0 GGAEHN Cc1ccc(OCCC(=O)N(C)[C@@H]2CCN(C3CC3)C2)c(Br)c1 ZINC000520366478 566999200 /nfs/dbraw/zinc/99/92/00/566999200.db2.gz QNQFNIIKHQYRFM-OAHLLOKOSA-N 0 3 381.314 3.222 10 0 GGAEHN CN(C)CCOc1ccccc1C(=O)NCc1cc(F)ccc1Br ZINC000520369484 566999313 /nfs/dbraw/zinc/99/93/13/566999313.db2.gz FZZJGZHQWBWGQQ-UHFFFAOYSA-N 0 3 395.272 3.459 10 0 GGAEHN COc1cc(Br)ccc1CN[C@H](C)c1cccc(-n2cnnn2)c1 ZINC000681742513 567003407 /nfs/dbraw/zinc/00/34/07/567003407.db2.gz GROAOUXJOGQGBS-GFCCVEGCSA-N 0 3 388.269 3.284 10 0 GGAEHN CSC1(CNC(=O)c2ccn(-c3cccc(Cl)c3)n2)CCN(C)CC1 ZINC000584025052 567004887 /nfs/dbraw/zinc/00/48/87/567004887.db2.gz LPFRTFPMIQKXPK-UHFFFAOYSA-N 0 3 378.929 3.083 10 0 GGAEHN C[C@@]1(O)C[C@H](NCc2cc(Br)ccc2OCc2ccccn2)C1 ZINC000564786356 567007816 /nfs/dbraw/zinc/00/78/16/567007816.db2.gz IOSHCBVMNVZPOX-MAEOIBBWSA-N 0 3 377.282 3.426 10 0 GGAEHN Cc1c(Br)cccc1CS(=O)(=O)N[C@H]1CCN(C(C)(C)C)C1 ZINC000657061521 567009164 /nfs/dbraw/zinc/00/91/64/567009164.db2.gz WCHCRRONJJQXNJ-AWEZNQCLSA-N 0 3 389.359 3.050 10 0 GGAEHN Cc1cc(C(=O)N[C@H]2CNCCC2(F)F)c2ccc(Br)cc2n1 ZINC000564798164 567009893 /nfs/dbraw/zinc/00/98/93/567009893.db2.gz NZMLDJMJJPFFNI-AWEZNQCLSA-N 0 3 384.224 3.033 10 0 GGAEHN CCc1cnc(CCNC[C@@H](O)COc2ccc(Br)cc2)s1 ZINC000564850914 567013235 /nfs/dbraw/zinc/01/32/35/567013235.db2.gz ZEALAHODQXKTAS-CYBMUJFWSA-N 0 3 385.327 3.040 10 0 GGAEHN CCc1cnc(CCNC[C@H](O)COc2ccc(Br)cc2)s1 ZINC000564850920 567013299 /nfs/dbraw/zinc/01/32/99/567013299.db2.gz ZEALAHODQXKTAS-ZDUSSCGKSA-N 0 3 385.327 3.040 10 0 GGAEHN C[C@](O)(CN[C@@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1)C(F)(F)F ZINC000564850114 567013340 /nfs/dbraw/zinc/01/33/40/567013340.db2.gz QDNJSECIMRXMDR-SKDRFNHKSA-N 0 3 391.743 3.235 10 0 GGAEHN Cc1ccsc1[C@H](CO)NC[C@H](O)COc1c(Cl)cccc1Cl ZINC000494675098 567017403 /nfs/dbraw/zinc/01/74/03/567017403.db2.gz YSQIVOZRPIDNBT-FZMZJTMJSA-N 0 3 376.305 3.426 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1C(=O)N1CCC[C@H]1CN(C)C ZINC000494739238 567018881 /nfs/dbraw/zinc/01/88/81/567018881.db2.gz PQEDDCDZJNQQBW-INIZCTEOSA-N 0 3 391.313 3.109 10 0 GGAEHN CCC1(C[N-]S(=O)(=O)c2cscn2)CC[NH+](Cc2ccccc2)CC1 ZINC000564912092 567019263 /nfs/dbraw/zinc/01/92/63/567019263.db2.gz COSHYAWSHJIJRN-UHFFFAOYSA-N 0 3 379.551 3.114 10 0 GGAEHN Cc1cc2c(o1)c(C(=O)NC[C@H]1CCCCN1CCO)ccc2Br ZINC000584213899 567021983 /nfs/dbraw/zinc/02/19/83/567021983.db2.gz SFDPJYNXBRHNFB-CYBMUJFWSA-N 0 3 395.297 3.080 10 0 GGAEHN CC1=CCN(CCNCc2cnn(-c3ccc(Br)cc3)c2)CC1 ZINC000545148488 567022099 /nfs/dbraw/zinc/02/20/99/567022099.db2.gz OPXMTHFFHAFSQC-UHFFFAOYSA-N 0 3 375.314 3.376 10 0 GGAEHN C[C@@H]1C[C@@H](Nc2ncnc3cccc(I)c32)CN1C1CC1 ZINC000545163191 567023599 /nfs/dbraw/zinc/02/35/99/567023599.db2.gz AWMRTOJVSVECBC-GHMZBOCLSA-N 0 3 394.260 3.272 10 0 GGAEHN CC(C)[C@@H]1CN(C)CCN1c1ncnc2cccc(I)c21 ZINC000545164031 567023717 /nfs/dbraw/zinc/02/37/17/567023717.db2.gz HFXJGNDSVJZZPK-AWEZNQCLSA-N 0 3 396.276 3.011 10 0 GGAEHN C[C@@H]1C[C@H](Nc2ncnc3cccc(I)c32)CN1C1CC1 ZINC000545163192 567024395 /nfs/dbraw/zinc/02/43/95/567024395.db2.gz AWMRTOJVSVECBC-MNOVXSKESA-N 0 3 394.260 3.272 10 0 GGAEHN O=C(NC[C@@H]1NCCc2ccccc21)[C@@H]1CCc2cc(Br)ccc21 ZINC000564994162 567027216 /nfs/dbraw/zinc/02/72/16/567027216.db2.gz OHNQCEHVGPQTKS-MOPGFXCFSA-N 0 3 385.305 3.482 10 0 GGAEHN C[C@@H](N[C@H]1CCCC(F)(F)C1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430695310 567028550 /nfs/dbraw/zinc/02/85/50/567028550.db2.gz MTYZOTSJLKRKDO-KOLCDFICSA-N 0 3 397.285 3.325 10 0 GGAEHN C[C@@H](c1ccccc1)N1CC[C@@H](Nc2cc(Br)cnc2C(N)=O)C1 ZINC000472493886 567029340 /nfs/dbraw/zinc/02/93/40/567029340.db2.gz FIELFJJVLLEZMR-SWLSCSKDSA-N 0 3 389.297 3.190 10 0 GGAEHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)[C@H]2CCc3cc(Br)ccc32)C1 ZINC000564998478 567029653 /nfs/dbraw/zinc/02/96/53/567029653.db2.gz NOOYHUYRCCJGJQ-JCGIZDLHSA-N 0 3 377.326 3.422 10 0 GGAEHN COc1ccc(Br)c(CC(=O)N2CCc3ccccc3[C@H]2CN)c1 ZINC000565005374 567029716 /nfs/dbraw/zinc/02/97/16/567029716.db2.gz SKRHWDUQKCZZSG-GOSISDBHSA-N 0 3 389.293 3.085 10 0 GGAEHN C[C@H](c1ccccc1)N1CC[C@@H](Nc2ncc(I)cn2)C1 ZINC000545208468 567029925 /nfs/dbraw/zinc/02/99/25/567029925.db2.gz VNHHGBRZEAUIHT-IUODEOHRSA-N 0 3 394.260 3.329 10 0 GGAEHN NC(=O)c1ncc(Br)cc1N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000472490058 567030005 /nfs/dbraw/zinc/03/00/05/567030005.db2.gz WROOSKSKGPEWGF-HNNXBMFYSA-N 0 3 389.297 3.020 10 0 GGAEHN Cc1ccc([C@H](CNc2cc(Br)cnc2C(N)=O)N2CCCC2)o1 ZINC000472490943 567030099 /nfs/dbraw/zinc/03/00/99/567030099.db2.gz ACTULDFCUOJPKK-AWEZNQCLSA-N 0 3 393.285 3.093 10 0 GGAEHN NC(=O)c1ncc(Br)cc1NC[C@H](c1ccccc1)N1CCCC1 ZINC000472500712 567031279 /nfs/dbraw/zinc/03/12/79/567031279.db2.gz NBIDSUZHIYCJBD-MRXNPFEDSA-N 0 3 389.297 3.192 10 0 GGAEHN CCN(CC)CCN(C(=O)c1ocnc1C)c1ccc(Br)cn1 ZINC000565047541 567032480 /nfs/dbraw/zinc/03/24/80/567032480.db2.gz KTEWGUNHRTYWQI-UHFFFAOYSA-N 0 3 381.274 3.129 10 0 GGAEHN C[C@@H](NC[C@H]1CCCCS1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430740814 567032528 /nfs/dbraw/zinc/03/25/28/567032528.db2.gz CQFUWOYATRLUCM-ZYHUDNBSSA-N 0 3 393.372 3.033 10 0 GGAEHN CCN1CC[C@@H](NCCn2c(C)csc2=O)[C@H]1c1ccc(Cl)c(F)c1 ZINC000584339040 567034249 /nfs/dbraw/zinc/03/42/49/567034249.db2.gz DLAVBRGNLCEXKZ-IAGOWNOFSA-N 0 3 383.920 3.436 10 0 GGAEHN CCNC(=O)c1cc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)c(C)s1 ZINC000634419742 567034336 /nfs/dbraw/zinc/03/43/36/567034336.db2.gz MEMGFHRMMYXWPX-WDEREUQCSA-N 0 3 378.416 3.492 10 0 GGAEHN CCN1CC[C@@H](NCCn2c(C)csc2=O)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000584339042 567034917 /nfs/dbraw/zinc/03/49/17/567034917.db2.gz DLAVBRGNLCEXKZ-SJORKVTESA-N 0 3 383.920 3.436 10 0 GGAEHN CCN1CC[C@H](NCCn2c(C)csc2=O)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000584339041 567035345 /nfs/dbraw/zinc/03/53/45/567035345.db2.gz DLAVBRGNLCEXKZ-IRXDYDNUSA-N 0 3 383.920 3.436 10 0 GGAEHN CC(C)(C)OC(=O)[C@@H]1CCN(C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000495067789 567044815 /nfs/dbraw/zinc/04/48/15/567044815.db2.gz OTIUHVFNWPLNBH-OCCSQVGLSA-N 0 3 390.307 3.397 10 0 GGAEHN O=C(NCc1ccc(OCCN2CCCC2)cc1)c1coc(Br)c1 ZINC000521156929 567045242 /nfs/dbraw/zinc/04/52/42/567045242.db2.gz GABUYLWGVYZSNT-UHFFFAOYSA-N 0 3 393.281 3.447 10 0 GGAEHN Fc1cncc(Br)c1CNCC1(N2CCSCC2)CCCC1 ZINC000657307702 567045980 /nfs/dbraw/zinc/04/59/80/567045980.db2.gz HCYXOYSSJNWDOE-UHFFFAOYSA-N 0 3 388.350 3.434 10 0 GGAEHN COc1cc(Br)ccc1[C@@H](C)NC(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000682458435 567046420 /nfs/dbraw/zinc/04/64/20/567046420.db2.gz XGBLWTUOMUCOAL-DOMZBBRYSA-N 0 3 396.329 3.302 10 0 GGAEHN Brc1cccc(C2(CNCc3cc4n(n3)CCC4)CCOCC2)c1 ZINC000657317611 567047153 /nfs/dbraw/zinc/04/71/53/567047153.db2.gz ZTNISXRWHXFCAU-UHFFFAOYSA-N 0 3 390.325 3.430 10 0 GGAEHN Brc1ccc(N2CC[C@H](CNCc3cnn4c3CCC4)C2)cc1 ZINC000657325171 567047512 /nfs/dbraw/zinc/04/75/12/567047512.db2.gz BUEZVNCQXPLJQX-CQSZACIVSA-N 0 3 375.314 3.208 10 0 GGAEHN Brc1cccc(N2CC[C@H](CNCc3cnn4c3CCC4)C2)c1 ZINC000657328578 567047741 /nfs/dbraw/zinc/04/77/41/567047741.db2.gz AILSOALECPKOFS-CQSZACIVSA-N 0 3 375.314 3.208 10 0 GGAEHN CN(C)CCn1cc(NC(=O)Cc2ccc(Br)c(Cl)c2)cn1 ZINC000682486541 567050009 /nfs/dbraw/zinc/05/00/09/567050009.db2.gz VMJJZDOLBPFMBM-UHFFFAOYSA-N 0 3 385.693 3.042 10 0 GGAEHN C[C@H](Cn1ncc2ccccc2c1=O)N[C@H](C)c1cncc(Br)c1 ZINC000565241923 567050387 /nfs/dbraw/zinc/05/03/87/567050387.db2.gz AMDNTKWNXVSYTE-CHWSQXEVSA-N 0 3 387.281 3.293 10 0 GGAEHN COc1ccc([C@@H](NCCC2CS(=O)(=O)C2)c2ccccc2Cl)cc1 ZINC000682500789 567051542 /nfs/dbraw/zinc/05/15/42/567051542.db2.gz KTFBSFNFNXNNMS-LJQANCHMSA-N 0 3 379.909 3.462 10 0 GGAEHN CO[C@H](c1ccccc1Cl)[C@H](C)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000545459454 567052259 /nfs/dbraw/zinc/05/22/59/567052259.db2.gz YAITYBBGGFYLAK-LXIYXOSZSA-N 0 3 382.913 3.414 10 0 GGAEHN Brc1ccccc1N1CC[C@@H](NCc2ccnn2-c2ccncc2)C1 ZINC000657357133 567052611 /nfs/dbraw/zinc/05/26/11/567052611.db2.gz RBTSHWAUKQPLCD-OAHLLOKOSA-N 0 3 398.308 3.398 10 0 GGAEHN CO[C@H](c1ccccc1Cl)[C@@H](C)N[C@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000545459456 567052837 /nfs/dbraw/zinc/05/28/37/567052837.db2.gz YAITYBBGGFYLAK-VFVRVIDISA-N 0 3 382.913 3.414 10 0 GGAEHN Cc1ccc2cc(CNCCNS(=O)(=O)c3ccc(Cl)s3)[nH]c2c1 ZINC000657414653 567054435 /nfs/dbraw/zinc/05/44/35/567054435.db2.gz SHXMIQYYEPNLDG-UHFFFAOYSA-N 0 3 383.926 3.259 10 0 GGAEHN CCCOC[C@H](Cc1cccc(Br)c1)NC[C@@H](O)C(F)(F)F ZINC000565300381 567055524 /nfs/dbraw/zinc/05/55/24/567055524.db2.gz WRALGTYAMSYOKS-UONOGXRCSA-N 0 3 384.236 3.300 10 0 GGAEHN Cc1noc(CCN[C@H](C)c2ccc(F)c(I)c2)n1 ZINC000453133994 567056027 /nfs/dbraw/zinc/05/60/27/567056027.db2.gz JKCUBJZHHJEBQO-MRVPVSSYSA-N 0 3 375.185 3.015 10 0 GGAEHN Cn1ncc(C2CCC2)c1CNC[C@@H](CO)Cc1ccccc1Br ZINC000657448213 567056608 /nfs/dbraw/zinc/05/66/08/567056608.db2.gz JKNWFTVUGZATDS-AWEZNQCLSA-N 0 3 392.341 3.391 10 0 GGAEHN O=C(NC[C@H]1CCCN(Cc2cccs2)C1)N[C@H](CO)c1ccsc1 ZINC000472962483 567058694 /nfs/dbraw/zinc/05/86/94/567058694.db2.gz WHYMJVXYZWHUIT-RHSMWYFYSA-N 0 3 379.551 3.054 10 0 GGAEHN C[C@H](NCC[C@H](C)[S@@](C)=O)c1ccc(F)c(I)c1 ZINC000453167857 567059500 /nfs/dbraw/zinc/05/95/00/567059500.db2.gz UKJWBGRJGXAZTK-LXIMFEHMSA-N 0 3 383.270 3.238 10 0 GGAEHN COc1cc(CN[C@@H](C)C2(OC)CCOCC2)cc(Br)c1OC ZINC000453161894 567059647 /nfs/dbraw/zinc/05/96/47/567059647.db2.gz RACGUDUBIIFYHT-LBPRGKRZSA-N 0 3 388.302 3.140 10 0 GGAEHN COc1ccc2c(c1)C[C@@H](N[C@H](CO)c1cccc(Br)c1)CO2 ZINC000453158005 567060146 /nfs/dbraw/zinc/06/01/46/567060146.db2.gz IAVMRKPENAZEFY-NVXWUHKLSA-N 0 3 378.266 3.084 10 0 GGAEHN COc1cc(CN[C@H](C)C2(OC)CCOCC2)cc(Br)c1OC ZINC000453161884 567060228 /nfs/dbraw/zinc/06/02/28/567060228.db2.gz RACGUDUBIIFYHT-GFCCVEGCSA-N 0 3 388.302 3.140 10 0 GGAEHN Cc1cc(C(=O)NCCN2CCCCC2)nn1-c1ccc(Br)cc1 ZINC000431158369 567060404 /nfs/dbraw/zinc/06/04/04/567060404.db2.gz BDSFBDYTBJSCOI-UHFFFAOYSA-N 0 3 391.313 3.159 10 0 GGAEHN COc1ccc(Br)c(CN(C)C(=O)CCN(C)c2ccncc2)c1 ZINC000584696775 567060777 /nfs/dbraw/zinc/06/07/77/567060777.db2.gz KQPQHOYUPRSNIZ-UHFFFAOYSA-N 0 3 392.297 3.338 10 0 GGAEHN COC1([C@@H](C)NCc2cn3cc(Br)cc(C)c3n2)CCOCC1 ZINC000453188739 567061260 /nfs/dbraw/zinc/06/12/60/567061260.db2.gz AELUQGWJFJMWFA-CYBMUJFWSA-N 0 3 382.302 3.079 10 0 GGAEHN COc1ccc(CCC(=O)N(C)CC2(N(C)C)CCC2)c(Br)c1 ZINC000613799169 567061986 /nfs/dbraw/zinc/06/19/86/567061986.db2.gz OFHARQJOKGAERA-UHFFFAOYSA-N 0 3 383.330 3.333 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)c1cc(C)n(-c2ccc(Br)cc2)n1 ZINC000431166488 567062478 /nfs/dbraw/zinc/06/24/78/567062478.db2.gz KQJFFXGEVLCWNL-INIZCTEOSA-N 0 3 391.313 3.157 10 0 GGAEHN CN(C)C1(CNC(=O)c2cc(Br)cc(N3CCCC3)c2)CCC1 ZINC000613796713 567063116 /nfs/dbraw/zinc/06/31/16/567063116.db2.gz XWEITJRXGUKYKO-UHFFFAOYSA-N 0 3 380.330 3.263 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cc3c(cccc3Br)[nH]2)C[C@@H]1N(C)C ZINC000495608378 567064193 /nfs/dbraw/zinc/06/41/93/567064193.db2.gz RLZQJXUPKJJWSC-LSDHHAIUSA-N 0 3 382.327 3.048 10 0 GGAEHN COc1cc(C[NH2+]C[C@@H](c2ccnn2C)C(C)C)cc(Br)c1[O-] ZINC000682616877 567064408 /nfs/dbraw/zinc/06/44/08/567064408.db2.gz KWMBVIMBOMRSFM-CYBMUJFWSA-N 0 3 382.302 3.426 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1C(=O)Cc1ccc(Br)c(F)c1 ZINC000584722552 567065183 /nfs/dbraw/zinc/06/51/83/567065183.db2.gz QOWVTHAFOVVICX-KRWDZBQOSA-N 0 3 377.257 3.215 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)Cc1ccc(Br)c(F)c1 ZINC000584722553 567065242 /nfs/dbraw/zinc/06/52/42/567065242.db2.gz QOWVTHAFOVVICX-QGZVFWFLSA-N 0 3 377.257 3.215 10 0 GGAEHN CS[C@@H]1CN(C(=O)C[C@H](C)c2ccc(Br)cc2)C[C@H]1N(C)C ZINC000495712221 567066713 /nfs/dbraw/zinc/06/67/13/567066713.db2.gz JJPVLURBDUYDKS-APHBMKBZSA-N 0 3 385.371 3.447 10 0 GGAEHN CO[C@H](CNCc1cc(OC(F)F)ccc1Br)[C@H]1CCOC1 ZINC000657543195 567066701 /nfs/dbraw/zinc/06/67/01/567066701.db2.gz RVTAUFIIKJOZKH-IINYFYTJSA-N 0 3 380.229 3.192 10 0 GGAEHN CO[C@H](CNCc1cn(-c2ccc(Br)cc2)nc1C)[C@H]1CCOC1 ZINC000657545559 567067205 /nfs/dbraw/zinc/06/72/05/567067205.db2.gz SDKUSQSOHPZMPS-KBXCAEBGSA-N 0 3 394.313 3.084 10 0 GGAEHN CO[C@@H](CNCc1cn(-c2ccccc2Br)nc1C)[C@@H]1CCOC1 ZINC000657542323 567067749 /nfs/dbraw/zinc/06/77/49/567067749.db2.gz XFDRZYICLAIPTM-KDOFPFPSSA-N 0 3 394.313 3.084 10 0 GGAEHN COC[C@H](CCNCc1cn(-c2ccccc2Br)nc1C)OC ZINC000657553575 567068425 /nfs/dbraw/zinc/06/84/25/567068425.db2.gz LFYVHVSLXDJEOW-HNNXBMFYSA-N 0 3 382.302 3.084 10 0 GGAEHN COC[C@@H](CCNCc1c(C)nn(-c2ccc(Br)cc2)c1C)OC ZINC000657552274 567068678 /nfs/dbraw/zinc/06/86/78/567068678.db2.gz CZNIPZVTGQIVQV-QGZVFWFLSA-N 0 3 396.329 3.393 10 0 GGAEHN COC[C@@H](CCNCc1cn(-c2ccccc2Br)nc1C)OC ZINC000657553578 567068735 /nfs/dbraw/zinc/06/87/35/567068735.db2.gz LFYVHVSLXDJEOW-OAHLLOKOSA-N 0 3 382.302 3.084 10 0 GGAEHN CO[C@H](CNCc1ccc(Br)c(Br)c1)[C@@H]1CCOC1 ZINC000657546011 567068991 /nfs/dbraw/zinc/06/89/91/567068991.db2.gz VBSIHMXIIPLQJA-BXUZGUMPSA-N 0 3 393.119 3.353 10 0 GGAEHN COc1c(Br)cc(CN[C@H](CO)C2CCC2)cc1Br ZINC000657558266 567069066 /nfs/dbraw/zinc/06/90/66/567069066.db2.gz LYGBAQJCLQNKGP-CYBMUJFWSA-N 0 3 393.119 3.471 10 0 GGAEHN CO[C@@H](CNCc1ccc(Br)c(Br)c1)[C@H]1CCOC1 ZINC000657546014 567069216 /nfs/dbraw/zinc/06/92/16/567069216.db2.gz VBSIHMXIIPLQJA-FZMZJTMJSA-N 0 3 393.119 3.353 10 0 GGAEHN COc1ccc(-c2nc(CNCCC3(CS(C)(=O)=O)CC3)cs2)cc1 ZINC000657545752 567069264 /nfs/dbraw/zinc/06/92/64/567069264.db2.gz HGWGESQKYQOQLU-UHFFFAOYSA-N 0 3 380.535 3.123 10 0 GGAEHN CCN(CC)CCN(C(=O)c1cscn1)c1ccc(Br)cn1 ZINC000584758742 567069297 /nfs/dbraw/zinc/06/92/97/567069297.db2.gz CRSGCOYYVNQWNJ-UHFFFAOYSA-N 0 3 383.315 3.289 10 0 GGAEHN CO[C@@H](CNCc1ccc(Br)c(Br)c1)[C@@H]1CCOC1 ZINC000657546017 567069751 /nfs/dbraw/zinc/06/97/51/567069751.db2.gz VBSIHMXIIPLQJA-RISCZKNCSA-N 0 3 393.119 3.353 10 0 GGAEHN COCC[C@H](COC)N[C@H](C)c1ccc(F)c(I)c1 ZINC000453257603 567069905 /nfs/dbraw/zinc/06/99/05/567069905.db2.gz SHYWVKQWTWWCMO-ZYHUDNBSSA-N 0 3 381.229 3.132 10 0 GGAEHN CN(CCNS(=O)(=O)c1ccccc1OC(F)(F)F)C1CCCCC1 ZINC000521641424 567071001 /nfs/dbraw/zinc/07/10/01/567071001.db2.gz LDADMUDISJRJQX-UHFFFAOYSA-N 0 3 380.432 3.128 10 0 GGAEHN CC(C)Cc1ncc(CNCCNC(=O)c2ccc(Br)cn2)s1 ZINC000657564054 567071532 /nfs/dbraw/zinc/07/15/32/567071532.db2.gz SNFHHLLUJAGJBM-UHFFFAOYSA-N 0 3 397.342 3.019 10 0 GGAEHN CO[C@@H]1CCC[C@@H]([C@@H](CO)NCc2cnc3c(C)cc(Br)cn23)C1 ZINC000657577076 567072976 /nfs/dbraw/zinc/07/29/76/567072976.db2.gz OKXCFHTUWLRGGA-KBRIMQKVSA-N 0 3 396.329 3.061 10 0 GGAEHN O=C(NC[C@H]1CCN(Cc2ccccc2)C1)c1ncsc1Br ZINC000565485454 567072964 /nfs/dbraw/zinc/07/29/64/567072964.db2.gz DKGVUVJRPSILKW-CYBMUJFWSA-N 0 3 380.311 3.158 10 0 GGAEHN COc1sc(CN[C@H](CO)[C@H]2CCC[C@H](OC)C2)cc1Br ZINC000657576224 567073138 /nfs/dbraw/zinc/07/31/38/567073138.db2.gz ITNQCXLNQUHKGR-COPLHBTASA-N 0 3 378.332 3.175 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)c1cc(Br)c2c(c1)OCCO2 ZINC000521683514 567073800 /nfs/dbraw/zinc/07/38/00/567073800.db2.gz HGIPLMXYFPGOGP-BETUJISGSA-N 0 3 397.313 3.213 10 0 GGAEHN C[C@@H](NC[C@@H]1CCCC1(F)F)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000453326535 567073934 /nfs/dbraw/zinc/07/39/34/567073934.db2.gz YDPCPLLJKAUCCH-KOLCDFICSA-N 0 3 397.285 3.183 10 0 GGAEHN Oc1ccc(Br)c(CNCc2ccc(CN3CC[C@H](O)C3)cc2)c1 ZINC000657596435 567074205 /nfs/dbraw/zinc/07/42/05/567074205.db2.gz NFMSHOIAWZKZCL-SFHVURJKSA-N 0 3 391.309 3.011 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)c1csc(I)c1 ZINC000521671412 567074321 /nfs/dbraw/zinc/07/43/21/567074321.db2.gz FUDSCFNKOATZMY-GHMZBOCLSA-N 0 3 392.306 3.345 10 0 GGAEHN O[C@H]1CCN(Cc2ccc(CNCc3c(F)cccc3Br)cc2)C1 ZINC000657596011 567074584 /nfs/dbraw/zinc/07/45/84/567074584.db2.gz KXBBCTSBQUUZEB-INIZCTEOSA-N 0 3 393.300 3.445 10 0 GGAEHN Brc1ccc2c(c1)[C@H](NCCN1C[C@H]3CC[C@@H](C1)O3)CCCO2 ZINC000453332745 567074754 /nfs/dbraw/zinc/07/47/54/567074754.db2.gz IIIQIAUENOOMTO-HLLBOEOZSA-N 0 3 381.314 3.116 10 0 GGAEHN C[C@H](NC[C@@H]1CCCC1(F)F)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000453326537 567074978 /nfs/dbraw/zinc/07/49/78/567074978.db2.gz YDPCPLLJKAUCCH-ONGXEEELSA-N 0 3 397.285 3.183 10 0 GGAEHN O[C@@H]1CCN(Cc2ccc(CNCc3cc(F)ccc3Br)cc2)C1 ZINC000657598250 567075079 /nfs/dbraw/zinc/07/50/79/567075079.db2.gz ZMRZGRYSBHILON-GOSISDBHSA-N 0 3 393.300 3.445 10 0 GGAEHN Cc1cc(C)cc(CNCc2ccc(S(N)(=O)=O)c(Br)c2)c1 ZINC000657625839 567076445 /nfs/dbraw/zinc/07/64/45/567076445.db2.gz JJCYVJRUBFZTDA-UHFFFAOYSA-N 0 3 383.311 3.003 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CNCCO[C@@H]1CC1(F)F ZINC000657619834 567076762 /nfs/dbraw/zinc/07/67/62/567076762.db2.gz VBLRICXXKUNDRB-OAHLLOKOSA-N 0 3 386.240 3.457 10 0 GGAEHN CCOc1cc(CNCCO[C@H]2CC2(F)F)cc(Br)c1OC ZINC000657618450 567076955 /nfs/dbraw/zinc/07/69/55/567076955.db2.gz UIHCWFBOQILBGG-ZDUSSCGKSA-N 0 3 380.229 3.370 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CNCCO[C@H]1CC1(F)F ZINC000657618511 567077028 /nfs/dbraw/zinc/07/70/28/567077028.db2.gz GJPKVNBAQBWNGJ-HNNXBMFYSA-N 0 3 386.240 3.457 10 0 GGAEHN C[C@@H]1CC[C@@H](NCc2ccnc3c(Br)cccc23)CS1(=O)=O ZINC000657637458 567078855 /nfs/dbraw/zinc/07/88/55/567078855.db2.gz IVHAATIKNYVWEF-DGCLKSJQSA-N 0 3 383.311 3.053 10 0 GGAEHN CN(C)C[C@]1(O)CCCN(C(=O)C2(c3c(Cl)cccc3Cl)CCC2)C1 ZINC000614065663 567080234 /nfs/dbraw/zinc/08/02/34/567080234.db2.gz RRYFOTHXWTXTED-GOSISDBHSA-N 0 3 385.335 3.330 10 0 GGAEHN CN(C)C[C@@]1(O)CCCN(C(=O)c2cc(Br)c3ccccc3c2)C1 ZINC000614063509 567080660 /nfs/dbraw/zinc/08/06/60/567080660.db2.gz CEZIAHRVUUYLLM-IBGZPJMESA-N 0 3 391.309 3.131 10 0 GGAEHN CN(C)C[C@@]1(O)CCCN(C(=O)c2ccc3scc(Br)c3c2)C1 ZINC000614063771 567080895 /nfs/dbraw/zinc/08/08/95/567080895.db2.gz HLDOYCLXDOPMGF-KRWDZBQOSA-N 0 3 397.338 3.193 10 0 GGAEHN CN(C)C[C@]1(O)CCCN(C(=O)c2cc(Br)c3ccccc3c2)C1 ZINC000614063511 567081141 /nfs/dbraw/zinc/08/11/41/567081141.db2.gz CEZIAHRVUUYLLM-LJQANCHMSA-N 0 3 391.309 3.131 10 0 GGAEHN CCN1CCN(C[C@H](C)CNC(=O)c2ccc(C)c(Br)c2C)CC1 ZINC000682899473 567081253 /nfs/dbraw/zinc/08/12/53/567081253.db2.gz LYKRJVXJIFCXMR-CQSZACIVSA-N 0 3 396.373 3.069 10 0 GGAEHN CCN1CCN(C[C@@H](C)CNC(=O)c2ccc(C)c(Br)c2C)CC1 ZINC000682899472 567081548 /nfs/dbraw/zinc/08/15/48/567081548.db2.gz LYKRJVXJIFCXMR-AWEZNQCLSA-N 0 3 396.373 3.069 10 0 GGAEHN C[C@]1(CNCc2ccc(Br)cc2N2CCOCC2)CC1(F)F ZINC000657667092 567082549 /nfs/dbraw/zinc/08/25/49/567082549.db2.gz SOGFXFCOSPHVFG-OAHLLOKOSA-N 0 3 375.257 3.421 10 0 GGAEHN Cc1sc([C@H](C)NC(=O)CCOC2CNC2)nc1-c1ccc(Cl)cc1 ZINC000521860932 567082736 /nfs/dbraw/zinc/08/27/36/567082736.db2.gz FRGZCXRDWIBOTL-NSHDSACASA-N 0 3 379.913 3.328 10 0 GGAEHN Cn1cc(C[C@H]2CCC[C@@H]2NCc2cn3ccc(Br)cc3n2)cn1 ZINC000657685955 567083655 /nfs/dbraw/zinc/08/36/55/567083655.db2.gz BIHURFHZSFYPSB-PBHICJAKSA-N 0 3 388.313 3.331 10 0 GGAEHN Cn1cc(C[C@H]2CCC[C@H]2NCc2cn3ccc(Br)cc3n2)cn1 ZINC000657685958 567084585 /nfs/dbraw/zinc/08/45/85/567084585.db2.gz BIHURFHZSFYPSB-RHSMWYFYSA-N 0 3 388.313 3.331 10 0 GGAEHN C[C@@H](CC(=O)NC[C@]1(N(C)C)CCSC1)c1ccc(Br)cc1 ZINC000431493314 567084772 /nfs/dbraw/zinc/08/47/72/567084772.db2.gz IGTZFSUXUXEVSG-SUMWQHHRSA-N 0 3 385.371 3.496 10 0 GGAEHN CC(C)(C)O[C@H]1C[C@@H](NCc2ccc(S(N)(=O)=O)c(Cl)c2)C12CCC2 ZINC000657703136 567085668 /nfs/dbraw/zinc/08/56/68/567085668.db2.gz UTDMJUBTMKRSQF-CVEARBPZSA-N 0 3 386.945 3.203 10 0 GGAEHN CCOCCOc1ccc(Br)cc1CN[C@@H]1C[C@H](O)C12CCC2 ZINC000657702848 567085899 /nfs/dbraw/zinc/08/58/99/567085899.db2.gz JRSGVOPQJNKWBI-SJORKVTESA-N 0 3 384.314 3.258 10 0 GGAEHN COc1cc(CN[C@@H]2C[C@@H](O)C23CCC3)cc(Br)c1OC(F)F ZINC000657703557 567086221 /nfs/dbraw/zinc/08/62/21/567086221.db2.gz NOFIKVRYTZLRNH-CHWSQXEVSA-N 0 3 392.240 3.452 10 0 GGAEHN Cc1nn(-c2cccc(Br)c2)cc1CN[C@@H]1C[C@@H](O)C12CCC2 ZINC000657710625 567087326 /nfs/dbraw/zinc/08/73/26/567087326.db2.gz XIEPEJKVKPNJGI-IAGOWNOFSA-N 0 3 376.298 3.336 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN[C@@H]1C[C@@H](O)C12CCC2 ZINC000657708094 567087370 /nfs/dbraw/zinc/08/73/70/567087370.db2.gz KPQPNJZESSICMK-IAGOWNOFSA-N 0 3 376.298 3.336 10 0 GGAEHN CC[C@H](C)N1CCN(c2nnc(-c3ccccc3Br)n2C)CC1 ZINC000453436675 567088685 /nfs/dbraw/zinc/08/86/85/567088685.db2.gz ZOQGAJVJLUCOGQ-ZDUSSCGKSA-N 0 3 378.318 3.165 10 0 GGAEHN CCS(=O)(=O)C1(CNC2CCN(Cc3c(F)cccc3Cl)CC2)CC1 ZINC000657758831 567092389 /nfs/dbraw/zinc/09/23/89/567092389.db2.gz NEIOEQWUWRPDAX-UHFFFAOYSA-N 0 3 388.936 3.000 10 0 GGAEHN Cc1cc(Br)c(CNC[C@@H](Cc2ccc(F)cc2)C(N)=O)s1 ZINC000453574504 567092522 /nfs/dbraw/zinc/09/25/22/567092522.db2.gz RBKLECBPTXCTIH-GFCCVEGCSA-N 0 3 385.302 3.392 10 0 GGAEHN CCS(=O)(=O)C1(CN[C@H](C)Cc2ccc(F)cc2Br)CC1 ZINC000657758823 567092890 /nfs/dbraw/zinc/09/28/90/567092890.db2.gz MXIXKJNXPKLEQZ-LLVKDONJSA-N 0 3 378.307 3.076 10 0 GGAEHN OC1(CNCc2cc(Br)cc3c2OCC3)CCC(F)(F)CC1 ZINC000657777430 567094420 /nfs/dbraw/zinc/09/44/20/567094420.db2.gz PVFGXHVLINGZAY-UHFFFAOYSA-N 0 3 376.241 3.414 10 0 GGAEHN COc1cc(C[NH2+]CC2(O)CCC(F)(F)CC2)cc(Br)c1[O-] ZINC000657775012 567094709 /nfs/dbraw/zinc/09/47/09/567094709.db2.gz BVEXONXNXLMZMP-UHFFFAOYSA-N 0 3 380.229 3.193 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)Cn1c(C)c(Br)c2ccccc21 ZINC000614230951 567094814 /nfs/dbraw/zinc/09/48/14/567094814.db2.gz BAWOAIWKUPXQCU-CQSZACIVSA-N 0 3 378.314 3.313 10 0 GGAEHN Cc1[nH]c2ccc(Br)cc2c1CC(=O)N(C)[C@@H]1CCN(C2CC2)C1 ZINC000522037498 567095220 /nfs/dbraw/zinc/09/52/20/567095220.db2.gz LDCRECDXUKNESQ-OAHLLOKOSA-N 0 3 390.325 3.476 10 0 GGAEHN O=S(=O)(c1ccccc1)N1CC[C@H](N[C@@H]2CCc3c2cccc3Cl)C1 ZINC000522022929 567095322 /nfs/dbraw/zinc/09/53/22/567095322.db2.gz CGSSPAZQUWNKLC-IFXJQAMLSA-N 0 3 376.909 3.380 10 0 GGAEHN NC(=O)CC1(CNCc2cc3c(cc2Br)OCO3)CCCCC1 ZINC000657796813 567096356 /nfs/dbraw/zinc/09/63/56/567096356.db2.gz IGIYZHNRADJZOL-UHFFFAOYSA-N 0 3 383.286 3.093 10 0 GGAEHN Cc1sc(NC(=O)CCOC2CNC2)nc1-c1ccc(Br)cc1 ZINC000565769767 567098338 /nfs/dbraw/zinc/09/83/38/567098338.db2.gz OKHYLNGPAWICIR-UHFFFAOYSA-N 0 3 396.310 3.198 10 0 GGAEHN CS[C@H]1CN(C(=O)CCC(=O)c2cc(C)sc2C)C[C@H]1N1CCCC1 ZINC000546039289 567098426 /nfs/dbraw/zinc/09/84/26/567098426.db2.gz DKBBJIVHMADJQI-AEFFLSMTSA-N 0 3 380.579 3.366 10 0 GGAEHN Nc1c(Br)cc(Br)cc1CNC[C@H]1CCC[C@@H]1O ZINC000453632151 567098935 /nfs/dbraw/zinc/09/89/35/567098935.db2.gz ORFDYUZVMNYQEZ-PELKAZGASA-N 0 3 378.108 3.044 10 0 GGAEHN CS[C@@H]1CN(C(=O)CCC(=O)c2cc(C)sc2C)C[C@@H]1N1CCCC1 ZINC000546039290 567099192 /nfs/dbraw/zinc/09/91/92/567099192.db2.gz DKBBJIVHMADJQI-FUHWJXTLSA-N 0 3 380.579 3.366 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1coc2c1cc(Br)cc2C ZINC000473739297 567099570 /nfs/dbraw/zinc/09/95/70/567099570.db2.gz VEUOYTUZZMJEGI-CQSZACIVSA-N 0 3 395.297 3.344 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1coc2c1cc(Br)cc2C ZINC000473739296 567100049 /nfs/dbraw/zinc/10/00/49/567100049.db2.gz VEUOYTUZZMJEGI-AWEZNQCLSA-N 0 3 395.297 3.344 10 0 GGAEHN COc1cc(CNC[C@H]2CCC[C@@H]2O)cc(Br)c1OC(F)F ZINC000453634985 567100313 /nfs/dbraw/zinc/10/03/13/567100313.db2.gz UIXKPDVBKUIDSU-PWSUYJOCSA-N 0 3 380.229 3.310 10 0 GGAEHN C[C@H](NC(=O)Nc1cccc(CN(C)C)c1)c1ncc(Br)cn1 ZINC000431693869 567101200 /nfs/dbraw/zinc/10/12/00/567101200.db2.gz UMCXAOPUMMBFAB-NSHDSACASA-N 0 3 378.274 3.183 10 0 GGAEHN CC[C@H]1CN(C)CCCN1C(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000614332948 567102710 /nfs/dbraw/zinc/10/27/10/567102710.db2.gz WSRDEDRDYTZYKS-GJZGRUSLSA-N 0 3 381.314 3.258 10 0 GGAEHN CC[C@H]1CN(C)CCCN1C(=O)Cc1c(F)ccc(Br)c1F ZINC000614340745 567103171 /nfs/dbraw/zinc/10/31/71/567103171.db2.gz DHUNCAOZYOZSNW-NSHDSACASA-N 0 3 375.257 3.213 10 0 GGAEHN COC[C@H](CC1CCOCC1)N[C@@H](CCO)c1ccccc1Br ZINC000657969587 567110685 /nfs/dbraw/zinc/11/06/85/567110685.db2.gz REFLDHVJSPXBHN-YJBOKZPZSA-N 0 3 386.330 3.294 10 0 GGAEHN CC(C)(C(=O)N1CCN(c2ccncc2)CC1)c1cccc(Br)c1 ZINC000588079774 567112788 /nfs/dbraw/zinc/11/27/88/567112788.db2.gz POVVJKDJGGNWGF-UHFFFAOYSA-N 0 3 388.309 3.471 10 0 GGAEHN CC[C@H](Cc1ccc(Cl)cc1)NC[C@@H]1CS(=O)(=O)c2ccccc2O1 ZINC000658046185 567116664 /nfs/dbraw/zinc/11/66/64/567116664.db2.gz PBXQWQBXUMZCON-IAGOWNOFSA-N 0 3 379.909 3.486 10 0 GGAEHN CC[C@@H](Cc1ccc(Cl)cc1)NC[C@H]1CS(=O)(=O)c2ccccc2O1 ZINC000658046186 567117631 /nfs/dbraw/zinc/11/76/31/567117631.db2.gz PBXQWQBXUMZCON-IRXDYDNUSA-N 0 3 379.909 3.486 10 0 GGAEHN COc1ccccc1/C=C\CNCCNC(=O)c1ccc(Br)cc1 ZINC000588178107 567118799 /nfs/dbraw/zinc/11/87/99/567118799.db2.gz MZORHZLBQNGGNQ-XQRVVYSFSA-N 0 3 389.293 3.491 10 0 GGAEHN Cc1cc(Br)ccc1CN(C)C(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000683384684 567119282 /nfs/dbraw/zinc/11/92/82/567119282.db2.gz MWLHXDBPDUEUTF-QGZVFWFLSA-N 0 3 380.330 3.383 10 0 GGAEHN C[C@@H](NCCC1(CS(C)(=O)=O)CC1)c1ccc(F)cc1Br ZINC000658078658 567120403 /nfs/dbraw/zinc/12/04/03/567120403.db2.gz SZMISJVZXZRCQV-LLVKDONJSA-N 0 3 378.307 3.454 10 0 GGAEHN C[C@@H](NCCC1(CS(C)(=O)=O)CC1)c1ccc(Br)cc1F ZINC000658080636 567120437 /nfs/dbraw/zinc/12/04/37/567120437.db2.gz KCQKJTVMLHXDHP-LLVKDONJSA-N 0 3 378.307 3.454 10 0 GGAEHN CO[C@H](CN[C@H](c1ccc(Br)cc1)[C@@H]1CCCO1)[C@@H]1CCOC1 ZINC000658079726 567120658 /nfs/dbraw/zinc/12/06/58/567120658.db2.gz XDGBDIDVKYZPBN-BZZMCLGOSA-N 0 3 384.314 3.310 10 0 GGAEHN CC[C@@H](NCCNC(=O)c1ccc(Br)cn1)c1cccc(OC)c1 ZINC000658093859 567122367 /nfs/dbraw/zinc/12/23/67/567122367.db2.gz ZMBNOSKMRVFCNB-MRXNPFEDSA-N 0 3 392.297 3.323 10 0 GGAEHN CC[C@H](NCCNC(=O)c1ccc(Br)cn1)c1cccc(OC)c1 ZINC000658093858 567122391 /nfs/dbraw/zinc/12/23/91/567122391.db2.gz ZMBNOSKMRVFCNB-INIZCTEOSA-N 0 3 392.297 3.323 10 0 GGAEHN CC(C)C[C@H](NCCNC(=O)c1ccc(Br)cn1)c1ccncc1 ZINC000658097387 567122739 /nfs/dbraw/zinc/12/27/39/567122739.db2.gz WXCZPEMVPVIUBC-KRWDZBQOSA-N 0 3 391.313 3.346 10 0 GGAEHN C[C@H](NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1ccc(Br)cn1 ZINC000658141085 567123657 /nfs/dbraw/zinc/12/36/57/567123657.db2.gz WEWNCWNWZSWAHK-KBXCAEBGSA-N 0 3 390.325 3.262 10 0 GGAEHN CC[C@@H](NC[C@]1(OCCO)CCOC1)c1ccc(Br)cc1Cl ZINC000658143245 567123772 /nfs/dbraw/zinc/12/37/72/567123772.db2.gz GMPJOIFFSJAEER-HZPDHXFCSA-N 0 3 392.721 3.311 10 0 GGAEHN CC1=CCN(CCNCc2ccc(Br)cc2N2CCOCC2)CC1 ZINC000473997027 567124346 /nfs/dbraw/zinc/12/43/46/567124346.db2.gz TXFYERDWWZAWDF-UHFFFAOYSA-N 0 3 394.357 3.027 10 0 GGAEHN C[C@H](NC[C@@]1(OCCO)CCOC1)c1cc2cc(Br)ccc2o1 ZINC000658148320 567125518 /nfs/dbraw/zinc/12/55/18/567125518.db2.gz LCFFQOKRJXNUBU-SJCJKPOMSA-N 0 3 384.270 3.014 10 0 GGAEHN Cc1ccc(S(=O)(=O)NCc2ccc(OCCN(C)C)cc2)cc1Cl ZINC000614613155 567125831 /nfs/dbraw/zinc/12/58/31/567125831.db2.gz CBUMDPIKFLWTAM-UHFFFAOYSA-N 0 3 382.913 3.067 10 0 GGAEHN C[C@@H](NC[C@@]1(OCCO)CCOC1)c1cc2cc(Br)ccc2o1 ZINC000658148319 567126428 /nfs/dbraw/zinc/12/64/28/567126428.db2.gz LCFFQOKRJXNUBU-PXAZEXFGSA-N 0 3 384.270 3.014 10 0 GGAEHN Cc1c(Cl)cccc1S(=O)(=O)NCc1ccc(OCCN(C)C)cc1 ZINC000614613298 567126783 /nfs/dbraw/zinc/12/67/83/567126783.db2.gz VGEGDOQNXPPCHG-UHFFFAOYSA-N 0 3 382.913 3.067 10 0 GGAEHN C[C@H](NC[C@@H]1CC(=O)N(C)C1)c1ccc(Br)cc1Br ZINC000658244059 567132134 /nfs/dbraw/zinc/13/21/34/567132134.db2.gz JVEYOAKTUNQYJD-UWVGGRQHSA-N 0 3 390.119 3.341 10 0 GGAEHN C[C@H](N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2)c1cncc(Br)c1 ZINC000658290903 567133337 /nfs/dbraw/zinc/13/33/37/567133337.db2.gz HYJLTUBDLXFHLL-IAOVAPTHSA-N 0 3 380.330 3.138 10 0 GGAEHN CN(Cc1ccccc1)C[C@H](O)CN(C)Cc1cccc(Br)c1 ZINC000588690898 567134501 /nfs/dbraw/zinc/13/45/01/567134501.db2.gz KQWTWPIBQOLARM-IBGZPJMESA-N 0 3 377.326 3.374 10 0 GGAEHN O=C1N(CCN[C@@H]2CCc3ccc(Br)cc32)C[C@H]2CCCCN12 ZINC000658304966 567135330 /nfs/dbraw/zinc/13/53/30/567135330.db2.gz IDMAGYYQJRPBOT-NVXWUHKLSA-N 0 3 378.314 3.316 10 0 GGAEHN CC1(C)OCC[C@@H]1CN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000658329619 567135813 /nfs/dbraw/zinc/13/58/13/567135813.db2.gz GMEWGYBFDMQBOM-RISCZKNCSA-N 0 3 388.327 3.072 10 0 GGAEHN O=C1N(CCN[C@@H]2CCc3cc(Br)ccc32)C[C@H]2CCCCN12 ZINC000658305567 567135886 /nfs/dbraw/zinc/13/58/86/567135886.db2.gz ANOFYBLSJDQRJB-NVXWUHKLSA-N 0 3 378.314 3.316 10 0 GGAEHN O=C1N(CCN[C@H]2CCc3cc(Br)ccc32)C[C@@H]2CCCCN12 ZINC000658305568 567136304 /nfs/dbraw/zinc/13/63/04/567136304.db2.gz ANOFYBLSJDQRJB-RDJZCZTQSA-N 0 3 378.314 3.316 10 0 GGAEHN O=C1N(CCN[C@H]2CCc3c2ccc(F)c3Br)C[C@@H]2CCCCN12 ZINC000658305694 567136565 /nfs/dbraw/zinc/13/65/65/567136565.db2.gz LRQMOZFRZIHULH-LRDDRELGSA-N 0 3 396.304 3.455 10 0 GGAEHN O=C1N(CCN[C@H]2CCc3ccc(Br)cc32)C[C@@H]2CCCCN12 ZINC000658304972 567136604 /nfs/dbraw/zinc/13/66/04/567136604.db2.gz IDMAGYYQJRPBOT-RDJZCZTQSA-N 0 3 378.314 3.316 10 0 GGAEHN COCCCN(C)CCNC(=O)c1coc2c1cc(Br)cc2C ZINC000474118103 567137360 /nfs/dbraw/zinc/13/73/60/567137360.db2.gz MQPITPAEOWCUQG-UHFFFAOYSA-N 0 3 383.286 3.202 10 0 GGAEHN O=S(=O)(Cc1cc(F)ccc1Cl)N[C@@H]1CNCC[C@@H]1c1ccccc1 ZINC000658391474 567138876 /nfs/dbraw/zinc/13/88/76/567138876.db2.gz IZBDMYVTRBLRDF-SJLPKXTDSA-N 0 3 382.888 3.044 10 0 GGAEHN O=C(C1CCC1)N1CCN(CCNCc2ccc(F)c(Cl)c2Cl)CC1 ZINC000432234194 567139192 /nfs/dbraw/zinc/13/91/92/567139192.db2.gz VFMVDSJRICLPOI-UHFFFAOYSA-N 0 3 388.314 3.166 10 0 GGAEHN O=S(=O)(Cc1ccc(F)c(Cl)c1)N[C@@H]1CNCC[C@@H]1c1ccccc1 ZINC000658390674 567139969 /nfs/dbraw/zinc/13/99/69/567139969.db2.gz DYVUWVQXXPJYCN-CRAIPNDOSA-N 0 3 382.888 3.044 10 0 GGAEHN CN(C)CCn1cc(NC(=O)Nc2cc3c(cc2Br)CCC3)cn1 ZINC000683631728 567140284 /nfs/dbraw/zinc/14/02/84/567140284.db2.gz ZWCMDNLZAZUMON-UHFFFAOYSA-N 0 3 392.301 3.340 10 0 GGAEHN O=C(NCCCNCc1cccnc1)[C@@H]1CCc2cc(Br)ccc21 ZINC000566240060 567142341 /nfs/dbraw/zinc/14/23/41/567142341.db2.gz HDNIJSYKINPNHF-GOSISDBHSA-N 0 3 388.309 3.170 10 0 GGAEHN O=C(CN1CCNC[C@H]1C(F)F)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000566243537 567142840 /nfs/dbraw/zinc/14/28/40/567142840.db2.gz WUWCYJWTROOVJL-CABCVRRESA-N 0 3 392.277 3.196 10 0 GGAEHN COCCCN1CCC(NC(=O)CCOc2cccc(Cl)c2Cl)CC1 ZINC000588936808 567145740 /nfs/dbraw/zinc/14/57/40/567145740.db2.gz UOPPAURSHLRYFV-UHFFFAOYSA-N 0 3 389.323 3.379 10 0 GGAEHN CCN(CC)CCN(C(=O)Cc1ccco1)c1ccc(Br)cn1 ZINC000566304509 567147008 /nfs/dbraw/zinc/14/70/08/567147008.db2.gz OOUIFNFUOMUHLY-UHFFFAOYSA-N 0 3 380.286 3.355 10 0 GGAEHN NC(=O)c1ncc(Br)cc1NC[C@H](c1cccs1)N1CCCC1 ZINC000546736493 567152328 /nfs/dbraw/zinc/15/23/28/567152328.db2.gz YGEIKXXLMLIQFW-CYBMUJFWSA-N 0 3 395.326 3.254 10 0 GGAEHN Cn1ncc(Br)c1CN[C@H]1CCc2nc(-c3ccccc3)ncc2C1 ZINC000683767236 567153464 /nfs/dbraw/zinc/15/34/64/567153464.db2.gz FKKIGMUBGWFEGE-HNNXBMFYSA-N 0 3 398.308 3.287 10 0 GGAEHN C[C@H]1CCN(Cc2ccccc2)CCN1Cc1c(Br)cnn1C ZINC000683829433 567157198 /nfs/dbraw/zinc/15/71/98/567157198.db2.gz DKEYXKYWEZEYFK-HNNXBMFYSA-N 0 3 377.330 3.279 10 0 GGAEHN C[C@H]1CCC[C@@](CNC(=O)Cc2ccc(Br)cc2[O-])([NH+](C)C)C1 ZINC000432408609 567158392 /nfs/dbraw/zinc/15/83/92/567158392.db2.gz CLKJWTQKNZPDGT-SCLBCKFNSA-N 0 3 383.330 3.324 10 0 GGAEHN C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)N1CCC[C@@](O)(CN(C)C)C1 ZINC000683912957 567160637 /nfs/dbraw/zinc/16/06/37/567160637.db2.gz OWTHTURQCXPKRQ-YVEFUNNKSA-N 0 3 391.364 3.389 10 0 GGAEHN CCCCN(C)CCNC(=O)c1ncc(Br)cc1Br ZINC000546799979 567161757 /nfs/dbraw/zinc/16/17/57/567161757.db2.gz ZSSBXDFELOBDPF-UHFFFAOYSA-N 0 3 393.123 3.068 10 0 GGAEHN CN(Cc1nc(Cc2cccc(Br)c2)no1)[C@@H]1CCN(C2CC2)C1 ZINC000523582816 567163645 /nfs/dbraw/zinc/16/36/45/567163645.db2.gz IDCINTGHRDWGSP-MRXNPFEDSA-N 0 3 391.313 3.091 10 0 GGAEHN CN(Cc1nc(-c2cccc(Br)c2)no1)[C@H]1CCN(C2CC2)C1 ZINC000523583010 567164698 /nfs/dbraw/zinc/16/46/98/567164698.db2.gz PZISYTKXTCGAES-HNNXBMFYSA-N 0 3 377.286 3.168 10 0 GGAEHN Cc1c(Br)ccc(C(=O)N2CCN(c3ccncc3)CC2)c1F ZINC000683953310 567165522 /nfs/dbraw/zinc/16/55/22/567165522.db2.gz AUFWNLFRVYLUPP-UHFFFAOYSA-N 0 3 378.245 3.254 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)COc1ccc(Br)cc1F ZINC000498336237 567169092 /nfs/dbraw/zinc/16/90/92/567169092.db2.gz VQSZNDRGVVMPIA-ZDUSSCGKSA-N 0 3 375.282 3.060 10 0 GGAEHN N[C@@H]1CN(C(=O)Cc2ccc(Br)cc2)CC[C@@H]1c1cccc(F)c1 ZINC000658947597 567171284 /nfs/dbraw/zinc/17/12/84/567171284.db2.gz KXXVFHKSSKXZPU-QZTJIDSGSA-N 0 3 391.284 3.474 10 0 GGAEHN Cc1oc(Br)cc1C(=O)N1CC[C@H](c2cccc(F)c2)[C@H](N)C1 ZINC000658949773 567171763 /nfs/dbraw/zinc/17/17/63/567171763.db2.gz FXOJYELTMPTTKB-UKRRQHHQSA-N 0 3 381.245 3.447 10 0 GGAEHN CN(C(=O)NCC1(c2cccc(Br)c2)CC1)[C@H]1CCN(C2CC2)C1 ZINC000523808562 567172513 /nfs/dbraw/zinc/17/25/13/567172513.db2.gz NJFYBFHZLBUKIC-KRWDZBQOSA-N 0 3 392.341 3.359 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)CCOc1cccc(Cl)c1Cl ZINC000615263792 567173331 /nfs/dbraw/zinc/17/33/31/567173331.db2.gz JKLMXKMDPHSONQ-HUUCEWRRSA-N 0 3 387.307 3.084 10 0 GGAEHN Cc1cc(Br)cc(C(=O)N2CCOC[C@H]2[C@H]2CCCN2C)c1C ZINC000615274494 567175091 /nfs/dbraw/zinc/17/50/91/567175091.db2.gz JICPGWHTPPAYFF-SJORKVTESA-N 0 3 381.314 3.001 10 0 GGAEHN Cc1cc(Br)cc(C(=O)N2CCOC[C@@H]2[C@H]2CCCN2C)c1C ZINC000615274490 567175260 /nfs/dbraw/zinc/17/52/60/567175260.db2.gz JICPGWHTPPAYFF-IAGOWNOFSA-N 0 3 381.314 3.001 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N1CCOC[C@H]1[C@H]1CCCN1C ZINC000615266676 567175600 /nfs/dbraw/zinc/17/56/00/567175600.db2.gz ONJSDNQFVCYHLB-MAZHCROVSA-N 0 3 387.307 3.082 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1cc(Cl)cc(Br)c1 ZINC000615268225 567175815 /nfs/dbraw/zinc/17/58/15/567175815.db2.gz FVEXHQMMARHFMI-CABCVRRESA-N 0 3 387.705 3.038 10 0 GGAEHN N[C@@H]1CN(C(=O)Nc2ccc(Br)cc2C(F)(F)F)CC[C@H]1F ZINC000658987901 567176205 /nfs/dbraw/zinc/17/62/05/567176205.db2.gz YHRYLKDHZWNYTF-NXEZZACHSA-N 0 3 384.171 3.371 10 0 GGAEHN N[C@@H]1CN(C(=O)Nc2ccc(Br)c(C(F)(F)F)c2)CC[C@H]1F ZINC000658981916 567176341 /nfs/dbraw/zinc/17/63/41/567176341.db2.gz IAOWNPMIHWCKRR-GHMZBOCLSA-N 0 3 384.171 3.371 10 0 GGAEHN N[C@@H]1CN(C(=O)Nc2cc(Br)cc(C(F)(F)F)c2)CC[C@H]1F ZINC000658997224 567177648 /nfs/dbraw/zinc/17/76/48/567177648.db2.gz XCTFIJKLCVCBAJ-GHMZBOCLSA-N 0 3 384.171 3.371 10 0 GGAEHN Cc1cc(Br)c(CNC(=O)Nc2cnc3c(c2)CNCC3)s1 ZINC000659019651 567177722 /nfs/dbraw/zinc/17/77/22/567177722.db2.gz GLAGDWMOICHTAS-UHFFFAOYSA-N 0 3 381.299 3.181 10 0 GGAEHN Cc1ccc2c(c1Br)CN(C(=O)Nc1cnc3c(c1)CNCC3)C2 ZINC000659018211 567177856 /nfs/dbraw/zinc/17/78/56/567177856.db2.gz GPTXQORCDJAEJJ-UHFFFAOYSA-N 0 3 387.281 3.346 10 0 GGAEHN O=C(NCc1cccc(Br)c1)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659030736 567179635 /nfs/dbraw/zinc/17/96/35/567179635.db2.gz LZOIZNIZDCXJPH-QGZVFWFLSA-N 0 3 390.281 3.432 10 0 GGAEHN O=C(NCc1ccc(Br)cc1)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659032391 567179844 /nfs/dbraw/zinc/17/98/44/567179844.db2.gz FQUIFUKDWKMYOG-QGZVFWFLSA-N 0 3 390.281 3.432 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3cc(Br)cc(C)c3C)[C@H]2C1 ZINC000615348452 567180421 /nfs/dbraw/zinc/18/04/21/567180421.db2.gz IXVZPRQBFXUENP-DLBZAZTESA-N 0 3 381.314 3.001 10 0 GGAEHN Cc1ccc(C(=O)NCCN2CCCC[C@@H]2C)cc1I ZINC000524128810 567183100 /nfs/dbraw/zinc/18/31/00/567183100.db2.gz NGENJHRRDHSXGA-ZDUSSCGKSA-N 0 3 386.277 3.204 10 0 GGAEHN CN(Cc1ccc(Cl)s1)C(=O)CN[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000566766279 567187996 /nfs/dbraw/zinc/18/79/96/567187996.db2.gz FLFCHWKVXQGQOJ-VQIMIIECSA-N 0 3 377.941 3.395 10 0 GGAEHN CN(Cc1ccc(Cl)s1)C(=O)CN[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000566766276 567189035 /nfs/dbraw/zinc/18/90/35/567189035.db2.gz FLFCHWKVXQGQOJ-APWZRJJASA-N 0 3 377.941 3.395 10 0 GGAEHN Cc1nc(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cs1 ZINC000684248947 567191775 /nfs/dbraw/zinc/19/17/75/567191775.db2.gz DHDFNTWNWZTAPU-UHFFFAOYSA-N 0 3 376.448 3.056 10 0 GGAEHN CC(C)[C@@H](O)CN(C)Cc1cccc(Br)c1OC[C@H]1CCCO1 ZINC000432793851 567193002 /nfs/dbraw/zinc/19/30/02/567193002.db2.gz QUCCRYKIXWNOLI-WBVHZDCISA-N 0 3 386.330 3.456 10 0 GGAEHN O=C(C[C@H]1NCc2ccccc21)NCCc1cc(Br)ccc1F ZINC000659251039 567193715 /nfs/dbraw/zinc/19/37/15/567193715.db2.gz ACFOVQJLJKZRIF-QGZVFWFLSA-N 0 3 377.257 3.482 10 0 GGAEHN O=C(C[C@@H]1NCc2ccccc21)NCCc1cc(Br)ccc1F ZINC000659251037 567193728 /nfs/dbraw/zinc/19/37/28/567193728.db2.gz ACFOVQJLJKZRIF-KRWDZBQOSA-N 0 3 377.257 3.482 10 0 GGAEHN O=C(C[C@@H]1NCc2ccccc21)NCCOc1cccc(Br)c1 ZINC000659253986 567194403 /nfs/dbraw/zinc/19/44/03/567194403.db2.gz CKFKQHPBKHSZAW-KRWDZBQOSA-N 0 3 375.266 3.179 10 0 GGAEHN CCN1CCC(Nc2ncnc3cccc(I)c32)CC1 ZINC000547279012 567194363 /nfs/dbraw/zinc/19/43/63/567194363.db2.gz IHFKCUKHPULNTI-UHFFFAOYSA-N 0 3 382.249 3.131 10 0 GGAEHN CN1CC[C@H](Cn2nnnc2Sc2nc3cc(Cl)cc(Cl)c3o2)C1 ZINC000432827805 567194724 /nfs/dbraw/zinc/19/47/24/567194724.db2.gz DZPJJPCOSUHHPN-QMMMGPOBSA-N 0 3 385.280 3.224 10 0 GGAEHN COc1c(Br)ccc(C)c1C(=O)N1CCC[C@]2(CCN(C)C2)C1 ZINC000615602365 567194889 /nfs/dbraw/zinc/19/48/89/567194889.db2.gz BHTJCUFEQZAROT-GOSISDBHSA-N 0 3 381.314 3.324 10 0 GGAEHN CN1CC[C@]2(C1)CCCN(C(=O)c1c[nH]c3cccc(Br)c13)C2 ZINC000615611992 567196670 /nfs/dbraw/zinc/19/66/70/567196670.db2.gz NHFMRBOMBJSGPL-SFHVURJKSA-N 0 3 376.298 3.488 10 0 GGAEHN CN(C)CCN(C(=O)c1sc2c(c1Br)CNC2)c1ccccc1 ZINC000659256552 567197031 /nfs/dbraw/zinc/19/70/31/567197031.db2.gz MWLVLDOKPOCHHF-UHFFFAOYSA-N 0 3 394.338 3.322 10 0 GGAEHN C[C@@H]1CN(CCCNc2ccc3cccc(Br)c3n2)CCCO1 ZINC000432851273 567198482 /nfs/dbraw/zinc/19/84/82/567198482.db2.gz AQESWBQKTFWYAK-CQSZACIVSA-N 0 3 378.314 3.332 10 0 GGAEHN COc1ccc(Br)c(CNC(=O)C[C@@H]2NCc3ccccc32)c1 ZINC000659274054 567198962 /nfs/dbraw/zinc/19/89/62/567198962.db2.gz OHDRXWSQWXVZEN-KRWDZBQOSA-N 0 3 375.266 3.309 10 0 GGAEHN CC(C)C[C@H](CNC[C@H](O)CS(=O)(=O)c1cccs1)c1ccccc1 ZINC000474803482 567200848 /nfs/dbraw/zinc/20/08/48/567200848.db2.gz CHTUQDJJFHPQBH-MSOLQXFVSA-N 0 3 381.563 3.302 10 0 GGAEHN CC(C)C[C@@H](CNC[C@H](O)CS(=O)(=O)c1cccs1)c1ccccc1 ZINC000474803484 567201233 /nfs/dbraw/zinc/20/12/33/567201233.db2.gz CHTUQDJJFHPQBH-ROUUACIJSA-N 0 3 381.563 3.302 10 0 GGAEHN O=C(Nc1cscc1Br)C(C[C@H]1COCCO1)C(F)(F)F ZINC000615734818 567202488 /nfs/dbraw/zinc/20/24/88/567202488.db2.gz ZCEQVQCXUDZONY-YUMQZZPRSA-N 0 3 388.205 3.433 10 0 GGAEHN Cc1cc(C[C@@H](C)NCc2c(F)ccc(I)c2F)n[nH]1 ZINC000474819046 567202797 /nfs/dbraw/zinc/20/27/97/567202797.db2.gz NHCGQCXTZHXPIY-MRVPVSSYSA-N 0 3 391.203 3.322 10 0 GGAEHN Cc1cc(C[C@@H](C)NCc2c(F)ccc(I)c2F)[nH]n1 ZINC000474819046 567202802 /nfs/dbraw/zinc/20/28/02/567202802.db2.gz NHCGQCXTZHXPIY-MRVPVSSYSA-N 0 3 391.203 3.322 10 0 GGAEHN C[C@@H]1CN(C(=O)[C@H]2CCc3cc(Br)ccc32)CCN(C2CC2)C1 ZINC000566918246 567203507 /nfs/dbraw/zinc/20/35/07/567203507.db2.gz UDEIMYWBTSFXRT-UGSOOPFHSA-N 0 3 377.326 3.422 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2Cc2ccc(I)c(Cl)c2)C1 ZINC000590010648 567203854 /nfs/dbraw/zinc/20/38/54/567203854.db2.gz OCABLSRBEQYBBL-FZMZJTMJSA-N 0 3 376.669 3.081 10 0 GGAEHN O[C@@H](CCNCc1cc(Br)c2c(c1)OCCCO2)C(F)(F)F ZINC000566941177 567203994 /nfs/dbraw/zinc/20/39/94/567203994.db2.gz BMVHMHOTELEXFO-LBPRGKRZSA-N 0 3 384.192 3.013 10 0 GGAEHN COc1ccc(CCC(=O)NCc2ccc3c(c2)CNC3)c(Br)c1 ZINC000659305827 567204087 /nfs/dbraw/zinc/20/40/87/567204087.db2.gz ZVRWDZBASMWZQG-UHFFFAOYSA-N 0 3 389.293 3.310 10 0 GGAEHN CCn1c(CNCC2(OC)CCOCC2)nc2cc(Br)ccc21 ZINC000432930527 567204874 /nfs/dbraw/zinc/20/48/74/567204874.db2.gz YRDJMUVIMYKQCU-UHFFFAOYSA-N 0 3 382.302 3.104 10 0 GGAEHN O=C(NCC1(Cc2ccc(Br)cc2)CC1)[C@@H]1CNCCC1(F)F ZINC000659358218 567207796 /nfs/dbraw/zinc/20/77/96/567207796.db2.gz GKMGAPSJSKRTGU-AWEZNQCLSA-N 0 3 387.268 3.133 10 0 GGAEHN COc1ccc(C(=O)Nc2ccc([C@@H]3CNCCO3)cc2)c(Br)c1 ZINC000659372007 567209121 /nfs/dbraw/zinc/20/91/21/567209121.db2.gz XPNKDUCJADWPHM-KRWDZBQOSA-N 0 3 391.265 3.371 10 0 GGAEHN COCc1csc(NC(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)n1 ZINC000454888866 567209161 /nfs/dbraw/zinc/20/91/61/567209161.db2.gz UIVNCJAUCPISBH-OAHLLOKOSA-N 0 3 380.539 3.436 10 0 GGAEHN O=C(COc1cccc(Br)c1)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000659368074 567209466 /nfs/dbraw/zinc/20/94/66/567209466.db2.gz KTBDXIHTFNMSKW-QGZVFWFLSA-N 0 3 391.265 3.128 10 0 GGAEHN CN(C)[C@@H](CNc1cc(Br)cnc1C(N)=O)c1ccc(Cl)cc1 ZINC000547443963 567210228 /nfs/dbraw/zinc/21/02/28/567210228.db2.gz QMKCLVKTKOVJNK-AWEZNQCLSA-N 0 3 397.704 3.311 10 0 GGAEHN C[C@H](CCc1ccc(I)cc1)NCc1cc(C(N)=O)co1 ZINC000474923869 567210182 /nfs/dbraw/zinc/21/01/82/567210182.db2.gz FWCLVPRLUDCNAU-LLVKDONJSA-N 0 3 398.244 3.094 10 0 GGAEHN NC[C@H](C(=O)N1CCc2sc(Br)cc2C1)c1ccc(F)cc1 ZINC000659368953 567210335 /nfs/dbraw/zinc/21/03/35/567210335.db2.gz RJDPXGLFENZLAR-ZDUSSCGKSA-N 0 3 383.286 3.277 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)CSc1cc(Cl)ccc1Cl ZINC000590119434 567210357 /nfs/dbraw/zinc/21/03/57/567210357.db2.gz XHWHOQYLKBWQGB-CYBMUJFWSA-N 0 3 377.337 3.313 10 0 GGAEHN O=C(c1ccc2c(c1)CNC2)N1CCOC[C@@H]1c1cccc(Br)c1 ZINC000659367160 567210426 /nfs/dbraw/zinc/21/04/26/567210426.db2.gz JREBXZMWOVLSPN-GOSISDBHSA-N 0 3 387.277 3.266 10 0 GGAEHN NC[C@@H](C(=O)N1CCc2sc(Br)cc2C1)c1ccc(F)cc1 ZINC000659368951 567210512 /nfs/dbraw/zinc/21/05/12/567210512.db2.gz RJDPXGLFENZLAR-CYBMUJFWSA-N 0 3 383.286 3.277 10 0 GGAEHN Cc1c(Br)cncc1C(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000659365422 567210549 /nfs/dbraw/zinc/21/05/49/567210549.db2.gz XQVJWZFCZCMZEV-INIZCTEOSA-N 0 3 376.254 3.066 10 0 GGAEHN C[C@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1cc(Br)cs1 ZINC000567009582 567211035 /nfs/dbraw/zinc/21/10/35/567211035.db2.gz UBBTUFAXENHBPG-WCQYABFASA-N 0 3 397.342 3.086 10 0 GGAEHN N[C@@H]1CN(C(=O)c2cc(COc3c(Cl)cccc3Cl)on2)CC[C@H]1F ZINC000659389589 567211908 /nfs/dbraw/zinc/21/19/08/567211908.db2.gz NBHOSAFSJQSATR-CHWSQXEVSA-N 0 3 388.226 3.072 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)N[C@@H]2[C@H]3Cc4cc(Br)ccc4[C@@H]23)CCN1C ZINC000637650969 567212232 /nfs/dbraw/zinc/21/22/32/567212232.db2.gz RQFFLQMQHWMGRE-WBVYRUSMSA-N 0 3 392.341 3.211 10 0 GGAEHN N[C@@H]1CN(C(=O)CCc2nc3cc(C(F)(F)F)ccc3s2)CC[C@H]1F ZINC000659390569 567212241 /nfs/dbraw/zinc/21/22/41/567212241.db2.gz WKQYLYSOGFKBRI-GHMZBOCLSA-N 0 3 375.391 3.145 10 0 GGAEHN O=C(C[C@@H]1CSCCN1)N[C@@H]1CCCCc2cc(Br)ccc21 ZINC000659386490 567212296 /nfs/dbraw/zinc/21/22/96/567212296.db2.gz OUSVAZNNDOVKRN-GDBMZVCRSA-N 0 3 383.355 3.428 10 0 GGAEHN N[C@@H]1CN(C(=O)c2ccc(Oc3cccc(Cl)c3Cl)nn2)CC[C@H]1F ZINC000659391069 567213284 /nfs/dbraw/zinc/21/32/84/567213284.db2.gz OIVKCPVZPUNDRB-GHMZBOCLSA-N 0 3 385.226 3.087 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@H]1CCCOCC1)c1ccc(Br)cn1 ZINC000567053281 567213509 /nfs/dbraw/zinc/21/35/09/567213509.db2.gz YBLQTSHTCTUXRL-HNNXBMFYSA-N 0 3 398.345 3.336 10 0 GGAEHN C[C@](O)(CO)CNCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000684537879 567214857 /nfs/dbraw/zinc/21/48/57/567214857.db2.gz FQVCHHSJFGTYRH-GOSISDBHSA-N 0 3 383.275 3.079 10 0 GGAEHN C[C@@](O)(CO)CNCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000684537880 567214931 /nfs/dbraw/zinc/21/49/31/567214931.db2.gz FQVCHHSJFGTYRH-SFHVURJKSA-N 0 3 383.275 3.079 10 0 GGAEHN C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2C[C@@H]2c2cccc(Br)c2)CCN1C ZINC000524787402 567215063 /nfs/dbraw/zinc/21/50/63/567215063.db2.gz QKJRVULWHSNNHN-BASLNEPJSA-N 0 3 380.330 3.429 10 0 GGAEHN O=S1(=O)CC(CCN[C@@H](c2ccc(Br)cc2F)C2CC2)C1 ZINC000684559671 567216191 /nfs/dbraw/zinc/21/61/91/567216191.db2.gz OMIVQINVCKDKPP-OAHLLOKOSA-N 0 3 376.291 3.064 10 0 GGAEHN CC[C@H](NC(=O)N1CC[C@@H](F)[C@H](N)C1)c1cc(F)cc(Br)c1 ZINC000659483838 567216550 /nfs/dbraw/zinc/21/65/50/567216550.db2.gz KAPJTFXKZRQBBL-MCIONIFRSA-N 0 3 376.245 3.120 10 0 GGAEHN N[C@@H]1CN(C(=O)N[C@H](c2cc(F)cc(Br)c2)C2CC2)CC[C@H]1F ZINC000659484713 567216601 /nfs/dbraw/zinc/21/66/01/567216601.db2.gz ZMGRLUWYLOHVLL-KFWWJZLASA-N 0 3 388.256 3.120 10 0 GGAEHN N[C@@H]1CN(C(=O)NCCOc2c(Cl)cc(Cl)cc2Cl)CC[C@H]1F ZINC000659466355 567216924 /nfs/dbraw/zinc/21/69/24/567216924.db2.gz YJGRXFFLNMIARL-VXGBXAGGSA-N 0 3 384.666 3.106 10 0 GGAEHN N[C@@H]1CN(C(=O)NCC2(c3ccc(Br)s3)CCC2)CC[C@H]1F ZINC000659492046 567217275 /nfs/dbraw/zinc/21/72/75/567217275.db2.gz HGABTINIWAGQML-GHMZBOCLSA-N 0 3 390.322 3.013 10 0 GGAEHN CN(C)Cc1ccc(S(=O)(=O)NCCc2ccccc2Br)cc1 ZINC000433065087 567218514 /nfs/dbraw/zinc/21/85/14/567218514.db2.gz ZTAIWDRNOFJTTF-UHFFFAOYSA-N 0 3 397.338 3.032 10 0 GGAEHN O=C(NC[C@H]1CCCCN1CCO)Nc1ccc(Cl)cc1Br ZINC000454986756 567220177 /nfs/dbraw/zinc/22/01/77/567220177.db2.gz FAMDEKRVJHXTAN-GFCCVEGCSA-N 0 3 390.709 3.071 10 0 GGAEHN CC(C)(NCC(=O)N1CCO[C@H]2CCCC[C@H]21)c1ccc(Br)cc1 ZINC000616010881 567220155 /nfs/dbraw/zinc/22/01/55/567220155.db2.gz QUQFENSZPXVTMO-SJORKVTESA-N 0 3 395.341 3.444 10 0 GGAEHN CN(CCCCOc1cccc(C(F)(F)F)c1)C[C@H]1CCS(=O)(=O)C1 ZINC000524892337 567221044 /nfs/dbraw/zinc/22/10/44/567221044.db2.gz ACZJQKBYTAGHEX-CQSZACIVSA-N 0 3 379.444 3.231 10 0 GGAEHN CCN(CCCN[C@H](CO)c1cccc(Br)c1)CC(F)(F)F ZINC000475130400 567226930 /nfs/dbraw/zinc/22/69/30/567226930.db2.gz NSRKBHFVRACSFK-CQSZACIVSA-N 0 3 383.252 3.346 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N[C@H]1CCN(C)[C@H](C)C1 ZINC000525102013 567228171 /nfs/dbraw/zinc/22/81/71/567228171.db2.gz GDHNQGDQMOKZOA-OCCSQVGLSA-N 0 3 378.314 3.311 10 0 GGAEHN C[C@H]1OCC[C@]1(O)CNCc1cnc(-c2ccc(Br)cc2)s1 ZINC000433189838 567228653 /nfs/dbraw/zinc/22/86/53/567228653.db2.gz SSLIPPXZHPQDPM-BZNIZROVSA-N 0 3 383.311 3.202 10 0 GGAEHN C[C@H]1CCN(CC(=O)N2CCC(Nc3cccc(Br)c3)CC2)C1 ZINC000567247381 567230217 /nfs/dbraw/zinc/23/02/17/567230217.db2.gz FSVFISOXGUDLPG-AWEZNQCLSA-N 0 3 380.330 3.194 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2cc3cc(Cl)sc3[nH]2)CC1 ZINC000638038868 567230521 /nfs/dbraw/zinc/23/05/21/567230521.db2.gz WOGJBHSVGNBGBO-UHFFFAOYSA-N 0 3 376.869 3.249 10 0 GGAEHN CN(C)CCOc1ccccc1CNC(=O)Cc1cscc1Br ZINC000433248010 567236845 /nfs/dbraw/zinc/23/68/45/567236845.db2.gz RPPWZXQLOZVJTB-UHFFFAOYSA-N 0 3 397.338 3.310 10 0 GGAEHN Cc1nc(CCNC(=O)NC[C@H]2CCCN(C)[C@@H]2c2cccs2)cs1 ZINC000525256618 567238594 /nfs/dbraw/zinc/23/85/94/567238594.db2.gz DCIKPBDKFNWJBI-PBHICJAKSA-N 0 3 378.567 3.438 10 0 GGAEHN Clc1cc(Br)cnc1CN1CCN(CC2CCOCC2)CC1 ZINC000659940346 567239668 /nfs/dbraw/zinc/23/96/68/567239668.db2.gz YTOZEEMQCQUWSN-UHFFFAOYSA-N 0 3 388.737 3.042 10 0 GGAEHN Cc1cc(C)c(C(=O)N2CCC[C@@H]2CN(C)C)cc1I ZINC000475535955 567256481 /nfs/dbraw/zinc/25/64/81/567256481.db2.gz ZGYAPVZQGDNNDE-CYBMUJFWSA-N 0 3 386.277 3.074 10 0 GGAEHN Brc1ccc(OCCN2CCCC[C@@H]2CN2CCOCC2)cc1 ZINC000525283315 567239952 /nfs/dbraw/zinc/23/99/52/567239952.db2.gz NFJLOJGITGWFCI-QGZVFWFLSA-N 0 3 383.330 3.015 10 0 GGAEHN COc1cccc(SC)c1NC(=O)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000616350815 567240205 /nfs/dbraw/zinc/24/02/05/567240205.db2.gz OKYHGDRRSIABGX-GHMZBOCLSA-N 0 3 379.400 3.340 10 0 GGAEHN CN(C[C@H]1CCCN1C)C(=O)c1c(F)c(F)c(Br)c(F)c1F ZINC000616384373 567242540 /nfs/dbraw/zinc/24/25/40/567242540.db2.gz QSJYMPGAIWNEMF-SSDOTTSWSA-N 0 3 383.183 3.172 10 0 GGAEHN CN(C[C@H]1CCCN1C)C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000616384330 567243119 /nfs/dbraw/zinc/24/31/19/567243119.db2.gz PRDCVNKWBBBZSE-MRXNPFEDSA-N 0 3 380.330 3.216 10 0 GGAEHN CS[C@H]1CN(C(=O)Cc2cscc2Br)C[C@H]1N1CCCC1 ZINC000499400977 567243807 /nfs/dbraw/zinc/24/38/07/567243807.db2.gz SRAQYJPPBCDSBB-KGLIPLIRSA-N 0 3 389.384 3.091 10 0 GGAEHN CN(C)CCn1cc(NC(=O)C(C)(C)c2ccccc2Br)cn1 ZINC000684901323 567243860 /nfs/dbraw/zinc/24/38/60/567243860.db2.gz WECHMYQVWSGYNY-UHFFFAOYSA-N 0 3 379.302 3.124 10 0 GGAEHN CO[C@@H]1CC[C@H](C(=O)Nc2cc(Br)ccc2N(C)CCN(C)C)C1 ZINC000616422949 567244405 /nfs/dbraw/zinc/24/44/05/567244405.db2.gz USGQSRYJDUBAIX-DZGCQCFKSA-N 0 3 398.345 3.201 10 0 GGAEHN OC[C@H](CNCc1ccc(-c2cc[nH]n2)o1)Cc1ccccc1Br ZINC000433336356 567244490 /nfs/dbraw/zinc/24/44/90/567244490.db2.gz PIUHFDAKZQSMPL-ZDUSSCGKSA-N 0 3 390.281 3.373 10 0 GGAEHN CO[C@@H](C(=O)Nc1cc(Br)ccc1N(C)CCN(C)C)C1CCC1 ZINC000616422882 567244558 /nfs/dbraw/zinc/24/45/58/567244558.db2.gz OKALYZKPHCDHLV-QGZVFWFLSA-N 0 3 398.345 3.201 10 0 GGAEHN Cc1cc(C)c(NC(=O)NC[C@H]2CCCCN2CCO)cc1Br ZINC000455196126 567245524 /nfs/dbraw/zinc/24/55/24/567245524.db2.gz QCCRNMFRUXUZCZ-CQSZACIVSA-N 0 3 384.318 3.034 10 0 GGAEHN COC(=O)c1cc(NC(=O)NCCN2CCC(C)CC2)ccc1Br ZINC000547754370 567245864 /nfs/dbraw/zinc/24/58/64/567245864.db2.gz YHVXSPNSHCFCNC-UHFFFAOYSA-N 0 3 398.301 3.089 10 0 GGAEHN COc1ccc(C[C@H](C)N[C@H](C(N)=O)c2cccc(Br)c2)cc1 ZINC000475438204 567248889 /nfs/dbraw/zinc/24/88/89/567248889.db2.gz FPTLDYYSCRGQHH-SJCJKPOMSA-N 0 3 377.282 3.205 10 0 GGAEHN C[C@@H](NC(=O)Nc1ccccc1CCN(C)C)c1ncc(Br)cn1 ZINC000455230494 567249300 /nfs/dbraw/zinc/24/93/00/567249300.db2.gz PPGHFZCMTPSJCX-GFCCVEGCSA-N 0 3 392.301 3.226 10 0 GGAEHN Cc1c(Br)cncc1C(=O)NC[C@@H]1CN(C)C[C@H]1c1ccccc1 ZINC000616482781 567249414 /nfs/dbraw/zinc/24/94/14/567249414.db2.gz ZIDHEGYTQVAWNR-WBVHZDCISA-N 0 3 388.309 3.228 10 0 GGAEHN CN1CCC[C@H](NC(=O)Nc2cc(Cl)ccc2I)C1 ZINC000590841933 567251906 /nfs/dbraw/zinc/25/19/06/567251906.db2.gz RJOHBVZIHRHYPW-JTQLQIEISA-N 0 3 393.656 3.160 10 0 GGAEHN O=S(=O)(NC[C@@H]1CN(Cc2ccccc2)CC12CCC2)c1ccsc1 ZINC000660055325 567252140 /nfs/dbraw/zinc/25/21/40/567252140.db2.gz BVYHTBVGHYKNHI-QGZVFWFLSA-N 0 3 376.547 3.329 10 0 GGAEHN O=C(NC[C@H]1CCCCN1CCO)Nc1cccc(Cl)c1Br ZINC000455261555 567254206 /nfs/dbraw/zinc/25/42/06/567254206.db2.gz WESQZYMRDGGXSG-LLVKDONJSA-N 0 3 390.709 3.071 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NC[C@H](C)N1CCCC[C@@H]1C ZINC000525657164 567256818 /nfs/dbraw/zinc/25/68/18/567256818.db2.gz KYWJHDHOXKWIDP-KBPBESRZSA-N 0 3 383.330 3.379 10 0 GGAEHN C/C(=C/c1cccc(C(F)(F)F)c1)CN1CCC[C@H](CS(N)(=O)=O)C1 ZINC000567546307 567256919 /nfs/dbraw/zinc/25/69/19/567256919.db2.gz IWWHCGUUWUVEHI-ODDCISTRSA-N 0 3 376.444 3.109 10 0 GGAEHN CCOC(=O)CC[N@H+](Cc1cc(Br)c([O-])c(OCC)c1)C1CC1 ZINC000590951616 567257773 /nfs/dbraw/zinc/25/77/73/567257773.db2.gz KLJLIHSQWKSIDI-UHFFFAOYSA-N 0 3 386.286 3.471 10 0 GGAEHN CCOC(=O)CC[N@@H+](Cc1cc(Br)c([O-])c(OCC)c1)C1CC1 ZINC000590951616 567257779 /nfs/dbraw/zinc/25/77/79/567257779.db2.gz KLJLIHSQWKSIDI-UHFFFAOYSA-N 0 3 386.286 3.471 10 0 GGAEHN O=C(NCc1cc(F)cc(Br)c1)NC[C@H]1CCCCN1C1CC1 ZINC000433560663 567258040 /nfs/dbraw/zinc/25/80/40/567258040.db2.gz MRBVAZBWKFRNOM-MRXNPFEDSA-N 0 3 384.293 3.404 10 0 GGAEHN O=C(NCc1cc(F)cc(Br)c1)NC[C@@H]1CCCCN1C1CC1 ZINC000433560661 567258597 /nfs/dbraw/zinc/25/85/97/567258597.db2.gz MRBVAZBWKFRNOM-INIZCTEOSA-N 0 3 384.293 3.404 10 0 GGAEHN C[C@@H](C(=O)N[C@@](C)(CO)c1ccc(Br)cc1)N1CCCCCC1 ZINC000616832158 567260782 /nfs/dbraw/zinc/26/07/82/567260782.db2.gz RFPAEVOBZNTRGE-KSSFIOAISA-N 0 3 383.330 3.037 10 0 GGAEHN CCCN(CCN1CCCCCC1)C(=O)c1cc[nH]c(=O)c1Br ZINC000685202192 567261206 /nfs/dbraw/zinc/26/12/06/567261206.db2.gz PDINGYPLIMMGDL-UHFFFAOYSA-N 0 3 384.318 3.278 10 0 GGAEHN N[C@@H](C(=O)Nc1nnc(-c2c(Cl)cccc2Cl)s1)C1CCOCC1 ZINC000638654201 567262228 /nfs/dbraw/zinc/26/22/28/567262228.db2.gz KNBLNECRMGGIHB-GFCCVEGCSA-N 0 3 387.292 3.204 10 0 GGAEHN C[C@@H]1CN(CCCCNc2nc(C3CC3)ncc2Br)C[C@H](C)O1 ZINC000685272348 567265495 /nfs/dbraw/zinc/26/54/95/567265495.db2.gz HZRDJZCOPBTLKU-BETUJISGSA-N 0 3 383.334 3.418 10 0 GGAEHN CC[C@@H]1CCCCN1CCNC(=O)c1[nH]nc2ccc(Br)cc21 ZINC000499697902 567265883 /nfs/dbraw/zinc/26/58/83/567265883.db2.gz KGHWWRZFYXQUCQ-CYBMUJFWSA-N 0 3 379.302 3.320 10 0 GGAEHN CN(Cc1ccccc1Br)C(=O)CN1CCC[C@@]2(CCCOC2)C1 ZINC000475731214 567271639 /nfs/dbraw/zinc/27/16/39/567271639.db2.gz NGLPZYZKYNVXRE-LJQANCHMSA-N 0 3 395.341 3.300 10 0 GGAEHN O=C(NC[C@@H]1CCCN1CCCO)Nc1cc(Cl)ccc1C(F)(F)F ZINC000455411531 567272569 /nfs/dbraw/zinc/27/25/69/567272569.db2.gz PCBLENULNVDPCJ-LBPRGKRZSA-N 0 3 379.810 3.327 10 0 GGAEHN O=C(NC[C@H]1CCCN1CCCO)Nc1cc(Cl)ccc1C(F)(F)F ZINC000455411530 567272733 /nfs/dbraw/zinc/27/27/33/567272733.db2.gz PCBLENULNVDPCJ-GFCCVEGCSA-N 0 3 379.810 3.327 10 0 GGAEHN CN1CC[C@H](N[C@@H](CO)CC(F)(F)F)C[C@H]1c1ccc(Br)cc1 ZINC000638833308 567274526 /nfs/dbraw/zinc/27/45/26/567274526.db2.gz VDAYVQITXKYWEU-ZNMIVQPWSA-N 0 3 395.263 3.487 10 0 GGAEHN C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000617017264 567274796 /nfs/dbraw/zinc/27/47/96/567274796.db2.gz VUPVJUXHSPSNPF-NEPJUHHUSA-N 0 3 386.323 3.101 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)Cc1noc2ccc(Br)cc21 ZINC000617005989 567275454 /nfs/dbraw/zinc/27/54/54/567275454.db2.gz SGKLSCHGAXZPLU-GFCCVEGCSA-N 0 3 380.286 3.122 10 0 GGAEHN COc1ccc(Br)cc1C1(C(=O)NC[C@H]2CCN2C(C)(C)C)CC1 ZINC000617005301 567275498 /nfs/dbraw/zinc/27/54/98/567275498.db2.gz FNUCUUQALMAKFG-CQSZACIVSA-N 0 3 395.341 3.478 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O ZINC000617019720 567275815 /nfs/dbraw/zinc/27/58/15/567275815.db2.gz QQELNAYMIKENJQ-DOMZBBRYSA-N 0 3 381.929 3.132 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)c1cnn(-c2ccc(Br)cc2)c1 ZINC000617016053 567275992 /nfs/dbraw/zinc/27/59/92/567275992.db2.gz BPDWNGVYRVUFNA-MRXNPFEDSA-N 0 3 391.313 3.237 10 0 GGAEHN Cc1nc2ccc(Br)cn2c1C(=O)NC[C@H]1CCN1C(C)(C)C ZINC000617008429 567276014 /nfs/dbraw/zinc/27/60/14/567276014.db2.gz GYZKHLDKJOPDBZ-CYBMUJFWSA-N 0 3 379.302 3.008 10 0 GGAEHN COc1ccc(CCC(=O)NC[C@@H]2CCN2C(C)(C)C)cc1Br ZINC000617019205 567276286 /nfs/dbraw/zinc/27/62/86/567276286.db2.gz GOYZIXMLXZDAEO-AWEZNQCLSA-N 0 3 383.330 3.379 10 0 GGAEHN CC(C)(C)N1CC[C@H]1CNC(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000617006221 567276335 /nfs/dbraw/zinc/27/63/35/567276335.db2.gz YFXMNXBHCHTTIK-KBPBESRZSA-N 0 3 381.314 3.304 10 0 GGAEHN CCC[NH+]1CCC(C[N-]S(=O)(=O)c2cc(C)c(Br)s2)CC1 ZINC000433837715 567277040 /nfs/dbraw/zinc/27/70/40/567277040.db2.gz VNNWJRYLABRLKO-UHFFFAOYSA-N 0 3 395.388 3.219 10 0 GGAEHN NC(=O)C[C@@H]1CCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000685475004 567277449 /nfs/dbraw/zinc/27/74/49/567277449.db2.gz YARUVQJWPCFZKR-NSHDSACASA-N 0 3 380.311 3.270 10 0 GGAEHN Cc1nc2ccc(S(=O)(=O)NC[C@H]3CCCN(CC4CC4)C3)cc2s1 ZINC000660180840 567277455 /nfs/dbraw/zinc/27/74/55/567277455.db2.gz XAXILIWKCLHFKA-OAHLLOKOSA-N 0 3 379.551 3.005 10 0 GGAEHN C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)Cc1c(F)ccc(Br)c1F ZINC000499880284 567279461 /nfs/dbraw/zinc/27/94/61/567279461.db2.gz OOOJAIZTONVVHA-HZMBPMFUSA-N 0 3 375.257 3.068 10 0 GGAEHN C[C@H]1CN(C)CC[C@H]1N(C)C(=O)Cc1c(F)ccc(Br)c1F ZINC000499880292 567279478 /nfs/dbraw/zinc/27/94/78/567279478.db2.gz OOOJAIZTONVVHA-IINYFYTJSA-N 0 3 375.257 3.068 10 0 GGAEHN CCN1C[C@@H](C)N(c2nnc(-c3ccccc3Br)n2C)C[C@@H]1C ZINC000685509592 567279802 /nfs/dbraw/zinc/27/98/02/567279802.db2.gz YOSYAJVPWHEWLT-QWHCGFSZSA-N 0 3 378.318 3.164 10 0 GGAEHN COC(=O)CC1(NCC(=O)Nc2ccc(C)cc2Br)CCCC1 ZINC000548099665 567280101 /nfs/dbraw/zinc/28/01/01/567280101.db2.gz ZFHFRBAIVGLOAQ-UHFFFAOYSA-N 0 3 383.286 3.162 10 0 GGAEHN COC(=O)CC1(NCc2nc3ccc(Br)cc3n2C)CCCC1 ZINC000548099637 567280447 /nfs/dbraw/zinc/28/04/47/567280447.db2.gz NMCRHUDSQRHUBO-UHFFFAOYSA-N 0 3 380.286 3.301 10 0 GGAEHN CCCN1CCC[C@H]1C(=O)N1CCO[C@H](c2ccc(F)c(Br)c2)C1 ZINC000475832289 567280517 /nfs/dbraw/zinc/28/05/17/567280517.db2.gz AIKCTSCRBXMIHB-IRXDYDNUSA-N 0 3 399.304 3.363 10 0 GGAEHN Cc1cc(Br)ccc1CNC[C@H]1CS(=O)(=O)c2ccccc2O1 ZINC000567854017 567282825 /nfs/dbraw/zinc/28/28/25/567282825.db2.gz WLJDNHWZODJKGA-HNNXBMFYSA-N 0 3 396.306 3.082 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)N(C)Cc1ccc(Br)cc1C ZINC000433926905 567283660 /nfs/dbraw/zinc/28/36/60/567283660.db2.gz OFJFUDIDPVTYQE-KRWDZBQOSA-N 0 3 398.345 3.010 10 0 GGAEHN Cc1cc(Br)ccc1CN(C)C(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C ZINC000433926107 567284197 /nfs/dbraw/zinc/28/41/97/567284197.db2.gz JIIZJBISODTDSS-SUMWQHHRSA-N 0 3 380.330 3.382 10 0 GGAEHN CC(C)[C@](C)(CO)NCC(=O)Nc1ccc(Br)c(C(F)(F)F)c1 ZINC000685598517 567285396 /nfs/dbraw/zinc/28/53/96/567285396.db2.gz CEXZFGDCBNIBBT-AWEZNQCLSA-N 0 3 397.235 3.403 10 0 GGAEHN CN(C)Cc1ccccc1CNC(=O)c1cc(Br)cc2[nH]cnc21 ZINC000499972811 567286999 /nfs/dbraw/zinc/28/69/99/567286999.db2.gz AJYZMWQNBZJUQZ-UHFFFAOYSA-N 0 3 387.281 3.317 10 0 GGAEHN COc1ccc(C(=O)N2C[C@H](SC)[C@@H](N3CCCC3)C2)c(Br)c1 ZINC000548188280 567287160 /nfs/dbraw/zinc/28/71/60/567287160.db2.gz CGZMSRKXTWQKKU-HOTGVXAUSA-N 0 3 399.354 3.110 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)CCOc1ccccc1Br ZINC000567926615 567289907 /nfs/dbraw/zinc/28/99/07/567289907.db2.gz MBGWXGAPQPQDDK-QGZVFWFLSA-N 0 3 389.293 3.303 10 0 GGAEHN NC(=O)Cc1ccc(CN[C@@H]2CCCOc3ccc(Br)cc32)cc1 ZINC000685656622 567290150 /nfs/dbraw/zinc/29/01/50/567290150.db2.gz XEFUPAHRXIBNAS-QGZVFWFLSA-N 0 3 389.293 3.480 10 0 GGAEHN Cc1ccc([C@H](CNC(=O)Nc2ccnc(C)c2Br)N(C)C)cc1 ZINC000526094976 567291067 /nfs/dbraw/zinc/29/10/67/567291067.db2.gz POCOZAYSLGAGPJ-INIZCTEOSA-N 0 3 391.313 3.307 10 0 GGAEHN CN(C)CCOC1CCN(C(=O)[C@@H]2CCc3cc(Br)ccc32)CC1 ZINC000567938825 567292127 /nfs/dbraw/zinc/29/21/27/567292127.db2.gz JISFSNUONZDGAX-GOSISDBHSA-N 0 3 395.341 3.048 10 0 GGAEHN COCCN(Cc1cc(Br)cs1)C[C@@H](OC)[C@@H]1CCOC1 ZINC000660411642 567292345 /nfs/dbraw/zinc/29/23/45/567292345.db2.gz SKRCDTJRSHITPC-IUODEOHRSA-N 0 3 378.332 3.011 10 0 GGAEHN Cc1cc(Br)cc(C)c1CNC(=O)Nc1ccnn1CCN(C)C ZINC000455670174 567294064 /nfs/dbraw/zinc/29/40/64/567294064.db2.gz QIKMIMGEOQPNQG-UHFFFAOYSA-N 0 3 394.317 3.146 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(Br)cc1 ZINC000617288666 567295814 /nfs/dbraw/zinc/29/58/14/567295814.db2.gz QGYODHKKAIRXIZ-GOSISDBHSA-N 0 3 375.310 3.281 10 0 GGAEHN CN(CCNS(=O)(=O)Cc1ccccc1C(F)(F)F)C1CCCCC1 ZINC000500069215 567296520 /nfs/dbraw/zinc/29/65/20/567296520.db2.gz WRVMBBTUPLFHBS-UHFFFAOYSA-N 0 3 378.460 3.389 10 0 GGAEHN CN(C)CCOc1ccc(CNC(=O)c2cccc(F)c2Br)cc1 ZINC000568002573 567296737 /nfs/dbraw/zinc/29/67/37/567296737.db2.gz GHOARYVCMIZYOU-UHFFFAOYSA-N 0 3 395.272 3.459 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)c1ccc(Br)cc1F ZINC000617290041 567297655 /nfs/dbraw/zinc/29/76/55/567297655.db2.gz VMPVFUYJYUQXHM-HNNXBMFYSA-N 0 3 379.273 3.491 10 0 GGAEHN CN(C)C[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(F)c(Br)c1 ZINC000617292187 567297805 /nfs/dbraw/zinc/29/78/05/567297805.db2.gz XVCWMKKHBJWHOD-MRXNPFEDSA-N 0 3 393.300 3.420 10 0 GGAEHN Brc1cnc2c(CNC[C@@H]3C[C@H](c4ccccc4)CO3)cnn2c1 ZINC000639317931 567300534 /nfs/dbraw/zinc/30/05/34/567300534.db2.gz PBVFLVRGMCAIMB-YOEHRIQHSA-N 0 3 387.281 3.154 10 0 GGAEHN CN(C(=O)NCCc1ccc(F)c(Br)c1)[C@H]1CCN(C2CC2)C1 ZINC000476142923 567300523 /nfs/dbraw/zinc/30/05/23/567300523.db2.gz IFVCMDHUOSWHSA-AWEZNQCLSA-N 0 3 384.293 3.009 10 0 GGAEHN CC(C)(C)N1CC[C@H](NC(=O)c2cc(=O)[nH]c3ccc(Br)cc32)C1 ZINC000617349924 567300708 /nfs/dbraw/zinc/30/07/08/567300708.db2.gz ZEBDZTQVURGSAV-LBPRGKRZSA-N 0 3 392.297 3.306 10 0 GGAEHN CCc1ccc([C@@H](CNC(=O)c2cc[nH]c(=O)c2Br)N(C)C)cc1 ZINC000434328088 567303336 /nfs/dbraw/zinc/30/33/36/567303336.db2.gz UEJLHDSCDQRPFQ-OAHLLOKOSA-N 0 3 392.297 3.145 10 0 GGAEHN CC[C@H](NC[C@H](O)COC[C@@H]1CCCO1)c1cc(F)cc(Br)c1 ZINC000548275285 567303800 /nfs/dbraw/zinc/30/38/00/567303800.db2.gz AFOFNPHOPKKNKM-ULQDDVLXSA-N 0 3 390.293 3.185 10 0 GGAEHN CS(=O)(=O)N1CCC[C@@H](CN2CCC(F)(c3ccc(Cl)cc3)CC2)C1 ZINC000500172416 567304980 /nfs/dbraw/zinc/30/49/80/567304980.db2.gz ZSPCNNLTGVMKAK-HNNXBMFYSA-N 0 3 388.936 3.272 10 0 GGAEHN CS(=O)(=O)[C@@H]1CCC[C@H](N[C@H]2CCCc3ncc(C(F)(F)F)cc32)C1 ZINC000548306286 567305940 /nfs/dbraw/zinc/30/59/40/567305940.db2.gz IOJKALJIWUQETC-ZENOOKHLSA-N 0 3 376.444 3.423 10 0 GGAEHN CCN1CCN(CCC(=O)N2CCc3cc(Cl)cc(Cl)c3[C@H]2C)CC1 ZINC000434366798 567306479 /nfs/dbraw/zinc/30/64/79/567306479.db2.gz KSQUMGYUNKZPTL-CQSZACIVSA-N 0 3 384.351 3.467 10 0 GGAEHN CCN1CCN(CCC(=O)N2CCc3cc(Cl)cc(Cl)c3[C@@H]2C)CC1 ZINC000434366797 567306905 /nfs/dbraw/zinc/30/69/05/567306905.db2.gz KSQUMGYUNKZPTL-AWEZNQCLSA-N 0 3 384.351 3.467 10 0 GGAEHN CN(C)[C@]1(CNC(=O)c2cc(F)c(Br)cc2Cl)CCSC1 ZINC000476238755 567307210 /nfs/dbraw/zinc/30/72/10/567307210.db2.gz ZQQBEHRZDXIXJS-AWEZNQCLSA-N 0 3 395.725 3.409 10 0 GGAEHN CCN1CCC[C@H](NC(=O)COc2ccc(Br)cc2Cl)C1 ZINC000617450476 567311133 /nfs/dbraw/zinc/31/11/33/567311133.db2.gz VUFAWGMVHZHWQQ-LBPRGKRZSA-N 0 3 375.694 3.082 10 0 GGAEHN C[C@H](NCCO[C@H]1CC1(F)F)c1ccc(Br)cc1OCCCO ZINC000660597495 567311959 /nfs/dbraw/zinc/31/19/59/567311959.db2.gz RLCKDLHICSQPQR-NHYWBVRUSA-N 0 3 394.256 3.285 10 0 GGAEHN O[C@H](COc1ccc(Br)cc1)CN1CCC[C@H](c2ccccn2)C1 ZINC000660628392 567312942 /nfs/dbraw/zinc/31/29/42/567312942.db2.gz LRMGTOKFSIRHGV-RDJZCZTQSA-N 0 3 391.309 3.463 10 0 GGAEHN Cc1nccc(NC(=O)N2CCN(C3CCCCC3)CC2)c1Br ZINC000527089031 567312953 /nfs/dbraw/zinc/31/29/53/567312953.db2.gz ALFNVUZFNAROOP-UHFFFAOYSA-N 0 3 381.318 3.057 10 0 GGAEHN O[C@H](COc1ccc(Br)cc1)CN1CCC[C@@H](c2ccccn2)C1 ZINC000660628393 567313281 /nfs/dbraw/zinc/31/32/81/567313281.db2.gz LRMGTOKFSIRHGV-WBVHZDCISA-N 0 3 391.309 3.463 10 0 GGAEHN CCO[C@@H]1C[C@@H](NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)cc2)[C@@H]1SC ZINC000592085306 567313472 /nfs/dbraw/zinc/31/34/72/567313472.db2.gz BJYIASNTULKNOU-TWMKSMIVSA-N 0 3 385.961 3.151 10 0 GGAEHN Cn1cc([C@H](NCCOc2ccc(Br)cc2)C2(CO)CCC2)cn1 ZINC000660607564 567313526 /nfs/dbraw/zinc/31/35/26/567313526.db2.gz XUVVWJFVFIOOAV-KRWDZBQOSA-N 0 3 394.313 3.055 10 0 GGAEHN COc1ccc([C@H](C)NC(=O)N(C)[C@@H]2CCN(C3CC3)C2)cc1Br ZINC000476326346 567314457 /nfs/dbraw/zinc/31/44/57/567314457.db2.gz VFCLQOCHQBMMDO-SWLSCSKDSA-N 0 3 396.329 3.397 10 0 GGAEHN COC(=O)CC1(NCC(=O)Nc2ccc(Br)c(C)c2)CCCC1 ZINC000548426814 567314796 /nfs/dbraw/zinc/31/47/96/567314796.db2.gz MRHWLBWWKOUNPE-UHFFFAOYSA-N 0 3 383.286 3.162 10 0 GGAEHN CCOC(=O)CC1(NCC(=O)Nc2ccc(Br)cc2)CCCC1 ZINC000434620368 567315663 /nfs/dbraw/zinc/31/56/63/567315663.db2.gz XSMOWICNNAOILZ-UHFFFAOYSA-N 0 3 383.286 3.243 10 0 GGAEHN O=C(CNC1(CCO)CCCC1)Nc1ccc(Br)cc1Cl ZINC000660681913 567318799 /nfs/dbraw/zinc/31/87/99/567318799.db2.gz XSOIEXDAHSVXCG-UHFFFAOYSA-N 0 3 375.694 3.326 10 0 GGAEHN CCC[NH+]1CCC(C[N-]S(=O)(=O)c2csc(-c3ccccc3)n2)CC1 ZINC000500415000 567318918 /nfs/dbraw/zinc/31/89/18/567318918.db2.gz ISKCYBAWJGFSOZ-UHFFFAOYSA-N 0 3 379.551 3.210 10 0 GGAEHN CCN(C(=O)[C@@H](CCOC)Cc1cccc(Br)c1)[C@H]1CCN(C)C1 ZINC000617555040 567321072 /nfs/dbraw/zinc/32/10/72/567321072.db2.gz OYWUGYQGSVULSK-WMZOPIPTSA-N 0 3 397.357 3.197 10 0 GGAEHN CCN(C(=O)c1cc(Br)cc(Br)c1)[C@H]1CCN(C)C1 ZINC000617552171 567321761 /nfs/dbraw/zinc/32/17/61/567321761.db2.gz IJOSDHLFBZCZNG-ZDUSSCGKSA-N 0 3 390.119 3.378 10 0 GGAEHN CCN(C(=O)CCSc1ncnc2sc(C)c(C)c21)[C@@H]1CCN(C)C1 ZINC000617557645 567321831 /nfs/dbraw/zinc/32/18/31/567321831.db2.gz POPPXBAVAARBLV-CQSZACIVSA-N 0 3 378.567 3.343 10 0 GGAEHN CCN(C(=O)c1cc(Br)cc(N2CCCC2)c1)[C@H]1CCN(C)C1 ZINC000617562716 567323864 /nfs/dbraw/zinc/32/38/64/567323864.db2.gz VOAQDRRGOISFDN-INIZCTEOSA-N 0 3 380.330 3.216 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N(CC)[C@@H]2CCN(C)C2)cc1OC ZINC000617560421 567324097 /nfs/dbraw/zinc/32/40/97/567324097.db2.gz ORCQBBSNOUNPFU-CYBMUJFWSA-N 0 3 385.302 3.023 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@@H]1N(C)C ZINC000476456834 567324963 /nfs/dbraw/zinc/32/49/63/567324963.db2.gz JCTBFTPRLKYAEU-QWHCGFSZSA-N 0 3 395.725 3.359 10 0 GGAEHN CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NCc1cc(C(F)(F)F)ccc1Cl ZINC000500476075 567326216 /nfs/dbraw/zinc/32/62/16/567326216.db2.gz QPWYUCAPIUQJCO-HZMBPMFUSA-N 0 3 384.851 3.166 10 0 GGAEHN CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NCc1ccc(-c2ccccc2Cl)o1 ZINC000500501044 567327277 /nfs/dbraw/zinc/32/72/77/567327277.db2.gz SUHLTUVIELSQCH-GUYCJALGSA-N 0 3 382.913 3.408 10 0 GGAEHN CS(=O)(=O)NC[C@H]1CCC[C@@H]1NCc1ccc(-c2ccccc2Cl)o1 ZINC000500501043 567327994 /nfs/dbraw/zinc/32/79/94/567327994.db2.gz SUHLTUVIELSQCH-DYVFJYSZSA-N 0 3 382.913 3.408 10 0 GGAEHN CN1CCC[C@H](CNC(=O)N[C@@H]2CSCc3ccc(Br)cc32)C1 ZINC000660847079 567329005 /nfs/dbraw/zinc/32/90/05/567329005.db2.gz NEDFAKMRTFBRBR-MLGOLLRUSA-N 0 3 398.370 3.378 10 0 GGAEHN Cc1ccc2c(c1Br)CN(C(=O)NC[C@]1(N(C)C)CCSC1)C2 ZINC000660824431 567329024 /nfs/dbraw/zinc/32/90/24/567329024.db2.gz NOSGJUVFVIBSGV-QGZVFWFLSA-N 0 3 398.370 3.220 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)c1ccc(Cl)c(Cl)c1 ZINC000617696080 567329345 /nfs/dbraw/zinc/32/93/45/567329345.db2.gz BDHZOJRZNPKOPV-INIZCTEOSA-N 0 3 379.287 3.490 10 0 GGAEHN Cc1cc(Br)c(CNC(=O)NC[C@]2(N(C)C)CCSC2)s1 ZINC000660825496 567329223 /nfs/dbraw/zinc/32/92/23/567329223.db2.gz UZTXDSALAGLTFC-CQSZACIVSA-N 0 3 392.388 3.056 10 0 GGAEHN C[C@@H]1CN(CCCCNC(=O)COc2ccc(Cl)c(Cl)c2)C[C@H](C)O1 ZINC000434786479 567329353 /nfs/dbraw/zinc/32/93/53/567329353.db2.gz OVIITYHLRDMWDO-OKILXGFUSA-N 0 3 389.323 3.378 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)c1cscc1Br ZINC000617705618 567329551 /nfs/dbraw/zinc/32/95/51/567329551.db2.gz ZSSFPOYOASPLLW-AWEZNQCLSA-N 0 3 395.322 3.007 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)c1sccc1Br ZINC000617700008 567329593 /nfs/dbraw/zinc/32/95/93/567329593.db2.gz YLRULIYHDISPPT-AWEZNQCLSA-N 0 3 395.322 3.007 10 0 GGAEHN O=C(N[C@@H]1CCN(C2CC2)C1)N[C@H]1CSCc2ccc(Br)cc21 ZINC000660840923 567330031 /nfs/dbraw/zinc/33/00/31/567330031.db2.gz NELQBZONSBJYKX-CJNGLKHVSA-N 0 3 396.354 3.273 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1ccc(Br)s1 ZINC000617697900 567330224 /nfs/dbraw/zinc/33/02/24/567330224.db2.gz JPGRFNLZXHUECJ-CQSZACIVSA-N 0 3 395.322 3.007 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1cscc1Br ZINC000617705619 567330241 /nfs/dbraw/zinc/33/02/41/567330241.db2.gz ZSSFPOYOASPLLW-CQSZACIVSA-N 0 3 395.322 3.007 10 0 GGAEHN O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1cc(Cl)cc(Cl)c1 ZINC000617696834 567330269 /nfs/dbraw/zinc/33/02/69/567330269.db2.gz PIAKYOAUPRELAM-GOSISDBHSA-N 0 3 379.287 3.490 10 0 GGAEHN OCc1ccc(CN2CC[C@@H](Cc3cccc(I)c3)C2)o1 ZINC000568473143 567332135 /nfs/dbraw/zinc/33/21/35/567332135.db2.gz IOCWCARLIQNEKB-AWEZNQCLSA-N 0 3 397.256 3.441 10 0 GGAEHN COc1ncncc1CN[C@H](C)CCc1ccc(I)cc1 ZINC000592367494 567333439 /nfs/dbraw/zinc/33/34/39/567333439.db2.gz YPXBMHSFQADPOP-GFCCVEGCSA-N 0 3 397.260 3.201 10 0 GGAEHN C[C@H](NCC(C)(C)[C@]1(O)CCOC1)c1ccccc1I ZINC000592398113 567334971 /nfs/dbraw/zinc/33/49/71/567334971.db2.gz OQJUNPYYFCKSRA-LRDDRELGSA-N 0 3 389.277 3.119 10 0 GGAEHN O=C(CCN1C[C@@H](CO)[C@H](C(F)(F)F)C1)Nc1c(Cl)cccc1Cl ZINC000640053857 567339033 /nfs/dbraw/zinc/33/90/33/567339033.db2.gz JMFHKHKAWQWRJI-VHSXEESVSA-N 0 3 385.213 3.425 10 0 GGAEHN CC(C)[C@H]1CCC[C@H](NCc2ccc(S(=O)(=O)N3CCOCC3)s2)C1 ZINC000527523603 567342465 /nfs/dbraw/zinc/34/24/65/567342465.db2.gz NFJPMMPNKVNDPU-HOTGVXAUSA-N 0 3 386.583 3.073 10 0 GGAEHN CC(C)[C@@H]1CCC[C@@H](NCc2ccc(S(=O)(=O)N3CCOCC3)s2)C1 ZINC000527523604 567343222 /nfs/dbraw/zinc/34/32/22/567343222.db2.gz NFJPMMPNKVNDPU-HZPDHXFCSA-N 0 3 386.583 3.073 10 0 GGAEHN CC(C)[C@H]1CCC[C@@H](NCc2ccc(S(=O)(=O)N3CCOCC3)s2)C1 ZINC000527523605 567343275 /nfs/dbraw/zinc/34/32/75/567343275.db2.gz NFJPMMPNKVNDPU-JKSUJKDBSA-N 0 3 386.583 3.073 10 0 GGAEHN CCCN1CC[C@H](NC(=O)N[C@H](C)c2ccc(Br)cc2OC)C1 ZINC000661058697 567343667 /nfs/dbraw/zinc/34/36/67/567343667.db2.gz QOVWONRKBHZLIH-OCCSQVGLSA-N 0 3 384.318 3.302 10 0 GGAEHN CC(C)[C@H](NCc1ncc(I)s1)C1(CO)CC=CC1 ZINC000592526480 567344387 /nfs/dbraw/zinc/34/43/87/567344387.db2.gz AHQGCKKBSRPYAF-ZDUSSCGKSA-N 0 3 392.306 3.191 10 0 GGAEHN COC(=O)CC1(NCc2cc(OC)c(OC)cc2Br)CCCC1 ZINC000548755465 567346148 /nfs/dbraw/zinc/34/61/48/567346148.db2.gz OVIXLJWTLRZFPW-UHFFFAOYSA-N 0 3 386.286 3.432 10 0 GGAEHN CCN(C(=O)[C@H](C)NC(=O)c1cccc(Cl)c1Cl)[C@@H]1CCN(CC)C1 ZINC000617930681 567346546 /nfs/dbraw/zinc/34/65/46/567346546.db2.gz GEMQGZUQZCWKPK-QWHCGFSZSA-N 0 3 386.323 3.054 10 0 GGAEHN CCN(C(=O)c1cc(=O)[nH]c2c(Br)cccc12)[C@@H]1CCN(CC)C1 ZINC000617928180 567346792 /nfs/dbraw/zinc/34/67/92/567346792.db2.gz KSTKTGLGYRUPGN-GFCCVEGCSA-N 0 3 392.297 3.259 10 0 GGAEHN CCN(C(=O)c1cnn(-c2ccc(Br)cc2)c1)[C@H]1CCN(CC)C1 ZINC000617931437 567347118 /nfs/dbraw/zinc/34/71/18/567347118.db2.gz XDEXBJVQTLDFBK-KRWDZBQOSA-N 0 3 391.313 3.191 10 0 GGAEHN CCOc1c(Br)cc(C(=O)N(CC)[C@@H]2CCN(CC)C2)cc1OC ZINC000617933049 567347391 /nfs/dbraw/zinc/34/73/91/567347391.db2.gz FAMVHGFGKTWHTP-CQSZACIVSA-N 0 3 399.329 3.413 10 0 GGAEHN CCN(CC)CCN(CCC(F)(F)F)S(=O)(=O)c1nc(C)c(C)s1 ZINC000435212227 567347623 /nfs/dbraw/zinc/34/76/23/567347623.db2.gz ZQYFQIZJXZWLOE-UHFFFAOYSA-N 0 3 387.493 3.045 10 0 GGAEHN O=C(Cc1c(F)ccc(Br)c1F)N1CC[C@@H](N2CCCCC2)C1 ZINC000500826539 567347835 /nfs/dbraw/zinc/34/78/35/567347835.db2.gz YZZHIGYKCFAYFY-GFCCVEGCSA-N 0 3 387.268 3.357 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000661127149 567349363 /nfs/dbraw/zinc/34/93/63/567349363.db2.gz IHLNJXLJROADHE-IUODEOHRSA-N 0 3 396.329 3.445 10 0 GGAEHN CCCN1CC[C@@H](NC(=O)N[C@@H]2CCOc3c(Br)cccc32)C1 ZINC000661127119 567349766 /nfs/dbraw/zinc/34/97/66/567349766.db2.gz HZCARYODKYNEQN-IUODEOHRSA-N 0 3 382.302 3.056 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000661127147 567350214 /nfs/dbraw/zinc/35/02/14/567350214.db2.gz IHLNJXLJROADHE-DOMZBBRYSA-N 0 3 396.329 3.445 10 0 GGAEHN CCO[C@H]1C[C@](N)(C(=O)N2CCc3ccc(F)c(Br)c3C2)C1(C)C ZINC000527617850 567350403 /nfs/dbraw/zinc/35/04/03/567350403.db2.gz RTISXANZGHQWDT-KSSFIOAISA-N 0 3 399.304 3.005 10 0 GGAEHN O=C([C@H]1CNCc2ccccc21)N1CCc2ccc(F)c(Br)c2C1 ZINC000527616747 567350915 /nfs/dbraw/zinc/35/09/15/567350915.db2.gz NUXVYXANDZYUOY-HNNXBMFYSA-N 0 3 389.268 3.360 10 0 GGAEHN C[C@@H](NCCn1cc(Br)ccc1=O)c1cnn(C2CCCC2)c1 ZINC000568721840 567350956 /nfs/dbraw/zinc/35/09/56/567350956.db2.gz OHALAEQNWVMHGI-CYBMUJFWSA-N 0 3 379.302 3.273 10 0 GGAEHN COC[C@@H](NCC(=O)N[C@H](C)c1ccc(Cl)c(Cl)c1)C1CCOCC1 ZINC000661161082 567352679 /nfs/dbraw/zinc/35/26/79/567352679.db2.gz QTFCPYKNIRSQCS-SJKOYZFVSA-N 0 3 389.323 3.202 10 0 GGAEHN Cc1sc(NC(=O)CN[C@H](CO)C2CCC2)nc1-c1ccc(Cl)cc1 ZINC000661151134 567353350 /nfs/dbraw/zinc/35/33/50/567353350.db2.gz CQMGSZRXRLRVAI-OAHLLOKOSA-N 0 3 379.913 3.461 10 0 GGAEHN CC(=O)N1CCN(CCNCc2cc(Cl)c(OC(C)C)cc2Cl)CC1 ZINC000527639462 567354663 /nfs/dbraw/zinc/35/46/63/567354663.db2.gz DRTQXJCWFNTYDL-UHFFFAOYSA-N 0 3 388.339 3.034 10 0 GGAEHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1cc(Br)cc2[nH]cnc21 ZINC000548843748 567355466 /nfs/dbraw/zinc/35/54/66/567355466.db2.gz RTYCNHWRJWSJBG-OAHLLOKOSA-N 0 3 399.292 3.330 10 0 GGAEHN O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1cc(Br)cc2nc[nH]c21 ZINC000548843748 567355470 /nfs/dbraw/zinc/35/54/70/567355470.db2.gz RTYCNHWRJWSJBG-OAHLLOKOSA-N 0 3 399.292 3.330 10 0 GGAEHN CN(C)CCNC(=O)c1cccc(CNCc2ccsc2Br)c1 ZINC000527653619 567356917 /nfs/dbraw/zinc/35/69/17/567356917.db2.gz NUZSATNZAGVSIY-UHFFFAOYSA-N 0 3 396.354 3.092 10 0 GGAEHN CO[C@@H]1CCC[C@H]([C@@H](CO)NCC(=O)Nc2ccc(Cl)c(Cl)c2)C1 ZINC000661218246 567357188 /nfs/dbraw/zinc/35/71/88/567357188.db2.gz KVPGTZGZJLPJBO-NORZTCDRSA-N 0 3 375.296 3.088 10 0 GGAEHN CO[C@@H]1CCC[C@@H]([C@@H](CO)NCC(=O)Nc2ccc(Cl)cc2Cl)C1 ZINC000661219362 567357680 /nfs/dbraw/zinc/35/76/80/567357680.db2.gz NFJCCSXDZZCTDJ-AXAPSJFSSA-N 0 3 375.296 3.088 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)c1cc[nH]c(=O)c1Br)c1ccccc1 ZINC000435342473 567357794 /nfs/dbraw/zinc/35/77/94/567357794.db2.gz HGFNHBSKBSVKPD-OAHLLOKOSA-N 0 3 392.297 3.363 10 0 GGAEHN CO[C@@H]1CCC[C@H]([C@@H](CO)NCc2cc(Br)cc(F)c2F)C1 ZINC000661219557 567357972 /nfs/dbraw/zinc/35/79/72/567357972.db2.gz USJYIPNVHKWZOY-PSOPSSQASA-N 0 3 378.257 3.383 10 0 GGAEHN O=C(NC[C@H]1CCCCN1C1CC1)c1cc(Br)cc2[nH]cnc21 ZINC000548884145 567359016 /nfs/dbraw/zinc/35/90/16/567359016.db2.gz UYFZJZYAYUYBCL-CYBMUJFWSA-N 0 3 377.286 3.072 10 0 GGAEHN CO[C@@H]1CCC[C@H]([C@@H](CO)NCC(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000661221610 567358966 /nfs/dbraw/zinc/35/89/66/567358966.db2.gz WLRJPEVKUHRYAW-NORZTCDRSA-N 0 3 375.296 3.088 10 0 GGAEHN Cc1nn(C)c(CNc2cccc3c2OCC[C@H]3N(C)C)c1Br ZINC000568835400 567360838 /nfs/dbraw/zinc/36/08/38/567360838.db2.gz GJTSCHJWCLGLAF-CQSZACIVSA-N 0 3 379.302 3.488 10 0 GGAEHN O=S1(=O)CCC(CCNCc2ccc(Br)c(F)c2F)CC1 ZINC000527689323 567361723 /nfs/dbraw/zinc/36/17/23/567361723.db2.gz YXLJHZORTTVCNE-UHFFFAOYSA-N 0 3 382.270 3.032 10 0 GGAEHN CO[C@@]1(CNCc2cc(Br)c(C)cc2Br)CCOC1 ZINC000527691824 567363311 /nfs/dbraw/zinc/36/33/11/567363311.db2.gz LLLAKMLHJXWIOV-CQSZACIVSA-N 0 3 393.119 3.415 10 0 GGAEHN O[C@@H]1CCN(Cc2ccccc2CNCc2ccsc2Br)C1 ZINC000527691172 567363544 /nfs/dbraw/zinc/36/35/44/567363544.db2.gz LMJGMMFCSICWNZ-MRXNPFEDSA-N 0 3 381.339 3.367 10 0 GGAEHN Cc1cc(Br)c(CNC[C@@]2(O)CCO[C@@H]2C)cc1Br ZINC000527698917 567364217 /nfs/dbraw/zinc/36/42/17/567364217.db2.gz ATECWAIBWDTDGI-YGRLFVJLSA-N 0 3 393.119 3.150 10 0 GGAEHN O=C([C@@H]1CC[C@H](NCc2ncc(Br)cc2F)C1)N1CCCCC1 ZINC000527703093 567364626 /nfs/dbraw/zinc/36/46/26/567364626.db2.gz KJQKAKBHADRHPT-OCCSQVGLSA-N 0 3 384.293 3.254 10 0 GGAEHN OC[C@H](CNCc1c[nH]nc1-c1ccc(Br)s1)c1cccnc1 ZINC000527711375 567365860 /nfs/dbraw/zinc/36/58/60/567365860.db2.gz ZCPAYRFJYHRVCN-ZDUSSCGKSA-N 0 3 393.310 3.161 10 0 GGAEHN COc1ccc(Br)cc1CNC(=O)NC[C@H]1CCN1C1CCCC1 ZINC000527707949 567366396 /nfs/dbraw/zinc/36/63/96/567366396.db2.gz CXFIXZRUDVBKSA-MRXNPFEDSA-N 0 3 396.329 3.274 10 0 GGAEHN OC[C@@H](CNCc1c[nH]nc1-c1ccc(Br)s1)c1cccnc1 ZINC000527711374 567367190 /nfs/dbraw/zinc/36/71/90/567367190.db2.gz ZCPAYRFJYHRVCN-CYBMUJFWSA-N 0 3 393.310 3.161 10 0 GGAEHN CN(C)C[C@H](Cc1ccccc1)NC(=O)NCc1sccc1Br ZINC000549007573 567368102 /nfs/dbraw/zinc/36/81/02/567368102.db2.gz YROGEBZURXRFMG-AWEZNQCLSA-N 0 3 396.354 3.483 10 0 GGAEHN COc1cc(C[NH2+]C[C@@]2(C)COc3ccccc3O2)cc(Br)c1[O-] ZINC000527733356 567370196 /nfs/dbraw/zinc/37/01/96/567370196.db2.gz GGPYYTYXIXMVBD-SFHVURJKSA-N 0 3 394.265 3.483 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2c(Cl)cc(F)cc2Cl)[C@H](C)C1 ZINC000435443447 567370244 /nfs/dbraw/zinc/37/02/44/567370244.db2.gz NZDJSEWEVXQRRR-QMTHXVAHSA-N 0 3 383.316 3.483 10 0 GGAEHN CCN(Cc1ccccc1Br)C(=O)NC[C@@H]1CCCN1CCOC ZINC000477111699 567371740 /nfs/dbraw/zinc/37/17/40/567371740.db2.gz UKJNXVASHASLEG-INIZCTEOSA-N 0 3 398.345 3.091 10 0 GGAEHN O=C(NCc1ccc(F)cc1Br)NC[C@@H]1CCN1C1CCCC1 ZINC000527750864 567371805 /nfs/dbraw/zinc/37/18/05/567371805.db2.gz CKJHENGIKCEFNF-HNNXBMFYSA-N 0 3 384.293 3.404 10 0 GGAEHN Fc1ccc(I)c(F)c1CNCC[C@@H]1CCCOC1 ZINC000527741206 567371822 /nfs/dbraw/zinc/37/18/22/567371822.db2.gz YSWMRZVDUZXMBN-JTQLQIEISA-N 0 3 381.204 3.476 10 0 GGAEHN CS[C@@H]1CN(S(=O)(=O)c2cccc3ccccc32)C[C@@H]1N1CCCC1 ZINC000477129647 567372362 /nfs/dbraw/zinc/37/23/62/567372362.db2.gz WXQXZFSHWBRBCN-ZWKOTPCHSA-N 0 3 376.547 3.040 10 0 GGAEHN CN(C)CCNC(=O)c1ccc(NCc2ccc(Br)c(F)c2)cc1 ZINC000527767417 567373525 /nfs/dbraw/zinc/37/35/25/567373525.db2.gz RRDXFQGLHFUPBA-UHFFFAOYSA-N 0 3 394.288 3.492 10 0 GGAEHN COc1ccc(CN2CC[C@@H]2CNCc2ccc(Br)cn2)cc1 ZINC000527773269 567373573 /nfs/dbraw/zinc/37/35/73/567373573.db2.gz NGUITROIUGBBIB-QGZVFWFLSA-N 0 3 376.298 3.217 10 0 GGAEHN COc1ccc(CNC[C@@H]2c3ccccc3C(=O)N2C)cc1Br ZINC000527804952 567374833 /nfs/dbraw/zinc/37/48/33/567374833.db2.gz HBCRJEBQXCLSSD-MRXNPFEDSA-N 0 3 375.266 3.374 10 0 GGAEHN C[C@H]1C[C@@H](NC(=O)NCc2ccc(Br)c(F)c2F)CN1C1CC1 ZINC000527814329 567377222 /nfs/dbraw/zinc/37/72/22/567377222.db2.gz SWAZBYGVLHIFRY-GXSJLCMTSA-N 0 3 388.256 3.152 10 0 GGAEHN C[C@H](C(=O)N(C)Cc1ccc(Br)cc1)N1C[C@]2(C)COC[C@]2(C)C1 ZINC000661494606 567377262 /nfs/dbraw/zinc/37/72/62/567377262.db2.gz BILGWDMLJLCSCU-ZMYBRWDISA-N 0 3 395.341 3.154 10 0 GGAEHN Brc1ccccc1-n1cc(CNC[C@@H]2CCN2C2CCCC2)nn1 ZINC000527813528 567377279 /nfs/dbraw/zinc/37/72/79/567377279.db2.gz XKXMMDXAFFRZOZ-INIZCTEOSA-N 0 3 390.329 3.136 10 0 GGAEHN CC(C)(CNCC1=Cc2cc(Br)ccc2OC1)C(=O)N1CCCC1 ZINC000527812805 567377292 /nfs/dbraw/zinc/37/72/92/567377292.db2.gz WWRUBXQEPWWLNJ-UHFFFAOYSA-N 0 3 393.325 3.463 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)NC[C@H]1CCN1C1CCCC1 ZINC000527868583 567379961 /nfs/dbraw/zinc/37/99/61/567379961.db2.gz UOCRAAUEMNDCNS-MRXNPFEDSA-N 0 3 396.329 3.274 10 0 GGAEHN C[NH+](C)Cc1cccc(CNC(=O)Cc2ccc(Br)cc2[O-])c1 ZINC000477206992 567380308 /nfs/dbraw/zinc/38/03/08/567380308.db2.gz WVNMPRVODDPEKL-UHFFFAOYSA-N 0 3 377.282 3.075 10 0 GGAEHN C[C@H](CN[C@H](C)c1cc(F)c(Br)cc1F)CN1CCOCC1 ZINC000527861373 567380608 /nfs/dbraw/zinc/38/06/08/567380608.db2.gz DFUTZSMNOVQYOT-VXGBXAGGSA-N 0 3 377.273 3.346 10 0 GGAEHN Cc1cc(N2CCC[C@H](N3C[C@@H](C)C(O)[C@H](C)C3)C2=O)ccc1Br ZINC000661629522 567384516 /nfs/dbraw/zinc/38/45/16/567384516.db2.gz XQUKMOAIRSGGHH-CPUCHLNUSA-N 0 3 395.341 3.202 10 0 GGAEHN CC1CC[NH+](CCCCNC(=O)Cc2ccc(Br)cc2[O-])CC1 ZINC000477280495 567385456 /nfs/dbraw/zinc/38/54/56/567385456.db2.gz KZNIPVGYWMVAKM-UHFFFAOYSA-N 0 3 383.330 3.326 10 0 GGAEHN Cc1ccc(I)cc1C(=O)NCCN1CCCC[C@@H]1C ZINC000477304536 567386643 /nfs/dbraw/zinc/38/66/43/567386643.db2.gz CFXVFSZIYUJFSD-ZDUSSCGKSA-N 0 3 386.277 3.204 10 0 GGAEHN CN(C)[C@H](CNC(=O)Cc1ccc(Br)cc1O)c1ccccc1 ZINC000477288759 567387215 /nfs/dbraw/zinc/38/72/15/567387215.db2.gz CFTLGSDWXQCZRB-MRXNPFEDSA-N 0 3 377.282 3.116 10 0 GGAEHN O=C([C@@H]1CC[C@H](NCc2cc(O)ccc2Br)C1)N1CCCCC1 ZINC000435744723 567387403 /nfs/dbraw/zinc/38/74/03/567387403.db2.gz HDUGXFBADRGFKO-HIFRSBDPSA-N 0 3 381.314 3.426 10 0 GGAEHN COc1ccc([C@H](C)N[C@H](C)Cn2cc(Br)ccc2=O)c(OC)c1 ZINC000527974563 567387705 /nfs/dbraw/zinc/38/77/05/567387705.db2.gz RSEZRJYEHROQQQ-OLZOCXBDSA-N 0 3 395.297 3.367 10 0 GGAEHN COc1ccc([C@@H](N[C@@H](C)Cn2cc(Br)ccc2=O)C2CC2)cn1 ZINC000528043709 567391410 /nfs/dbraw/zinc/39/14/10/567391410.db2.gz RKZGSVMRDBTXIE-SGTLLEGYSA-N 0 3 392.297 3.144 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)c1cc[nH]c(=O)c1Br)c1ccsc1 ZINC000435865668 567392228 /nfs/dbraw/zinc/39/22/28/567392228.db2.gz RBIQSWUJLPIPGP-CYBMUJFWSA-N 0 3 398.326 3.424 10 0 GGAEHN Cn1cc(C[C@@H]2CCC[C@@H]2NCC(=O)Nc2ccccc2Br)cn1 ZINC000661777585 567392867 /nfs/dbraw/zinc/39/28/67/567392867.db2.gz IFPOARYREGNIKF-HOCLYGCPSA-N 0 3 391.313 3.122 10 0 GGAEHN O[C@@H](CN[C@@H]1CCOc2c(Br)cccc21)COc1ccccc1 ZINC000501501070 567392970 /nfs/dbraw/zinc/39/29/70/567392970.db2.gz KVVCOPSDDMMCML-SUMWQHHRSA-N 0 3 378.266 3.302 10 0 GGAEHN Cn1cc(C[C@@H]2CCC[C@@H]2NCC(=O)Nc2ccc(Br)cc2)cn1 ZINC000661777298 567393176 /nfs/dbraw/zinc/39/31/76/567393176.db2.gz GFPUUNYOZINYQJ-YOEHRIQHSA-N 0 3 391.313 3.122 10 0 GGAEHN Cn1cc(C[C@H]2CCC[C@H]2NCC(=O)Nc2ccc(Br)cc2)cn1 ZINC000661777295 567393332 /nfs/dbraw/zinc/39/33/32/567393332.db2.gz GFPUUNYOZINYQJ-RHSMWYFYSA-N 0 3 391.313 3.122 10 0 GGAEHN Cc1cc(S(=O)(=O)NCCNCc2ccc3nc(C)sc3c2)c(C)s1 ZINC000569299018 567393920 /nfs/dbraw/zinc/39/39/20/567393920.db2.gz HYPGLAPPLDZKPI-UHFFFAOYSA-N 0 3 395.575 3.351 10 0 GGAEHN O[C@H](CN[C@H]1CCOc2c(Br)cccc21)COCc1ccco1 ZINC000501517393 567393925 /nfs/dbraw/zinc/39/39/25/567393925.db2.gz GSDJHQHKZDMORK-WBMJQRKESA-N 0 3 382.254 3.033 10 0 GGAEHN O[C@H](CN[C@H]1CCOc2c(Br)cccc21)COc1ccc(F)cc1 ZINC000501549064 567395861 /nfs/dbraw/zinc/39/58/61/567395861.db2.gz HQBBXZQIKMHNJJ-DYVFJYSZSA-N 0 3 396.256 3.441 10 0 GGAEHN CN(C)S(=O)(=O)c1ccc(CN[C@@H]2C[C@H](OC(C)(C)C)C23CCC3)s1 ZINC000661846561 567396380 /nfs/dbraw/zinc/39/63/80/567396380.db2.gz VOMSXSCQZCSZHC-CABCVRRESA-N 0 3 386.583 3.214 10 0 GGAEHN CN(C)S(=O)(=O)c1ccc(CN[C@@H]2C[C@@H](OC(C)(C)C)C23CCC3)s1 ZINC000661846563 567396410 /nfs/dbraw/zinc/39/64/10/567396410.db2.gz VOMSXSCQZCSZHC-HUUCEWRRSA-N 0 3 386.583 3.214 10 0 GGAEHN CC[C@@H](C)OCC(=O)N(CCN(CC)CC)c1ccc(Br)cn1 ZINC000569345768 567397720 /nfs/dbraw/zinc/39/77/20/567397720.db2.gz ZCHUWOJUCFFCNG-CQSZACIVSA-N 0 3 386.334 3.334 10 0 GGAEHN C[C@@H](NC[C@@H]1CSc2ccccc2O1)c1ccc(NS(C)(=O)=O)cc1 ZINC000569339488 567397841 /nfs/dbraw/zinc/39/78/41/567397841.db2.gz IBBANHUATCQUNB-CZUORRHYSA-N 0 3 378.519 3.262 10 0 GGAEHN CN1CCC[C@H](NC(=O)NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)C1 ZINC000618555778 567400333 /nfs/dbraw/zinc/40/03/33/567400333.db2.gz VTTAYOHPMHZBLF-MXWKQRLJSA-N 0 3 375.357 3.289 10 0 GGAEHN Brc1cnn(Cc2c[nH]c(=NC[C@@H]3CCN3C3CCCC3)s2)c1 ZINC000528206058 567401061 /nfs/dbraw/zinc/40/10/61/567401061.db2.gz BIYVTSYHQCTUED-AWEZNQCLSA-N 0 3 396.358 3.001 10 0 GGAEHN Cn1ncc(Br)c1C(=O)N1CCN(C(C)(C)CC(C)(C)C)CC1 ZINC000456695361 567403019 /nfs/dbraw/zinc/40/30/19/567403019.db2.gz OVNWISQVIOVSRH-UHFFFAOYSA-N 0 3 385.350 3.155 10 0 GGAEHN CCOC(=O)c1csc(CN[C@@H](C)C2CCN(CC(F)(F)F)CC2)n1 ZINC000549688973 567404222 /nfs/dbraw/zinc/40/42/22/567404222.db2.gz UOAXIWQYYYUSHG-NSHDSACASA-N 0 3 379.448 3.072 10 0 GGAEHN COc1cc(Br)ccc1CCCN1CC[C@H](N(C)C(=O)N(C)C)C1 ZINC000662013563 567404696 /nfs/dbraw/zinc/40/46/96/567404696.db2.gz UKYWZSRNXGTSFB-INIZCTEOSA-N 0 3 398.345 3.078 10 0 GGAEHN C[C@]1(Br)C[C@H]1C(=O)N1CCC(N2CCc3ccccc3C2)CC1 ZINC000528270117 567405492 /nfs/dbraw/zinc/40/54/92/567405492.db2.gz MMFFRHNPSWPGHI-HKUYNNGSSA-N 0 3 377.326 3.209 10 0 GGAEHN O=c1cc(CN2CCC[C@H](C3CCC3)C2)nc2ccc(Br)cn12 ZINC000662045392 567405721 /nfs/dbraw/zinc/40/57/21/567405721.db2.gz SNZDAGISPLHKPF-AWEZNQCLSA-N 0 3 376.298 3.469 10 0 GGAEHN CO[C@H]1C[C@H]2C[C@@H](NCC(=O)Nc3ccc(Br)cc3C)C[C@H]2C1 ZINC000569474198 567406905 /nfs/dbraw/zinc/40/69/05/567406905.db2.gz HJTCESMBIGRNRV-SDSIWUNFSA-N 0 3 381.314 3.489 10 0 GGAEHN CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)[C@H]1C[C@]1(C)Br ZINC000528276176 567406985 /nfs/dbraw/zinc/40/69/85/567406985.db2.gz BFVHRRDKHSXREB-WBMJQRKESA-N 0 3 375.257 3.029 10 0 GGAEHN COc1ccc(CN2CCC(CNC(=O)[C@H]3C[C@@]3(C)Br)CC2)cc1 ZINC000528280763 567407122 /nfs/dbraw/zinc/40/71/22/567407122.db2.gz QSXUXZGESVLSTR-IEBWSBKVSA-N 0 3 395.341 3.197 10 0 GGAEHN CN1CC[C@@H](NCC(=O)Nc2ccc(Cl)cn2)[C@@H]1c1ccc(Cl)cc1 ZINC000569533452 567411377 /nfs/dbraw/zinc/41/13/77/567411377.db2.gz ITVTXHQUPSNUAU-QAPCUYQASA-N 0 3 379.291 3.362 10 0 GGAEHN O=C(C[C@H]1CSCCN1)Nc1nnc(SCc2ccc(F)cc2)s1 ZINC000569567777 567413857 /nfs/dbraw/zinc/41/38/57/567413857.db2.gz ZNUDZZGMCHRZEG-LBPRGKRZSA-N 0 3 384.527 3.003 10 0 GGAEHN Fc1c(Br)ccc(CN2CCN(CC3CCOCC3)CC2)c1F ZINC000528389793 567418681 /nfs/dbraw/zinc/41/86/81/567418681.db2.gz SEQMDEGVOFCAGX-UHFFFAOYSA-N 0 3 389.284 3.272 10 0 GGAEHN CSC1(CNC(=O)Cc2ccc(OC(F)(F)F)cc2)CCN(C)CC1 ZINC000569655591 567421183 /nfs/dbraw/zinc/42/11/83/567421183.db2.gz ZRXFCAHPSDDOTO-UHFFFAOYSA-N 0 3 376.444 3.071 10 0 GGAEHN CCCN(CC(=O)Nc1cc(Cl)ccc1Cl)C[C@H]1CCC2(CNC2)O1 ZINC000662248978 567421782 /nfs/dbraw/zinc/42/17/82/567421782.db2.gz GFECADKJISSURS-CQSZACIVSA-N 0 3 386.323 3.165 10 0 GGAEHN COc1ccc([C@H](NC[C@@H]2CNCCO2)c2ccccc2)cc1Br ZINC000662259572 567421841 /nfs/dbraw/zinc/42/18/41/567421841.db2.gz YWPRUFMSMBGVSZ-QFBILLFUSA-N 0 3 391.309 3.125 10 0 GGAEHN COc1ccc([C@@H](NC[C@@H]2CNCCO2)c2ccccc2)cc1Br ZINC000662259571 567422162 /nfs/dbraw/zinc/42/21/62/567422162.db2.gz YWPRUFMSMBGVSZ-LPHOPBHVSA-N 0 3 391.309 3.125 10 0 GGAEHN COc1ccc(Br)cc1[C@H]1CCCN1C[C@H]1CCC2(CNC2)O1 ZINC000662255199 567422497 /nfs/dbraw/zinc/42/24/97/567422497.db2.gz BCPVBNADHVJMPG-GDBMZVCRSA-N 0 3 381.314 3.116 10 0 GGAEHN CCCN(CC(=O)Nc1cc(Cl)ccc1Cl)C[C@@H]1CCC2(CNC2)O1 ZINC000662248974 567422667 /nfs/dbraw/zinc/42/26/67/567422667.db2.gz GFECADKJISSURS-AWEZNQCLSA-N 0 3 386.323 3.165 10 0 GGAEHN C[C@H](NC[C@H]1CNCCO1)c1nc(-c2ccc(Br)cc2)cs1 ZINC000662280156 567423462 /nfs/dbraw/zinc/42/34/62/567423462.db2.gz CXUATVOHQGVONH-SMDDNHRTSA-N 0 3 382.327 3.212 10 0 GGAEHN CCN(CC)CCN(C(=O)Cc1ccoc1)c1ccc(Br)cn1 ZINC000569697471 567424297 /nfs/dbraw/zinc/42/42/97/567424297.db2.gz CPOBQNZUUSJLKN-UHFFFAOYSA-N 0 3 380.286 3.355 10 0 GGAEHN Brc1cccc(C[C@@H]2CCCCN2C[C@@H]2CCC3(CNC3)O2)c1 ZINC000662282068 567424664 /nfs/dbraw/zinc/42/46/64/567424664.db2.gz CQJRHOIGLNQJJG-ROUUACIJSA-N 0 3 379.342 3.367 10 0 GGAEHN CN(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)[C@@H](CN)C(F)(F)F ZINC000662327774 567426882 /nfs/dbraw/zinc/42/68/82/567426882.db2.gz MJMXUXMPDLCRFF-JTQLQIEISA-N 0 3 377.716 3.119 10 0 GGAEHN O=C(c1[nH]nc2ccc(Br)cc21)N1CCN(Cc2ccccc2)CC1 ZINC000569721638 567426998 /nfs/dbraw/zinc/42/69/98/567426998.db2.gz BFZDFIBNOHZQKA-UHFFFAOYSA-N 0 3 399.292 3.283 10 0 GGAEHN CC(=O)N(c1nc(CN2CC[C@@H](F)[C@H](N)C2)cs1)c1cccc(Cl)c1 ZINC000662322501 567426978 /nfs/dbraw/zinc/42/69/78/567426978.db2.gz IHKLPVOXYHXNNL-HZPDHXFCSA-N 0 3 382.892 3.352 10 0 GGAEHN CN(CC(=O)Nc1c(Cl)cc(Cl)cc1Cl)[C@@H](CN)C(F)(F)F ZINC000662327443 567427319 /nfs/dbraw/zinc/42/73/19/567427319.db2.gz JISJNKBBWRHVBN-VIFPVBQESA-N 0 3 378.609 3.407 10 0 GGAEHN CS[C@H]1CN(C(=O)[C@@H]2CSC[C@H]2c2ccccc2)C[C@@H]1N1CCCC1 ZINC000593603762 567427285 /nfs/dbraw/zinc/42/72/85/567427285.db2.gz WNTUKGPBAQDGOL-RDGPPVDQSA-N 0 3 376.591 3.171 10 0 GGAEHN CN(CC(=O)Nc1cc(Cl)c(Cl)cc1Cl)[C@@H](CN)C(F)(F)F ZINC000662328537 567427547 /nfs/dbraw/zinc/42/75/47/567427547.db2.gz SBZNJEXGBNLGOJ-JTQLQIEISA-N 0 3 378.609 3.407 10 0 GGAEHN COCC1(NCCS(=O)(=O)c2cccc(Br)c2)CCCCC1 ZINC000662340865 567429047 /nfs/dbraw/zinc/42/90/47/567429047.db2.gz KHWHMJJYRRBARO-UHFFFAOYSA-N 0 3 390.343 3.162 10 0 GGAEHN C[C@@H]1COCCN1C1CCN(Cc2ccc(Br)c(F)c2F)CC1 ZINC000528510821 567431993 /nfs/dbraw/zinc/43/19/93/567431993.db2.gz RBZLDDQQUQADLO-GFCCVEGCSA-N 0 3 389.284 3.412 10 0 GGAEHN NCc1cccc(NC(=O)[C@@H]2CCO[C@H]2c2cncc(Br)c2)c1 ZINC000662393565 567433141 /nfs/dbraw/zinc/43/31/41/567433141.db2.gz VRGHINYXPLBRCT-CVEARBPZSA-N 0 3 376.254 3.019 10 0 GGAEHN CC(C)N1CC[C@H](N(C)C(=O)c2cc(=O)[nH]c3ccc(Br)cc32)C1 ZINC000457115201 567441278 /nfs/dbraw/zinc/44/12/78/567441278.db2.gz KTPNWJWCSLHTHZ-ZDUSSCGKSA-N 0 3 392.297 3.258 10 0 GGAEHN CCO[C@@H]1C[C@@H](NCc2cc(Br)c(OC)s2)[C@H]1n1cccn1 ZINC000550327227 567441443 /nfs/dbraw/zinc/44/14/43/567441443.db2.gz SHECLIHOFRQDNY-MGPQQGTHSA-N 0 3 386.315 3.224 10 0 GGAEHN CC(C)Oc1cc(Br)cc(NC(=O)c2cn[n-]c2[C@H]2CC[NH2+]C2)c1 ZINC000662490665 567441534 /nfs/dbraw/zinc/44/15/34/567441534.db2.gz IOSGHGXAHOXIKB-NSHDSACASA-N 0 3 393.285 3.289 10 0 GGAEHN O[C@@H](CNC[C@H]1COc2ccccc2O1)COc1c(Cl)cccc1Cl ZINC000550328364 567441984 /nfs/dbraw/zinc/44/19/84/567441984.db2.gz RGBPGUUILACYPE-STQMWFEESA-N 0 3 384.259 3.163 10 0 GGAEHN Cc1cc(Br)cc(CNC2CCC(C(N)=O)CC2)c1OC(F)F ZINC000478212127 567442154 /nfs/dbraw/zinc/44/21/54/567442154.db2.gz ULVMVTSETMFRGF-UHFFFAOYSA-N 0 3 391.256 3.493 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@@H]3C[C@@H]3c3ccc(Cl)cc3Cl)[C@H]2C1 ZINC000502567457 567443714 /nfs/dbraw/zinc/44/37/14/567443714.db2.gz BIZDDSPCONWQGE-XYVMCAHJSA-N 0 3 383.319 3.419 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3[nH]c4ccc(Cl)cc4c3Cl)[C@H]2C1 ZINC000502575919 567444032 /nfs/dbraw/zinc/44/40/32/567444032.db2.gz JRGSEHKYMSOHTL-LSDHHAIUSA-N 0 3 382.291 3.410 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)[C@H](C)Oc3cccc(Cl)c3Cl)[C@H]2C1 ZINC000502575197 567444371 /nfs/dbraw/zinc/44/43/71/567444371.db2.gz GBWBIZWCGFHEND-AEGPPILISA-N 0 3 387.307 3.082 10 0 GGAEHN C[C@@H](NC(=O)C1(NC2CC2)CCC1)c1cc2c(cc1Br)OCCO2 ZINC000662515496 567444833 /nfs/dbraw/zinc/44/48/33/567444833.db2.gz UETHEJJCRLIVSM-LLVKDONJSA-N 0 3 395.297 3.072 10 0 GGAEHN CN(C)[C@@H](CNC(=O)c1sc2c(c1Br)CNC2)c1ccccc1 ZINC000662524539 567444995 /nfs/dbraw/zinc/44/49/95/567444995.db2.gz YCXUWQKTJCUGSG-ZDUSSCGKSA-N 0 3 394.338 3.147 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3cc(Br)ccc3Cl)[C@H]2C1 ZINC000502622696 567445571 /nfs/dbraw/zinc/44/55/71/567445571.db2.gz NVXIHZVXSWSXSV-LSDHHAIUSA-N 0 3 387.705 3.038 10 0 GGAEHN NC1(C(=O)N2CCO[C@H](c3cccc(Br)c3)C2)CC2(CCC2)C1 ZINC000662541812 567446231 /nfs/dbraw/zinc/44/62/31/567446231.db2.gz UIFUBIXJEHALTL-HNNXBMFYSA-N 0 3 379.298 3.011 10 0 GGAEHN O=C(N1CCO[C@H](c2cccc(Br)c2)C1)C1(NC2CC2)CCC1 ZINC000662540659 567446411 /nfs/dbraw/zinc/44/64/11/567446411.db2.gz LTYBTRSJDJFTQA-INIZCTEOSA-N 0 3 379.298 3.024 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)C(C)(C)c3ccc(Br)cc3)[C@H]2C1 ZINC000502663664 567446480 /nfs/dbraw/zinc/44/64/80/567446480.db2.gz XJOKGTVGTCMQHA-DLBZAZTESA-N 0 3 395.341 3.048 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3ccc(Cl)c(Br)c3)[C@H]2C1 ZINC000502680376 567446604 /nfs/dbraw/zinc/44/66/04/567446604.db2.gz QFVLABUGGZKSKE-LSDHHAIUSA-N 0 3 387.705 3.038 10 0 GGAEHN COc1ccc(CCNC(=O)NCC2(SC)CCN(C)CC2)c(Cl)c1 ZINC000569954343 567446794 /nfs/dbraw/zinc/44/67/94/567446794.db2.gz UCRUPSRKNHAGGX-UHFFFAOYSA-N 0 3 385.961 3.018 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)c3ccc(Br)cc3Cl)[C@H]2C1 ZINC000502668363 567447022 /nfs/dbraw/zinc/44/70/22/567447022.db2.gz KYEKEWVJXPIJKI-LSDHHAIUSA-N 0 3 387.705 3.038 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)CCc3ccc(C)cc3Br)[C@H]2C1 ZINC000502684075 567447385 /nfs/dbraw/zinc/44/73/85/567447385.db2.gz YTVLZJPUWVMVJD-ZWKOTPCHSA-N 0 3 395.341 3.012 10 0 GGAEHN CCN1CC[C@H]2OCCN(C(=O)C[C@@H](C)c3ccc(Br)cc3)[C@H]2C1 ZINC000502715206 567448910 /nfs/dbraw/zinc/44/89/10/567448910.db2.gz LOOYDEBZIPXKIX-FHLIZLRMSA-N 0 3 395.341 3.264 10 0 GGAEHN O=C(NCc1csc(Br)c1)Nc1ccc2c(c1)OCCNC2 ZINC000528713484 567449215 /nfs/dbraw/zinc/44/92/15/567449215.db2.gz HCIKLLIMVBRKJP-UHFFFAOYSA-N 0 3 382.283 3.314 10 0 GGAEHN CN(C)C(=O)CCCN1CCC[C@H]1c1ccccc1I ZINC000593957750 567449144 /nfs/dbraw/zinc/44/91/44/567449144.db2.gz IJLJKQHXICRPKL-HNNXBMFYSA-N 0 3 386.277 3.297 10 0 GGAEHN C[C@@H](NC(=O)Nc1ccc2c(c1)OCCNC2)c1ccc(Br)cn1 ZINC000528708133 567449326 /nfs/dbraw/zinc/44/93/26/567449326.db2.gz JTFQPKWPFXRTFZ-LLVKDONJSA-N 0 3 391.269 3.209 10 0 GGAEHN O=C(Nc1cc(Cl)c(Br)cc1F)N[C@H]1CNCCC1(F)F ZINC000528697629 567449406 /nfs/dbraw/zinc/44/94/06/567449406.db2.gz NZGTTYLMSIXEFN-JTQLQIEISA-N 0 3 386.599 3.360 10 0 GGAEHN CC(C)C[C@H](NC(=O)Nc1ccc(Cl)c(Cl)c1)C(=O)NCCN(C)C ZINC000550522773 567450646 /nfs/dbraw/zinc/45/06/46/567450646.db2.gz NJQSMMXWJVABEQ-HNNXBMFYSA-N 0 3 389.327 3.207 10 0 GGAEHN CC1(N2CCOCC2)CCN(CC(=O)Nc2ccc(Cl)c(Cl)c2)CC1 ZINC000528727685 567451439 /nfs/dbraw/zinc/45/14/39/567451439.db2.gz JGNGLXBEQGQDAU-UHFFFAOYSA-N 0 3 386.323 3.119 10 0 GGAEHN CC1(N2CCOCC2)CCN(Cc2nc3cc(Br)ccc3[nH]2)CC1 ZINC000528726371 567451640 /nfs/dbraw/zinc/45/16/40/567451640.db2.gz IFFMXYAHVJPGIH-UHFFFAOYSA-N 0 3 393.329 3.012 10 0 GGAEHN CC1(N2CCOCC2)CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000528726371 567451646 /nfs/dbraw/zinc/45/16/46/567451646.db2.gz IFFMXYAHVJPGIH-UHFFFAOYSA-N 0 3 393.329 3.012 10 0 GGAEHN CC1(N2CCOCC2)CCN(Cc2nc3ccc(Br)cc3o2)CC1 ZINC000528726303 567451821 /nfs/dbraw/zinc/45/18/21/567451821.db2.gz FZLUBKKXDQHTPZ-UHFFFAOYSA-N 0 3 394.313 3.277 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@@H]1CCCCO1)c1ccc(Br)cn1 ZINC000570048124 567454508 /nfs/dbraw/zinc/45/45/08/567454508.db2.gz IIIPKQBDQXRDDU-HNNXBMFYSA-N 0 3 384.318 3.088 10 0 GGAEHN CN(C)C[C@H](NC[C@@H]1CCCS(=O)(=O)C1)c1ccc(Cl)c(Cl)c1 ZINC000528770534 567455078 /nfs/dbraw/zinc/45/50/78/567455078.db2.gz XQBNSSFWCFYOPE-LRDDRELGSA-N 0 3 379.353 3.011 10 0 GGAEHN CCOC(=O)c1csc(CCN[C@H](C)c2ccc(Br)cn2)n1 ZINC000619465805 567455502 /nfs/dbraw/zinc/45/55/02/567455502.db2.gz HJCYZFIJSVYXAT-SNVBAGLBSA-N 0 3 384.299 3.371 10 0 GGAEHN CC(C)c1[nH]nc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)c1Br ZINC000662685528 567456152 /nfs/dbraw/zinc/45/61/52/567456152.db2.gz DVRXRAMRWQTUDZ-CYBMUJFWSA-N 0 3 393.285 3.209 10 0 GGAEHN CCO[C@H]1C[C@](N)(C(=O)N2Cc3ccc(C)c(Br)c3C2)C1(C)C ZINC000662737677 567459660 /nfs/dbraw/zinc/45/96/60/567459660.db2.gz APHRYUSHDORMJR-KSSFIOAISA-N 0 3 381.314 3.132 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2cc(C)cc(Br)c2)CC1 ZINC000478459963 567459879 /nfs/dbraw/zinc/45/98/79/567459879.db2.gz MWWLONAYVAPYEX-UHFFFAOYSA-N 0 3 390.281 3.124 10 0 GGAEHN O=C(C[C@@H]1NCc2ccccc21)N1CCOc2cc(Br)ccc2C1 ZINC000662740611 567460188 /nfs/dbraw/zinc/46/01/88/567460188.db2.gz AEYUPOZKYTZIDD-KRWDZBQOSA-N 0 3 387.277 3.405 10 0 GGAEHN O=C(Nc1ccc2c(c1)CNC2)[C@@H]1CCO[C@H]1c1cncc(Br)c1 ZINC000662786210 567460375 /nfs/dbraw/zinc/46/03/75/567460375.db2.gz ULWCNGKKPYHNQR-SJORKVTESA-N 0 3 388.265 3.164 10 0 GGAEHN O=C(C[C@H]1NCc2ccccc21)N1CCOc2cc(Br)ccc2C1 ZINC000662740612 567460770 /nfs/dbraw/zinc/46/07/70/567460770.db2.gz AEYUPOZKYTZIDD-QGZVFWFLSA-N 0 3 387.277 3.405 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)c2cc(C)sc2Br)CC1 ZINC000478474699 567460983 /nfs/dbraw/zinc/46/09/83/567460983.db2.gz MTJLCLMOIHVLOA-UHFFFAOYSA-N 0 3 396.310 3.185 10 0 GGAEHN CC(C)(C)n1cc(Br)c(C(=O)N2CCc3ccccc3[C@@H]2CN)n1 ZINC000662821432 567462520 /nfs/dbraw/zinc/46/25/20/567462520.db2.gz FUOYILGINLZMAR-HNNXBMFYSA-N 0 3 391.313 3.099 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)N[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000503026638 567464969 /nfs/dbraw/zinc/46/49/69/567464969.db2.gz NYLNMGJGCOIFJQ-LRDDRELGSA-N 0 3 386.323 3.391 10 0 GGAEHN CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)[C@H]1C[C@@]1(C)Br ZINC000528905279 567467466 /nfs/dbraw/zinc/46/74/66/567467466.db2.gz YCHIPZYJPULLQQ-SZVBFZGTSA-N 0 3 395.341 3.379 10 0 GGAEHN COc1ccc([C@H](C)N[C@@H](C)Cn2cc(Br)ccc2=O)cc1F ZINC000550940155 567469864 /nfs/dbraw/zinc/46/98/64/567469864.db2.gz SNKZXCFVRNBNOQ-RYUDHWBXSA-N 0 3 383.261 3.498 10 0 GGAEHN CC(C)N1CCN(c2cccc(NC(=O)[C@H]3C[C@]3(C)Br)c2)CC1 ZINC000528944494 567470956 /nfs/dbraw/zinc/47/09/56/567470956.db2.gz NFSWGZPGQBYVDZ-AEFFLSMTSA-N 0 3 380.330 3.329 10 0 GGAEHN C[C@H]1OC(C)(C)N[C@H]1CNC(=O)Nc1cc(-c2ccc(Cl)s2)nn1C ZINC000570262762 567471587 /nfs/dbraw/zinc/47/15/87/567471587.db2.gz AKYBZFTWNRXJMQ-KOLCDFICSA-N 0 3 383.905 3.037 10 0 GGAEHN C[C@@H]1OC(C)(C)N[C@H]1CNC(=O)Nc1cc(-c2ccc(Cl)s2)nn1C ZINC000570262765 567471945 /nfs/dbraw/zinc/47/19/45/567471945.db2.gz AKYBZFTWNRXJMQ-ONGXEEELSA-N 0 3 383.905 3.037 10 0 GGAEHN CC(=O)NCCN(Cc1ccc(Br)s1)C[C@@H]1CCO[C@H](C)C1 ZINC000503248355 567477523 /nfs/dbraw/zinc/47/75/23/567477523.db2.gz YVQDEJLTEJPFNW-TZMCWYRMSA-N 0 3 389.359 3.264 10 0 GGAEHN CC(=O)NCCN(Cc1ccc(Br)s1)C[C@H]1CCO[C@H](C)C1 ZINC000503248354 567477585 /nfs/dbraw/zinc/47/75/85/567477585.db2.gz YVQDEJLTEJPFNW-OCCSQVGLSA-N 0 3 389.359 3.264 10 0 GGAEHN CSCC[C@@H](N)C(=O)N1CCN(c2cc(Cl)c(Cl)c(Cl)c2)CC1 ZINC000594456181 567477566 /nfs/dbraw/zinc/47/75/66/567477566.db2.gz XWEADDVDJZXPIN-CYBMUJFWSA-N 0 3 396.771 3.376 10 0 GGAEHN CC(C)CN(CCN(C)C)C(=O)Cc1c(F)ccc(Br)c1F ZINC000503314487 567480198 /nfs/dbraw/zinc/48/01/98/567480198.db2.gz TXQANRXIJPPBNB-UHFFFAOYSA-N 0 3 377.273 3.316 10 0 GGAEHN COc1cc(CN[C@H]2CSC2(C)C)cc(I)c1OC ZINC000619799195 567481353 /nfs/dbraw/zinc/48/13/53/567481353.db2.gz CNFZVCSDTGCGRS-LBPRGKRZSA-N 0 3 393.290 3.292 10 0 GGAEHN COc1cc(CN[C@@H]2CSC2(C)C)cc(I)c1OC ZINC000619799194 567481935 /nfs/dbraw/zinc/48/19/35/567481935.db2.gz CNFZVCSDTGCGRS-GFCCVEGCSA-N 0 3 393.290 3.292 10 0 GGAEHN CCCC(=O)NC1CCN(C[C@@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000642624246 567483883 /nfs/dbraw/zinc/48/38/83/567483883.db2.gz LZKABQDMFKZTJJ-CQSZACIVSA-N 0 3 389.323 3.114 10 0 GGAEHN NC(=O)[C@@H](NC1CCC(OC(F)F)CC1)c1cccc(Br)c1 ZINC000642707825 567485469 /nfs/dbraw/zinc/48/54/69/567485469.db2.gz ZDEGTNJSFDHJCD-BPCQOVAHSA-N 0 3 377.229 3.116 10 0 GGAEHN Ic1cccc(CNCc2ccc(-n3cncn3)cc2)c1 ZINC000551186999 567485706 /nfs/dbraw/zinc/48/57/06/567485706.db2.gz VKVKTDFZNJCYIJ-UHFFFAOYSA-N 0 3 390.228 3.162 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCC1)Nc1cnc2c(Br)cccn12 ZINC000529100196 567486657 /nfs/dbraw/zinc/48/66/57/567486657.db2.gz MBAYRRDRAYUWPG-CYBMUJFWSA-N 0 3 392.301 3.235 10 0 GGAEHN C[C@H](CNC(=O)c1cc(Br)cc2[nH]cnc21)N1CCC(C)CC1 ZINC000503461969 567487554 /nfs/dbraw/zinc/48/75/54/567487554.db2.gz NAPXUVWCSZMWRN-GFCCVEGCSA-N 0 3 379.302 3.176 10 0 GGAEHN CCN1CCC(N(C)C(=O)Cc2c(F)ccc(Br)c2F)CC1 ZINC000503482194 567488320 /nfs/dbraw/zinc/48/83/20/567488320.db2.gz JTRLMAFQBXUQPY-UHFFFAOYSA-N 0 3 375.257 3.213 10 0 GGAEHN COc1cc(CNC[C@H]2CS(=O)(=O)c3ccccc32)cc(Cl)c1OC ZINC000570477423 567489558 /nfs/dbraw/zinc/48/95/58/567489558.db2.gz JGDJHMSMCUOFSR-ZDUSSCGKSA-N 0 3 381.881 3.018 10 0 GGAEHN CN(c1nnc(-c2ccc(F)cc2Br)n1C)[C@H]1CCN(C2CC2)C1 ZINC000570486813 567489574 /nfs/dbraw/zinc/48/95/74/567489574.db2.gz KTBYSEVZPKIUDC-ZDUSSCGKSA-N 0 3 394.292 3.057 10 0 GGAEHN COc1cnccc1N1CCN(C(=O)Nc2ccc(Br)cc2)CC1 ZINC000478911416 567490773 /nfs/dbraw/zinc/49/07/73/567490773.db2.gz ORMJWVFACLNLJY-UHFFFAOYSA-N 0 3 391.269 3.207 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)N1CCc2cc(Br)ccc2C1 ZINC000478943755 567491690 /nfs/dbraw/zinc/49/16/90/567491690.db2.gz KVBZNTHQPRUATI-KRWDZBQOSA-N 0 3 382.346 3.493 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000594641845 567491767 /nfs/dbraw/zinc/49/17/67/567491767.db2.gz SWCUITMBIDKYIT-HNNXBMFYSA-N 0 3 390.325 3.313 10 0 GGAEHN COC(=O)c1cc(CNC[C@H](CO)Cc2ccc(Br)cc2)c(C)o1 ZINC000594615501 567492095 /nfs/dbraw/zinc/49/20/95/567492095.db2.gz VICJIWIQKMRDRY-CQSZACIVSA-N 0 3 396.281 3.078 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000594641846 567492474 /nfs/dbraw/zinc/49/24/74/567492474.db2.gz SWCUITMBIDKYIT-OAHLLOKOSA-N 0 3 390.325 3.313 10 0 GGAEHN O=C(N[C@@H]1CSc2ccc(Br)cc21)N1CCN2CCC1CC2 ZINC000503536776 567492883 /nfs/dbraw/zinc/49/28/83/567492883.db2.gz JOUCLZNAFRKPGQ-CQSZACIVSA-N 0 3 382.327 3.086 10 0 GGAEHN CCOC(=O)[C@@H]1CC[C@H](NCc2cc(Br)c3c(c2)OCCCO3)C1 ZINC000437340586 567492961 /nfs/dbraw/zinc/49/29/61/567492961.db2.gz FHYYZFMXLWSJNR-KGLIPLIRSA-N 0 3 398.297 3.432 10 0 GGAEHN O=C(NCC1(N2CCSCC2)CCCC1)NC1CCC(C(F)F)CC1 ZINC000457810601 567494747 /nfs/dbraw/zinc/49/47/47/567494747.db2.gz ZQDLAPZFRAMANL-UHFFFAOYSA-N 0 3 375.529 3.471 10 0 GGAEHN C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)N1CCN2CCC1CC2 ZINC000551290693 567495493 /nfs/dbraw/zinc/49/54/93/567495493.db2.gz GRJKPIQRIKKIQD-LBPRGKRZSA-N 0 3 384.293 3.009 10 0 GGAEHN CN([C@H](CN)C(F)(F)F)S(=O)(=O)c1ccc2nc(C(C)(C)C)sc2c1 ZINC000663310032 567495717 /nfs/dbraw/zinc/49/57/17/567495717.db2.gz GBZRWKNUSBXHAM-GFCCVEGCSA-N 0 3 395.472 3.104 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)N1CCc2cc(Cl)cc(Cl)c2C1 ZINC000437467818 567497002 /nfs/dbraw/zinc/49/70/02/567497002.db2.gz NKLPZLKLONFXBS-OAHLLOKOSA-N 0 3 386.323 3.172 10 0 GGAEHN COc1cc(CNC[C@H]2CCC[N@H+](CC3CC3)C2)cc(Br)c1[O-] ZINC000663346825 567499146 /nfs/dbraw/zinc/49/91/46/567499146.db2.gz OWHZLRXGFXMJPE-CQSZACIVSA-N 0 3 383.330 3.375 10 0 GGAEHN COc1cc(CNC[C@H]2CCC[N@@H+](CC3CC3)C2)cc(Br)c1[O-] ZINC000663346825 567499154 /nfs/dbraw/zinc/49/91/54/567499154.db2.gz OWHZLRXGFXMJPE-CQSZACIVSA-N 0 3 383.330 3.375 10 0 GGAEHN CCN1CCCC[C@H]1CNC(=O)Cc1c(F)ccc(Br)c1F ZINC000503644927 567499317 /nfs/dbraw/zinc/49/93/17/567499317.db2.gz ALNSENYFEORVPG-NSHDSACASA-N 0 3 375.257 3.260 10 0 GGAEHN CCCOc1c(Br)cc(CN2CCNC[C@H]2C(F)F)cc1OC ZINC000570632511 567500597 /nfs/dbraw/zinc/50/05/97/567500597.db2.gz QULGIPBNSUQJMO-ZDUSSCGKSA-N 0 3 393.272 3.285 10 0 GGAEHN CC1(C)[C@@H](CNCCS(=O)(=O)c2cccc(Br)c2)C1(F)F ZINC000663368111 567500501 /nfs/dbraw/zinc/50/05/01/567500501.db2.gz YZRZDZFHTQKPTH-GFCCVEGCSA-N 0 3 382.270 3.104 10 0 GGAEHN C[C@@H](O)[C@H](NCCC(=O)Nc1cccc(Br)c1)c1ccccc1 ZINC000663376990 567502738 /nfs/dbraw/zinc/50/27/38/567502738.db2.gz XPHDZHZLPQWSMY-ACJLOTCBSA-N 0 3 377.282 3.489 10 0 GGAEHN Cn1nc2c(c1CN[C@@H]1CCN(c3ccccc3Br)C1)CCCC2 ZINC000643321412 567504967 /nfs/dbraw/zinc/50/49/67/567504967.db2.gz QATFRLJBXZFWFD-CQSZACIVSA-N 0 3 389.341 3.430 10 0 GGAEHN OC1CCN(CCCNc2ncc(Br)cc2C(F)(F)F)CC1 ZINC000663402847 567505384 /nfs/dbraw/zinc/50/53/84/567505384.db2.gz MNVYVVLJAONDQE-UHFFFAOYSA-N 0 3 382.224 3.122 10 0 GGAEHN Cn1cc(Br)c(CN[C@H]2CCN(Cc3ccccc3)C3(CC3)C2)n1 ZINC000570718167 567508001 /nfs/dbraw/zinc/50/80/01/567508001.db2.gz RAODHAOVYDVHQU-INIZCTEOSA-N 0 3 389.341 3.469 10 0 GGAEHN O=C(c1sc2cc(C(F)(F)F)ccc2c1Cl)N1CCOC2(CNC2)C1 ZINC000663486696 567511727 /nfs/dbraw/zinc/51/17/27/567511727.db2.gz PNIQYKDWDMNHRU-UHFFFAOYSA-N 0 3 390.814 3.388 10 0 GGAEHN O=C(c1ccc(-c2ccc(Br)s2)s1)N1CCOC2(CNC2)C1 ZINC000663490858 567511845 /nfs/dbraw/zinc/51/18/45/567511845.db2.gz CCOMOJCPVDYPMM-UHFFFAOYSA-N 0 3 399.335 3.054 10 0 GGAEHN COc1c(Br)cc(Br)cc1CN1CC[C@@H](F)[C@H](N)C1 ZINC000663505662 567512518 /nfs/dbraw/zinc/51/25/18/567512518.db2.gz DKOFDLOHXRGEFL-VXGBXAGGSA-N 0 3 396.098 3.091 10 0 GGAEHN CS[C@H]1CN(C(=O)Nc2cccc(Br)c2)C[C@H]1N1CCCC1 ZINC000437914903 567515169 /nfs/dbraw/zinc/51/51/69/567515169.db2.gz AJEYNYDSCBFJTK-CABCVRRESA-N 0 3 384.343 3.493 10 0 GGAEHN CN(C)[C@H](CNC(=O)c1cc(Br)cc2nc[nH]c21)c1ccsc1 ZINC000503957292 567515481 /nfs/dbraw/zinc/51/54/81/567515481.db2.gz HGZWEEFRHHBHOH-CQSZACIVSA-N 0 3 393.310 3.420 10 0 GGAEHN C[C@H](CNC(=O)c1cc(Br)cc2[nH]cnc21)N1CCC[C@H](C)C1 ZINC000503975997 567516445 /nfs/dbraw/zinc/51/64/45/567516445.db2.gz ZPESLIYYGXJIMM-NWDGAFQWSA-N 0 3 379.302 3.176 10 0 GGAEHN C[C@@H]1CCCCN1CCNC(=O)Cc1c(F)ccc(Br)c1F ZINC000503988825 567517711 /nfs/dbraw/zinc/51/77/11/567517711.db2.gz YRKONAUXCNFZEG-LLVKDONJSA-N 0 3 375.257 3.260 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1 ZINC000504066230 567520738 /nfs/dbraw/zinc/52/07/38/567520738.db2.gz FAIVTHVOYHTGJO-HNNXBMFYSA-N 0 3 390.355 3.474 10 0 GGAEHN O=C(c1sc2ncccc2c1Cl)N1CCC(N2CCCOCC2)CC1 ZINC000529486540 567521209 /nfs/dbraw/zinc/52/12/09/567521209.db2.gz XRHMEKKOZGAZEZ-UHFFFAOYSA-N 0 3 379.913 3.277 10 0 GGAEHN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CCN2CCC1CC2 ZINC000551588217 567521732 /nfs/dbraw/zinc/52/17/32/567521732.db2.gz NKMCAUYUBFUSKD-LBPRGKRZSA-N 0 3 382.302 3.008 10 0 GGAEHN Brc1cccc(OCCSCCNCc2cnn3c2CCC3)c1 ZINC000594921102 567525530 /nfs/dbraw/zinc/52/55/30/567525530.db2.gz BHGDMRAZPJMNKT-UHFFFAOYSA-N 0 3 396.354 3.494 10 0 GGAEHN CC(C)Oc1ccc([C@H](CNc2ncncc2Br)N(C)C)cc1 ZINC000570961422 567525501 /nfs/dbraw/zinc/52/55/01/567525501.db2.gz JWBOCUHQASMLOU-INIZCTEOSA-N 0 3 379.302 3.163 10 0 GGAEHN COC(=O)[C@@H]1C[C@@H]1[C@@H](C)NCc1cc(Br)ccc1OC(F)F ZINC000594918508 567525614 /nfs/dbraw/zinc/52/56/14/567525614.db2.gz BEKRTXJCMVNANG-GGZOMVNGSA-N 0 3 378.213 3.338 10 0 GGAEHN NC(=O)C[C@H]1CCCCN1Cc1c[nH]nc1-c1ccc(Br)s1 ZINC000529526147 567525846 /nfs/dbraw/zinc/52/58/46/567525846.db2.gz SAEAJPSHCUWVGV-LLVKDONJSA-N 0 3 383.315 3.131 10 0 GGAEHN CCN(C(=O)NCCc1ccc(F)c(Br)c1)[C@@H]1CCN(CC)C1 ZINC000663758398 567526874 /nfs/dbraw/zinc/52/68/74/567526874.db2.gz CQHVMPBPOSJFSM-CQSZACIVSA-N 0 3 386.309 3.256 10 0 GGAEHN CC(C)C[C@@H](CN(C)C)NC(=O)N1CCc2ccc(Br)cc2C1 ZINC000551654752 567526971 /nfs/dbraw/zinc/52/69/71/567526971.db2.gz MWOFQSASXGSHKM-KRWDZBQOSA-N 0 3 382.346 3.493 10 0 GGAEHN C[C@@H](Cc1ccc(Br)cc1)NC(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000594977094 567530537 /nfs/dbraw/zinc/53/05/37/567530537.db2.gz YCNPUXKLDKELRR-GUYCJALGSA-N 0 3 380.330 3.164 10 0 GGAEHN C[C@H](NCC(=O)Nc1ccc(I)cc1)C1CC(F)(F)C1 ZINC000529556217 567530475 /nfs/dbraw/zinc/53/04/75/567530475.db2.gz RRKZJJOYSKPCTC-VIFPVBQESA-N 0 3 394.203 3.253 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)Nc1cccc2c1CCNC2 ZINC000644086427 567531329 /nfs/dbraw/zinc/53/13/29/567531329.db2.gz BBPKCHDYGFHISV-UHFFFAOYSA-N 0 3 375.266 3.285 10 0 GGAEHN Cc1ccc(S(=O)(=O)C[C@H](C)NCc2cc(-n3ccnc3)cs2)cc1 ZINC000479393762 567531948 /nfs/dbraw/zinc/53/19/48/567531948.db2.gz MXVWCXKUKJRSIX-HNNXBMFYSA-N 0 3 375.519 3.194 10 0 GGAEHN COc1ccc(C[C@H](CO)CNCc2ccsc2Br)cc1O ZINC000529566246 567532184 /nfs/dbraw/zinc/53/21/84/567532184.db2.gz CZPCAGLSSJVWLB-LBPRGKRZSA-N 0 3 386.311 3.166 10 0 GGAEHN Ic1ccc(CCNCc2cnc(C3CC3)nc2)cc1 ZINC000594996222 567532543 /nfs/dbraw/zinc/53/25/43/567532543.db2.gz XQMBZTOPMBEUQG-UHFFFAOYSA-N 0 3 379.245 3.291 10 0 GGAEHN CC1(C)CCCN[C@H]1C(=O)Nc1ccc(I)cc1F ZINC000571061910 567535014 /nfs/dbraw/zinc/53/50/14/567535014.db2.gz JRKLLWKUOWZMBO-LBPRGKRZSA-N 0 3 376.213 3.147 10 0 GGAEHN CN(C)CCc1ccccc1NC(=O)C(=O)c1ccc(Br)cc1 ZINC000438563273 567535329 /nfs/dbraw/zinc/53/53/29/567535329.db2.gz MEJKBIFBGWOBGJ-UHFFFAOYSA-N 0 3 375.266 3.375 10 0 GGAEHN C[C@H](CSCCF)NCc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1 ZINC000595016244 567535496 /nfs/dbraw/zinc/53/54/96/567535496.db2.gz JBSXRHFTTMVFOJ-JKSUJKDBSA-N 0 3 388.574 3.288 10 0 GGAEHN C[C@H](CSCCF)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O ZINC000595016914 567535772 /nfs/dbraw/zinc/53/57/72/567535772.db2.gz AWYBPXIJYMLGGS-IUODEOHRSA-N 0 3 376.444 3.464 10 0 GGAEHN COC(=O)c1ccc(CNCCCc2nc(C(C)C)no2)c(Br)c1 ZINC000551799176 567536327 /nfs/dbraw/zinc/53/63/27/567536327.db2.gz MLGLZICSFCZQIQ-UHFFFAOYSA-N 0 3 396.285 3.465 10 0 GGAEHN C[C@H](CSCCF)N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 ZINC000595034240 567536999 /nfs/dbraw/zinc/53/69/99/567536999.db2.gz WHCHNUSSVVPOOA-TZMCWYRMSA-N 0 3 378.435 3.487 10 0 GGAEHN C[C@H](NCC(=O)Nc1ccc(I)cc1)C(C)(C)C(F)F ZINC000595038323 567537005 /nfs/dbraw/zinc/53/70/05/567537005.db2.gz JLNBLFFSMHALPS-VIFPVBQESA-N 0 3 396.219 3.499 10 0 GGAEHN COc1sc(CN2CCC(C)(N3CCOCC3)CC2)cc1Br ZINC000529665268 567538305 /nfs/dbraw/zinc/53/83/05/567538305.db2.gz WKNUWDNLGPBKSI-UHFFFAOYSA-N 0 3 389.359 3.206 10 0 GGAEHN COc1cc(Br)ccc1CN1CCC(C)(N2CCOCC2)CC1 ZINC000529665228 567538384 /nfs/dbraw/zinc/53/83/84/567538384.db2.gz VSDIAVCKBDPCHF-UHFFFAOYSA-N 0 3 383.330 3.144 10 0 GGAEHN CC[C@H](N[C@H]1CCc2ccc(I)cc21)[C@@H](O)C(F)F ZINC000595042506 567539366 /nfs/dbraw/zinc/53/93/66/567539366.db2.gz SGGBCGYWUFYBGE-RWMBFGLXSA-N 0 3 381.204 3.273 10 0 GGAEHN C[C@H](CCc1ccc(I)cc1)N[C@H]1C[C@H](C)n2ncnc21 ZINC000595065634 567540044 /nfs/dbraw/zinc/54/00/44/567540044.db2.gz ISQPNSAKPQMLNB-XUJVJEKNSA-N 0 3 396.276 3.499 10 0 GGAEHN O=C(NC[C@@H]1CCCN1CCCO)N[C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000458368345 567542161 /nfs/dbraw/zinc/54/21/61/567542161.db2.gz JBVNULKOQQFRCQ-BLLLJJGKSA-N 0 3 386.323 3.127 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCCC1)c1ccccc1I ZINC000529719114 567542843 /nfs/dbraw/zinc/54/28/43/567542843.db2.gz QDAZPLZHTRSTLB-AWEZNQCLSA-N 0 3 398.288 3.428 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCCC1)c1[nH]nc(C2CC2)c1Br ZINC000529720056 567543129 /nfs/dbraw/zinc/54/31/29/567543129.db2.gz OYJYUQUUDAWSCO-ZDUSSCGKSA-N 0 3 381.318 3.186 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCCC1)C1(c2cncc(Br)c2)CC1 ZINC000529717254 567543470 /nfs/dbraw/zinc/54/34/70/567543470.db2.gz OYKPQUSJRJAJFT-KRWDZBQOSA-N 0 3 392.341 3.399 10 0 GGAEHN CC(C)c1n[nH]c(C(=O)NC[C@H]2CCN2C2CCCCC2)c1Br ZINC000529720464 567543565 /nfs/dbraw/zinc/54/35/65/567543565.db2.gz QWELFSORHBVFRB-CYBMUJFWSA-N 0 3 383.334 3.432 10 0 GGAEHN O=C(NC[C@H]1CCN1C1CCCCC1)C1(c2cncc(Br)c2)CC1 ZINC000529717255 567543915 /nfs/dbraw/zinc/54/39/15/567543915.db2.gz OYKPQUSJRJAJFT-QGZVFWFLSA-N 0 3 392.341 3.399 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)N[C@@H](CO)c1ccc(Br)cc1 ZINC000504695468 567544357 /nfs/dbraw/zinc/54/43/57/567544357.db2.gz PCGYEWGPRCJFHF-CPUCHLNUSA-N 0 3 398.345 3.045 10 0 GGAEHN CSC1(CNC(=O)Nc2ccc(C(F)(F)F)nc2C)CCN(C)CC1 ZINC000571211071 567546802 /nfs/dbraw/zinc/54/68/02/567546802.db2.gz YUIDFCVXWIKFDF-UHFFFAOYSA-N 0 3 376.448 3.358 10 0 GGAEHN CC[C@@H](N[C@H](C)Cn1cc(Br)ccc1=O)c1c(C)nn(C)c1C ZINC000438827848 567549471 /nfs/dbraw/zinc/54/94/71/567549471.db2.gz KLAVOMMELMCTFW-IAQYHMDHSA-N 0 3 381.318 3.091 10 0 GGAEHN CC[C@H](N[C@@H](C)Cn1cc(Br)ccc1=O)c1c(C)nn(C)c1C ZINC000438827849 567549582 /nfs/dbraw/zinc/54/95/82/567549582.db2.gz KLAVOMMELMCTFW-NHYWBVRUSA-N 0 3 381.318 3.091 10 0 GGAEHN CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1ccc(Br)cc1F ZINC000620913326 567550015 /nfs/dbraw/zinc/55/00/15/567550015.db2.gz AOHWBZDFFLYTOP-CQSZACIVSA-N 0 3 399.304 3.304 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1ccsc1Br ZINC000620917885 567550276 /nfs/dbraw/zinc/55/02/76/567550276.db2.gz BHJQPSCBJNDITM-LBPRGKRZSA-N 0 3 387.343 3.226 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)[C@H]1SCCc2sccc21 ZINC000620915124 567550386 /nfs/dbraw/zinc/55/03/86/567550386.db2.gz CNPPVELSRVGRTH-YOEHRIQHSA-N 0 3 380.579 3.180 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1cc(Br)ccc1F ZINC000620917938 567550584 /nfs/dbraw/zinc/55/05/84/567550584.db2.gz PSEYUHGXONJRLD-AWEZNQCLSA-N 0 3 399.304 3.304 10 0 GGAEHN CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1cccc(F)c1Br ZINC000620907555 567551160 /nfs/dbraw/zinc/55/11/60/567551160.db2.gz SQAVOUHKGNFHIB-ZDUSSCGKSA-N 0 3 399.304 3.304 10 0 GGAEHN Cc1c(Br)cc(CNC2COCCOC2)cc1Br ZINC000644422080 567552496 /nfs/dbraw/zinc/55/24/96/567552496.db2.gz LPDFMUMCJHNQBZ-UHFFFAOYSA-N 0 3 379.092 3.025 10 0 GGAEHN C[C@@H](N[C@H](CO)c1cccc(Br)c1)c1ccccc1-n1ccnn1 ZINC000552063083 567555492 /nfs/dbraw/zinc/55/54/92/567555492.db2.gz OPEHSEHPHLHUCE-CXAGYDPISA-N 0 3 387.281 3.414 10 0 GGAEHN C[C@@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)NC1COCCOC1 ZINC000644552763 567557898 /nfs/dbraw/zinc/55/78/98/567557898.db2.gz RWXICCSTAAMEIQ-JTQLQIEISA-N 0 3 380.794 3.081 10 0 GGAEHN COc1ccc2c(c1)[C@@H](NC[C@H]1CCCCN1S(C)(=O)=O)CCCS2 ZINC000552097013 567557938 /nfs/dbraw/zinc/55/79/38/567557938.db2.gz PZRAJWSXBWXQGX-PBHICJAKSA-N 0 3 384.567 3.026 10 0 GGAEHN CC1(C)CN([C@H](CNC[C@H](O)C(F)(F)F)c2ccc(Cl)cc2)CCO1 ZINC000644545383 567558139 /nfs/dbraw/zinc/55/81/39/567558139.db2.gz RATGDSKHERAYTJ-CABCVRRESA-N 0 3 380.838 3.005 10 0 GGAEHN COc1c(Br)ccc(C)c1C(=O)N1CCN(c2ccncc2)CC1 ZINC000644548676 567558206 /nfs/dbraw/zinc/55/82/06/567558206.db2.gz GXXXQCMDYQFDKL-UHFFFAOYSA-N 0 3 390.281 3.124 10 0 GGAEHN Cc1nc(NCc2ccc(CN3CC[C@H](O)C3)cc2)ccc1Br ZINC000664234748 567559142 /nfs/dbraw/zinc/55/91/42/567559142.db2.gz AEZPAEOBOHDSHO-INIZCTEOSA-N 0 3 376.298 3.331 10 0 GGAEHN COc1cc(NCc2ccc(CN3CC[C@@H](O)C3)cc2)c(Br)cn1 ZINC000664235318 567559509 /nfs/dbraw/zinc/55/95/09/567559509.db2.gz FHZXWYSDACBPQC-OAHLLOKOSA-N 0 3 392.297 3.031 10 0 GGAEHN Cc1cc(Br)cnc1NCc1ccc(CN2CC[C@H](O)C2)cc1 ZINC000664238184 567559689 /nfs/dbraw/zinc/55/96/89/567559689.db2.gz XYVXKYADAITUIC-KRWDZBQOSA-N 0 3 376.298 3.331 10 0 GGAEHN Cc1cnc(NCc2ccc(CN3CC[C@@H](O)C3)cc2)c(Br)c1 ZINC000664238132 567559773 /nfs/dbraw/zinc/55/97/73/567559773.db2.gz WPECHHDGVHIADA-MRXNPFEDSA-N 0 3 376.298 3.331 10 0 GGAEHN Cc1nc(C)c(Br)c(NCc2ccc(CN3CC[C@@H](O)C3)cc2)n1 ZINC000664234745 567559794 /nfs/dbraw/zinc/55/97/94/567559794.db2.gz ACSHIXCVYRUPGB-MRXNPFEDSA-N 0 3 391.313 3.035 10 0 GGAEHN O=C(NC[C@@H]1CCN1C1CCCC1)c1c[nH]c2ncc(Br)cc12 ZINC000530029202 567561338 /nfs/dbraw/zinc/56/13/38/567561338.db2.gz TZCPZHGEFNMKCT-ZDUSSCGKSA-N 0 3 377.286 3.072 10 0 GGAEHN COC1CCC(CNCCS(=O)(=O)c2cccc(Br)c2)CC1 ZINC000644585359 567561465 /nfs/dbraw/zinc/56/14/65/567561465.db2.gz BHXHJQVAZPTLTL-UHFFFAOYSA-N 0 3 390.343 3.018 10 0 GGAEHN CCc1cnc(CCNC[C@@H](O)COc2cccc(Br)c2)s1 ZINC000644579255 567561595 /nfs/dbraw/zinc/56/15/95/567561595.db2.gz FFAHUBYWLUKFQJ-CYBMUJFWSA-N 0 3 385.327 3.040 10 0 GGAEHN C[C@]1(C(=O)NC[C@@H]2CCN2C2CCCC2)CC1(Br)Br ZINC000530022359 567562201 /nfs/dbraw/zinc/56/22/01/567562201.db2.gz LRENJDUNXUOGKX-WCQYABFASA-N 0 3 394.151 3.016 10 0 GGAEHN C[C@H](Oc1ccccc1Br)C(=O)NC[C@H]1CCN1C1CCCC1 ZINC000530031085 567562338 /nfs/dbraw/zinc/56/23/38/567562338.db2.gz ZEUJPVWPPRTTPQ-DZGCQCFKSA-N 0 3 381.314 3.350 10 0 GGAEHN C[C@@]1(C(=O)NC[C@H]2CCN2C2CCCC2)CC1(Br)Br ZINC000530022360 567562347 /nfs/dbraw/zinc/56/23/47/567562347.db2.gz LRENJDUNXUOGKX-YPMHNXCESA-N 0 3 394.151 3.016 10 0 GGAEHN CN(C)C[C@@H](NC(=O)[C@@H]1CCn2ccnc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031237 567562647 /nfs/dbraw/zinc/56/26/47/567562647.db2.gz DAGUYTYOTAMQBP-CZUORRHYSA-N 0 3 381.307 3.171 10 0 GGAEHN CN(C)C[C@H](NC(=O)[C@@H]1CCc2nccn2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031460 567562661 /nfs/dbraw/zinc/56/26/61/567562661.db2.gz JWWUSQLLGUSJDF-CJNGLKHVSA-N 0 3 381.307 3.171 10 0 GGAEHN O=C(Cc1c(F)ccc(Br)c1F)NC[C@H]1CCN1C1CCCC1 ZINC000530028192 567562680 /nfs/dbraw/zinc/56/26/80/567562680.db2.gz PGMOHSAVWXOYBM-GFCCVEGCSA-N 0 3 387.268 3.403 10 0 GGAEHN COc1cc(Br)ccc1CNC(=O)N(C)[C@H]1CCN(C(C)C)C1 ZINC000458683716 567564280 /nfs/dbraw/zinc/56/42/80/567564280.db2.gz UDKQMFHCTLWMMP-HNNXBMFYSA-N 0 3 384.318 3.082 10 0 GGAEHN COc1cc(Br)ccc1CNC[C@@H](O)COCc1ccccc1 ZINC000644625779 567565853 /nfs/dbraw/zinc/56/58/53/567565853.db2.gz SGHPCFALOUUZHF-QGZVFWFLSA-N 0 3 380.282 3.125 10 0 GGAEHN COc1cc(Br)ccc1CNC[C@H](O)COCc1ccccc1F ZINC000644625792 567566058 /nfs/dbraw/zinc/56/60/58/567566058.db2.gz VDBNFGQKGMWCOD-INIZCTEOSA-N 0 3 398.272 3.264 10 0 GGAEHN COC(=O)C[C@@](C)(NCCO[C@H]1CC1(F)F)c1ccc(Br)cc1 ZINC000595484844 567566926 /nfs/dbraw/zinc/56/69/26/567566926.db2.gz SKCQQCSXGPHXSQ-DZGCQCFKSA-N 0 3 392.240 3.241 10 0 GGAEHN NC(=O)[C@@H]1CCCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000505232973 567567354 /nfs/dbraw/zinc/56/73/54/567567354.db2.gz ZCWKPHWKTBJUKG-GFCCVEGCSA-N 0 3 380.311 3.270 10 0 GGAEHN Cn1nc2c(c1CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)CCCC2 ZINC000644651852 567567996 /nfs/dbraw/zinc/56/79/96/567567996.db2.gz UQRLGPAOTYNBRM-GFCCVEGCSA-N 0 3 384.307 3.135 10 0 GGAEHN CC(C)N1CC[C@@H](N(C)C(=O)N[C@@H]2CCOc3c(Br)cccc32)C1 ZINC000458728647 567569562 /nfs/dbraw/zinc/56/95/62/567569562.db2.gz MXNHJRPTDFZDMU-CZUORRHYSA-N 0 3 396.329 3.397 10 0 GGAEHN CCN(C(=O)NCCc1cc(Cl)ccc1Br)[C@H]1CCN(C)C1 ZINC000664496468 567571834 /nfs/dbraw/zinc/57/18/34/567571834.db2.gz VRFDBNVSDRJYHN-AWEZNQCLSA-N 0 3 388.737 3.381 10 0 GGAEHN CCN(C(=O)NCCc1cc(Cl)ccc1Br)[C@@H]1CCN(C)C1 ZINC000664496469 567572131 /nfs/dbraw/zinc/57/21/31/567572131.db2.gz VRFDBNVSDRJYHN-CQSZACIVSA-N 0 3 388.737 3.381 10 0 GGAEHN COC[C@H](NCC[S@@](=O)c1cc(Cl)ccc1Cl)C1CCOCC1 ZINC000595617605 567574101 /nfs/dbraw/zinc/57/41/01/567574101.db2.gz XGMVLHCJLVQUNJ-NPMXOYFQSA-N 0 3 380.337 3.132 10 0 GGAEHN COc1cc(CN[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(Br)cn1 ZINC000621290946 567574416 /nfs/dbraw/zinc/57/44/16/567574416.db2.gz AALSSWSXUBWRKM-SJLPKXTDSA-N 0 3 376.298 3.388 10 0 GGAEHN C[C@H]1C[C@@H](N(C)C(=O)N[C@@H]2C[C@H]2c2cccc(Br)c2)CCN1C ZINC000571600600 567574491 /nfs/dbraw/zinc/57/44/91/567574491.db2.gz QKJRVULWHSNNHN-OSMBCOQSSA-N 0 3 380.330 3.429 10 0 GGAEHN O=C(Nc1cnc2c(Br)cccn12)[C@H]1CCCN1C1CCCC1 ZINC000552296514 567575120 /nfs/dbraw/zinc/57/51/20/567575120.db2.gz KXKGVOVFJYCDKU-CQSZACIVSA-N 0 3 377.286 3.442 10 0 GGAEHN COc1cc(CN[C@H]2CCC[C@H]2Cc2cnn(C)c2)c(Br)cn1 ZINC000621321682 567577492 /nfs/dbraw/zinc/57/74/92/567577492.db2.gz TWUMNRPGXBZANI-BBRMVZONSA-N 0 3 379.302 3.087 10 0 GGAEHN C[C@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccc(F)c(Br)c1 ZINC000552333460 567578441 /nfs/dbraw/zinc/57/84/41/567578441.db2.gz FZEFTBRTUQSZKQ-WCQYABFASA-N 0 3 393.322 3.053 10 0 GGAEHN C[C@H](NC(=O)N1CC[C@H](N2CC=CC2)C1)c1ccc(F)c(Br)c1 ZINC000458858212 567579859 /nfs/dbraw/zinc/57/98/59/567579859.db2.gz SYKKXOXYBPSFAA-JSGCOSHPSA-N 0 3 382.277 3.305 10 0 GGAEHN CCCOc1c(Br)cc(C(=O)N2CC[C@@H]3CN(C)C[C@@H]32)cc1OC ZINC000644819959 567580287 /nfs/dbraw/zinc/58/02/87/567580287.db2.gz UMAJZNOCNOLAAE-DOMZBBRYSA-N 0 3 397.313 3.023 10 0 GGAEHN COc1cc(Br)c(CNc2ccc3c(c2)OCCNC3)cc1O ZINC000530181168 567580431 /nfs/dbraw/zinc/58/04/31/567580431.db2.gz IEBNHHUHFFYUHK-UHFFFAOYSA-N 0 3 379.254 3.257 10 0 GGAEHN CN(CCCOc1cccc(I)c1)CC1=CCCOC1 ZINC000595754191 567580635 /nfs/dbraw/zinc/58/06/35/567580635.db2.gz WMAHLPUCKGCDQQ-UHFFFAOYSA-N 0 3 387.261 3.339 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)CCOc2ccc(Cl)cc2Br)C1 ZINC000644814330 567580796 /nfs/dbraw/zinc/58/07/96/567580796.db2.gz JOOKBSYJEUCYGQ-FZMZJTMJSA-N 0 3 387.705 3.034 10 0 GGAEHN CN1C[C@@H]2CCN(C(=O)CCc3nc4cc(Br)ccc4s3)[C@@H]2C1 ZINC000644818940 567580882 /nfs/dbraw/zinc/58/08/82/567580882.db2.gz OYSBVLCKEMGGHM-SMDDNHRTSA-N 0 3 394.338 3.154 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)CCOc3ccc(Cl)cc3Br)[C@H]2C1 ZINC000644814331 567580932 /nfs/dbraw/zinc/58/09/32/567580932.db2.gz JOOKBSYJEUCYGQ-RISCZKNCSA-N 0 3 387.705 3.034 10 0 GGAEHN Cc1cc(SCC(=O)N2CC[C@@H]3CN(C)C[C@H]32)c(C)cc1Br ZINC000644820138 567581155 /nfs/dbraw/zinc/58/11/55/567581155.db2.gz UQYMDEBRKXANCL-UKRRQHHQSA-N 0 3 383.355 3.321 10 0 GGAEHN CNC(=O)[C@@H](C)Oc1ccc(Br)cc1CNCC[C@@H]1CC1(F)F ZINC000621377367 567581193 /nfs/dbraw/zinc/58/11/93/567581193.db2.gz WSIHISXBVSHIQR-ZYHUDNBSSA-N 0 3 391.256 3.097 10 0 GGAEHN Fc1ccc(CC2(NCc3cncnc3)CCOCC2)c(Br)c1 ZINC000571704783 567582008 /nfs/dbraw/zinc/58/20/08/567582008.db2.gz AMYPAYALPIWYFL-UHFFFAOYSA-N 0 3 380.261 3.260 10 0 GGAEHN Cc1ccc(I)c(C(=O)N2CC[C@]3(C2)CCCN(C)C3)c1 ZINC000505585572 567584739 /nfs/dbraw/zinc/58/47/39/567584739.db2.gz FSRXPJWXIGMPIZ-QGZVFWFLSA-N 0 3 398.288 3.158 10 0 GGAEHN CSCCCCN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000480189065 567586045 /nfs/dbraw/zinc/58/60/45/567586045.db2.gz ADAPHGFNKUZCCA-CYBMUJFWSA-N 0 3 378.357 3.400 10 0 GGAEHN CC[C@H]1CN(C)CCN1CCCOc1cccc(I)c1 ZINC000552397507 567587553 /nfs/dbraw/zinc/58/75/53/567587553.db2.gz GMMASOXLCRAMJR-HNNXBMFYSA-N 0 3 388.293 3.086 10 0 GGAEHN CCN(C(=O)N[C@@H]1CSc2ccc(Br)cc21)[C@@H]1CCN(C)C1 ZINC000664773547 567588137 /nfs/dbraw/zinc/58/81/37/567588137.db2.gz UVFQCSDCJQMONX-TZMCWYRMSA-N 0 3 384.343 3.332 10 0 GGAEHN O[C@@H](CN[C@H](c1cccnc1)C1CC1)COc1cc(F)cc(Br)c1 ZINC000439458263 567588506 /nfs/dbraw/zinc/58/85/06/567588506.db2.gz SOBJVVHOTOYRQC-WMZOPIPTSA-N 0 3 395.272 3.464 10 0 GGAEHN O=S1(=O)CC[C@@H](NCCCc2ccccn2)c2cc(Br)ccc21 ZINC000480206319 567589023 /nfs/dbraw/zinc/58/90/23/567589023.db2.gz ZOSRQUNOEFJUHQ-MRXNPFEDSA-N 0 3 395.322 3.285 10 0 GGAEHN COC[C@H](NC[C@@H](O)COc1cc(F)cc(Br)c1)c1ccccc1 ZINC000439459965 567589443 /nfs/dbraw/zinc/58/94/43/567589443.db2.gz WZCSJAFWCSZWQO-AEFFLSMTSA-N 0 3 398.272 3.305 10 0 GGAEHN O=C(NC/C=C/c1ccc(Br)cc1)N1CC[C@H](N2CC=CC2)C1 ZINC000458958321 567589583 /nfs/dbraw/zinc/58/95/83/567589583.db2.gz ACVMTKAHNWBDBX-IDOMTICXSA-N 0 3 376.298 3.118 10 0 GGAEHN CN(C)CCN(C(=O)CSCc1ccc(Br)cc1F)C1CC1 ZINC000505662166 567590218 /nfs/dbraw/zinc/59/02/18/567590218.db2.gz VWCTYKILRJAQCB-UHFFFAOYSA-N 0 3 389.334 3.374 10 0 GGAEHN CN(C(=O)NC/C=C/c1ccc(Br)cc1)[C@@H]1CCN(C2CC2)C1 ZINC000458974368 567591092 /nfs/dbraw/zinc/59/10/92/567591092.db2.gz NHCFLMFMZLHOSX-RCAFFNEUSA-N 0 3 378.314 3.340 10 0 GGAEHN Cc1cc(C(=O)N(CCN(C)C)C2CC2)nn1-c1ccc(Br)cc1 ZINC000505669552 567591298 /nfs/dbraw/zinc/59/12/98/567591298.db2.gz OHRAOIROGFKXBT-UHFFFAOYSA-N 0 3 391.313 3.109 10 0 GGAEHN CN(C(=O)NC/C=C\c1ccc(Br)cc1)[C@@H]1CCN(C2CC2)C1 ZINC000458974364 567591517 /nfs/dbraw/zinc/59/15/17/567591517.db2.gz NHCFLMFMZLHOSX-BAHPRDJBSA-N 0 3 378.314 3.340 10 0 GGAEHN CCN(C(=O)N[C@H]1CCOc2c(Br)cccc21)[C@H]1CCN(CC)C1 ZINC000664822727 567592718 /nfs/dbraw/zinc/59/27/18/567592718.db2.gz BSEMJFPQFXUCMV-BBRMVZONSA-N 0 3 396.329 3.398 10 0 GGAEHN Cc1c(C(=O)NC[C@@]2(N(C)C)CCSC2)cnn1-c1ccccc1Cl ZINC000480275863 567593110 /nfs/dbraw/zinc/59/31/10/567593110.db2.gz DVUFPUQYQIUPAL-SFHVURJKSA-N 0 3 378.929 3.001 10 0 GGAEHN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NC[C@@]1(N(C)C)CCSC1 ZINC000480274848 567593439 /nfs/dbraw/zinc/59/34/39/567593439.db2.gz OOBZYWNGZBWAQW-ZBEGNZNMSA-N 0 3 377.337 3.314 10 0 GGAEHN CCN(C(=O)NCC(F)(F)c1ccc(Br)cc1)[C@H]1CCN(C)C1 ZINC000621553417 567593650 /nfs/dbraw/zinc/59/36/50/567593650.db2.gz ZWCYRKQDENKTDG-AWEZNQCLSA-N 0 3 390.272 3.277 10 0 GGAEHN O[C@H](COc1c(Cl)cccc1Cl)CN1CCC(O[C@H]2CCOC2)CC1 ZINC000480309080 567595797 /nfs/dbraw/zinc/59/57/97/567595797.db2.gz RAWXLCVQNNKGPZ-ZFWWWQNUSA-N 0 3 390.307 3.003 10 0 GGAEHN COC(=O)CC[C@@H](N)C(=O)NC1(c2ccc(Br)cc2)CCCCC1 ZINC000595959121 567596806 /nfs/dbraw/zinc/59/68/06/567596806.db2.gz BGQWCDWQJRJXCV-OAHLLOKOSA-N 0 3 397.313 3.005 10 0 GGAEHN O=C(N[C@H]1CCc2c1ccc(F)c2Br)N1CC[C@@H](N2CC=CC2)C1 ZINC000459072734 567597923 /nfs/dbraw/zinc/59/79/23/567597923.db2.gz SUZOEVMCLDXYQC-WBMJQRKESA-N 0 3 394.288 3.231 10 0 GGAEHN C[C@@H]1CN(CCCNc2ccc(Br)c(C(F)(F)F)n2)CCCO1 ZINC000571906195 567598402 /nfs/dbraw/zinc/59/84/02/567598402.db2.gz XPGNEWYUJXNBOE-LLVKDONJSA-N 0 3 396.251 3.198 10 0 GGAEHN CCOc1c(Br)cc(CNCC[C@H](O)C(F)(F)F)cc1OC ZINC000571926019 567599120 /nfs/dbraw/zinc/59/91/20/567599120.db2.gz RNQFYEXYGODECK-LBPRGKRZSA-N 0 3 386.208 3.259 10 0 GGAEHN COC(=O)C1CCN(CCCNC(=O)Nc2cc(Cl)cc(Cl)c2)CC1 ZINC000505845109 567599290 /nfs/dbraw/zinc/59/92/90/567599290.db2.gz NHEAGOKJCMOYMH-UHFFFAOYSA-N 0 3 388.295 3.390 10 0 GGAEHN O=C(Nc1ccc(Br)cc1)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000665074485 567607847 /nfs/dbraw/zinc/60/78/47/567607847.db2.gz CNDXIIJRCOQFAB-VXGBXAGGSA-N 0 3 382.176 3.372 10 0 GGAEHN O=C(Nc1cccc(Br)c1)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000665075060 567607938 /nfs/dbraw/zinc/60/79/38/567607938.db2.gz IROQNHBMBODHLG-NEPJUHHUSA-N 0 3 382.176 3.372 10 0 GGAEHN O=C(Nc1ccc(Br)cc1)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000665074478 567608133 /nfs/dbraw/zinc/60/81/33/567608133.db2.gz CNDXIIJRCOQFAB-NEPJUHHUSA-N 0 3 382.176 3.372 10 0 GGAEHN COCCN1CCC(N[C@@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621749961 567609058 /nfs/dbraw/zinc/60/90/58/567609058.db2.gz FUPCGPCHMCCQJU-HNNXBMFYSA-N 0 3 377.273 3.456 10 0 GGAEHN CN1CCN(CCCCN[C@@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621750941 567609146 /nfs/dbraw/zinc/60/91/46/567609146.db2.gz ZFXCQSPOVXESHO-INIZCTEOSA-N 0 3 390.316 3.373 10 0 GGAEHN CN(C)C1(CN[C@@H](c2ccc(Br)cc2)C(F)F)CCOCC1 ZINC000621752640 567609199 /nfs/dbraw/zinc/60/91/99/567609199.db2.gz BNJHIKFKROAJCK-AWEZNQCLSA-N 0 3 377.273 3.456 10 0 GGAEHN O=S1(=O)CC[C@@H](NCC[C@H]2CC2(F)F)c2cc(Br)ccc21 ZINC000621768498 567610217 /nfs/dbraw/zinc/61/02/17/567610217.db2.gz QIASCNCLZFGSNL-JOYOIKCWSA-N 0 3 380.254 3.303 10 0 GGAEHN O=S1(=O)CC[C@H](NCC[C@@H]2CC2(F)F)c2cc(Br)ccc21 ZINC000621768499 567610397 /nfs/dbraw/zinc/61/03/97/567610397.db2.gz QIASCNCLZFGSNL-SKDRFNHKSA-N 0 3 380.254 3.303 10 0 GGAEHN O=S1(=O)CC[C@H](NCC[C@H]2CC2(F)F)c2cc(Br)ccc21 ZINC000621768497 567610589 /nfs/dbraw/zinc/61/05/89/567610589.db2.gz QIASCNCLZFGSNL-CABZTGNLSA-N 0 3 380.254 3.303 10 0 GGAEHN CS[C@@H]1CN(C(=O)Cc2cccc(Br)c2C)C[C@@H]1N1CCCC1 ZINC000480575026 567612625 /nfs/dbraw/zinc/61/26/25/567612625.db2.gz FESDNPIPGBVBHT-DLBZAZTESA-N 0 3 397.382 3.338 10 0 GGAEHN CCN(C(=O)Nc1nnc(SCc2ccccc2)s1)[C@H]1CCN(C)C1 ZINC000665190026 567612955 /nfs/dbraw/zinc/61/29/55/567612955.db2.gz WRJWIBDZSNCWFT-AWEZNQCLSA-N 0 3 377.539 3.388 10 0 GGAEHN CC(C)[C@]1(CO)CCCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000645248236 567614322 /nfs/dbraw/zinc/61/43/22/567614322.db2.gz LVKDOVAUQIRLIR-KBXCAEBGSA-N 0 3 376.324 3.464 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)c1cc2c(cc1Br)OCO2 ZINC000621861290 567616645 /nfs/dbraw/zinc/61/66/45/567616645.db2.gz XFLMXENHYAPNRL-TXEJJXNPSA-N 0 3 383.286 3.171 10 0 GGAEHN CC1(C)CC[C@H](NCc2nc(C[NH3+])cc(=O)[n-]2)c2cc(Br)ccc21 ZINC000665292574 567617079 /nfs/dbraw/zinc/61/70/79/567617079.db2.gz DCHSESIOOXZJAQ-HNNXBMFYSA-N 0 3 391.313 3.306 10 0 GGAEHN C[C@H](NCc1nc(C[NH3+])cc(=O)[n-]1)c1cc2cc(Br)ccc2o1 ZINC000665291849 567617218 /nfs/dbraw/zinc/61/72/18/567617218.db2.gz MHSDCXRZKXXUBD-VIFPVBQESA-N 0 3 377.242 3.000 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)c1c(C)cc(Br)cc1Cl ZINC000480650733 567618424 /nfs/dbraw/zinc/61/84/24/567618424.db2.gz ICBNUGBAEBHELJ-ZDUSSCGKSA-N 0 3 389.721 3.252 10 0 GGAEHN O=C(c1cscc1C(F)(F)F)N1CC[C@H](OCCN2CCCCC2)C1 ZINC000621912885 567620784 /nfs/dbraw/zinc/62/07/84/567620784.db2.gz VYLVDKJMNINSPZ-ZDUSSCGKSA-N 0 3 376.444 3.484 10 0 GGAEHN CC(C)(C)N1CC[C@@H]1CNC(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1 ZINC000665362481 567623094 /nfs/dbraw/zinc/62/30/94/567623094.db2.gz FGEVARBHLMKLEJ-CQSZACIVSA-N 0 3 388.339 3.370 10 0 GGAEHN CCOc1cc(C[NH2+]CCc2c(C)nn(C)c2C)cc(Br)c1[O-] ZINC000506345466 567623129 /nfs/dbraw/zinc/62/31/29/567623129.db2.gz AOTCFQLBTPMMOX-UHFFFAOYSA-N 0 3 382.302 3.236 10 0 GGAEHN CCOc1cc(C[NH2+]C[C@@H](CO)c2ccccc2)cc(Br)c1[O-] ZINC000459426224 567623308 /nfs/dbraw/zinc/62/33/08/567623308.db2.gz NNGNHFIFGLEVEO-HNNXBMFYSA-N 0 3 380.282 3.419 10 0 GGAEHN CCN(CC)CCN(C(=O)[C@H]1CCCS1)c1ccc(Br)cn1 ZINC000572246868 567625869 /nfs/dbraw/zinc/62/58/69/567625869.db2.gz NUJKLIXBCBNFDK-CQSZACIVSA-N 0 3 386.359 3.415 10 0 GGAEHN CN(C)CCN(C(=O)c1cc(Br)cc(N2CCCC2)c1)C1CC1 ZINC000621957761 567626134 /nfs/dbraw/zinc/62/61/34/567626134.db2.gz GDFQOYHKVROJFC-UHFFFAOYSA-N 0 3 380.330 3.216 10 0 GGAEHN O=C(NC[C@H](c1cccs1)N1CCCC1)C1(C(F)(F)F)CCOCC1 ZINC000665537179 567628570 /nfs/dbraw/zinc/62/85/70/567628570.db2.gz JCNSVFBZYPMMAK-CYBMUJFWSA-N 0 3 376.444 3.360 10 0 GGAEHN CCN1CCC[C@H]1CNC(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000665529393 567628700 /nfs/dbraw/zinc/62/87/00/567628700.db2.gz JGTQYWSWIZUKJV-INIZCTEOSA-N 0 3 380.330 3.263 10 0 GGAEHN CCOc1c(Br)cc(CNC[C@H](CO)c2cccnc2)cc1OC ZINC000572318604 567631056 /nfs/dbraw/zinc/63/10/56/567631056.db2.gz PVPFWWWCQNZONY-OAHLLOKOSA-N 0 3 395.297 3.117 10 0 GGAEHN C[C@@H](NCCNC(=O)c1ccccc1)c1ccc(I)cc1 ZINC000480792822 567631558 /nfs/dbraw/zinc/63/15/58/567631558.db2.gz OHWFUMYNYCOGTG-CYBMUJFWSA-N 0 3 394.256 3.372 10 0 GGAEHN O=C(NC[C@@]1(O)CCN(Cc2ccccc2)C1)c1cc(Cl)sc1Cl ZINC000440502010 567631819 /nfs/dbraw/zinc/63/18/19/567631819.db2.gz GLZDZWIXOWRRIQ-KRWDZBQOSA-N 0 3 385.316 3.422 10 0 GGAEHN CCCN(C(=O)N[C@H]1CCOc2c(Br)cccc21)[C@H]1CCN(C)C1 ZINC000645491984 567632422 /nfs/dbraw/zinc/63/24/22/567632422.db2.gz FZVJLKXXMWJJQZ-BBRMVZONSA-N 0 3 396.329 3.398 10 0 GGAEHN CCCN(C(=O)N[C@@H]1CCOc2c(Br)cccc21)[C@H]1CCN(C)C1 ZINC000645491991 567632444 /nfs/dbraw/zinc/63/24/44/567632444.db2.gz FZVJLKXXMWJJQZ-XJKSGUPXSA-N 0 3 396.329 3.398 10 0 GGAEHN C[C@@H](NC[C@H]1CCN(S(=O)(=O)c2cccs2)C1)c1cc(F)ccc1F ZINC000506630417 567634206 /nfs/dbraw/zinc/63/42/06/567634206.db2.gz LEVUPGMGJBGMES-CHWSQXEVSA-N 0 3 386.489 3.388 10 0 GGAEHN CN1CCC2(CC1)CN(C(=O)N[C@H]1CCCc3sc(Cl)cc31)CCO2 ZINC000645514733 567635194 /nfs/dbraw/zinc/63/51/94/567635194.db2.gz GLYBORJTDDWEIM-AWEZNQCLSA-N 0 3 383.945 3.285 10 0 GGAEHN C[C@@H]1CCN(CC(=O)N2CCC(Oc3cccc(Br)c3)CC2)C1 ZINC000553221515 567636776 /nfs/dbraw/zinc/63/67/76/567636776.db2.gz FUTDSPQLOYUANA-CQSZACIVSA-N 0 3 381.314 3.161 10 0 GGAEHN CCOc1cc(CNC2(C(=O)N(C)C)CCCCC2)cc(Br)c1O ZINC000459585730 567639140 /nfs/dbraw/zinc/63/91/40/567639140.db2.gz VFQAIXZQNDXRHK-UHFFFAOYSA-N 0 3 399.329 3.434 10 0 GGAEHN CCOc1cc(C[NH2+][C@@H]([C@@H](CO)C2CC2)C2CC2)cc(Br)c1[O-] ZINC000459591081 567641361 /nfs/dbraw/zinc/64/13/61/567641361.db2.gz ZRBHQKGNGLGXDG-WMLDXEAASA-N 0 3 384.314 3.440 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)c(C)c1CNCCc1cn(C)cn1 ZINC000459667866 567648570 /nfs/dbraw/zinc/64/85/70/567648570.db2.gz SNLORWFFLKISFD-UHFFFAOYSA-N 0 3 388.313 3.317 10 0 GGAEHN C[C@H]1CCC[C@H](C)N1CCNS(=O)(=O)Cc1ccc(Br)cc1 ZINC000480988430 567648930 /nfs/dbraw/zinc/64/89/30/567648930.db2.gz NSQMVXGNZUUSDM-KBPBESRZSA-N 0 3 389.359 3.131 10 0 GGAEHN C[C@H]1C[C@H](NC(=O)CSCc2cc(-c3cccs3)on2)CN1C1CC1 ZINC000440925710 567649252 /nfs/dbraw/zinc/64/92/52/567649252.db2.gz NDLFAGDYELJAET-STQMWFEESA-N 0 3 377.535 3.378 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000440963827 567649885 /nfs/dbraw/zinc/64/98/85/567649885.db2.gz WJQUISJUDCBJIU-IOASZLSFSA-N 0 3 380.330 3.305 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000440963835 567650204 /nfs/dbraw/zinc/65/02/04/567650204.db2.gz WJQUISJUDCBJIU-XJKCOSOUSA-N 0 3 380.330 3.305 10 0 GGAEHN CCN(C(=O)Nc1cc(Br)ccc1-n1cccn1)[C@@H]1CCN(C)C1 ZINC000666038814 567650400 /nfs/dbraw/zinc/65/04/00/567650400.db2.gz ZIOPYMBDUMAENY-CQSZACIVSA-N 0 3 392.301 3.193 10 0 GGAEHN CCN1CC[C@H]2OCCN(c3ccc(Br)c(C(F)(F)F)n3)[C@H]2C1 ZINC000572612831 567653734 /nfs/dbraw/zinc/65/37/34/567653734.db2.gz IOKILLKPUTWPGA-NWDGAFQWSA-N 0 3 394.235 3.162 10 0 GGAEHN COc1ccc2c(c1)OCC[C@@H]2N[C@H](C)Cn1cc(Br)ccc1=O ZINC000666093949 567654163 /nfs/dbraw/zinc/65/41/63/567654163.db2.gz VBUYAWWFSHQOEQ-WBMJQRKESA-N 0 3 393.281 3.121 10 0 GGAEHN CC(=O)NC1CCC(N(C)Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000481054557 567654500 /nfs/dbraw/zinc/65/45/00/567654500.db2.gz GVENEEJISUSECY-UHFFFAOYSA-N 0 3 379.302 3.205 10 0 GGAEHN NC[C@@H]1c2ccccc2CCN1C(=O)NCc1ccc(Br)c(F)c1 ZINC000572639152 567655039 /nfs/dbraw/zinc/65/50/39/567655039.db2.gz QRKYHUNEDFJMCD-QGZVFWFLSA-N 0 3 392.272 3.356 10 0 GGAEHN Cc1ccc([C@H](CNc2ncc(I)cn2)N(C)C)cc1 ZINC000572662611 567656526 /nfs/dbraw/zinc/65/65/26/567656526.db2.gz PQPJKHWIRUPVJC-AWEZNQCLSA-N 0 3 382.249 3.104 10 0 GGAEHN COC(=O)c1cc(NC(=O)NC[C@H]2CCN2C(C)(C)C)ccc1Br ZINC000596821049 567657581 /nfs/dbraw/zinc/65/75/81/567657581.db2.gz SFNAZVSWIBZYFG-GFCCVEGCSA-N 0 3 398.301 3.230 10 0 GGAEHN CCN(C(=O)Nc1cc(I)ccc1C)[C@@H]1CCN(C)C1 ZINC000596844781 567658160 /nfs/dbraw/zinc/65/81/60/567658160.db2.gz LOAHLNMZAYCGIJ-CYBMUJFWSA-N 0 3 387.265 3.158 10 0 GGAEHN COC1(C(=O)NCC2(N3CCSCC3)CCCC2)CCC(F)(F)CC1 ZINC000666343691 567665727 /nfs/dbraw/zinc/66/57/27/567665727.db2.gz LZIDKGNWVNQPSW-UHFFFAOYSA-N 0 3 376.513 3.059 10 0 GGAEHN CCN1CC[C@H](NCCCS(=O)(=O)C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000572783461 567666028 /nfs/dbraw/zinc/66/60/28/567666028.db2.gz PWYJEUKARIDBKQ-ROUUACIJSA-N 0 3 390.952 3.417 10 0 GGAEHN CCOC(=O)c1cc(C(F)(F)F)sc1NC(=O)NC[C@@H]1CCCN1C ZINC000572840130 567670343 /nfs/dbraw/zinc/67/03/43/567670343.db2.gz PTDZLIBHPAKUAF-VIFPVBQESA-N 0 3 379.404 3.159 10 0 GGAEHN CN(C[C@H]1CCCN1C)C(=O)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000666400581 567672336 /nfs/dbraw/zinc/67/23/36/567672336.db2.gz NGKWOLBPNUZIKB-GDBMZVCRSA-N 0 3 398.370 3.473 10 0 GGAEHN CC[C@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccc(Br)cc1 ZINC000507268279 567673123 /nfs/dbraw/zinc/67/31/23/567673123.db2.gz QEBOJIWFTIMODG-HOTGVXAUSA-N 0 3 389.359 3.304 10 0 GGAEHN CCn1c(-c2cccc(Br)c2)nnc1N(C)[C@H]1CCN(C2CC2)C1 ZINC000460175467 567676264 /nfs/dbraw/zinc/67/62/64/567676264.db2.gz IGOAMSZDPKKZSK-INIZCTEOSA-N 0 3 390.329 3.400 10 0 GGAEHN CN(C)[C@@H]1CCCN(C(=O)N[C@H]2CSCc3ccc(Br)cc32)C1 ZINC000666402690 567676410 /nfs/dbraw/zinc/67/64/10/567676410.db2.gz GWWCWRMLTSTOQJ-ZBFHGGJFSA-N 0 3 398.370 3.473 10 0 GGAEHN Cc1nc(NC(=O)N[C@H](Cc2ccccc2)CN(C)C)ccc1Br ZINC000481395810 567676528 /nfs/dbraw/zinc/67/65/28/567676528.db2.gz DNWUZYFVIMHXFW-OAHLLOKOSA-N 0 3 391.313 3.447 10 0 GGAEHN CCCN1CCC[C@H]1CNC(=O)c1c(F)cccc1I ZINC000553690590 567676657 /nfs/dbraw/zinc/67/66/57/567676657.db2.gz QNIYWHMJFFSDDO-NSHDSACASA-N 0 3 390.240 3.035 10 0 GGAEHN CN(C)[C@@H]1CCCN(C(=O)N[C@@H]2CSCc3ccc(Br)cc32)C1 ZINC000666402687 567676889 /nfs/dbraw/zinc/67/68/89/567676889.db2.gz GWWCWRMLTSTOQJ-GDBMZVCRSA-N 0 3 398.370 3.473 10 0 GGAEHN Cc1nc(NC(=O)N[C@@H](Cc2ccccc2)CN(C)C)ccc1Br ZINC000481395809 567676953 /nfs/dbraw/zinc/67/69/53/567676953.db2.gz DNWUZYFVIMHXFW-HNNXBMFYSA-N 0 3 391.313 3.447 10 0 GGAEHN CCn1c(-c2cccc(Br)c2)nnc1N1CCCN(CC)CC1 ZINC000460242966 567680369 /nfs/dbraw/zinc/68/03/69/567680369.db2.gz GQVYWHMWTHLDFR-UHFFFAOYSA-N 0 3 378.318 3.260 10 0 GGAEHN CC[NH+](CC)[C@H](C[N-]S(=O)(=O)c1cccnc1C(F)(F)F)CC(C)C ZINC000553763998 567682144 /nfs/dbraw/zinc/68/21/44/567682144.db2.gz NVJZOEMCQAVBAF-ZDUSSCGKSA-N 0 3 381.464 3.135 10 0 GGAEHN CC(C)C[C@H](C)C[C@@H](C)NCc1ccc(S(=O)(=O)N2CCOCC2)s1 ZINC000507496357 567682206 /nfs/dbraw/zinc/68/22/06/567682206.db2.gz OHEDFGQJWXOYFX-JKSUJKDBSA-N 0 3 388.599 3.319 10 0 GGAEHN CC(C)C[C@@H](C)C[C@@H](C)NCc1ccc(S(=O)(=O)N2CCOCC2)s1 ZINC000507496356 567682322 /nfs/dbraw/zinc/68/23/22/567682322.db2.gz OHEDFGQJWXOYFX-HZPDHXFCSA-N 0 3 388.599 3.319 10 0 GGAEHN Cc1ncc(CN2CC[C@@H](Cc3cccc(I)c3)C2)n1C ZINC000597134503 567683436 /nfs/dbraw/zinc/68/34/36/567683436.db2.gz HIQVCRUQRTZFOL-HNNXBMFYSA-N 0 3 395.288 3.398 10 0 GGAEHN CCn1c(-c2ccc(Br)s2)nnc1N(C)[C@@H]1CCN(C2CC2)C1 ZINC000460299387 567683433 /nfs/dbraw/zinc/68/34/33/567683433.db2.gz DJCXFEIGIXEYBW-GFCCVEGCSA-N 0 3 396.358 3.462 10 0 GGAEHN COc1cc(C[NH2+]CC2CCN(CC(F)F)CC2)cc(Br)c1[O-] ZINC000623088459 567684418 /nfs/dbraw/zinc/68/44/18/567684418.db2.gz MYRRCJMXJHQVHA-UHFFFAOYSA-N 0 3 393.272 3.230 10 0 GGAEHN CS[C@H]1CN(CC(=O)Nc2cc(Cl)ccc2Cl)C[C@@H]1N1CCCC1 ZINC000460351909 567684566 /nfs/dbraw/zinc/68/45/66/567684566.db2.gz BDOLKKKYMPLXNS-HOTGVXAUSA-N 0 3 388.364 3.444 10 0 GGAEHN CCOc1cc(C[NH2+][C@@H]2CCC[C@@H]([S@@](C)=O)C2)cc(Br)c1[O-] ZINC000597184827 567687165 /nfs/dbraw/zinc/68/71/65/567687165.db2.gz QJYMHOCUCSNCCV-GIYNXVAASA-N 0 3 390.343 3.333 10 0 GGAEHN CCN(C(=O)c1cc(I)c(C)cc1C)[C@@H]1CCN(C)C1 ZINC000597947197 567728251 /nfs/dbraw/zinc/72/82/51/567728251.db2.gz VFILHSNNAWRYBD-CYBMUJFWSA-N 0 3 386.277 3.074 10 0 GGAEHN COC(=O)c1ccc2c(c1)[C@H](CNCc1c(Br)cnn1C)CCC2 ZINC000597202313 567688449 /nfs/dbraw/zinc/68/84/49/567688449.db2.gz XMCZZBUZSPJCSC-AWEZNQCLSA-N 0 3 392.297 3.179 10 0 GGAEHN COCCn1c(SC[C@H](C)N(C)C)nc2sc3c(c2c1=O)CCCC3 ZINC000460463506 567690259 /nfs/dbraw/zinc/69/02/59/567690259.db2.gz ZWFWFPODODPOJP-LBPRGKRZSA-N 0 3 381.567 3.025 10 0 GGAEHN COCCn1c(SC[C@@H](C)N(C)C)nc2sc3c(c2c1=O)CCCC3 ZINC000460463504 567690704 /nfs/dbraw/zinc/69/07/04/567690704.db2.gz ZWFWFPODODPOJP-GFCCVEGCSA-N 0 3 381.567 3.025 10 0 GGAEHN COC(=O)c1ccc(CNCC2(O)CCC(F)(F)CC2)c(Br)c1 ZINC000597231394 567691678 /nfs/dbraw/zinc/69/16/78/567691678.db2.gz NCWKTNXBEGJYBD-UHFFFAOYSA-N 0 3 392.240 3.266 10 0 GGAEHN O=C(CCNC[C@H]1COc2ccccc2O1)Nc1cccc(Br)c1 ZINC000573165585 567692063 /nfs/dbraw/zinc/69/20/63/567692063.db2.gz IXPZPMQXKWQPAH-HNNXBMFYSA-N 0 3 391.265 3.207 10 0 GGAEHN CC[C@@H](NC[C@](C)(O)CCC(C)C)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000481652500 567693078 /nfs/dbraw/zinc/69/30/78/567693078.db2.gz AOTDGBJQDUGDJQ-SJLPKXTDSA-N 0 3 390.977 3.476 10 0 GGAEHN CC(C)[C@H](NCC(=O)Nc1ccc(Br)cc1)C1(CO)CC=CC1 ZINC000646085002 567693194 /nfs/dbraw/zinc/69/31/94/567693194.db2.gz GTVLXQLDAXPSAH-KRWDZBQOSA-N 0 3 381.314 3.331 10 0 GGAEHN CC(C)[C@H](NCC(=O)Nc1ccc(Br)cc1F)C1(CO)CC=CC1 ZINC000646084982 567693209 /nfs/dbraw/zinc/69/32/09/567693209.db2.gz GMNUFVKQESEXTC-KRWDZBQOSA-N 0 3 399.304 3.470 10 0 GGAEHN CC(C)[C@H](NCC(=O)Nc1ccccc1Br)C1(CO)CC=CC1 ZINC000646085461 567693259 /nfs/dbraw/zinc/69/32/59/567693259.db2.gz FBRSCETYKPBHSG-KRWDZBQOSA-N 0 3 381.314 3.331 10 0 GGAEHN O=C(c1cc2c(s1)CCNC2)N1CCc2ccc(F)c(Br)c2C1 ZINC000623232324 567693633 /nfs/dbraw/zinc/69/36/33/567693633.db2.gz FXYCIFTUUPZWLE-UHFFFAOYSA-N 0 3 395.297 3.494 10 0 GGAEHN CC1(C)CC[C@H](NCC(=O)N2CCOCC2)c2cc(Br)ccc21 ZINC000481672437 567693941 /nfs/dbraw/zinc/69/39/41/567693941.db2.gz ZODRKVCRRUESJE-INIZCTEOSA-N 0 3 381.314 3.010 10 0 GGAEHN CCCCN([C@H]1CCN(CC(F)(F)F)C1=O)[C@@H]1CCc2ncsc2C1 ZINC000646129168 567695169 /nfs/dbraw/zinc/69/51/69/567695169.db2.gz YUMQMBHSMPUGIH-OCCSQVGLSA-N 0 3 375.460 3.266 10 0 GGAEHN CN(C)[C@]1(CNC(=O)N[C@H]2COc3c2ccc(Cl)c3Cl)CCSC1 ZINC000481699174 567697196 /nfs/dbraw/zinc/69/71/96/567697196.db2.gz VYULMHPKVPPQIK-LRDDRELGSA-N 0 3 390.336 3.163 10 0 GGAEHN CN(C)[C@@]1(CNC(=O)N[C@@H]2COc3c2ccc(Cl)c3Cl)CCSC1 ZINC000481699175 567697571 /nfs/dbraw/zinc/69/75/71/567697571.db2.gz VYULMHPKVPPQIK-MLGOLLRUSA-N 0 3 390.336 3.163 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)NC[C@@H](C)N1CCC[C@H](C)C1 ZINC000460718431 567699711 /nfs/dbraw/zinc/69/97/11/567699711.db2.gz LEWYCWYWCAYYOB-UONOGXRCSA-N 0 3 383.330 3.237 10 0 GGAEHN C[C@@H](CN[C@H](c1cc(F)cc(Br)c1)C1CC1)CS(C)(=O)=O ZINC000481736697 567699861 /nfs/dbraw/zinc/69/98/61/567699861.db2.gz CBIRTGAPEKCTAX-BONVTDFDSA-N 0 3 378.307 3.310 10 0 GGAEHN CCSCc1ccnc(NC(=O)C(C[C@H]2COCCO2)C(F)(F)F)c1 ZINC000597455189 567700182 /nfs/dbraw/zinc/70/01/82/567700182.db2.gz HKDAJFSPLOOFAX-QWHCGFSZSA-N 0 3 378.416 3.257 10 0 GGAEHN CC(C)C1CCC(NCc2ccc(S(=O)(=O)N3CCOCC3)s2)CC1 ZINC000532196736 567702659 /nfs/dbraw/zinc/70/26/59/567702659.db2.gz LCNWHKHUFIWGSB-UHFFFAOYSA-N 0 3 386.583 3.073 10 0 GGAEHN CCCCN1CCCC[C@@H]1CNS(=O)(=O)c1cnccc1C(F)(F)F ZINC000442746219 567704013 /nfs/dbraw/zinc/70/40/13/567704013.db2.gz YIOKMZCIYQBEAC-CYBMUJFWSA-N 0 3 379.448 3.033 10 0 GGAEHN CN(C)[C@H]1CCCN(C(=O)N[C@@H]2CCOc3c(Br)cccc32)C1 ZINC000507806615 567707500 /nfs/dbraw/zinc/70/75/00/567707500.db2.gz CVMCEHGCJNTEGC-SWLSCSKDSA-N 0 3 382.302 3.008 10 0 GGAEHN O=S1(=O)CCC[C@@H](CN[C@@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000554085902 567708128 /nfs/dbraw/zinc/70/81/28/567708128.db2.gz HSYVGKFSEMCPFU-LPHOPBHVSA-N 0 3 378.925 3.433 10 0 GGAEHN COC[C@](C)(O)CNCc1cc(Br)c(C)cc1Br ZINC000623415725 567708578 /nfs/dbraw/zinc/70/85/78/567708578.db2.gz VMZZCZMDYVGTDJ-CYBMUJFWSA-N 0 3 381.108 3.007 10 0 GGAEHN COCC[C@@](C)(O)CNCc1cc(Br)c(C)cc1Br ZINC000623421514 567708833 /nfs/dbraw/zinc/70/88/33/567708833.db2.gz OJZBJUWOXOVILH-CQSZACIVSA-N 0 3 395.135 3.397 10 0 GGAEHN CS(=O)(=O)[C@@H]1CCC[C@@H](NCc2cccc(F)c2OCC(F)(F)F)C1 ZINC000623428394 567709139 /nfs/dbraw/zinc/70/91/39/567709139.db2.gz JCLIHXKPGWMPQM-CHWSQXEVSA-N 0 3 383.407 3.212 10 0 GGAEHN O=S(=O)(c1ccccc1)N1CC[C@H](N[C@@H]2CCc3ccc(Cl)cc32)C1 ZINC000554116094 567709961 /nfs/dbraw/zinc/70/99/61/567709961.db2.gz LOGYBPKUWQVARQ-QFBILLFUSA-N 0 3 376.909 3.380 10 0 GGAEHN Clc1cc(Cl)c(OCCN2CCOCC2)c(CN[C@H]2CCSC2)c1 ZINC000623433020 567710539 /nfs/dbraw/zinc/71/05/39/567710539.db2.gz WVIRUNXZCUJTIF-HNNXBMFYSA-N 0 3 391.364 3.300 10 0 GGAEHN Cc1nc(-c2ccc(CNC(=O)N[C@H]3CN(C4CC4)C[C@H]3C)s2)cs1 ZINC000532320211 567710510 /nfs/dbraw/zinc/71/05/10/567710510.db2.gz BBYGWLSJUBNBNG-ABAIWWIYSA-N 0 3 376.551 3.462 10 0 GGAEHN O=C(CCCCOc1ccc(Br)cc1)N1CCN2CCC1CC2 ZINC000507873312 567712412 /nfs/dbraw/zinc/71/24/12/567712412.db2.gz GMNXKNZRFNJJPR-UHFFFAOYSA-N 0 3 381.314 3.305 10 0 GGAEHN Cc1c(Br)c2ccccc2n1CC(=O)N1CC[C@@]2(CCN(C)C2)C1 ZINC000554142710 567712726 /nfs/dbraw/zinc/71/27/26/567712726.db2.gz ZCKAUUFHKQGKDB-LJQANCHMSA-N 0 3 390.325 3.266 10 0 GGAEHN Cc1cc(CNC[C@@H](CO)Cc2ccc(F)c(F)c2)ncc1Br ZINC000623506203 567715388 /nfs/dbraw/zinc/71/53/88/567715388.db2.gz GWKKCAZXXNQISF-ZDUSSCGKSA-N 0 3 385.252 3.372 10 0 GGAEHN CCCN(C(=O)Nc1cnc2c(Br)cccn12)[C@H]1CCN(C)C1 ZINC000646403175 567715547 /nfs/dbraw/zinc/71/55/47/567715547.db2.gz ZSXZTBXMYJMCQA-LBPRGKRZSA-N 0 3 380.290 3.045 10 0 GGAEHN Cn1c(-c2ccccc2Br)nnc1N1CCN(C2CCCC2)CC1 ZINC000507930372 567717231 /nfs/dbraw/zinc/71/72/31/567717231.db2.gz LKSBAXQACKRZAK-UHFFFAOYSA-N 0 3 390.329 3.309 10 0 GGAEHN O=C(N[C@@H]1CNCCC1(F)F)C1(c2ccc(Br)cc2)CCCC1 ZINC000573490430 567717975 /nfs/dbraw/zinc/71/79/75/567717975.db2.gz PGPGRFQJEDVHLM-CQSZACIVSA-N 0 3 387.268 3.374 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)c1ccc(Br)cc1Cl ZINC000646456122 567718288 /nfs/dbraw/zinc/71/82/88/567718288.db2.gz SBRJMJAYSZCHRG-LSDHHAIUSA-N 0 3 387.705 3.038 10 0 GGAEHN CN1CCC[C@@H]1[C@@H]1COCCN1C(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000646444104 567718319 /nfs/dbraw/zinc/71/83/19/567718319.db2.gz KFTHBEFBNDMUIY-ONIAQPFYSA-N 0 3 383.319 3.419 10 0 GGAEHN Cc1cc(CCC(=O)N2CCOC[C@H]2[C@@H]2CCCN2C)ccc1Br ZINC000646456463 567718349 /nfs/dbraw/zinc/71/83/49/567718349.db2.gz UCXYXGMNWIHGPX-ROUUACIJSA-N 0 3 395.341 3.012 10 0 GGAEHN O=C([C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)N1CCN(c2ccncc2)CC1 ZINC000623533947 567718600 /nfs/dbraw/zinc/71/86/00/567718600.db2.gz OLWOHWAMVYZDNP-NZSAHSFTSA-N 0 3 398.304 3.079 10 0 GGAEHN Cc1nc(-c2cccs2)sc1C(=O)N1CCOC[C@@H]1[C@H]1CCCN1C ZINC000646455209 567718754 /nfs/dbraw/zinc/71/87/54/567718754.db2.gz LKLVIBSPLXULIS-ZIAGYGMSSA-N 0 3 377.535 3.115 10 0 GGAEHN Cc1cc(Br)c(F)c(C(=O)N2CCN(c3ccncc3)CC2)c1 ZINC000623533534 567718912 /nfs/dbraw/zinc/71/89/12/567718912.db2.gz FHKSFNSPFDOZEU-UHFFFAOYSA-N 0 3 378.245 3.254 10 0 GGAEHN C[C@H](Oc1cccc(Cl)c1Cl)C(=O)N1CCOC[C@H]1[C@H]1CCCN1C ZINC000646447499 567718984 /nfs/dbraw/zinc/71/89/84/567718984.db2.gz UNISWQOALOZPGB-CFVMTHIKSA-N 0 3 387.307 3.082 10 0 GGAEHN CN1CCC[C@H]1[C@@H]1COCCN1C(=O)c1cc(Cl)cc(C(F)(F)F)c1 ZINC000646449725 567719254 /nfs/dbraw/zinc/71/92/54/567719254.db2.gz QNMXVKTVCGIWMM-GJZGRUSLSA-N 0 3 376.806 3.294 10 0 GGAEHN COc1ccc(Br)cc1CC(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000461087183 567719650 /nfs/dbraw/zinc/71/96/50/567719650.db2.gz RODBSDMLQGGMGL-INIZCTEOSA-N 0 3 381.314 3.087 10 0 GGAEHN Cc1cc(Br)c(CNC[C@@H]2CCCNC2=O)cc1Br ZINC000623547741 567720566 /nfs/dbraw/zinc/72/05/66/567720566.db2.gz AGGOCFHLNKEGTK-JTQLQIEISA-N 0 3 390.119 3.136 10 0 GGAEHN CO[C@@H](CNCc1c[nH]nc1-c1ccc(Br)s1)[C@@H]1CCOC1 ZINC000623562003 567721842 /nfs/dbraw/zinc/72/18/42/567721842.db2.gz DZYRNDHIULJLNX-PWSUYJOCSA-N 0 3 386.315 3.042 10 0 GGAEHN CO[C@@H]1CCC[C@@H]([C@H](CO)NCc2ccc(Br)c(F)c2F)C1 ZINC000623562930 567722309 /nfs/dbraw/zinc/72/23/09/567722309.db2.gz IBNUUUXRTKGZNE-QKCSRTOESA-N 0 3 378.257 3.383 10 0 GGAEHN CC[C@@H](C)N[C@H](CNC(=O)Nc1ccnc(C)c1Br)c1ccco1 ZINC000554346350 567722586 /nfs/dbraw/zinc/72/25/86/567722586.db2.gz BOUFTVPTPOGBNM-BXUZGUMPSA-N 0 3 395.301 3.418 10 0 GGAEHN CN(C)CCN(C[C@H]1CCCO1)C(=O)[C@H]1CCc2cc(Br)ccc21 ZINC000573567931 567723098 /nfs/dbraw/zinc/72/30/98/567723098.db2.gz RPSRXXXUXRFDOZ-AEFFLSMTSA-N 0 3 395.341 3.048 10 0 GGAEHN C[C@H](NC[C@H](CO)c1cccnc1)c1ccccc1I ZINC000554403576 567726662 /nfs/dbraw/zinc/72/66/62/567726662.db2.gz XKNHHOKBBHPFKW-GXTWGEPZSA-N 0 3 382.245 3.113 10 0 GGAEHN CN1CCC[C@H](NC(=O)Nc2cnc(-c3ccc(Br)s3)nc2)C1 ZINC000646541860 567726817 /nfs/dbraw/zinc/72/68/17/567726817.db2.gz YDSBNGYJEJQNKW-JTQLQIEISA-N 0 3 396.314 3.183 10 0 GGAEHN CC(C)n1cncc1CN[C@@]1(CO)CCc2cc(Br)ccc2C1 ZINC000623645148 567727693 /nfs/dbraw/zinc/72/76/93/567727693.db2.gz PUJVKDRUKCDTAC-SFHVURJKSA-N 0 3 378.314 3.236 10 0 GGAEHN O=C(Nc1cnc(-c2ccc(Cl)s2)nc1)N[C@H]1CCN(CC2CC2)C1 ZINC000646543941 567727673 /nfs/dbraw/zinc/72/76/73/567727673.db2.gz VQIFYQCSSQLCSB-LBPRGKRZSA-N 0 3 377.901 3.464 10 0 GGAEHN OC[C@@]1(NCc2nc3c(s2)CCC3)CCc2cc(Br)ccc2C1 ZINC000623644922 567728191 /nfs/dbraw/zinc/72/81/91/567728191.db2.gz GSFMJMKNEMBQAE-GOSISDBHSA-N 0 3 393.350 3.404 10 0 GGAEHN CC(C)Cn1nccc1CN[C@@]1(CO)CCc2cc(Br)ccc2C1 ZINC000623644785 567728309 /nfs/dbraw/zinc/72/83/09/567728309.db2.gz AFSTWJAVWPNBKB-IBGZPJMESA-N 0 3 392.341 3.311 10 0 GGAEHN CCc1ncc(CN[C@]2(CO)CCc3cc(Br)ccc3C2)s1 ZINC000623645150 567728320 /nfs/dbraw/zinc/72/83/20/567728320.db2.gz PVGKIRIDUJEAJC-QGZVFWFLSA-N 0 3 381.339 3.478 10 0 GGAEHN CC[C@@H](Cc1ccc(Br)cc1)NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000667132745 567728400 /nfs/dbraw/zinc/72/84/00/567728400.db2.gz HOLDOHJZSHXGJR-ZWKOTPCHSA-N 0 3 392.341 3.426 10 0 GGAEHN CCCN(Cc1cc(=O)n2cc(Br)ccc2n1)C[C@H]1CCCCO1 ZINC000532715388 567730626 /nfs/dbraw/zinc/73/06/26/567730626.db2.gz JSQILEONQJQFIC-MRXNPFEDSA-N 0 3 394.313 3.238 10 0 GGAEHN O=C(NCCc1nc(C(F)(F)F)cs1)NC[C@@H]1CCN1C1CCCC1 ZINC000623682712 567730859 /nfs/dbraw/zinc/73/08/59/567730859.db2.gz ZMKJSNRCUHRDJS-LBPRGKRZSA-N 0 3 376.448 3.021 10 0 GGAEHN CN(C)[C@]1(CNC(=O)NCc2ccccc2CC(F)(F)F)CCSC1 ZINC000623708580 567731891 /nfs/dbraw/zinc/73/18/91/567731891.db2.gz NLKNFWJUPLRVEW-INIZCTEOSA-N 0 3 375.460 3.028 10 0 GGAEHN Cn1c(-c2ccccc2Br)nnc1N1CC[C@@H](N2CCCCC2)C1 ZINC000508138829 567732665 /nfs/dbraw/zinc/73/26/65/567732665.db2.gz PFTAHQIFGGMSOU-CQSZACIVSA-N 0 3 390.329 3.309 10 0 GGAEHN CO[C@H]1C[C@@H](N(C)Cc2cc(Br)cc(Br)c2N)C1 ZINC000573736858 567733055 /nfs/dbraw/zinc/73/30/55/567733055.db2.gz LRFAMBYGBVUMEN-PHIMTYICSA-N 0 3 378.108 3.403 10 0 GGAEHN CCN(C(=O)c1cccc(I)c1C)[C@H]1CCN(CC)C1 ZINC000598038457 567733709 /nfs/dbraw/zinc/73/37/09/567733709.db2.gz DECDQSTVDVLTPE-ZDUSSCGKSA-N 0 3 386.277 3.156 10 0 GGAEHN CN1C(=O)c2ccccc2[C@H]1CNCc1cc2c(c(Br)c1)OCO2 ZINC000623725039 567733732 /nfs/dbraw/zinc/73/37/32/567733732.db2.gz HGQAPUMRDUFNFR-OAHLLOKOSA-N 0 3 389.249 3.094 10 0 GGAEHN OCC1(NCc2cnc(-c3ccc(Br)cc3)s2)CCOCC1 ZINC000532785336 567734274 /nfs/dbraw/zinc/73/42/74/567734274.db2.gz RIYOZXMJPTVNER-UHFFFAOYSA-N 0 3 383.311 3.204 10 0 GGAEHN COc1cc(Br)ccc1CN[C@@H]1CCO[C@H]1c1ccc(=O)[nH]c1 ZINC000623737638 567734917 /nfs/dbraw/zinc/73/49/17/567734917.db2.gz FLJOAVMSIPHIGS-PBHICJAKSA-N 0 3 379.254 3.178 10 0 GGAEHN Cc1cc(CNC[C@H]2CN(Cc3ccncc3)CCO2)ccc1Br ZINC000623781752 567738020 /nfs/dbraw/zinc/73/80/20/567738020.db2.gz ZZYHROGUNWFKQL-SFHVURJKSA-N 0 3 390.325 3.143 10 0 GGAEHN CN(CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[C@H]1CCN(C2CC2)C1 ZINC000532981537 567745756 /nfs/dbraw/zinc/74/57/56/567745756.db2.gz MRLBPYZNFJBBQI-ZDUSSCGKSA-N 0 3 375.822 3.466 10 0 GGAEHN O=C(NC[C@@H](c1cccs1)N1CCCC1)[C@@H]1CCCN1CC(F)(F)F ZINC000461744088 567745785 /nfs/dbraw/zinc/74/57/85/567745785.db2.gz DFDIPADTFFVOTN-KBPBESRZSA-N 0 3 375.460 3.028 10 0 GGAEHN Cc1c(Br)cncc1C(=O)N(CCN(C)C)Cc1ccccc1 ZINC000667424425 567746377 /nfs/dbraw/zinc/74/63/77/567746377.db2.gz HMIJXCWLZHDECL-UHFFFAOYSA-N 0 3 376.298 3.357 10 0 GGAEHN C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2C)C1 ZINC000623918119 567746687 /nfs/dbraw/zinc/74/66/87/567746687.db2.gz IPHSKVCNLRHSCM-NDLNZWKESA-N 0 3 375.822 3.284 10 0 GGAEHN C[C@H](NCc1ccc(Br)cc1N1CCOCC1)[C@H]1CCCCO1 ZINC000623922351 567746765 /nfs/dbraw/zinc/74/67/65/567746765.db2.gz XKHHGTMZAIOWCE-KBXCAEBGSA-N 0 3 383.330 3.333 10 0 GGAEHN Cc1cc(CC(C)(C)C(=O)N2CC[C@@H]3CN(C)C[C@H]32)ccc1Br ZINC000646920369 567747964 /nfs/dbraw/zinc/74/79/64/567747964.db2.gz QISGVOQIPZSZSU-NVXWUHKLSA-N 0 3 379.342 3.489 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)C2(c3ccc(Br)cc3)CCCC2)C1 ZINC000646913399 567748207 /nfs/dbraw/zinc/74/82/07/567748207.db2.gz FPKAXIOJHHPOLU-YOEHRIQHSA-N 0 3 377.326 3.423 10 0 GGAEHN CC(C)CN1CCN(c2nnc(-c3ccc(Br)cc3)n2C)CC1 ZINC000508434563 567748376 /nfs/dbraw/zinc/74/83/76/567748376.db2.gz NWGFWGKZDKBBMR-UHFFFAOYSA-N 0 3 378.318 3.023 10 0 GGAEHN CN1C[C@H]2CCN(C(=O)C3(c4cccc(Br)c4)CCCC3)[C@@H]2C1 ZINC000646920986 567748740 /nfs/dbraw/zinc/74/87/40/567748740.db2.gz YIBYGSDHPRUTLX-RHSMWYFYSA-N 0 3 377.326 3.423 10 0 GGAEHN C[C@@H](Cc1ncc(C(F)(F)F)cc1Cl)NC[C@H]1CCCCS1(=O)=O ZINC000623958422 567749474 /nfs/dbraw/zinc/74/94/74/567749474.db2.gz LYPOVZYWDNFLCJ-CMPLNLGQSA-N 0 3 384.851 3.242 10 0 GGAEHN CN1C[C@H]2[C@@H](CCN2C(=O)COc2ccc3ccccc3c2Br)C1 ZINC000646927859 567749594 /nfs/dbraw/zinc/74/95/94/567749594.db2.gz SJBIFXAYKXEOQK-HOCLYGCPSA-N 0 3 389.293 3.144 10 0 GGAEHN COCCN1CCC[C@H]1CNC(=O)Nc1ccc(Br)c(F)c1C ZINC000667500469 567750722 /nfs/dbraw/zinc/75/07/22/567750722.db2.gz PUXPRONDNFJKRR-LBPRGKRZSA-N 0 3 388.281 3.129 10 0 GGAEHN C[C@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccc(F)cc1C(F)(F)F ZINC000623982328 567751647 /nfs/dbraw/zinc/75/16/47/567751647.db2.gz OVLXLNOZWNEOGL-AAEUAGOBSA-N 0 3 382.423 3.309 10 0 GGAEHN CCN1CC[C@H]2CC[C@@H](C1)N2Cc1cc(Br)ccc1C(=O)OC ZINC000554820290 567751652 /nfs/dbraw/zinc/75/16/52/567751652.db2.gz QDLRAJJZKWUHNH-CVEARBPZSA-N 0 3 381.314 3.294 10 0 GGAEHN OC[C@@H]1CN(Cc2ccccc2)CC[C@H]1Nc1ncc(Br)cc1F ZINC000623989077 567752050 /nfs/dbraw/zinc/75/20/50/567752050.db2.gz IUFQRZVLYLQGDJ-WMLDXEAASA-N 0 3 394.288 3.278 10 0 GGAEHN CC(C)(C)[C@@H]1CCN(C[C@@H](O)COc2ccc(Cl)cc2Cl)C[C@@H]1O ZINC000554854051 567752978 /nfs/dbraw/zinc/75/29/78/567752978.db2.gz KCFOYPAYMZSVFM-FMKPAKJESA-N 0 3 376.324 3.462 10 0 GGAEHN CC(C)(C)[C@@H]1CCN(C[C@H](O)COc2ccc(Cl)cc2Cl)C[C@@H]1O ZINC000554854054 567753176 /nfs/dbraw/zinc/75/31/76/567753176.db2.gz KCFOYPAYMZSVFM-LZWOXQAQSA-N 0 3 376.324 3.462 10 0 GGAEHN CCN(CC)[C@@H](CNC(=O)[C@H]1CCCN1CC(F)(F)F)c1ccsc1 ZINC000461905903 567753243 /nfs/dbraw/zinc/75/32/43/567753243.db2.gz WBGJJGDIXYMSCA-CABCVRRESA-N 0 3 377.476 3.274 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)[C@@H]1CCCN1CC(F)(F)F)c1ccsc1 ZINC000461905906 567753359 /nfs/dbraw/zinc/75/33/59/567753359.db2.gz WBGJJGDIXYMSCA-LSDHHAIUSA-N 0 3 377.476 3.274 10 0 GGAEHN C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@H]1C[C@H]2CCCCN2C1=O ZINC000623998031 567753465 /nfs/dbraw/zinc/75/34/65/567753465.db2.gz FITOVPOLLSAFPW-HCKVZZMMSA-N 0 3 375.822 3.428 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CNCC[C@@H](O)C(F)(F)F ZINC000554883939 567753917 /nfs/dbraw/zinc/75/39/17/567753917.db2.gz QXNIVYBYFPIPLK-CQSZACIVSA-N 0 3 392.219 3.346 10 0 GGAEHN OC[C@H](CNCc1cccc(Br)c1OC(F)F)c1cccnc1 ZINC000574074680 567754698 /nfs/dbraw/zinc/75/46/98/567754698.db2.gz ZWAVQXJVJXJBGK-ZDUSSCGKSA-N 0 3 387.224 3.311 10 0 GGAEHN CC[C@@H](Cc1ccccc1Br)C(=O)N[C@@H]1CNCCC1(F)F ZINC000647076225 567758776 /nfs/dbraw/zinc/75/87/76/567758776.db2.gz BVGZNKFDSLBXNA-SMDDNHRTSA-N 0 3 375.257 3.131 10 0 GGAEHN C[C@H](NCC1(OCCO)CCC(F)(F)CC1)c1ccc(Br)cn1 ZINC000624104054 567760224 /nfs/dbraw/zinc/76/02/24/567760224.db2.gz WNBZCGXYBJEKHW-LBPRGKRZSA-N 0 3 393.272 3.452 10 0 GGAEHN C[C@@H](N[C@H]1CCN(c2ccc3nncn3n2)C1)c1cccc(Cl)c1Cl ZINC000624113307 567760638 /nfs/dbraw/zinc/76/06/38/567760638.db2.gz CDKLFYYVQXKLMN-NEPJUHHUSA-N 0 3 377.279 3.361 10 0 GGAEHN COC(=O)[C@@H]1CCN(Cc2c(C)nn(-c3ccc(Br)cc3)c2C)C1 ZINC000508673835 567761487 /nfs/dbraw/zinc/76/14/87/567761487.db2.gz XOCPEJRAWLJPOF-CQSZACIVSA-N 0 3 392.297 3.247 10 0 GGAEHN COc1ncc(Br)cc1CN[C@H]1CCC[C@H](c2ccnn2C)C1 ZINC000624134443 567761927 /nfs/dbraw/zinc/76/19/27/567761927.db2.gz VCCKLNUDTGRYCN-WFASDCNBSA-N 0 3 379.302 3.402 10 0 GGAEHN COc1ncc(Br)cc1CN[C@@H]1CCC[C@H](c2ccnn2C)C1 ZINC000624134442 567762028 /nfs/dbraw/zinc/76/20/28/567762028.db2.gz VCCKLNUDTGRYCN-SWLSCSKDSA-N 0 3 379.302 3.402 10 0 GGAEHN COc1ncc(Br)cc1CNC1CCN(Cc2ccncc2)CC1 ZINC000624132808 567762274 /nfs/dbraw/zinc/76/22/74/567762274.db2.gz AGHGSBGRYBOBLX-UHFFFAOYSA-N 0 3 391.313 3.002 10 0 GGAEHN C[C@@H]1CCCN(CCNC(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)C1 ZINC000624138410 567763692 /nfs/dbraw/zinc/76/36/92/567763692.db2.gz MSCNEKZWUZYRBT-ZYRRHWMLSA-N 0 3 377.326 3.183 10 0 GGAEHN C[C@@H](NC[C@@H]1COCCN1C)c1ccc(Br)cc1Br ZINC000624171796 567764606 /nfs/dbraw/zinc/76/46/06/567764606.db2.gz CKMMPGPQTDLPCS-ZYHUDNBSSA-N 0 3 392.135 3.193 10 0 GGAEHN Fc1cc(CNC2CCN([C@H]3CCOC3)CC2)c(F)cc1Br ZINC000624160907 567765616 /nfs/dbraw/zinc/76/56/16/567765616.db2.gz RIOOIABWYIOAND-ZDUSSCGKSA-N 0 3 375.257 3.070 10 0 GGAEHN Brc1c[nH]nc1CN[C@@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC000647184954 567767624 /nfs/dbraw/zinc/76/76/24/567767624.db2.gz KBVUHUFFBPMHJQ-OAHLLOKOSA-N 0 3 375.314 3.459 10 0 GGAEHN NS(=O)(=O)c1ccc(CNCCCCOc2ccc(Cl)cc2)c(F)c1 ZINC000647176727 567767691 /nfs/dbraw/zinc/76/76/91/567767691.db2.gz WOPLNBMOPOGYFY-UHFFFAOYSA-N 0 3 386.876 3.075 10 0 GGAEHN COc1ncncc1CNCC1(c2cccc(Br)c2)CCOCC1 ZINC000647172925 567768277 /nfs/dbraw/zinc/76/82/77/567768277.db2.gz POJKOYBGOAHDED-UHFFFAOYSA-N 0 3 392.297 3.086 10 0 GGAEHN C[C@H](N[C@@H]1CCOC[C@H]1O)c1ccc(Br)cc1Br ZINC000624235248 567768878 /nfs/dbraw/zinc/76/88/78/567768878.db2.gz HDLKDJUCJUXDQQ-ZEGGKSINSA-N 0 3 379.092 3.012 10 0 GGAEHN COc1ncncc1CNC1CCN(Cc2ccc(Br)cc2)CC1 ZINC000647192630 567770268 /nfs/dbraw/zinc/77/02/68/567770268.db2.gz PYHNRAKZCOYFIG-UHFFFAOYSA-N 0 3 391.313 3.002 10 0 GGAEHN C[C@@H](NC[C@H]1CN(Cc2ccncc2)CCO1)c1ccc(Br)cc1 ZINC000624266588 567770943 /nfs/dbraw/zinc/77/09/43/567770943.db2.gz QVXKDFNMJSPRLC-BEFAXECRSA-N 0 3 390.325 3.396 10 0 GGAEHN C[C@@H](NC[C@@H]1CN(Cc2ccncc2)CCO1)c1cc(Br)cs1 ZINC000624263856 567771028 /nfs/dbraw/zinc/77/10/28/567771028.db2.gz PIIOIYNHWMIMNY-CZUORRHYSA-N 0 3 396.354 3.457 10 0 GGAEHN C[C@H](NC[C@H]1CN(Cc2ccncc2)CCO1)c1ccc(Br)cc1 ZINC000624266591 567771114 /nfs/dbraw/zinc/77/11/14/567771114.db2.gz QVXKDFNMJSPRLC-KXBFYZLASA-N 0 3 390.325 3.396 10 0 GGAEHN NS(=O)(=O)c1ccc(CNCCCCc2ccc(Cl)s2)c(F)c1 ZINC000647209487 567771257 /nfs/dbraw/zinc/77/12/57/567771257.db2.gz KNAQAFIOCQOLAC-UHFFFAOYSA-N 0 3 376.906 3.301 10 0 GGAEHN C[C@@H](NC[C@H]1CN(Cc2ccncc2)CCO1)c1cccc(Br)c1 ZINC000624266625 567771373 /nfs/dbraw/zinc/77/13/73/567771373.db2.gz RSVOFHJNWJJNNW-BEFAXECRSA-N 0 3 390.325 3.396 10 0 GGAEHN NS(=O)(=O)c1ccc2c(c1)[C@H](NCC1(C(F)(F)F)CCCC1)CCC2 ZINC000624272579 567772763 /nfs/dbraw/zinc/77/27/63/567772763.db2.gz LCACBOGUAGCMEH-OAHLLOKOSA-N 0 3 376.444 3.424 10 0 GGAEHN Cc1cc(Br)cc(CNCCCc2ncn(C)n2)c1OC(F)F ZINC000647231123 567772884 /nfs/dbraw/zinc/77/28/84/567772884.db2.gz HXBFZTVVDZYZHQ-UHFFFAOYSA-N 0 3 389.244 3.210 10 0 GGAEHN CC(C)(CNCc1nc(-c2ccc(Br)cc2)c[nH]1)[C@@]1(O)CCOC1 ZINC000647246451 567774262 /nfs/dbraw/zinc/77/42/62/567774262.db2.gz GOWZKASTODKFLD-GOSISDBHSA-N 0 3 394.313 3.106 10 0 GGAEHN C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@@H]1CCN(C2CCC2)C1=O ZINC000624345204 567775544 /nfs/dbraw/zinc/77/55/44/567775544.db2.gz ZCJIJOCHEJYBIH-QMTHXVAHSA-N 0 3 375.822 3.428 10 0 GGAEHN Cc1ccc(Br)c(S(=O)(=O)N2CCCc3cccc(CN)c32)c1 ZINC000624388706 567777631 /nfs/dbraw/zinc/77/76/31/567777631.db2.gz FIHXCLCKRGEWQA-UHFFFAOYSA-N 0 3 395.322 3.358 10 0 GGAEHN NCc1cccc2c1N(S(=O)(=O)c1cc(Br)ccc1F)CCC2 ZINC000624389169 567777793 /nfs/dbraw/zinc/77/77/93/567777793.db2.gz SJWDATWVBWAZMV-UHFFFAOYSA-N 0 3 399.285 3.188 10 0 GGAEHN C[C@H](NC[C@@H](CO)Cc1cccc(Br)c1)c1cc2n(n1)CCCC2 ZINC000647301483 567779131 /nfs/dbraw/zinc/77/91/31/567779131.db2.gz VJPGNTSUINAIDP-HOCLYGCPSA-N 0 3 392.341 3.484 10 0 GGAEHN C[C@H](CS(=O)(=O)c1ccccc1)NCC[C@@H]1CSc2ccccc2O1 ZINC000647320945 567779859 /nfs/dbraw/zinc/77/98/59/567779859.db2.gz NNKYFVFDHXEGCO-HZPDHXFCSA-N 0 3 377.531 3.382 10 0 GGAEHN CC(C)(CN[C@H]1CCCOc2ccc(Br)cc21)[C@@]1(O)CCOC1 ZINC000647340231 567780181 /nfs/dbraw/zinc/78/01/81/567780181.db2.gz GKGPBQGLFMKOPJ-MAUKXSAKSA-N 0 3 384.314 3.430 10 0 GGAEHN COc1c(Br)cccc1CN[C@@H]1CCCN(c2cc(C)nn2C)C1 ZINC000444011482 567785996 /nfs/dbraw/zinc/78/59/96/567785996.db2.gz QAKGYQQQSWVKJE-OAHLLOKOSA-N 0 3 393.329 3.258 10 0 GGAEHN Cc1cc(N2CC[C@H](N[C@H]3CO[C@@H](C4CC4)C3)C2=O)ccc1Br ZINC000667993417 567787193 /nfs/dbraw/zinc/78/71/93/567787193.db2.gz YCLUGZLXBZIWDV-XOKHGSTOSA-N 0 3 379.298 3.020 10 0 GGAEHN CS(=O)(=O)N1CCC[C@@H](CN2CCC[C@@H]2Cc2c(F)cccc2Cl)C1 ZINC000444060545 567787750 /nfs/dbraw/zinc/78/77/50/567787750.db2.gz VUPAWDGIMMFMJG-LSDHHAIUSA-N 0 3 388.936 3.158 10 0 GGAEHN CCN1CCC(n2nccc2NC(=O)c2cncc(Br)c2C)CC1 ZINC000668015518 567789045 /nfs/dbraw/zinc/78/90/45/567789045.db2.gz DDPNEADGDBSYCK-UHFFFAOYSA-N 0 3 392.301 3.258 10 0 GGAEHN Cc1cccc(C(=O)N2CC[C@@H](OCCN3CCCCC3)C2)c1Br ZINC000533845820 567789477 /nfs/dbraw/zinc/78/94/77/567789477.db2.gz PQZZHPBVGVUDEX-MRXNPFEDSA-N 0 3 395.341 3.475 10 0 GGAEHN OC[C@@H](Cc1ccc(F)cc1)NC[C@@H](O)COc1c(Cl)cccc1Cl ZINC000647529865 567789557 /nfs/dbraw/zinc/78/95/57/567789557.db2.gz NHEBHMUTMRUVGG-HUUCEWRRSA-N 0 3 388.266 3.065 10 0 GGAEHN OC[C@H](Cc1ccc(F)cc1)NC[C@H](O)COc1c(Cl)cccc1Cl ZINC000647529864 567789619 /nfs/dbraw/zinc/78/96/19/567789619.db2.gz NHEBHMUTMRUVGG-GJZGRUSLSA-N 0 3 388.266 3.065 10 0 GGAEHN CN(C)[C@H]1CCCN(C(=O)c2cc(Br)cc(N3CCCC3)c2)C1 ZINC000668022799 567790451 /nfs/dbraw/zinc/79/04/51/567790451.db2.gz QJQQIZLVMFBIKM-INIZCTEOSA-N 0 3 380.330 3.216 10 0 GGAEHN CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)cc2F)[C@H](C)C1 ZINC000444083167 567791525 /nfs/dbraw/zinc/79/15/25/567791525.db2.gz JOKCQHAOPXTNEF-BXUZGUMPSA-N 0 3 382.423 3.195 10 0 GGAEHN NC(=O)[C@@H](Cc1ccc(Cl)cc1)NCC[C@H]1CSc2ccccc2O1 ZINC000647607063 567792798 /nfs/dbraw/zinc/79/27/98/567792798.db2.gz ZZIDIMXGNIFRCF-JKSUJKDBSA-N 0 3 376.909 3.269 10 0 GGAEHN NC(=O)[C@H](Cc1ccc(Cl)cc1)NCC[C@@H]1CSc2ccccc2O1 ZINC000647607060 567792812 /nfs/dbraw/zinc/79/28/12/567792812.db2.gz ZZIDIMXGNIFRCF-CVEARBPZSA-N 0 3 376.909 3.269 10 0 GGAEHN NC(=O)[C@H](Cc1ccc(Cl)cc1)NCC[C@H]1CSc2ccccc2O1 ZINC000647607061 567792842 /nfs/dbraw/zinc/79/28/42/567792842.db2.gz ZZIDIMXGNIFRCF-HOTGVXAUSA-N 0 3 376.909 3.269 10 0 GGAEHN Cn1cc([C@H](NC[C@@H](O)COc2cccc(Br)c2)C(C)(C)C)cn1 ZINC000574712875 567793572 /nfs/dbraw/zinc/79/35/72/567793572.db2.gz KOLRLOWQAKVHGM-WBVHZDCISA-N 0 3 396.329 3.299 10 0 GGAEHN CCO[C@@H]1C[C@H](NCc2ccc(OC)c(Br)c2)[C@H]1n1cccn1 ZINC000555646983 567793658 /nfs/dbraw/zinc/79/36/58/567793658.db2.gz LPDQWEGQOGXXAG-USXIJHARSA-N 0 3 380.286 3.163 10 0 GGAEHN COCCN1CCC[C@@H]1CNC(=O)c1cc(Cl)cc(Br)c1F ZINC000444168764 567795017 /nfs/dbraw/zinc/79/50/17/567795017.db2.gz JBCYNUDXSHAYMY-LLVKDONJSA-N 0 3 393.684 3.082 10 0 GGAEHN N[C@H]1CCCc2cn(Cc3nc(-c4ccc(Br)s4)no3)nc21 ZINC000574750159 567795270 /nfs/dbraw/zinc/79/52/70/567795270.db2.gz XVQJBCUDRGOOBA-VIFPVBQESA-N 0 3 380.271 3.142 10 0 GGAEHN O=C(Nc1cc(Cl)c(Cl)c(Cl)c1)C(=O)NC1CCN(C2CC2)CC1 ZINC000574761210 567795528 /nfs/dbraw/zinc/79/55/28/567795528.db2.gz BSRVHSBZMMDDQS-UHFFFAOYSA-N 0 3 390.698 3.328 10 0 GGAEHN C[C@@H](CNC(=O)c1cc(Br)cc(N2CCCC2)c1)N(C)C1CC1 ZINC000668095764 567796396 /nfs/dbraw/zinc/79/63/96/567796396.db2.gz PUISDWFANSVHFT-ZDUSSCGKSA-N 0 3 380.330 3.262 10 0 GGAEHN CCN(CCNC(=O)c1c(F)c(F)c(Br)c(F)c1F)C1CC1 ZINC000668151975 567798018 /nfs/dbraw/zinc/79/80/18/567798018.db2.gz VMAYWHNYIXTDRX-UHFFFAOYSA-N 0 3 383.183 3.220 10 0 GGAEHN CC(C)Cn1ncc(NC(=O)NC[C@@]2(N(C)C)CCSC2)c1C(F)F ZINC000534090584 567799267 /nfs/dbraw/zinc/79/92/67/567799267.db2.gz NGHIXSFUJNDKKI-INIZCTEOSA-N 0 3 375.489 3.036 10 0 GGAEHN Nc1c(Br)cc(Br)cc1CN[C@@H]1C[C@@H](O)C12CCC2 ZINC000668623087 567814958 /nfs/dbraw/zinc/81/49/58/567814958.db2.gz ITMUHQQMZVTNNT-VXGBXAGGSA-N 0 3 390.119 3.187 10 0 GGAEHN CCN1CC[C@H]2OCCN(Cc3cc4cc(Br)ccc4o3)[C@H]2C1 ZINC000668193390 567800508 /nfs/dbraw/zinc/80/05/08/567800508.db2.gz CBDHJPOIYFNOGB-FUHWJXTLSA-N 0 3 379.298 3.490 10 0 GGAEHN COC[C@H](CC1CCOCC1)N[C@@H](CO)c1ccc(Br)c(F)c1 ZINC000668188668 567800562 /nfs/dbraw/zinc/80/05/62/567800562.db2.gz LAGRBKGASPCSBN-YOEHRIQHSA-N 0 3 390.293 3.043 10 0 GGAEHN CN1CCC[C@@H]1[C@H]1COCCN1C(=O)Cc1csc2ccc(Cl)cc12 ZINC000647821776 567803366 /nfs/dbraw/zinc/80/33/66/567803366.db2.gz MBDINRWAENBGIO-IAGOWNOFSA-N 0 3 378.925 3.419 10 0 GGAEHN CN1CCC[C@H]1[C@H]1COCCN1C(=O)Cc1csc2ccc(Cl)cc12 ZINC000647821775 567803399 /nfs/dbraw/zinc/80/33/99/567803399.db2.gz MBDINRWAENBGIO-DLBZAZTESA-N 0 3 378.925 3.419 10 0 GGAEHN COC[C@@H](CC1CCOCC1)NCC(=O)Nc1ccc(Br)c(C)c1 ZINC000668246222 567803522 /nfs/dbraw/zinc/80/35/22/567803522.db2.gz ZMEZBUMUXMASKG-MRXNPFEDSA-N 0 3 399.329 3.117 10 0 GGAEHN O=C1[C@H](N[C@H]2CCc3ccc(I)cc32)CCN1C1CCC1 ZINC000599092528 567804867 /nfs/dbraw/zinc/80/48/67/567804867.db2.gz JVDBBEQGPFMWOF-JKSUJKDBSA-N 0 3 396.272 3.022 10 0 GGAEHN Cc1nn(C)c(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c1Br ZINC000647984304 567808734 /nfs/dbraw/zinc/80/87/34/567808734.db2.gz PTDDHLWSBLVGIY-UKRRQHHQSA-N 0 3 392.301 3.058 10 0 GGAEHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)c1nn(C(C)(C)C)cc1Br ZINC000668430278 567809644 /nfs/dbraw/zinc/80/96/44/567809644.db2.gz DUOLHBIVIZOZCH-BETUJISGSA-N 0 3 385.350 3.393 10 0 GGAEHN NC[C@H]1c2ccccc2CCN1CCC(=O)Nc1ccccc1Br ZINC000647995823 567810005 /nfs/dbraw/zinc/81/00/05/567810005.db2.gz KCLKVTIUWJYWSI-SFHVURJKSA-N 0 3 388.309 3.336 10 0 GGAEHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)c1nn(C(C)(C)C)cc1Br ZINC000668430279 567810164 /nfs/dbraw/zinc/81/01/64/567810164.db2.gz DUOLHBIVIZOZCH-CHWSQXEVSA-N 0 3 385.350 3.393 10 0 GGAEHN CCOc1cc(C[NH2+][C@@H](COC)C2CCOCC2)cc(Br)c1[O-] ZINC000668461887 567811166 /nfs/dbraw/zinc/81/11/66/567811166.db2.gz HJFHAVGGRUBABW-HNNXBMFYSA-N 0 3 388.302 3.085 10 0 GGAEHN NC(=O)c1ccc(NC(=O)CCN2CC[C@@H](CC(F)(F)F)C2)cc1Cl ZINC000444711531 567811418 /nfs/dbraw/zinc/81/14/18/567811418.db2.gz XSQRMNDMLDCFKF-JTQLQIEISA-N 0 3 377.794 3.042 10 0 GGAEHN O[C@H](CCNCc1cc(OC(F)F)ccc1Br)C(F)(F)F ZINC000648034763 567811629 /nfs/dbraw/zinc/81/16/29/567811629.db2.gz DVUFADVEAHWQMS-SNVBAGLBSA-N 0 3 378.135 3.453 10 0 GGAEHN O[C@@H](CCNCc1ccc(OC(F)F)c(Br)c1)C(F)(F)F ZINC000575095340 567812444 /nfs/dbraw/zinc/81/24/44/567812444.db2.gz HWWKESDEXHJZHM-JTQLQIEISA-N 0 3 378.135 3.453 10 0 GGAEHN CO[C@@H]1CS(=O)(=O)C[C@@H]1N[C@@H]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000668506056 567812651 /nfs/dbraw/zinc/81/26/51/567812651.db2.gz GGDSAEINVOGQRX-BJKJVOPESA-N 0 3 378.321 3.031 10 0 GGAEHN O=C(CCc1cccc(F)c1Br)N1CCN(c2ccncc2)CC1 ZINC000648097044 567813348 /nfs/dbraw/zinc/81/33/48/567813348.db2.gz QFLHZXTUEPILLM-UHFFFAOYSA-N 0 3 392.272 3.265 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)N[C@@H]1CC[C@@H](C)S(=O)(=O)C1 ZINC000668560776 567813494 /nfs/dbraw/zinc/81/34/94/567813494.db2.gz HJYRWECDWADDGN-JTNHKYCSSA-N 0 3 378.307 3.075 10 0 GGAEHN C[C@H](Cc1ccc(Br)cc1F)N[C@H]1CC[C@@H](C)S(=O)(=O)C1 ZINC000668560775 567813500 /nfs/dbraw/zinc/81/35/00/567813500.db2.gz HJYRWECDWADDGN-GYSYKLTISA-N 0 3 378.307 3.075 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1C[C@@H](C)[C@H](O)[C@@H](C)C1 ZINC000668554290 567813758 /nfs/dbraw/zinc/81/37/58/567813758.db2.gz MXEZIJCZARHGHT-MCBXIFIFSA-N 0 3 378.314 3.392 10 0 GGAEHN Cc1c(Br)cncc1C(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000668567899 567813920 /nfs/dbraw/zinc/81/39/20/567813920.db2.gz NKRRUUPUOVVCCG-ZDUSSCGKSA-N 0 3 376.298 3.403 10 0 GGAEHN CN(C(=O)c1cc(Br)cc(N2CCCC2)c1)[C@@H]1CN2CCC1CC2 ZINC000668588040 567814245 /nfs/dbraw/zinc/81/42/45/567814245.db2.gz DEHOMQQSIAFDFR-GOSISDBHSA-N 0 3 392.341 3.216 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1C[C@H]2COC[C@@]2(C)C1 ZINC000668597162 567814320 /nfs/dbraw/zinc/81/43/20/567814320.db2.gz RNQJCJHAFZCKHG-MAUKXSAKSA-N 0 3 376.298 3.412 10 0 GGAEHN Cc1nn(-c2ccccc2Br)cc1CN1C[C@H]2COC[C@]2(C)C1 ZINC000668597164 567814344 /nfs/dbraw/zinc/81/43/44/567814344.db2.gz RNQJCJHAFZCKHG-YJBOKZPZSA-N 0 3 376.298 3.412 10 0 GGAEHN CN[C@H](CC(C)(C)C)C(=O)Nc1cc(Br)ccc1OCCOC ZINC000648150834 567814481 /nfs/dbraw/zinc/81/44/81/567814481.db2.gz CCQVRCCMLDPQAO-CQSZACIVSA-N 0 3 387.318 3.437 10 0 GGAEHN COc1ccc(CCC(=O)N(C)[C@H]2CCN(C3CC3)C2)c(Br)c1 ZINC000668599127 567814729 /nfs/dbraw/zinc/81/47/29/567814729.db2.gz RCEMXELNIFNORR-HNNXBMFYSA-N 0 3 381.314 3.085 10 0 GGAEHN Cc1nn(-c2ccc(Br)cc2)cc1CN1C[C@@H]2COC[C@]2(C)C1 ZINC000668598576 567814799 /nfs/dbraw/zinc/81/47/99/567814799.db2.gz ZGZYDRNSIHRQJQ-QAPCUYQASA-N 0 3 376.298 3.412 10 0 GGAEHN COc1cc(Br)c(CN[C@H]2CCC[C@@H]2Cc2cnn(C)c2)cc1O ZINC000668610258 567814841 /nfs/dbraw/zinc/81/48/41/567814841.db2.gz RGFGUJGKYJEVML-CJNGLKHVSA-N 0 3 394.313 3.398 10 0 GGAEHN COc1ccc(Br)cc1C1(NC(=O)c2ccc3c(c2)CNC3)CC1 ZINC000648191214 567815105 /nfs/dbraw/zinc/81/51/05/567815105.db2.gz AEEPKEJSZPTNIC-UHFFFAOYSA-N 0 3 387.277 3.480 10 0 GGAEHN O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)c1ccsc1Cl ZINC000668641197 567815143 /nfs/dbraw/zinc/81/51/43/567815143.db2.gz ZXEFSNNEVNJSMG-UHFFFAOYSA-N 0 3 377.897 3.479 10 0 GGAEHN O=C(NCC1(N2CCSCC2)CCCCC1)c1ncnc2sccc21 ZINC000668626960 567815275 /nfs/dbraw/zinc/81/52/75/567815275.db2.gz LKUWZXAAHFSPHB-UHFFFAOYSA-N 0 3 376.551 3.173 10 0 GGAEHN O=C(N[C@@H]1CCN2CCCC[C@H]12)c1cc2c(cncc2Br)s1 ZINC000648244934 567816064 /nfs/dbraw/zinc/81/60/64/567816064.db2.gz JVDDNBKVHPTXPO-CHWSQXEVSA-N 0 3 380.311 3.415 10 0 GGAEHN O=C(N[C@@H]1CCN2CCCC[C@@H]12)c1cc2c(cncc2Br)s1 ZINC000648244935 567816126 /nfs/dbraw/zinc/81/61/26/567816126.db2.gz JVDDNBKVHPTXPO-OLZOCXBDSA-N 0 3 380.311 3.415 10 0 GGAEHN CN1CCCN(c2ccc(CNC(=O)Nc3ccc4c(c3)CCC4)cn2)CC1 ZINC000048237940 570222952 /nfs/dbraw/zinc/22/29/52/570222952.db2.gz LGMNBCIHDDRICP-UHFFFAOYSA-N 0 3 379.508 3.034 10 0 GGAEHN CC(C)n1ncc2cc(NC(=O)N(CCN(C)C)Cc3cccnc3)cnc21 ZINC000048263661 570225048 /nfs/dbraw/zinc/22/50/48/570225048.db2.gz GWZODQCTHBPBEV-UHFFFAOYSA-N 0 3 381.484 3.003 10 0 GGAEHN CCN1CCN(Cc2ccc(CNC(=O)CCc3cccc(F)c3)cc2)CC1 ZINC000048333675 570237517 /nfs/dbraw/zinc/23/75/17/570237517.db2.gz GDEVKFPACLWZKP-UHFFFAOYSA-N 0 3 383.511 3.212 10 0 GGAEHN OCC[C@H]1CN(Cc2ccnc3ccccc23)CCN1CCc1ccccc1 ZINC000020109805 570240789 /nfs/dbraw/zinc/24/07/89/570240789.db2.gz DKERNBWJVJSNFE-QFIPXVFZSA-N 0 3 375.516 3.346 10 0 GGAEHN O=C(/C=C/c1ccc(Cl)c(C(F)(F)F)c1)NC[C@@H]1CN2CCC[C@H]2CO1 ZINC000061650449 570252873 /nfs/dbraw/zinc/25/28/73/570252873.db2.gz YBWAXKXVGNZOIE-CNPQOGTOSA-N 0 3 388.817 3.351 10 0 GGAEHN COc1ccc([C@@H](CNC(=O)CCc2nnc(-c3ccccc3)o2)N(C)C)cc1 ZINC000021556431 570292340 /nfs/dbraw/zinc/29/23/40/570292340.db2.gz VHAKAUOBQXUPOL-LJQANCHMSA-N 0 3 394.475 3.097 10 0 GGAEHN Cc1cccc(NC(=O)CSCC(=O)NCCCN(C)Cc2ccccc2)c1 ZINC000021938946 570300027 /nfs/dbraw/zinc/30/00/27/570300027.db2.gz CYYQPUQJMNOLGI-UHFFFAOYSA-N 0 3 399.560 3.305 10 0 GGAEHN CCOC(=O)c1cc2c(cc1F)[C@H](N)C[C@]1(CCN(C(=O)OC(C)(C)C)C1)O2 ZINC000725259953 570307305 /nfs/dbraw/zinc/30/73/05/570307305.db2.gz KWAKFVYOJIZAFV-QRWLVFNGSA-N 0 3 394.443 3.164 10 0 GGAEHN CCOC(=O)c1ccc2c(c1)[C@H](N)C[C@@]1(CCN(C(=O)OC(C)(C)C)C1)O2 ZINC000725260150 570308306 /nfs/dbraw/zinc/30/83/06/570308306.db2.gz NMGAJQMNJMWMFJ-FOIQADDNSA-N 0 3 376.453 3.025 10 0 GGAEHN CCOC(=O)c1ccc2c(c1)O[C@@]1(CCN(C(=O)OC(C)(C)C)C1)C[C@H]2N ZINC000725260527 570310076 /nfs/dbraw/zinc/31/00/76/570310076.db2.gz RNRWPNQWSSYDHZ-QRWLVFNGSA-N 0 3 376.453 3.025 10 0 GGAEHN CCOC(=O)c1cc(C)c2c(c1)O[C@]1(CCN(C(=O)OC(C)(C)C)C1)C[C@@H]2N ZINC000725260787 570310695 /nfs/dbraw/zinc/31/06/95/570310695.db2.gz WSCGUPNRDWZURE-YCRPNKLZSA-N 0 3 390.480 3.334 10 0 GGAEHN COc1c(C)cc(-c2ccc3nc(C(=O)NCCN4CCCC4)cn3c2)cc1C ZINC000034831171 570335550 /nfs/dbraw/zinc/33/55/50/570335550.db2.gz VGZFJWKBFZCZMT-UHFFFAOYSA-N 0 3 392.503 3.452 10 0 GGAEHN OCCn1c(CN[C@@H]2CCN(Cc3ccccc3)C2)nc2ccc(Cl)cc21 ZINC000022924801 570336344 /nfs/dbraw/zinc/33/63/44/570336344.db2.gz DURJTKQHUKWFNU-GOSISDBHSA-N 0 3 384.911 3.046 10 0 GGAEHN CCCn1c2ccccc2nc1N1CCC(C(=O)NCCN2CCCCC2)CC1 ZINC000034906600 570339121 /nfs/dbraw/zinc/33/91/21/570339121.db2.gz CYRPGWLXZVGMNU-UHFFFAOYSA-N 0 3 397.567 3.265 10 0 GGAEHN Cc1ccc(CN2CCCN(CC(=O)Nc3cc(C(C)(C)C)no3)CC2)cc1 ZINC000022995682 570339888 /nfs/dbraw/zinc/33/98/88/570339888.db2.gz XDIUCZQBWYDEGI-UHFFFAOYSA-N 0 3 384.524 3.427 10 0 GGAEHN CCN1CCC[C@@H]1CNC(=O)c1nc(-c2ccco2)n(-c2cccc(C)c2)n1 ZINC000034911556 570341117 /nfs/dbraw/zinc/34/11/17/570341117.db2.gz JWYQTNCYHUBVJM-QGZVFWFLSA-N 0 3 379.464 3.050 10 0 GGAEHN Cn1ncc2c1nc(-c1ccncc1)nc2N[C@H]1CCN(Cc2ccccc2)C1 ZINC000072167644 570351982 /nfs/dbraw/zinc/35/19/82/570351982.db2.gz YRKCBKLLJHATBU-SFHVURJKSA-N 0 3 385.475 3.112 10 0 GGAEHN CCOC(=O)c1cc(-c2ccc(C)cc2)n(CCC(=O)NCCN(C)C)c1C ZINC000003958351 570353886 /nfs/dbraw/zinc/35/38/86/570353886.db2.gz LNVXTFBKKJARDM-UHFFFAOYSA-N 0 3 385.508 3.017 10 0 GGAEHN Cc1ccc2c(C(=O)N(C)CCN3CCCC3)cc(-c3cn[nH]c3)nc2c1C ZINC000023379767 570359038 /nfs/dbraw/zinc/35/90/38/570359038.db2.gz DHFTUZAUDYUKTJ-UHFFFAOYSA-N 0 3 377.492 3.410 10 0 GGAEHN CN(C)[C@H]1CCN(C(=O)c2cc(-c3cncnc3)nc3ccc(Cl)cc32)C1 ZINC000023542339 570364893 /nfs/dbraw/zinc/36/48/93/570364893.db2.gz IDRNEBJBZCGIDE-HNNXBMFYSA-N 0 3 381.867 3.121 10 0 GGAEHN COc1cccc(Cn2ncc3ccc(C(=O)NCCN4CCCCC4)cc32)c1 ZINC000035559963 570396689 /nfs/dbraw/zinc/39/66/89/570396689.db2.gz KMSCTQPNZWITAG-UHFFFAOYSA-N 0 3 392.503 3.309 10 0 GGAEHN Cc1ccc(CN(C)C(=O)CN2CCCN(Cc3ccc(C)cc3)CC2)cc1 ZINC000024972484 570400562 /nfs/dbraw/zinc/40/05/62/570400562.db2.gz ZWARVIZWTCVVRX-UHFFFAOYSA-N 0 3 379.548 3.470 10 0 GGAEHN CCN(CC)[C@H](CNC(=O)NCc1ccc(C(=O)OC)cc1)c1ccccc1 ZINC000027334691 570433110 /nfs/dbraw/zinc/43/31/10/570433110.db2.gz BGHUWDMSYRIHSJ-HXUWFJFHSA-N 0 3 383.492 3.356 10 0 GGAEHN CC(C)[C@H]1CN(C(=O)[C@H]2CC[C@@H](O)CC2)CCCN1Cc1ccc(F)cc1 ZINC000244874465 570433985 /nfs/dbraw/zinc/43/39/85/570433985.db2.gz XBTIPTGDNOGTIC-HLAWJBBLSA-N 0 3 376.516 3.436 10 0 GGAEHN CCCN(Cc1c(-c2ccccc2)noc1N1CCN(C)CC1)C[C@@H](O)CC ZINC000035781191 570448453 /nfs/dbraw/zinc/44/84/53/570448453.db2.gz IINZNVBKRSLACC-IBGZPJMESA-N 0 3 386.540 3.076 10 0 GGAEHN COc1ccc(COC[C@@H](O)CN[C@@H]2CCSc3ccccc32)cc1OC ZINC000089464544 570453954 /nfs/dbraw/zinc/45/39/54/570453954.db2.gz LNZOZEAGCKMUBA-FUHWJXTLSA-N 0 3 389.517 3.408 10 0 GGAEHN C[C@H](NC(=O)CC[NH+]1CCC(C(=O)Nc2ccccc2[O-])CC1)c1ccccc1 ZINC000028901778 570466439 /nfs/dbraw/zinc/46/64/39/570466439.db2.gz NAYDARZCGGAITQ-KRWDZBQOSA-N 0 3 395.503 3.310 10 0 GGAEHN CN(C)C[C@@H](NC(=O)C1CCN(C(=O)c2ccsc2)CC1)c1ccccc1 ZINC000030521814 570490463 /nfs/dbraw/zinc/49/04/63/570490463.db2.gz QLDDJLIKNLHJNV-LJQANCHMSA-N 0 3 385.533 3.019 10 0 GGAEHN CCCN(Cc1ccc(OC)c(OC)c1)C[C@@H](O)COc1ccc(OC)cc1 ZINC000036095967 570535459 /nfs/dbraw/zinc/53/54/59/570535459.db2.gz LEWOVYLBLQSUKA-GOSISDBHSA-N 0 3 389.492 3.364 10 0 GGAEHN COc1cccc(CN(CC(C)C)C[C@H](O)COCc2ccco2)c1OC ZINC000036097051 570535542 /nfs/dbraw/zinc/53/55/42/570535542.db2.gz JOTCXVQGRORTPM-SFHVURJKSA-N 0 3 377.481 3.333 10 0 GGAEHN COc1cccc(CN(CC(C)C)C[C@@H](O)COCc2ccco2)c1OC ZINC000036097053 570535625 /nfs/dbraw/zinc/53/56/25/570535625.db2.gz JOTCXVQGRORTPM-GOSISDBHSA-N 0 3 377.481 3.333 10 0 GGAEHN CC(C)CC(=O)Nc1ccc(N(C)C)c(CN(CCN(C)C)C(=O)C(C)C)c1 ZINC000006695920 570539107 /nfs/dbraw/zinc/53/91/07/570539107.db2.gz CSWPKHWJYIXVCQ-UHFFFAOYSA-N 0 3 390.572 3.283 10 0 GGAEHN Cc1ccc(C(=O)N2CCC(CC(=O)NCCN3CCCC[C@@H]3C)CC2)cc1 ZINC000032974205 570562783 /nfs/dbraw/zinc/56/27/83/570562783.db2.gz HJLAYXBJGWVOQW-IBGZPJMESA-N 0 3 385.552 3.228 10 0 GGAEHN CN(C)CCNC(=O)c1ccc2c(c1)NC(=O)/C(=C/c1ccccc1Cl)O2 ZINC000032983824 570572101 /nfs/dbraw/zinc/57/21/01/570572101.db2.gz YSCILTKNBGGTKB-PDGQHHTCSA-N 0 3 385.851 3.003 10 0 GGAEHN COc1ccc(Cc2nc3ccc(C(=O)NCCN4CCCC4)cc3o2)cc1 ZINC000040451182 570583246 /nfs/dbraw/zinc/58/32/46/570583246.db2.gz UHQFVUKMZVVMIR-UHFFFAOYSA-N 0 3 379.460 3.253 10 0 GGAEHN CCN(CC(=O)N1CCC(C)CC1)[C@H]1CCCN(C(=O)OC(C)(C)C)CC1 ZINC000225670144 570600958 /nfs/dbraw/zinc/60/09/58/570600958.db2.gz NQTKYYQXBOQWAB-SFHVURJKSA-N 0 3 381.561 3.356 10 0 GGAEHN CC(C)CNC(=O)[C@@H]1Cc2ccccc2N2CCN(CCc3ccccc3)C[C@@H]12 ZINC000169680429 570601645 /nfs/dbraw/zinc/60/16/45/570601645.db2.gz OQSNJTBOUXXRGX-VWNXMTODSA-N 0 3 391.559 3.364 10 0 GGAEHN CC[C@@H]1CN(Cc2ccccc2)[C@@H](CC)CN1C(=O)CNC(=O)C1CCCC1 ZINC000229751296 570666442 /nfs/dbraw/zinc/66/64/42/570666442.db2.gz PRGBXSCJCNYYSE-LEWJYISDSA-N 0 3 385.552 3.194 10 0 GGAEHN CN1CCN([C@@H]2CCCCN(C(=O)Nc3cccc(-n4cccc4)c3)C2)CC1 ZINC000241213415 570685900 /nfs/dbraw/zinc/68/59/00/570685900.db2.gz KOQHBJUFJAIWCK-OAQYLSRUSA-N 0 3 381.524 3.111 10 0 GGAEHN CN1CCN([C@H]2CCCCN(C(=O)Nc3cccc(-n4cccc4)c3)C2)CC1 ZINC000241213414 570685939 /nfs/dbraw/zinc/68/59/39/570685939.db2.gz KOQHBJUFJAIWCK-NRFANRHFSA-N 0 3 381.524 3.111 10 0 GGAEHN COCCCN(Cc1cncnc1)[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1 ZINC000241316815 570686630 /nfs/dbraw/zinc/68/66/30/570686630.db2.gz LVCXVFSXASMGDI-GOSISDBHSA-N 0 3 378.517 3.105 10 0 GGAEHN Cc1ccc(OC2CCN(CCCN3CCN(c4ccccc4)CC3)CC2)nc1 ZINC000242191266 570688828 /nfs/dbraw/zinc/68/88/28/570688828.db2.gz XEFPSCZMQZSZGZ-UHFFFAOYSA-N 0 3 394.563 3.446 10 0 GGAEHN Cn1cc([C@@H]2NC(=O)CC[C@H]2NCc2cccc(OCC3CCCCC3)c2)cn1 ZINC000275718837 570699115 /nfs/dbraw/zinc/69/91/15/570699115.db2.gz YVGUCMKMPVYBAB-GGAORHGYSA-N 0 3 396.535 3.489 10 0 GGAEHN Cc1ccc(CC(=O)N2CCC3(CN(C)C[C@@H]3c3noc(C4CC4)n3)CC2)cc1 ZINC000097940993 570742869 /nfs/dbraw/zinc/74/28/69/570742869.db2.gz BTWRORSCAMFFFN-LJQANCHMSA-N 0 3 394.519 3.136 10 0 GGAEHN CN(C)C[C@H]1CN(C(=O)Nc2cc(Cl)ccc2OCC2CCC2)CCO1 ZINC000189335148 570750568 /nfs/dbraw/zinc/75/05/68/570750568.db2.gz VSJBIPCQVJRHLC-INIZCTEOSA-N 0 3 381.904 3.313 10 0 GGAEHN O=C(NCc1cccc(F)c1)c1cccnc1N1CCN[C@@H](c2ccccc2)C1 ZINC000065255785 570754425 /nfs/dbraw/zinc/75/44/25/570754425.db2.gz QFMHKYLYFRLOHG-OAQYLSRUSA-N 0 3 390.462 3.302 10 0 GGAEHN O=C(NCc1ccc(F)cc1)c1ccc(N2CCN[C@@H](c3ccccc3)C2)nc1 ZINC000065256091 570754780 /nfs/dbraw/zinc/75/47/80/570754780.db2.gz GRFCTYKYXDZNMJ-OAQYLSRUSA-N 0 3 390.462 3.302 10 0 GGAEHN COc1cccc(NC(=O)c2ccc(N3CCN[C@H](c4ccccc4)C3)nc2)c1 ZINC000065256158 570754839 /nfs/dbraw/zinc/75/48/39/570754839.db2.gz QFOWPBHXUZRONQ-NRFANRHFSA-N 0 3 388.471 3.493 10 0 GGAEHN COc1ccc(-c2nccn3cc(C(=O)NCCN4CCCCCC4)nc23)cc1 ZINC000065274458 570777008 /nfs/dbraw/zinc/77/70/08/570777008.db2.gz DJRSYIAPVRURFM-UHFFFAOYSA-N 0 3 393.491 3.011 10 0 GGAEHN COC1(c2nc(Cc3ccccc3)no2)CCN(C[C@H](O)c2ccccc2)CC1 ZINC000283937539 570785747 /nfs/dbraw/zinc/78/57/47/570785747.db2.gz FUFLTPYJEOWQRE-FQEVSTJZSA-N 0 3 393.487 3.332 10 0 GGAEHN Cc1ccc2[nH]c(N3CCC(C(=O)NCCN4CCCC[C@@H]4C)CC3)nc2c1 ZINC000033070819 570802154 /nfs/dbraw/zinc/80/21/54/570802154.db2.gz MFHSFQCEDCKYBA-KRWDZBQOSA-N 0 3 383.540 3.078 10 0 GGAEHN Cc1ccc2nc(N3CCC(C(=O)NCCN4CCCC[C@@H]4C)CC3)[nH]c2c1 ZINC000033070819 570802158 /nfs/dbraw/zinc/80/21/58/570802158.db2.gz MFHSFQCEDCKYBA-KRWDZBQOSA-N 0 3 383.540 3.078 10 0 GGAEHN CN(CCNC(=O)[C@H]1CCCN(c2nc3ccccc3[nH]2)C1)Cc1ccccc1 ZINC000033071814 570803093 /nfs/dbraw/zinc/80/30/93/570803093.db2.gz BEUPGVJRELHVPN-IBGZPJMESA-N 0 3 391.519 3.028 10 0 GGAEHN CN(C)C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1 ZINC000032779414 570807749 /nfs/dbraw/zinc/80/77/49/570807749.db2.gz PDSAYRGGCMGBTH-JOCHJYFZSA-N 0 3 380.536 3.253 10 0 GGAEHN CCN(CC)CCOC(=O)c1ccc(NC(=O)Cc2ccc(OC)cc2)cc1 ZINC000004666164 570813588 /nfs/dbraw/zinc/81/35/88/570813588.db2.gz VORBFJGJWVJJQT-UHFFFAOYSA-N 0 3 384.476 3.375 10 0 GGAEHN Cc1cccc(N2CCN(C(=O)C3CCN(c4ccncc4)CC3)C[C@H]2C)c1 ZINC000033128941 570818113 /nfs/dbraw/zinc/81/81/13/570818113.db2.gz VVNUNXSFOIXUMO-LJQANCHMSA-N 0 3 378.520 3.344 10 0 GGAEHN CC(C)C[C@@H](N[C@@H](C)C(=O)Nc1cccc(S(N)(=O)=O)c1)c1ccccc1 ZINC000032806159 570822686 /nfs/dbraw/zinc/82/26/86/570822686.db2.gz IURZMOMMLGVOSA-HNAYVOBHSA-N 0 3 389.521 3.038 10 0 GGAEHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(-n2cncn2)c(F)c1 ZINC000170597554 570855555 /nfs/dbraw/zinc/85/55/55/570855555.db2.gz JLKBXLZMXWSHSF-HXUWFJFHSA-N 0 3 395.482 3.293 10 0 GGAEHN CN(C)CCOc1cccc(CC(=O)NCc2coc(-c3cccs3)n2)c1 ZINC000170600234 570858617 /nfs/dbraw/zinc/85/86/17/570858617.db2.gz KUXBVXPEGKXKEI-UHFFFAOYSA-N 0 3 385.489 3.202 10 0 GGAEHN COC(=O)c1ccc(OC[C@@H](O)CNCc2cccc(C(F)(F)F)c2)cc1 ZINC000003353485 570860517 /nfs/dbraw/zinc/86/05/17/570860517.db2.gz YWEGFHLMPLEAPO-INIZCTEOSA-N 0 3 383.366 3.022 10 0 GGAEHN COc1cccc(N2C(=O)C3ON(c4ccccc4)[C@@H](c4ccco4)[C@@H]3C2=O)c1 ZINC000103560991 570886607 /nfs/dbraw/zinc/88/66/07/570886607.db2.gz KYNAPNJVTRUHCO-SLFFLAALSA-N 0 3 390.395 3.339 10 0 GGAEHN C[C@@H](N[C@@H]1CCCC[C@H]1NC(=O)OC(C)(C)C)C(=O)N1C[C@H](C)C[C@H](C)C1 ZINC000097102614 570894802 /nfs/dbraw/zinc/89/48/02/570894802.db2.gz JNRHZMFLPVOTPD-CWQOZTLDSA-N 0 3 381.561 3.305 10 0 GGAEHN CCn1ccnc1[C@H]1OCCC[C@@H]1NCc1ccc(Oc2cnccn2)cc1 ZINC000190428823 570899226 /nfs/dbraw/zinc/89/92/26/570899226.db2.gz GQSPITSEUGFDIE-ICSRJNTNSA-N 0 3 379.464 3.495 10 0 GGAEHN COC(=O)c1cccc(OC[C@H](O)CN(C)[C@H](C)c2ccc(F)c(F)c2)c1 ZINC000104887919 570907185 /nfs/dbraw/zinc/90/71/85/570907185.db2.gz OQRDPNFIUUEVEG-CZUORRHYSA-N 0 3 379.403 3.184 10 0 GGAEHN COCCn1c(C)cc(O)c([C@@H](c2cccc(F)c2)N2CCC(C)CC2)c1=O ZINC000016993389 570923179 /nfs/dbraw/zinc/92/31/79/570923179.db2.gz AYQJNMZDQYNLJH-OAQYLSRUSA-N 0 3 388.483 3.469 10 0 GGAEHN CCN1CCC(N(C)C(=O)CCC(=O)N2CCC[C@@H]2C2CCCCC2)CC1 ZINC000073708475 570933049 /nfs/dbraw/zinc/93/30/49/570933049.db2.gz OGSMDAVRLXDEER-HXUWFJFHSA-N 0 3 377.573 3.281 10 0 GGAEHN CCc1c(NC(=O)N2CCN(c3ccncc3)CC2)cnn1-c1cccc(C)c1 ZINC000252484227 570968757 /nfs/dbraw/zinc/96/87/57/570968757.db2.gz FSBRYPYVKBPQFT-UHFFFAOYSA-N 0 3 390.491 3.492 10 0 GGAEHN CC(C)CCc1cc(NC(=O)Nc2cnn(CCN3CCCCC3)c2)n(C)n1 ZINC000252484813 570969059 /nfs/dbraw/zinc/96/90/59/570969059.db2.gz GIMRUDLNGOCAIP-UHFFFAOYSA-N 0 3 387.532 3.335 10 0 GGAEHN CCc1ccc(Cn2nnc(C(=O)Nc3cnccc3N3CCCC3)c2C)cc1 ZINC000252498682 570976535 /nfs/dbraw/zinc/97/65/35/570976535.db2.gz RIMULZWSSYEBMV-UHFFFAOYSA-N 0 3 390.491 3.445 10 0 GGAEHN COCCN1CCC(CNC(=O)Nc2nn([C@H](C)c3ccccc3)cc2C)CC1 ZINC000252509503 570979572 /nfs/dbraw/zinc/97/95/72/570979572.db2.gz YOVYSNRSJUQYQV-GOSISDBHSA-N 0 3 399.539 3.281 10 0 GGAEHN CC(C)c1ccccc1NC(=O)[C@@H](C)N1CCN(C2CCN(C)CC2)[C@@H](C)C1 ZINC000108155961 570984385 /nfs/dbraw/zinc/98/43/85/570984385.db2.gz KARPIIIHJYUWBH-RBUKOAKNSA-N 0 3 386.584 3.237 10 0 GGAEHN COCCN1CCC(CNC(=O)N[C@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000108548710 570989851 /nfs/dbraw/zinc/98/98/51/570989851.db2.gz NJFFPVYQRROPBH-CQSZACIVSA-N 0 3 387.446 3.424 10 0 GGAEHN C[C@H](CCN1CCN(c2ccccc2)CC1)NC(=O)NCc1cccc(F)c1 ZINC000045593660 570993021 /nfs/dbraw/zinc/99/30/21/570993021.db2.gz XQZXWDQOOACTAV-GOSISDBHSA-N 0 3 384.499 3.226 10 0 GGAEHN Cc1cccc(CNC(=O)N[C@@H](C)CCN2CCN(c3ccccc3)CC2)c1 ZINC000045701329 570995350 /nfs/dbraw/zinc/99/53/50/570995350.db2.gz VDUUZRKHHKHIDM-FQEVSTJZSA-N 0 3 380.536 3.395 10 0 GGAEHN Cc1cccc(CNC(=O)N[C@H](C)CCN2CCN(c3ccccc3)CC2)c1 ZINC000045701335 570995398 /nfs/dbraw/zinc/99/53/98/570995398.db2.gz VDUUZRKHHKHIDM-HXUWFJFHSA-N 0 3 380.536 3.395 10 0 GGAEHN CCOC(=O)c1[nH]c(C)c(CCC(=O)N2CCN(C3CCCCC3)CC2)c1C ZINC000046045801 571015088 /nfs/dbraw/zinc/01/50/88/571015088.db2.gz OBIANUWHBFOCBI-UHFFFAOYSA-N 0 3 389.540 3.218 10 0 GGAEHN Cc1cccc([C@@H]2CC[C@@H](C(=O)NCCN(C)C)CN2C(=O)C2CCCC2)c1 ZINC000037545814 571029281 /nfs/dbraw/zinc/02/92/81/571029281.db2.gz LIVKSFWUGVRFFF-RTWAWAEBSA-N 0 3 385.552 3.143 10 0 GGAEHN C/C=C/c1ccc(OC[C@H](O)CNCc2ccc(OC)c(OC)c2)c(OC)c1 ZINC000007014906 1398584017 /nfs/dbraw/zinc/58/40/17/1398584017.db2.gz MPWATAZEHXNZCX-DUMMIQTOSA-N 0 3 387.476 3.275 10 0 GGAEHN O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CCCc2ccccc21 ZINC000007983228 1398786389 /nfs/dbraw/zinc/78/63/89/1398786389.db2.gz SSXJFZNTIXHACN-UHFFFAOYSA-N 0 3 376.504 3.056 10 0 GGAEHN COc1cc(NC(=S)N2CCN(C3CCCCC3)CC2)cc(OC)c1OC ZINC000017080452 1399271520 /nfs/dbraw/zinc/27/15/20/1399271520.db2.gz UFOBPCZGZZPJHG-UHFFFAOYSA-N 0 3 393.553 3.360 10 0 GGAEHN Cc1ccc2cc3cc(C(=O)NCCCN4CCN(C)CC4)sc3nc2c1 ZINC000020178736 1399343648 /nfs/dbraw/zinc/34/36/48/1399343648.db2.gz HGNANRHUDVFORP-UHFFFAOYSA-N 0 3 382.533 3.125 10 0 GGAEHN CCN1CCN(CCCNC(=O)c2cc3c(s2)-c2c(C)cccc2OC3)CC1 ZINC000020355764 1399345243 /nfs/dbraw/zinc/34/52/43/1399345243.db2.gz UJOWNZVQTKSBRO-UHFFFAOYSA-N 0 3 399.560 3.373 10 0 GGAEHN COCCn1c(C)cc(O)c([C@H](c2ccccc2OC)N2CCCCC2)c1=O ZINC000021097688 1399364251 /nfs/dbraw/zinc/36/42/51/1399364251.db2.gz UCVZFPGYFKPGRZ-NRFANRHFSA-N 0 3 386.492 3.093 10 0 GGAEHN COCCn1c(C)cc(O)c([C@@H](c2ccccc2OC)N2CCCCC2)c1=O ZINC000021097694 1399364955 /nfs/dbraw/zinc/36/49/55/1399364955.db2.gz UCVZFPGYFKPGRZ-OAQYLSRUSA-N 0 3 386.492 3.093 10 0 GGAEHN O=C(NCc1ccccc1Cl)[C@H]1C[C@H]2CCCN2[C@@]12C(=O)Nc1ccccc12 ZINC000021161484 1399367340 /nfs/dbraw/zinc/36/73/40/1399367340.db2.gz YPFUZZSXZHNHQM-ZDPZECHZSA-N 0 3 395.890 3.288 10 0 GGAEHN NC(=O)CNC(=O)c1ccc(CNCc2ccc(-c3ccc(F)cc3)s2)cc1 ZINC000047798962 1404951479 /nfs/dbraw/zinc/95/14/79/1404951479.db2.gz DKGSQXKXIMKLNY-UHFFFAOYSA-N 0 3 397.475 3.059 10 0 GGAEHN C[C@H]1CN(c2ccccc2NC(=O)N2CCN(C3CCCC3)CC2)C[C@H](C)O1 ZINC000047809184 1404957475 /nfs/dbraw/zinc/95/74/75/1404957475.db2.gz DODKXWAGNZWNTG-ROUUACIJSA-N 0 3 386.540 3.392 10 0 GGAEHN Clc1cc(CNCc2cccc(CN3CCOCC3)c2)cc2c1OCCO2 ZINC000048745593 1405279708 /nfs/dbraw/zinc/27/97/08/1405279708.db2.gz HGMPOMMPLOGVCY-UHFFFAOYSA-N 0 3 388.895 3.233 10 0 GGAEHN CN(C)C(=O)COc1cccc(CNCc2cc(Br)cs2)c1 ZINC000048745697 1405279801 /nfs/dbraw/zinc/27/98/01/1405279801.db2.gz FTTXSSMKUIVZFC-UHFFFAOYSA-N 0 3 383.311 3.267 10 0 GGAEHN CCOc1c(Br)cc(Br)cc1CN[C@H]1CCN(C)C1 ZINC000049084882 1405339788 /nfs/dbraw/zinc/33/97/88/1405339788.db2.gz CXJXQKKCPCMSRX-LBPRGKRZSA-N 0 3 392.135 3.404 10 0 GGAEHN CN(C)CCn1c(=O)oc2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccc(F)cc3)cc21 ZINC000058739858 1407873200 /nfs/dbraw/zinc/87/32/00/1407873200.db2.gz AZMJGVXHIHPTLP-IAGOWNOFSA-N 0 3 383.423 3.037 10 0 GGAEHN COc1ccc2cc(CNCC(=O)N3CCN(c4ccccc4)CC3)ccc2c1 ZINC000062256131 1408225227 /nfs/dbraw/zinc/22/52/27/1408225227.db2.gz HFKHEQJYOHHDBI-UHFFFAOYSA-N 0 3 389.499 3.287 10 0 GGAEHN Cc1oc2c(c1C(=O)NCCN1CCCC1)CN(Cc1ccc(F)cc1)CC2 ZINC000065291960 1408659820 /nfs/dbraw/zinc/65/98/20/1408659820.db2.gz GNSRQAPFJPUHGJ-UHFFFAOYSA-N 0 3 385.483 3.111 10 0 GGAEHN COc1ccc(OC)c(CCNC(=O)N2CCN(CC3CCCCC3)CC2)c1 ZINC000065460582 1408672910 /nfs/dbraw/zinc/67/29/10/1408672910.db2.gz CDYSWGJBYOSCBG-UHFFFAOYSA-N 0 3 389.540 3.154 10 0 GGAEHN CN1CCN(C(=O)c2ccc(CNCc3ccc(Cl)c(F)c3)cc2)CC1 ZINC000065931874 1408756856 /nfs/dbraw/zinc/75/68/56/1408756856.db2.gz HLFUIUPMVDQERS-UHFFFAOYSA-N 0 3 375.875 3.157 10 0 GGAEHN COc1cc(CNCc2ccccc2N2CCOCC2)ccc1OC(F)F ZINC000065934963 1408757503 /nfs/dbraw/zinc/75/75/03/1408757503.db2.gz FXSOHNLIYBNCLR-UHFFFAOYSA-N 0 3 378.419 3.423 10 0 GGAEHN CN(C)C(=O)COc1ccccc1CNC[C@H](O)c1ccc2ccccc2c1 ZINC000067121972 1409013318 /nfs/dbraw/zinc/01/33/18/1409013318.db2.gz CUSCQBGAGYEJDN-NRFANRHFSA-N 0 3 378.472 3.130 10 0 GGAEHN CN(C)C(=O)COc1ccccc1CNC[C@@H](O)c1ccc2ccccc2c1 ZINC000067121973 1409013502 /nfs/dbraw/zinc/01/35/02/1409013502.db2.gz CUSCQBGAGYEJDN-OAQYLSRUSA-N 0 3 378.472 3.130 10 0 GGAEHN Cc1nn(CCO)c(C)c1CN[C@H](C)c1ccc(OCc2cccnc2)cc1 ZINC000067188103 1409035998 /nfs/dbraw/zinc/03/59/98/1409035998.db2.gz FMTZNSSRZZFKCY-MRXNPFEDSA-N 0 3 380.492 3.317 10 0 GGAEHN CCCOc1cc(CN[C@@H](C)c2ccc(S(=O)(=O)NC)cc2)ccc1OC ZINC000067248027 1409052261 /nfs/dbraw/zinc/05/22/61/1409052261.db2.gz GWBLGEYFRBBOMA-HNNXBMFYSA-N 0 3 392.521 3.243 10 0 GGAEHN Cc1cccc(OC[C@H](O)CNCc2ccccc2OCc2ccccn2)c1 ZINC000067253994 1409053800 /nfs/dbraw/zinc/05/38/00/1409053800.db2.gz GYNQYEBUUJNZIT-OAQYLSRUSA-N 0 3 378.472 3.499 10 0 GGAEHN C[C@@H]1CN(Cc2cccc(CNCc3cccc4c3OCCCO4)c2)CCO1 ZINC000067976555 1409267978 /nfs/dbraw/zinc/26/79/78/1409267978.db2.gz FESYGAJLCZKXOY-GOSISDBHSA-N 0 3 382.504 3.358 10 0 GGAEHN O=C(NC[C@@H]1CCCO1)c1cccc(CNCc2ccc(-n3cccn3)cc2)c1 ZINC000067979433 1409269122 /nfs/dbraw/zinc/26/91/22/1409269122.db2.gz HJBUHEGFIZRXRJ-QFIPXVFZSA-N 0 3 390.487 3.071 10 0 GGAEHN CCOc1ccc(CN[C@H](C)c2ccc(S(=O)(=O)NC)cc2)cc1OCC ZINC000069061208 1409554693 /nfs/dbraw/zinc/55/46/93/1409554693.db2.gz DSGUZHJPBYIUPW-OAHLLOKOSA-N 0 3 392.521 3.243 10 0 GGAEHN CCOc1ccc(CN[C@@H](C)c2ccc(S(=O)(=O)NC)cc2)cc1OCC ZINC000069061202 1409554721 /nfs/dbraw/zinc/55/47/21/1409554721.db2.gz DSGUZHJPBYIUPW-HNNXBMFYSA-N 0 3 392.521 3.243 10 0 GGAEHN CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(SC)c(OC)c2)cc1 ZINC000069159992 1409577516 /nfs/dbraw/zinc/57/75/16/1409577516.db2.gz GUFHOBRTNZDWLW-CYBMUJFWSA-N 0 3 380.535 3.176 10 0 GGAEHN COc1ccc(CNCc2c[nH]nc2-c2ccc3c(c2)OCCO3)cc1OC ZINC000069645087 1409667046 /nfs/dbraw/zinc/66/70/46/1409667046.db2.gz DGDDEQSDLSDQNV-UHFFFAOYSA-N 0 3 381.432 3.155 10 0 GGAEHN CN(C)CCn1c(=O)oc2ccc(NC(=O)[C@H]3C[C@H]3c3ccc(F)cc3)cc21 ZINC000069918835 1409723552 /nfs/dbraw/zinc/72/35/52/1409723552.db2.gz AZMJGVXHIHPTLP-IRXDYDNUSA-N 0 3 383.423 3.037 10 0 GGAEHN COc1ccc2ccccc2c1CNCc1ccc(N2CCN(C)CC2)nc1 ZINC000075759688 1409882652 /nfs/dbraw/zinc/88/26/52/1409882652.db2.gz DBTYTZZGXYDTMO-UHFFFAOYSA-N 0 3 376.504 3.285 10 0 GGAEHN CN1CCN(c2cc(CNCc3cccc(OC4CCCC4)c3)ccn2)CC1 ZINC000077506917 1409896782 /nfs/dbraw/zinc/89/67/82/1409896782.db2.gz GPVVQVDQLRDKTR-UHFFFAOYSA-N 0 3 380.536 3.445 10 0 GGAEHN CC[C@@H](NC(=O)NC[C@H](C)CN1CCN(CC)CC1)c1ccc(C)c(F)c1 ZINC000093135053 1410224860 /nfs/dbraw/zinc/22/48/60/1410224860.db2.gz GVNUKZLDRJCISB-OXJNMPFZSA-N 0 3 378.536 3.158 10 0 GGAEHN C[C@@H]1CN(c2ccc(CNCc3cn(C)nc3-c3cccs3)cn2)CCO1 ZINC000093947756 1410289080 /nfs/dbraw/zinc/28/90/80/1410289080.db2.gz FRLYTAGQQQBXEO-OAHLLOKOSA-N 0 3 383.521 3.059 10 0 GGAEHN CCN(C)C(C)(C)C(=O)NCCCCCc1nc(-c2ccc(OC)cc2)no1 ZINC000095432817 1410310403 /nfs/dbraw/zinc/31/04/03/1410310403.db2.gz HMMSFEWBIFBUMW-UHFFFAOYSA-N 0 3 388.512 3.305 10 0 GGAEHN Cc1cc(CNC[C@H](Cc2ccc(F)cc2)C(N)=O)c(OC(F)F)cc1C ZINC000095464345 1410312737 /nfs/dbraw/zinc/31/27/37/1410312737.db2.gz SZGHIMCJRUPIGA-INIZCTEOSA-N 0 3 380.410 3.478 10 0 GGAEHN C[C@H]1CCCCN1CCNC(=O)CSc1nccnc1Oc1ccccc1 ZINC000096332622 1410327824 /nfs/dbraw/zinc/32/78/24/1410327824.db2.gz HRRIHLMRDMRSCE-INIZCTEOSA-N 0 3 386.521 3.352 10 0 GGAEHN O=C(c1ccc2ncnc(N3CCCC3)c2c1)N1CCN(C2CCCCC2)CC1 ZINC000096399918 1410331356 /nfs/dbraw/zinc/33/13/56/1410331356.db2.gz PRPMWYMFALEMIA-UHFFFAOYSA-N 0 3 393.535 3.321 10 0 GGAEHN COc1cc(/C=C\C(=O)N2CCCN(C)CC2)ccc1OCc1c(C)noc1C ZINC000096536910 1410332703 /nfs/dbraw/zinc/33/27/03/1410332703.db2.gz GBTRNZFEISEIAA-CLFYSBASSA-N 0 3 399.491 3.056 10 0 GGAEHN C/C=C\c1ccc(OC[C@H](O)CNCc2ccc(OC)c(OC)c2)c(OC)c1 ZINC000096635245 1410335115 /nfs/dbraw/zinc/33/51/15/1410335115.db2.gz MPWATAZEHXNZCX-OOFWQKGWSA-N 0 3 387.476 3.275 10 0 GGAEHN O=C(C1CCN(Cc2cccc(F)c2)CC1)N1CCN(Cc2ccccc2)CC1 ZINC000096626068 1410335589 /nfs/dbraw/zinc/33/55/89/1410335589.db2.gz ZQNSMYQOURSAIE-UHFFFAOYSA-N 0 3 395.522 3.382 10 0 GGAEHN CCN(CC)C[C@@H](C)NS(=O)(=O)/C=C/c1ccc(Br)cc1 ZINC000097104245 1410352335 /nfs/dbraw/zinc/35/23/35/1410352335.db2.gz QGNJPNZZHSAPLA-OCHBPSSRSA-N 0 3 375.332 3.070 10 0 GGAEHN CC[C@@H](NC(=O)NCCCN1CCC[C@@H]1C(=O)N(C)C)c1ccc(Cl)cc1 ZINC000102050456 1410551026 /nfs/dbraw/zinc/55/10/26/1410551026.db2.gz HVJRJYYGLOGCPG-QZTJIDSGSA-N 0 3 394.947 3.033 10 0 GGAEHN COc1cc(CN[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc(OC)c1 ZINC000105463186 1411069172 /nfs/dbraw/zinc/06/91/72/1411069172.db2.gz CVUHPTHYCCJZGJ-INIZCTEOSA-N 0 3 387.499 3.446 10 0 GGAEHN COc1cc(OC)c(OC)cc1CN[C@H]1CCN(c2ccc(F)cc2F)C1 ZINC000106488081 1411225768 /nfs/dbraw/zinc/22/57/68/1411225768.db2.gz BBXBXOXHGZHIJP-HNNXBMFYSA-N 0 3 378.419 3.359 10 0 GGAEHN CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)CC1CCC(c2ccccc2)CC1 ZINC000108264778 1411462424 /nfs/dbraw/zinc/46/24/24/1411462424.db2.gz HTISKTTUOOAXDU-VTLFHKLASA-N 0 3 399.579 3.409 10 0 GGAEHN CN(C(=O)[C@@H]1C[C@@H]1c1ccccc1Cl)C1CCN(CCn2cccn2)CC1 ZINC000109292827 1411734136 /nfs/dbraw/zinc/73/41/36/1411734136.db2.gz HRWHUYIUKQTGPE-RTBURBONSA-N 0 3 386.927 3.263 10 0 GGAEHN CN(C(=O)[C@@H]1C[C@H]1c1ccccc1Cl)C1CCN(CCn2cccn2)CC1 ZINC000109292832 1411734463 /nfs/dbraw/zinc/73/44/63/1411734463.db2.gz HRWHUYIUKQTGPE-RBUKOAKNSA-N 0 3 386.927 3.263 10 0 GGAEHN C[C@@H](NC(=O)N(C)C1CCN(CCn2cccn2)CC1)c1cc2ccccc2o1 ZINC000109392490 1411754036 /nfs/dbraw/zinc/75/40/36/1411754036.db2.gz HIKSWMBSQOHNCZ-QGZVFWFLSA-N 0 3 395.507 3.496 10 0 GGAEHN CCCc1nc(C)c(C(=O)N(CCC(=O)OCC)C[C@@H]2CCCN2CC)s1 ZINC000109591704 1411796579 /nfs/dbraw/zinc/79/65/79/1411796579.db2.gz CGVBNTBLBMZDLY-INIZCTEOSA-N 0 3 395.569 3.284 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)Nc3ccc4oc(=O)ccc4c3)cc2)CC1 ZINC000114173823 1412386941 /nfs/dbraw/zinc/38/69/41/1412386941.db2.gz DVDMBMAPFKMBIA-UHFFFAOYSA-N 0 3 377.444 3.187 10 0 GGAEHN Cc1ccc(-c2ncc(CNC[C@H](O)COc3ccc4c(c3)OCO4)s2)cc1 ZINC000115613932 1412734361 /nfs/dbraw/zinc/73/43/61/1412734361.db2.gz FCDBHTCEHCCFDL-INIZCTEOSA-N 0 3 398.484 3.377 10 0 GGAEHN CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)c1cc2ccc(C(C)(C)C)cc2[nH]1 ZINC000116649750 1412891754 /nfs/dbraw/zinc/89/17/54/1412891754.db2.gz HPDIHMIHLBLARL-HXUWFJFHSA-N 0 3 398.551 3.138 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)Nc3ccc(N4CCCC4=O)cc3)cc2)CC1 ZINC000118870825 1413255541 /nfs/dbraw/zinc/25/55/41/1413255541.db2.gz FQGPSWXFJQYFJH-UHFFFAOYSA-N 0 3 392.503 3.208 10 0 GGAEHN CNS(=O)(=O)Cc1ccc(CNCc2ccc(C)c(Br)c2)cc1 ZINC000119119330 1413344723 /nfs/dbraw/zinc/34/47/23/1413344723.db2.gz DMKUJNRBONHVJK-UHFFFAOYSA-N 0 3 397.338 3.097 10 0 GGAEHN COc1cc(CNC[C@@H]2CN(Cc3ccccc3)CCO2)ccc1OC(F)F ZINC000119696397 1413535107 /nfs/dbraw/zinc/53/51/07/1413535107.db2.gz FMKQMVCTHJAKIX-GOSISDBHSA-N 0 3 392.446 3.287 10 0 GGAEHN CN(C)CCN(Cc1ccco1)C(=O)Nc1nnc(/C=C/c2ccco2)s1 ZINC000119743783 1413551851 /nfs/dbraw/zinc/55/18/51/1413551851.db2.gz HSYDCBWVOQPOPD-BQYQJAHWSA-N 0 3 387.465 3.490 10 0 GGAEHN CCN1CCN(Cc2ccc(NC(=O)c3cc(OC)c(OC)cc3C)cc2)CC1 ZINC000119945185 1413627412 /nfs/dbraw/zinc/62/74/12/1413627412.db2.gz CANVNCTVYMCEOF-UHFFFAOYSA-N 0 3 397.519 3.402 10 0 GGAEHN COc1cc(CN2CC[C@@H](N3CCOCC3)C2)ccc1OCc1ccccc1 ZINC000121061937 1413992820 /nfs/dbraw/zinc/99/28/20/1413992820.db2.gz RMYJJBNAPWBZJU-OAQYLSRUSA-N 0 3 382.504 3.181 10 0 GGAEHN COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH2+][C@H](C)[C@@H]3CCOC3)c2)cc1 ZINC000121696308 1414226699 /nfs/dbraw/zinc/22/66/99/1414226699.db2.gz FFJTWDQEDQLISI-NVXWUHKLSA-N 0 3 390.505 3.011 10 0 GGAEHN CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000122966786 1414608678 /nfs/dbraw/zinc/60/86/78/1414608678.db2.gz FGNUDKIPEDUEEZ-IBGZPJMESA-N 0 3 395.503 3.335 10 0 GGAEHN CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000122966786 1414608680 /nfs/dbraw/zinc/60/86/80/1414608680.db2.gz FGNUDKIPEDUEEZ-IBGZPJMESA-N 0 3 395.503 3.335 10 0 GGAEHN Cc1cc(S(=O)(=O)[N-]C[C@@H](C)C[NH+]2CCCCC2)sc1Br ZINC000123747652 1414819279 /nfs/dbraw/zinc/81/92/79/1414819279.db2.gz AVZBXYLBRSMHKA-LLVKDONJSA-N 0 3 395.388 3.219 10 0 GGAEHN Cc1cc(S(=O)(=O)[N-]C[C@H](C)C[NH+]2CCCCC2)sc1Br ZINC000123747839 1414819615 /nfs/dbraw/zinc/81/96/15/1414819615.db2.gz AVZBXYLBRSMHKA-NSHDSACASA-N 0 3 395.388 3.219 10 0 GGAEHN CCc1ccc([C@@H]2CCCCN2CCOc2ccc(S(N)(=O)=O)cc2)o1 ZINC000124815457 1415051178 /nfs/dbraw/zinc/05/11/78/1415051178.db2.gz HUWPZKQMTSIEHR-SFHVURJKSA-N 0 3 378.494 3.095 10 0 GGAEHN COC(=O)Nc1ccc(CNC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1 ZINC000125103586 1415109795 /nfs/dbraw/zinc/10/97/95/1415109795.db2.gz DYKNOFKXBNPXPC-JXFKEZNVSA-N 0 3 396.491 3.327 10 0 GGAEHN Cc1ccc(-c2ncc(CNCc3ccnc(N4CCN(C)CC4)c3)s2)o1 ZINC000125555423 1415225869 /nfs/dbraw/zinc/22/58/69/1415225869.db2.gz AHHSCLYEQWXPCU-UHFFFAOYSA-N 0 3 383.521 3.148 10 0 GGAEHN CN(C)[C@H](CNC(=O)NCc1cnn(Cc2ccccc2)c1)c1ccccc1 ZINC000125676929 1415252470 /nfs/dbraw/zinc/25/24/70/1415252470.db2.gz DVIGMRBXDMQELA-OAQYLSRUSA-N 0 3 377.492 3.034 10 0 GGAEHN CS[C@@H](CO)[C@@H](C)NCc1cn(-c2ccc(Br)cc2)nc1C ZINC000125772195 1415276647 /nfs/dbraw/zinc/27/66/47/1415276647.db2.gz FEGRKUZIJZZRKI-WBMJQRKESA-N 0 3 384.343 3.145 10 0 GGAEHN CC(C)(CNC(=O)N1CC[C@@H](Oc2cccnc2)C1)N1CCc2ccccc2C1 ZINC000177914884 1428890397 /nfs/dbraw/zinc/89/03/97/1428890397.db2.gz BRDLJZJDILYQII-OAQYLSRUSA-N 0 3 394.519 3.081 10 0 GGAEHN CCC(=O)N1CC[C@H](NCc2cn(-c3ccc(Br)cc3)nc2C)C1 ZINC000126743179 1415544606 /nfs/dbraw/zinc/54/46/06/1415544606.db2.gz FQYROXGGVZWXHB-INIZCTEOSA-N 0 3 391.313 3.044 10 0 GGAEHN CCOc1c(CNC2CCN(C(=O)c3ccco3)CC2)c(C)nn1CC(C)C ZINC000128376199 1415974221 /nfs/dbraw/zinc/97/42/21/1415974221.db2.gz CAIVVPNADOBEKQ-UHFFFAOYSA-N 0 3 388.512 3.234 10 0 GGAEHN CN(C)[C@@H](CNC(=O)[C@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1)c1ccccc1 ZINC000129720542 1416253733 /nfs/dbraw/zinc/25/37/33/1416253733.db2.gz FMUKPAREIBOHCT-OTWHNJEPSA-N 0 3 389.540 3.489 10 0 GGAEHN CNC(=O)c1cccc(CN(C)CC[C@H](NC(=O)OC(C)(C)C)C(C)C)c1 ZINC000178468206 1429084256 /nfs/dbraw/zinc/08/42/56/1429084256.db2.gz AZYBXAIAVWMOGD-SFHVURJKSA-N 0 3 377.529 3.417 10 0 GGAEHN CN(C[C@H]1CCCCO1)C(=O)Nc1ccc(CCN2CCSCC2)cc1 ZINC000130689836 1416425492 /nfs/dbraw/zinc/42/54/92/1416425492.db2.gz AWVOYMRDZODBAR-LJQANCHMSA-N 0 3 377.554 3.311 10 0 GGAEHN CNS(=O)(=O)Cc1ccc(CNCc2ccc(Cl)c3cccnc23)cc1 ZINC000131064145 1416503385 /nfs/dbraw/zinc/50/33/85/1416503385.db2.gz GBJJPHMIOUHYJJ-UHFFFAOYSA-N 0 3 389.908 3.227 10 0 GGAEHN C[C@H](N[C@H]1CCCC[C@@H]1C(N)=O)C(=O)Nc1ccccc1Cc1ccccc1 ZINC000131239632 1416528386 /nfs/dbraw/zinc/52/83/86/1416528386.db2.gz BQVVCGWGOAFKAC-LRQRDZAKSA-N 0 3 379.504 3.238 10 0 GGAEHN C[C@@H](N[C@@H]1CCCC[C@@H]1C(N)=O)C(=O)Nc1ccccc1Cc1ccccc1 ZINC000131239447 1416528442 /nfs/dbraw/zinc/52/84/42/1416528442.db2.gz BQVVCGWGOAFKAC-LKUPVBHCSA-N 0 3 379.504 3.238 10 0 GGAEHN O[C@H](CNCc1ccc(N2CCCC2)nc1)COc1ccc(C(F)(F)F)cc1 ZINC000131570475 1416577720 /nfs/dbraw/zinc/57/77/20/1416577720.db2.gz CSPARFXTHCNTCZ-QGZVFWFLSA-N 0 3 395.425 3.230 10 0 GGAEHN COCCOc1ccc([C@H](C)NCc2cccc(CS(C)(=O)=O)c2)cc1 ZINC000131587340 1416580536 /nfs/dbraw/zinc/58/05/36/1416580536.db2.gz HCBSTNJBBKTHOE-INIZCTEOSA-N 0 3 377.506 3.107 10 0 GGAEHN CN1CCN(c2ncc(CNCc3ccc(OC4CCCCC4)cc3)cn2)CC1 ZINC000134262434 1417046569 /nfs/dbraw/zinc/04/65/69/1417046569.db2.gz CKQLUNJJYKOGKL-UHFFFAOYSA-N 0 3 395.551 3.230 10 0 GGAEHN CCC1CCC(N(C(=O)NCCCN2CCC[C@@H]2C(=O)N(C)C)C2CC2)CC1 ZINC000138415668 1417413451 /nfs/dbraw/zinc/41/34/51/1417413451.db2.gz ADJKXRRJDMKMNC-AFMYVXGZSA-N 0 3 392.588 3.072 10 0 GGAEHN O[C@@H](CNCc1cnn(-c2ccc(Cl)cc2)c1)COc1cccc(F)c1 ZINC000140071641 1417487727 /nfs/dbraw/zinc/48/77/27/1417487727.db2.gz GQAUCEBBOVWBDD-SFHVURJKSA-N 0 3 375.831 3.194 10 0 GGAEHN CN(Cc1cn(C)nc1C(F)(F)F)C[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000178885532 1429210896 /nfs/dbraw/zinc/21/08/96/1429210896.db2.gz POYIBCQZLQMLKP-LBPRGKRZSA-N 0 3 376.423 3.128 10 0 GGAEHN CN(Cc1cn(C)nc1C(F)(F)F)C[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000178885518 1429211215 /nfs/dbraw/zinc/21/12/15/1429211215.db2.gz POYIBCQZLQMLKP-GFCCVEGCSA-N 0 3 376.423 3.128 10 0 GGAEHN Fc1ccc(CNCc2cccc(OCCN3CCOCC3)c2)c2ncccc12 ZINC000151433088 1417965991 /nfs/dbraw/zinc/96/59/91/1417965991.db2.gz GMCYOVABRPMNGU-UHFFFAOYSA-N 0 3 395.478 3.375 10 0 GGAEHN C[C@@H]1CN(c2ccc(CNCc3c[nH]nc3-c3ccccc3F)cn2)CCO1 ZINC000151536114 1418017303 /nfs/dbraw/zinc/01/73/03/1418017303.db2.gz CHJDZUIIHAWAFH-OAHLLOKOSA-N 0 3 381.455 3.126 10 0 GGAEHN COc1cc([C@@H](C)NCc2c[nH]nc2-c2ccccc2F)ccc1OCCO ZINC000151680334 1418059037 /nfs/dbraw/zinc/05/90/37/1418059037.db2.gz GEUVIYVUKIDKSK-CQSZACIVSA-N 0 3 385.439 3.446 10 0 GGAEHN COc1cc([C@H](C)NCc2c[nH]nc2-c2ccccc2F)ccc1OCCO ZINC000151680267 1418059217 /nfs/dbraw/zinc/05/92/17/1418059217.db2.gz GEUVIYVUKIDKSK-AWEZNQCLSA-N 0 3 385.439 3.446 10 0 GGAEHN Fc1ccc([C@@H](CNCc2ncccc2C(F)(F)F)N2CCOCC2)cc1 ZINC000152026590 1418124602 /nfs/dbraw/zinc/12/46/02/1418124602.db2.gz FHYJKTPSUJGMEL-GOSISDBHSA-N 0 3 383.389 3.403 10 0 GGAEHN C[C@@H]1CCc2nc(CNCc3ccc(CN4CCN(C)CC4)cc3)sc2C1 ZINC000152214499 1418175332 /nfs/dbraw/zinc/17/53/32/1418175332.db2.gz BJULRMDFTIJNIU-QGZVFWFLSA-N 0 3 384.593 3.305 10 0 GGAEHN CC[C@@H](CNC(=O)N[C@H](CCO)c1ccccc1)N1CCc2ccccc2C1 ZINC000153482647 1422561356 /nfs/dbraw/zinc/56/13/56/1422561356.db2.gz BDICNLWBCMJEBZ-FCHUYYIVSA-N 0 3 381.520 3.246 10 0 GGAEHN CC(C)(CNC(=O)N1CC[C@@H](Oc2ccncc2)C1)N1CCc2ccccc2C1 ZINC000153723705 1422722603 /nfs/dbraw/zinc/72/26/03/1422722603.db2.gz CVRKANCHBOQXCS-OAQYLSRUSA-N 0 3 394.519 3.081 10 0 GGAEHN O=C1C[C@H](NCc2cc(Br)cc(C(F)(F)F)c2)CN1C1CC1 ZINC000156056439 1423654183 /nfs/dbraw/zinc/65/41/83/1423654183.db2.gz HRLAPKUCBNROHD-LBPRGKRZSA-N 0 3 377.204 3.321 10 0 GGAEHN Cc1ccc(CNCc2ccnc(N3CCN(C)CC3)c2)c(Br)c1 ZINC000160012791 1424562791 /nfs/dbraw/zinc/56/27/91/1424562791.db2.gz CXZUGHKULNMLNJ-UHFFFAOYSA-N 0 3 389.341 3.194 10 0 GGAEHN CCc1nn(C)c(CC)c1CNC[C@@H](O)COc1cccc(C(F)(F)F)c1 ZINC000160932807 1424646312 /nfs/dbraw/zinc/64/63/12/1424646312.db2.gz HBDSXYKRMWTOLX-CQSZACIVSA-N 0 3 385.430 3.093 10 0 GGAEHN Cc1cc(=O)n(C)cc1NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 ZINC000162560983 1424866163 /nfs/dbraw/zinc/86/61/63/1424866163.db2.gz HVYCBZGJZSPZJL-QGZVFWFLSA-N 0 3 388.537 3.350 10 0 GGAEHN CN1CCN(Cc2ccc(Nc3ncnc4c3cnn4-c3ccccc3)cc2)CC1 ZINC000170545702 1425264348 /nfs/dbraw/zinc/26/43/48/1425264348.db2.gz BJWFDVNIWPSGCI-UHFFFAOYSA-N 0 3 399.502 3.307 10 0 GGAEHN Cc1ccc([C@H](CNC(=O)N(C)[C@@H](C)CNC(=O)OC(C)(C)C)N(C)C)cc1 ZINC000171904953 1425848412 /nfs/dbraw/zinc/84/84/12/1425848412.db2.gz ALFZZYWAFVJTFJ-WMZOPIPTSA-N 0 3 392.544 3.152 10 0 GGAEHN O=S(=O)([N-]C1CC[NH+](CC2CCCC2)CC1)c1cnc(Cl)c(Cl)c1 ZINC000172600121 1426107923 /nfs/dbraw/zinc/10/79/23/1426107923.db2.gz QBQZZYSQGVACMI-UHFFFAOYSA-N 0 3 392.352 3.321 10 0 GGAEHN Cc1cc(F)ccc1S(=O)(=O)N(C)C[C@H]1CCN(Cc2ccccc2)C1 ZINC000174039844 1426963635 /nfs/dbraw/zinc/96/36/35/1426963635.db2.gz PYSGNEHLPBDOND-GOSISDBHSA-N 0 3 376.497 3.277 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)N(C)Cc3ccc(OC)cc3OC)cc2)CC1 ZINC000174939180 1427455960 /nfs/dbraw/zinc/45/59/60/1427455960.db2.gz JMCVDECMGFQNMH-UHFFFAOYSA-N 0 3 397.519 3.118 10 0 GGAEHN Cc1ccc(N2CCOC2=O)cc1NC(=O)N1CCN([C@H]2C[C@H]3CC[C@@H]2C3)CC1 ZINC000175447373 1427759577 /nfs/dbraw/zinc/75/95/77/1427759577.db2.gz GPOYKLJKTPUMLW-QKLQHJQFSA-N 0 3 398.507 3.290 10 0 GGAEHN Cc1ccc(N2CCOC2=O)cc1NC(=O)N1CCN([C@@H]2C[C@H]3CC[C@@H]2C3)CC1 ZINC000175447350 1427759703 /nfs/dbraw/zinc/75/97/03/1427759703.db2.gz GPOYKLJKTPUMLW-SQGPQFPESA-N 0 3 398.507 3.290 10 0 GGAEHN CCN1CCN(c2ccc(C(=O)Nc3cccc(-c4nnco4)c3)cc2)CC1 ZINC000175616044 1427833194 /nfs/dbraw/zinc/83/31/94/1427833194.db2.gz VLLSIIUHESAMNR-UHFFFAOYSA-N 0 3 377.448 3.131 10 0 GGAEHN O=C(NCc1ccccc1CN1CCC(O)CC1)N[C@H]1C[C@@H]1c1cccc(F)c1 ZINC000176019578 1428030405 /nfs/dbraw/zinc/03/04/05/1428030405.db2.gz DTOIEOSIMUDKSH-YADHBBJMSA-N 0 3 397.494 3.138 10 0 GGAEHN CCCn1c2ccc(S(=O)(=O)N(C)C)cc2nc1CN(C(C)C)C(C)C ZINC000180449242 1429872232 /nfs/dbraw/zinc/87/22/32/1429872232.db2.gz HQVIUNCLFCXXDP-UHFFFAOYSA-N 0 3 380.558 3.315 10 0 GGAEHN COc1ccccc1[C@@H](C)NC(=O)CN[C@@H](C)c1ccc(-n2cccn2)cc1 ZINC000180846027 1430067697 /nfs/dbraw/zinc/06/76/97/1430067697.db2.gz GJFPKASTSZIASF-DLBZAZTESA-N 0 3 378.476 3.409 10 0 GGAEHN C[C@@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)C(=O)NC(=O)NCC(F)(F)F ZINC000180903369 1430099376 /nfs/dbraw/zinc/09/93/76/1430099376.db2.gz HSBDDZAHWLXNKE-QWHCGFSZSA-N 0 3 394.397 3.176 10 0 GGAEHN Cc1ccccc1[C@@H](C)NCC(=O)Nc1cccc(C(=O)N2CCSCC2)c1 ZINC000181537668 1430317033 /nfs/dbraw/zinc/31/70/33/1430317033.db2.gz CDKGVFJWULXROK-QGZVFWFLSA-N 0 3 397.544 3.473 10 0 GGAEHN Cn1ccnc1CC1CCN([C@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)CC1 ZINC000182238519 1430435014 /nfs/dbraw/zinc/43/50/14/1430435014.db2.gz ATUPIBUJOKHZBS-SFHVURJKSA-N 0 3 390.890 3.273 10 0 GGAEHN CC(C)(C)OC(=O)N1CC[C@H](N[C@@H](CO)c2cccc(Br)c2)C1 ZINC000182619380 1430503881 /nfs/dbraw/zinc/50/38/81/1430503881.db2.gz GDJMHVVSDGQPKJ-GJZGRUSLSA-N 0 3 385.302 3.082 10 0 GGAEHN Cc1cnc(C(C)(C)N[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)s1 ZINC000183921965 1430813533 /nfs/dbraw/zinc/81/35/33/1430813533.db2.gz CHQJBEISDTWZND-SJLPKXTDSA-N 0 3 386.565 3.055 10 0 GGAEHN CN1CCN(CCC(C)(C)NC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)CC1 ZINC000184199943 1430855323 /nfs/dbraw/zinc/85/53/23/1430855323.db2.gz HMQBTJZZIJGPIC-FCHUYYIVSA-N 0 3 379.548 3.476 10 0 GGAEHN CC(C)(C)OC(=O)N[C@@H]1CC[C@H]2CN(Cc3ccc(N4CCCC4)nc3)C[C@@H]21 ZINC000184244729 1430861539 /nfs/dbraw/zinc/86/15/39/1430861539.db2.gz HHMKWAKXDQZQOR-GBESFXJTSA-N 0 3 386.540 3.417 10 0 GGAEHN CC[C@H](N[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1nc(C)cs1 ZINC000184346727 1430876130 /nfs/dbraw/zinc/87/61/30/1430876130.db2.gz DJUNIBGCGBNIAG-UHOSZYNNSA-N 0 3 386.565 3.271 10 0 GGAEHN CCOC(=O)c1nn(C)cc1CNC[C@H]1CCN(c2cc(Cl)ccc2C)C1 ZINC000186332385 1431385090 /nfs/dbraw/zinc/38/50/90/1431385090.db2.gz DOKZYIGWCYNJHS-OAHLLOKOSA-N 0 3 390.915 3.175 10 0 GGAEHN C[C@H]1CN(C2CCN(Cc3ccc(OCc4ccccc4F)nc3)CC2)CCO1 ZINC000186726690 1431502894 /nfs/dbraw/zinc/50/28/94/1431502894.db2.gz CLTAGHBLCQLWLW-SFHVURJKSA-N 0 3 399.510 3.485 10 0 GGAEHN CCOc1cc(CN2CC[C@@H](O)[C@H](C)C2)ccc1OCC(=O)Nc1ccccc1 ZINC000190060607 1432312712 /nfs/dbraw/zinc/31/27/12/1432312712.db2.gz FOTVEOLOBUYTTH-YLJYHZDGSA-N 0 3 398.503 3.306 10 0 GGAEHN CN(Cc1cccnc1)C[C@H]1CCN(C(=O)/C=C/c2ccc3c(c2)CCO3)C1 ZINC000190576187 1432411621 /nfs/dbraw/zinc/41/16/21/1432411621.db2.gz IFZKSZATRGUXIK-ZEZYUPADSA-N 0 3 377.488 3.010 10 0 GGAEHN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)C2=Cc3cc(Cl)ccc3OC2)C1 ZINC000190649292 1432430875 /nfs/dbraw/zinc/43/08/75/1432430875.db2.gz FVXOQQOBLKTKQL-KRWDZBQOSA-N 0 3 397.906 3.491 10 0 GGAEHN COc1cccc([C@@H](O)CN2CCC23CCN(C(=O)OC(C)(C)C)CC3)c1 ZINC000193749754 1433051805 /nfs/dbraw/zinc/05/18/05/1433051805.db2.gz KAZBIQQLDZSGTE-SFHVURJKSA-N 0 3 376.497 3.204 10 0 GGAEHN CCN(CC)C[C@H](C)NS(=O)(=O)/C=C\c1ccc(Br)cc1 ZINC000221923672 1433366163 /nfs/dbraw/zinc/36/61/63/1433366163.db2.gz QGNJPNZZHSAPLA-OEYXZAGESA-N 0 3 375.332 3.070 10 0 GGAEHN CC1CCN([C@H](CNC(=O)[C@@H]2Cc3ccccc3CN2)c2cccs2)CC1 ZINC000236730447 1433377223 /nfs/dbraw/zinc/37/72/23/1433377223.db2.gz CMMJCEUMRGWZLR-VQTJNVASSA-N 0 3 383.561 3.352 10 0 GGAEHN Cc1nn(C)c(OCC(F)(F)F)c1CNC[C@@H](c1cccc(F)c1)N(C)C ZINC000237157030 1433390935 /nfs/dbraw/zinc/39/09/35/1433390935.db2.gz AOSNDSKYFGEUCR-INIZCTEOSA-N 0 3 388.409 3.201 10 0 GGAEHN CSCC[C@H](N)C(=O)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1 ZINC000237323901 1433397477 /nfs/dbraw/zinc/39/74/77/1433397477.db2.gz FLKZEIIDDODHTO-IBGZPJMESA-N 0 3 398.507 3.375 10 0 GGAEHN C[C@@H](NCc1cccc2c1OCCO2)c1cc(F)ccc1N1CCN(C)CC1 ZINC000237336759 1433398076 /nfs/dbraw/zinc/39/80/76/1433398076.db2.gz AVNOMVBJDAUOCG-MRXNPFEDSA-N 0 3 385.483 3.200 10 0 GGAEHN COc1ccc([C@H](CNC(=O)[C@H]2Cc3ccccc3CN2)N2CCCCC2)cc1 ZINC000237352344 1433398844 /nfs/dbraw/zinc/39/88/44/1433398844.db2.gz CEXNWWCOMMSGCJ-PKTZIBPZSA-N 0 3 393.531 3.053 10 0 GGAEHN O[C@H](CNCc1cccc(OC(F)(F)F)c1)COc1ccc(F)c(F)c1 ZINC000238143493 1433444361 /nfs/dbraw/zinc/44/43/61/1433444361.db2.gz BVXFSOWRIAXXMU-GFCCVEGCSA-N 0 3 377.309 3.393 10 0 GGAEHN C[C@H](CNC(=O)[C@@H]1CCCC[C@H]1C(=O)N1CCCC1)N(C)Cc1ccccc1 ZINC000246540808 1433628019 /nfs/dbraw/zinc/62/80/19/1433628019.db2.gz HXUZXMRCPAKTAO-HMXCVIKNSA-N 0 3 385.552 3.052 10 0 GGAEHN O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)N[C@H]1C[C@H]1c1cccc(F)c1 ZINC000248656303 1433814109 /nfs/dbraw/zinc/81/41/09/1433814109.db2.gz DMMJVWQFNWINNW-FSSWDIPSSA-N 0 3 397.494 3.272 10 0 GGAEHN CCO[C@H](O)[C@@H]1N[C@H](c2ccc(Cl)cc2)C([N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000252627424 1433863534 /nfs/dbraw/zinc/86/35/34/1433863534.db2.gz RTTHNEXNTOBPTG-QQXKLLMISA-N 0 3 376.840 3.137 10 0 GGAEHN CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)N[C@H](C)c2ccc(OC(C)C)cc2)C1 ZINC000253556960 1433869240 /nfs/dbraw/zinc/86/92/40/1433869240.db2.gz ANYWBGZEAOVDLW-ZHALLVOQSA-N 0 3 390.524 3.315 10 0 GGAEHN Cc1ncsc1CN1CCC[C@H](c2nc(C(C)C)no2)CCNC(=O)CC1 ZINC000257177838 1433893548 /nfs/dbraw/zinc/89/35/48/1433893548.db2.gz FKASUGGTZAGDND-HNNXBMFYSA-N 0 3 391.541 3.234 10 0 GGAEHN CCS(=O)(=O)c1ccc(Cc2nc(-c3ccc(CN(C)C)cc3)no2)cc1 ZINC000267106899 1434407840 /nfs/dbraw/zinc/40/78/40/1434407840.db2.gz XLIPQKWRFFAJAX-UHFFFAOYSA-N 0 3 385.489 3.183 10 0 GGAEHN CS[C@@H]1CN(C(=O)c2cnc(-c3ccccc3)nc2C)C[C@@H]1N1CCCC1 ZINC000273465197 1434990487 /nfs/dbraw/zinc/99/04/87/1434990487.db2.gz GBLKKYUBZWXXJQ-RBUKOAKNSA-N 0 3 382.533 3.104 10 0 GGAEHN CS[C@H]1CN(C(=O)c2cnc(-c3ccccc3)nc2C)C[C@H]1N1CCCC1 ZINC000273465188 1434990527 /nfs/dbraw/zinc/99/05/27/1434990527.db2.gz GBLKKYUBZWXXJQ-MOPGFXCFSA-N 0 3 382.533 3.104 10 0 GGAEHN CC(C)OCCN1CCC(N2C(=O)N[C@@H](c3ccc4ccccc4c3)C2=O)CC1 ZINC000277147300 1435268873 /nfs/dbraw/zinc/26/88/73/1435268873.db2.gz AQNFEDDCMVGVGV-NRFANRHFSA-N 0 3 395.503 3.322 10 0 GGAEHN COc1ccccc1S(=O)(=O)CCCN1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000281293776 1435802704 /nfs/dbraw/zinc/80/27/04/1435802704.db2.gz HAXIHVMZHHDAKI-HCXYKTFWSA-N 0 3 395.565 3.121 10 0 GGAEHN CN(C)Cc1ccc(-c2noc([C@@H]3CCS(=O)(=O)c4ccccc43)n2)cc1 ZINC000283802880 1435926930 /nfs/dbraw/zinc/92/69/30/1435926930.db2.gz HYKCPLARGXJXDI-QGZVFWFLSA-N 0 3 383.473 3.108 10 0 GGAEHN