smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCN(CCC)S(=O)(=O)N1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000160590728 539220298 /nfs/dbraw/zinc/22/02/98/539220298.db2.gz RFTCXJPGDRHSIF-HUUCEWRRSA-N 0 0 318.483 1.980 10 70 DDIERN CNC(=O)C1(C(=O)N[C@@H]2CC(C)(C)Oc3ccccc32)CC1 ZINC000159916004 283283335 /nfs/dbraw/zinc/28/33/35/283283335.db2.gz NJGAAMSAMFGJTP-GFCCVEGCSA-N 0 0 302.374 1.931 10 70 DDIERN CCc1nnc(CN2C[C@H](O)C[C@@H]2c2cc(F)ccc2F)[nH]1 ZINC000159466648 197356133 /nfs/dbraw/zinc/35/61/33/197356133.db2.gz VVEGUZNKLAGTOS-ZWNOBZJWSA-N 0 0 308.332 1.953 10 70 DDIERN O=C(CCNC(=O)[C@@H]1C[C@H]1C1CCCCC1)N1CCOCC1 ZINC000159979735 408448220 /nfs/dbraw/zinc/44/82/20/408448220.db2.gz XNZKTEBCJOGRGW-LSDHHAIUSA-N 0 0 308.422 1.568 10 70 DDIERN CC(C)[C@@H](O)CC(=O)N(C)[C@H]1CCCN(c2cccnn2)C1 ZINC000160440854 408485166 /nfs/dbraw/zinc/48/51/66/408485166.db2.gz YUFPIDUNSRZUAH-KBPBESRZSA-N 0 0 306.410 1.311 10 70 DDIERN CC[N@@H+]1CCC[C@H](NS(=O)(=O)Cc2c(F)cccc2F)C1 ZINC000161100815 408559702 /nfs/dbraw/zinc/55/97/02/408559702.db2.gz FLFXVHDWGKQREN-NSHDSACASA-N 0 0 318.389 1.869 10 70 DDIERN COc1cc(C(=O)NCCn2cc(C)cn2)cc(OC)c1O ZINC000161142930 408564683 /nfs/dbraw/zinc/56/46/83/408564683.db2.gz OBHNTKGKVVHTSI-UHFFFAOYSA-N 0 0 305.334 1.344 10 70 DDIERN CCc1ncc(NC(=O)N2CC[C@@H](c3cnn(C)c3)C2)cn1 ZINC000161214579 408574170 /nfs/dbraw/zinc/57/41/70/408574170.db2.gz UVMLKPYFSODORH-LLVKDONJSA-N 0 0 300.366 1.794 10 70 DDIERN COc1ccc(NC(=O)N[C@H]2CCc3ncnn3C2)c(OC)c1 ZINC000161342935 408590486 /nfs/dbraw/zinc/59/04/86/408590486.db2.gz MORIEDQOKSISPB-JTQLQIEISA-N 0 0 317.349 1.432 10 70 DDIERN CCn1c(C)nnc1CN1CC[C@@H](CNc2ccccn2)C1 ZINC000160909740 408536933 /nfs/dbraw/zinc/53/69/33/408536933.db2.gz CRSGMYLVZFEOHZ-AWEZNQCLSA-N 0 0 300.410 1.935 10 70 DDIERN CCOC(=O)C[C@H](C)NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C ZINC000160871629 520877178 /nfs/dbraw/zinc/87/71/78/520877178.db2.gz UROHFVNPDWDZHZ-WFASDCNBSA-N 0 0 314.426 1.631 10 70 DDIERN CN(CC(F)(F)F)C(=O)CN1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000160812279 282373489 /nfs/dbraw/zinc/37/34/89/282373489.db2.gz BHRXIELBWJIRHE-YPMHNXCESA-N 0 0 308.344 1.634 10 70 DDIERN CC(C)COc1ccc([C@H](C)NC(=O)Cn2cnnn2)cc1 ZINC000159567255 186127711 /nfs/dbraw/zinc/12/77/11/186127711.db2.gz SFNFZLWEYQXCKH-LBPRGKRZSA-N 0 0 303.366 1.585 10 70 DDIERN CC(C)OC(=O)CCCNC(=O)N[C@H]1CCCC[C@@H]1CO ZINC000160042235 408451588 /nfs/dbraw/zinc/45/15/88/408451588.db2.gz OZCGCQNCPBKLEX-OLZOCXBDSA-N 0 0 300.399 1.569 10 70 DDIERN C[C@H](CNC(=O)CCCc1nc(C2CC2)no1)N1CCOCC1 ZINC000159645856 408421491 /nfs/dbraw/zinc/42/14/91/408421491.db2.gz QSAZJWZJWKNPSP-GFCCVEGCSA-N 0 0 322.409 1.107 10 70 DDIERN O=C(Nc1ccc(F)nc1)C(=O)N1CCC(c2cc[nH]n2)CC1 ZINC000161227253 408575582 /nfs/dbraw/zinc/57/55/82/408575582.db2.gz PUIGQUPZXUROFQ-UHFFFAOYSA-N 0 0 317.324 1.289 10 70 DDIERN COc1ccc(OC)c(CN2CCOC[C@@H]2c2nc(C)no2)c1 ZINC000161057279 524826322 /nfs/dbraw/zinc/82/63/22/524826322.db2.gz WQJGVWZHURVQNB-CQSZACIVSA-N 0 0 319.361 1.969 10 70 DDIERN CC(C)CC(=O)N[C@@H](C(=O)N[C@@H](CO)CC(C)C)C(C)C ZINC000160870815 290777845 /nfs/dbraw/zinc/77/78/45/290777845.db2.gz XMNMLJOFUUTFCD-UKRRQHHQSA-N 0 0 300.443 1.697 10 70 DDIERN C[C@H](CCO)NC(=O)N[C@@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000161417355 197493261 /nfs/dbraw/zinc/49/32/61/197493261.db2.gz FRENFEZBBTZXCH-MNOVXSKESA-N 0 0 314.407 1.221 10 70 DDIERN CC1(C)C[C@@H](NC(=O)CSCC(N)=O)c2ccccc2O1 ZINC000159969396 278361622 /nfs/dbraw/zinc/36/16/22/278361622.db2.gz KCRMCGBOFMOJDT-LLVKDONJSA-N 0 0 308.403 1.624 10 70 DDIERN CCS(=O)(=O)CCN(C)C(=O)N[C@@H]1COc2ccccc21 ZINC000160775140 408521565 /nfs/dbraw/zinc/52/15/65/408521565.db2.gz QEFQBOWCFFGQTI-GFCCVEGCSA-N 0 0 312.391 1.196 10 70 DDIERN CCOc1cccc(NC(=O)N[C@H]2CCc3ncnn3C2)c1 ZINC000161166926 408566957 /nfs/dbraw/zinc/56/69/57/408566957.db2.gz PSXVJXGGPCLTSL-LBPRGKRZSA-N 0 0 301.350 1.813 10 70 DDIERN CC[C@H](COC)NC(=O)N[C@H]1CCc2nc(C(C)C)nn2C1 ZINC000161432727 408601942 /nfs/dbraw/zinc/60/19/42/408601942.db2.gz GAAOTHNNBJXWRH-NEPJUHHUSA-N 0 0 309.414 1.441 10 70 DDIERN CNC(=O)C1(C(=O)N[C@H]2CC(C)(C)Oc3ccccc32)CC1 ZINC000159915861 283283743 /nfs/dbraw/zinc/28/37/43/283283743.db2.gz NJGAAMSAMFGJTP-LBPRGKRZSA-N 0 0 302.374 1.931 10 70 DDIERN CCOc1ccc(NC(=O)N[C@H]2CCc3ncnn3C2)cc1 ZINC000161051714 197460905 /nfs/dbraw/zinc/46/09/05/197460905.db2.gz XUVANPGWHNMEIV-LBPRGKRZSA-N 0 0 301.350 1.813 10 70 DDIERN CC(C)[C@@H](C)NC(=O)N(C)CCN1C(=O)c2ccccc2C1=O ZINC000161361416 197488228 /nfs/dbraw/zinc/48/82/28/197488228.db2.gz GRFYFAYOOKELKC-GFCCVEGCSA-N 0 0 317.389 1.969 10 70 DDIERN CCCCC[C@@H](C)NC(=O)CN1CCOC[C@@H]1c1nc(C)no1 ZINC000160833554 162149757 /nfs/dbraw/zinc/14/97/57/162149757.db2.gz XJJDJJXWHZNIDU-TZMCWYRMSA-N 0 0 324.425 1.836 10 70 DDIERN COc1ccc(CN(C)C(=O)N[C@H]2CCc3ncnn3C2)cc1 ZINC000161286980 408580768 /nfs/dbraw/zinc/58/07/68/408580768.db2.gz ZHTKJUDIVCBGGL-ZDUSSCGKSA-N 0 0 315.377 1.443 10 70 DDIERN CCCCS(=O)(=O)N[C@@H]1CCc2nc(C(C)C)nn2C1 ZINC000159395154 520939601 /nfs/dbraw/zinc/93/96/01/520939601.db2.gz DCXOLHNMJBRNQW-LLVKDONJSA-N 0 0 300.428 1.436 10 70 DDIERN C[C@H](NC(=O)N1CCCN(CC(F)F)CC1)[C@H]1CCCO1 ZINC000160456473 525020293 /nfs/dbraw/zinc/02/02/93/525020293.db2.gz RLJDOZJSLVBHBK-NWDGAFQWSA-N 0 0 305.369 1.536 10 70 DDIERN CC(C)[C@H](O)CC(=O)Nc1ccccc1-n1ccc(C(N)=O)n1 ZINC000160038755 197381118 /nfs/dbraw/zinc/38/11/18/197381118.db2.gz JVSDKVDBYULZGD-CQSZACIVSA-N 0 0 316.361 1.317 10 70 DDIERN C[C@H]1CC[C@@H](NC(=O)c2nccnc2C(N)=O)c2ccccc21 ZINC000159563928 408417193 /nfs/dbraw/zinc/41/71/93/408417193.db2.gz RWEOJHYOBWPWII-GXFFZTMASA-N 0 0 310.357 1.944 10 70 DDIERN CN(Cc1ccc(Cl)nc1)C(=O)N[C@H]1CCc2ncnn2C1 ZINC000161174658 408568290 /nfs/dbraw/zinc/56/82/90/408568290.db2.gz YYVAISCXWHEZAX-NSHDSACASA-N 0 0 320.784 1.483 10 70 DDIERN CCN1CCN(C(=O)N[C@H]2CCc3nc(C(C)C)nn3C2)CC1 ZINC000161433016 408603117 /nfs/dbraw/zinc/60/31/17/408603117.db2.gz WIVHZEQGJZJAMH-ZDUSSCGKSA-N 0 0 320.441 1.063 10 70 DDIERN O=C(NCCc1cccnc1)N1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000159472336 197356158 /nfs/dbraw/zinc/35/61/58/197356158.db2.gz VILKDBNFFLVOBX-WBVHZDCISA-N 0 0 303.406 1.961 10 70 DDIERN COc1nc(C)nc(NC[C@H](CO)Cc2ccccn2)c1C ZINC000159419739 408409172 /nfs/dbraw/zinc/40/91/72/408409172.db2.gz AFZKXBJFPYMRAS-CYBMUJFWSA-N 0 0 302.378 1.760 10 70 DDIERN COc1ncc(NC(=O)c2cccc3[nH]ccc32)cc1C(N)=O ZINC000160753701 408520768 /nfs/dbraw/zinc/52/07/68/408520768.db2.gz GDRIOEHQOBTOSO-UHFFFAOYSA-N 0 0 310.313 1.923 10 70 DDIERN COC[C@@H](NC(=O)N[C@@H]1CCc2nc(C(C)C)nn2C1)C1CC1 ZINC000160183017 408462767 /nfs/dbraw/zinc/46/27/67/408462767.db2.gz SOIYDHGEIUHOIN-CHWSQXEVSA-N 0 0 321.425 1.441 10 70 DDIERN CN(Cc1ccc(F)cc1)C(=O)N[C@@H]1CCc2ncnn2C1 ZINC000161051110 408553476 /nfs/dbraw/zinc/55/34/76/408553476.db2.gz QYOTYUIRULPVFF-CYBMUJFWSA-N 0 0 303.341 1.574 10 70 DDIERN Cc1ccc(CN(C)C(=O)N[C@H]2CCc3ncnn3C2)s1 ZINC000161201570 408572005 /nfs/dbraw/zinc/57/20/05/408572005.db2.gz XAADAPZFYASGHY-NSHDSACASA-N 0 0 305.407 1.804 10 70 DDIERN COC(=O)c1cc(CN2CCOC[C@H]2c2nc(C)no2)oc1C ZINC000160907359 521842366 /nfs/dbraw/zinc/84/23/66/521842366.db2.gz RUBCHBOHBSOWLG-ZDUSSCGKSA-N 0 0 321.333 1.640 10 70 DDIERN CC(C)N(C)S(=O)(=O)N1CCC(Cn2cccn2)CC1 ZINC000159415779 408404875 /nfs/dbraw/zinc/40/48/75/408404875.db2.gz ZWLKJOMQPQVHJD-UHFFFAOYSA-N 0 0 300.428 1.180 10 70 DDIERN CC(C)[C@@H](O)CC(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1 ZINC000160653379 408508104 /nfs/dbraw/zinc/50/81/04/408508104.db2.gz FXUWBCNRTIQMLY-OCCSQVGLSA-N 0 0 318.373 1.237 10 70 DDIERN CN(CCOc1ccccc1)C(=O)N[C@H]1CCc2ncnn2C1 ZINC000161287209 408581395 /nfs/dbraw/zinc/58/13/95/408581395.db2.gz RVXMCEFDIKTCOR-ZDUSSCGKSA-N 0 0 315.377 1.313 10 70 DDIERN COc1c(F)cc(NC(=O)N[C@H]2CCc3ncnn3C2)cc1F ZINC000161265421 197479808 /nfs/dbraw/zinc/47/98/08/197479808.db2.gz NPUZFZXAEAVQSQ-QMMMGPOBSA-N 0 0 323.303 1.701 10 70 DDIERN COCCC1(CNC(=O)N2CCC[C@@H](n3cncn3)C2)CC1 ZINC000161032920 408552525 /nfs/dbraw/zinc/55/25/25/408552525.db2.gz VCUUIIOEJDVQMI-CYBMUJFWSA-N 0 0 307.398 1.441 10 70 DDIERN O=C1NC[C@H]2CN(c3ccnc4c(F)cc(F)cc34)CCN12 ZINC000159874653 284909839 /nfs/dbraw/zinc/90/98/39/284909839.db2.gz MEWQSLQDHVIRCN-JTQLQIEISA-N 0 0 304.300 1.727 10 70 DDIERN CCc1cc(=O)n2nc(N[C@@H]3CCCC[C@H]3C(N)=O)sc2n1 ZINC000159607171 408419867 /nfs/dbraw/zinc/41/98/67/408419867.db2.gz SCFKWZYIBFTRFI-NXEZZACHSA-N 0 0 321.406 1.169 10 70 DDIERN CC(C)c1nc2n(n1)C[C@@H](NC(=O)NCC1(C)COC1)CC2 ZINC000159852648 408437624 /nfs/dbraw/zinc/43/76/24/408437624.db2.gz RZEUFZGWYAQLGI-NSHDSACASA-N 0 0 307.398 1.052 10 70 DDIERN O=C(N[C@@H]1CCc2ncnn2C1)NC1(c2ccccc2F)CC1 ZINC000161002984 408549144 /nfs/dbraw/zinc/54/91/44/408549144.db2.gz KEBMSHHMXCRHBK-LLVKDONJSA-N 0 0 315.352 1.721 10 70 DDIERN O=C(NCCCNc1ccccc1)N[C@H]1CCc2ncnn2C1 ZINC000161251573 408578700 /nfs/dbraw/zinc/57/87/00/408578700.db2.gz OHEUCFDQABLGQD-AWEZNQCLSA-N 0 0 314.393 1.394 10 70 DDIERN CCCCc1nnc(NC(=O)N[C@H]2CCc3ncnn3C2)s1 ZINC000161323081 408586740 /nfs/dbraw/zinc/58/67/40/408586740.db2.gz UJVSCXYKFCLYSF-VIFPVBQESA-N 0 0 321.410 1.609 10 70 DDIERN COCCOc1cccc(CC(=O)N[C@H](C)[C@@H]2CCCO2)c1 ZINC000161446972 408602489 /nfs/dbraw/zinc/60/24/89/408602489.db2.gz ZUGAFSUZSJFOGQ-CJNGLKHVSA-N 0 0 307.390 1.938 10 70 DDIERN C[C@H](CCO)NC(=O)N[C@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000161417493 408600858 /nfs/dbraw/zinc/60/08/58/408600858.db2.gz FRENFEZBBTZXCH-GHMZBOCLSA-N 0 0 314.407 1.221 10 70 DDIERN CCC[C@H](NC(=O)[C@@H]1CC(=O)N(CC)C1)C(=O)OC(C)(C)C ZINC000161392910 521136914 /nfs/dbraw/zinc/13/69/14/521136914.db2.gz DYGTVBXVTDAHCX-NEPJUHHUSA-N 0 0 312.410 1.481 10 70 DDIERN Cc1nn(C)c(C)c1CN1CCN(C(=O)C[C@H](O)C(C)C)CC1 ZINC000160215430 290768125 /nfs/dbraw/zinc/76/81/25/290768125.db2.gz DPIXJULTCZCSMX-INIZCTEOSA-N 0 0 322.453 1.088 10 70 DDIERN CCc1ncsc1C(=O)N[C@@H]1CCCN(c2cccnn2)C1 ZINC000160320481 197399764 /nfs/dbraw/zinc/39/97/64/197399764.db2.gz CFCBCRYBBHWPGC-LLVKDONJSA-N 0 0 317.418 1.894 10 70 DDIERN COc1cccc([C@H](O)C(=O)N2CCO[C@@H]3CCCC[C@@H]32)c1 ZINC000159970696 408450005 /nfs/dbraw/zinc/45/00/05/408450005.db2.gz VFIXJCLEUTWZRR-XHSDSOJGSA-N 0 0 305.374 1.899 10 70 DDIERN CCCCCNC(=O)CS(=O)(=O)Cc1nccn1C(C)C ZINC000161220180 408574291 /nfs/dbraw/zinc/57/42/91/408574291.db2.gz KJSZKYSIDFWAJN-UHFFFAOYSA-N 0 0 315.439 1.685 10 70 DDIERN CCOC(=O)NCCCC(=O)N1CCC[C@H]1Cn1ccnc1C ZINC000161361192 408595319 /nfs/dbraw/zinc/59/53/19/408595319.db2.gz MDNPBKGNWONDLE-AWEZNQCLSA-N 0 0 322.409 1.709 10 70 DDIERN CC[C@H](COC)NC(=O)N[C@@H]1CCc2nc(C(C)C)nn2C1 ZINC000161432445 408602726 /nfs/dbraw/zinc/60/27/26/408602726.db2.gz GAAOTHNNBJXWRH-VXGBXAGGSA-N 0 0 309.414 1.441 10 70 DDIERN C[C@@H](CNC(=O)CCCc1nc(C2CC2)no1)N1CCOCC1 ZINC000159645719 524649031 /nfs/dbraw/zinc/64/90/31/524649031.db2.gz QSAZJWZJWKNPSP-LBPRGKRZSA-N 0 0 322.409 1.107 10 70 DDIERN NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC1(C2CC2)CC1 ZINC000159702730 186136408 /nfs/dbraw/zinc/13/64/08/186136408.db2.gz SKFGXWFLQXJCFT-AWEZNQCLSA-N 0 0 301.390 1.572 10 70 DDIERN CN(Cc1cccc(F)c1)C(=O)N[C@H]1CCc2ncnn2C1 ZINC000160990997 408547084 /nfs/dbraw/zinc/54/70/84/408547084.db2.gz QETNEGALGOAPMH-ZDUSSCGKSA-N 0 0 303.341 1.574 10 70 DDIERN CC(C)Oc1ncccc1NC(=O)N[C@H]1CCc2ncnn2C1 ZINC000161272394 408580964 /nfs/dbraw/zinc/58/09/64/408580964.db2.gz MWFVLGMJNNDTCQ-NSHDSACASA-N 0 0 316.365 1.597 10 70 DDIERN COc1cccc(Cl)c1CC(=O)N1C[C@H]2OCCN(C)[C@H]2C1 ZINC000160712640 484067927 /nfs/dbraw/zinc/06/79/27/484067927.db2.gz ZNZSONJZWAWVJB-DZGCQCFKSA-N 0 0 324.808 1.433 10 70 DDIERN C[C@H](C(=O)N1CCC2(CNc3ccccc32)CC1)n1cncn1 ZINC000217560595 201519278 /nfs/dbraw/zinc/51/92/78/201519278.db2.gz XVWMOVKCQKFHEM-CYBMUJFWSA-N 0 0 311.389 1.825 10 70 DDIERN CC(C)OC(=O)CCCNC(=O)N1CCC[C@H](n2cncn2)C1 ZINC000160132558 197387766 /nfs/dbraw/zinc/38/77/66/197387766.db2.gz INVBCRWWNMLRQE-ZDUSSCGKSA-N 0 0 323.397 1.356 10 70 DDIERN CCOc1ccc(NC(=O)N[C@@H]2CCc3ncnn3C2)cc1 ZINC000161051595 408555178 /nfs/dbraw/zinc/55/51/78/408555178.db2.gz XUVANPGWHNMEIV-GFCCVEGCSA-N 0 0 301.350 1.813 10 70 DDIERN CCC[C@H](NC(=O)[C@H]1CC(=O)N(CC)C1)C(=O)OC(C)(C)C ZINC000161393176 408596357 /nfs/dbraw/zinc/59/63/57/408596357.db2.gz DYGTVBXVTDAHCX-RYUDHWBXSA-N 0 0 312.410 1.481 10 70 DDIERN CNC(=O)[C@@H]1CCCN1C(=O)NC1CCC(OC(C)C)CC1 ZINC000160238193 539219731 /nfs/dbraw/zinc/21/97/31/539219731.db2.gz PWZHSXOYIMEZSZ-RUXDESIVSA-N 0 0 311.426 1.643 10 70 DDIERN CC(=O)N1CCN(C[C@H]2CC(c3ccc(Cl)cc3)=NO2)CC1 ZINC000159726579 186138037 /nfs/dbraw/zinc/13/80/37/186138037.db2.gz BSSKIMUAEWIBFY-OAHLLOKOSA-N 0 0 321.808 1.997 10 70 DDIERN NC(=O)[C@@H]1CN(C[C@H]2CC(c3ccc(Cl)cc3)=NO2)CCO1 ZINC000159786671 197364132 /nfs/dbraw/zinc/36/41/32/197364132.db2.gz KGFDHNGJORKVDN-OCCSQVGLSA-N 0 0 323.780 1.019 10 70 DDIERN Cc1cnn(CCNC(=O)[C@H](C)Oc2cccc(CO)c2)c1 ZINC000161149321 290781905 /nfs/dbraw/zinc/78/19/05/290781905.db2.gz FBNJMZGHSBDXCY-ZDUSSCGKSA-N 0 0 303.362 1.268 10 70 DDIERN C[C@H](NC(=O)N[C@@H](C)[C@@H]1CCCO1)c1nnc2n1CCCC2 ZINC000159792529 299167103 /nfs/dbraw/zinc/16/71/03/299167103.db2.gz YZPAKJMPGZWVLR-SRVKXCTJSA-N 0 0 307.398 1.542 10 70 DDIERN COc1cc(CNC(=O)N2CC[C@]3(O)CCCC[C@H]3C2)ccn1 ZINC000159410908 197351839 /nfs/dbraw/zinc/35/18/39/197351839.db2.gz NPYYLLVKCLYJGN-WMLDXEAASA-N 0 0 319.405 1.927 10 70 DDIERN C[C@@H]1CCCCN1S(=O)(=O)N1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000160577016 296317717 /nfs/dbraw/zinc/31/77/17/296317717.db2.gz HVZZUYVAYJTDLD-RBSFLKMASA-N 0 0 316.467 1.733 10 70 DDIERN CCc1nc(-c2ccccc2NC(=O)[C@H]2C[C@@H]2C(=O)OC)n[nH]1 ZINC000161352741 408592063 /nfs/dbraw/zinc/59/20/63/408592063.db2.gz LVBHTHVQCZTBSC-QWRGUYRKSA-N 0 0 314.345 1.782 10 70 DDIERN CC(C)c1nc2n(n1)C[C@@H](NC(=O)N1CCS[C@H](C)C1)CC2 ZINC000161508933 408610139 /nfs/dbraw/zinc/61/01/39/408610139.db2.gz ZQIQKAUXVMMUKQ-NEPJUHHUSA-N 0 0 323.466 1.863 10 70 DDIERN CN(C(=O)CN1CC[C@]2(O)CCCC[C@@H]2C1)c1nccs1 ZINC000160508304 408488823 /nfs/dbraw/zinc/48/88/23/408488823.db2.gz BCYHNPSLCWSRPR-IUODEOHRSA-N 0 0 309.435 1.733 10 70 DDIERN CC(C)[C@@H](O)CC(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1 ZINC000160653628 408508272 /nfs/dbraw/zinc/50/82/72/408508272.db2.gz FXUWBCNRTIQMLY-JSGCOSHPSA-N 0 0 318.373 1.237 10 70 DDIERN COc1ccc(CN(C)C(=O)N[C@@H]2CCc3ncnn3C2)cc1 ZINC000161286860 408582590 /nfs/dbraw/zinc/58/25/90/408582590.db2.gz ZHTKJUDIVCBGGL-CYBMUJFWSA-N 0 0 315.377 1.443 10 70 DDIERN CCCNC(=O)CCCC(=O)N1CC[C@@H](Oc2cccnc2)C1 ZINC000161379283 408596350 /nfs/dbraw/zinc/59/63/50/408596350.db2.gz MRSOGLBLVUTMLG-OAHLLOKOSA-N 0 0 319.405 1.758 10 70 DDIERN CC(C)[C@@H](C)NC(=O)c1cc(S(N)(=O)=O)cc(Cl)c1F ZINC000161261873 197478714 /nfs/dbraw/zinc/47/87/14/197478714.db2.gz QJKQLFDRWMMJSV-SSDOTTSWSA-N 0 0 322.789 1.901 10 70 DDIERN COCc1nc2n(n1)CCC[C@@H]2NC(=O)NCC1(C2CC2)CC1 ZINC000160448305 162149805 /nfs/dbraw/zinc/14/98/05/162149805.db2.gz OZSMBDZJHLEHBG-LBPRGKRZSA-N 0 0 319.409 1.749 10 70 DDIERN Cc1cnn(CCNC(=O)Nc2ccn(CC(F)(F)F)n2)c1 ZINC000160350014 408474087 /nfs/dbraw/zinc/47/40/87/408474087.db2.gz FEVQNECHAYJYDL-UHFFFAOYSA-N 0 0 316.287 1.772 10 70 DDIERN CC[C@@H](C(=O)N1CC[C@@H](Oc2cccnc2)C1)N1CCCC1=O ZINC000161359548 408594277 /nfs/dbraw/zinc/59/42/77/408594277.db2.gz ZNKLEFDANHECCB-CABCVRRESA-N 0 0 317.389 1.462 10 70 DDIERN Cn1cnnc1CN1CCCC[C@H]1c1nnc2n1CCCC2 ZINC000160902192 408538315 /nfs/dbraw/zinc/53/83/15/408538315.db2.gz ZQXQLVCKKBPPRX-LBPRGKRZSA-N 0 0 301.398 1.470 10 70 DDIERN CCC(CC)(CNC(=O)N[C@H]1CCCn2ncnc21)C(=O)OC ZINC000159542361 282108446 /nfs/dbraw/zinc/10/84/46/282108446.db2.gz RRWNNWVFAMFZGK-NSHDSACASA-N 0 0 323.397 1.392 10 70 DDIERN CCOC(=O)c1[nH]c(C)c(S(=O)(=O)N[C@@H]2C[C@@H]2C)c1C ZINC000159648211 354235504 /nfs/dbraw/zinc/23/55/04/354235504.db2.gz MPLZRNGOVMUOCS-OIBJUYFYSA-N 0 0 300.380 1.495 10 70 DDIERN CC[C@@H](c1ccncc1)N(C)C(=O)N[C@@H]1CCc2ncnn2C1 ZINC000161345369 197487840 /nfs/dbraw/zinc/48/78/40/197487840.db2.gz HHVKVUFDAABUNK-KGLIPLIRSA-N 0 0 314.393 1.781 10 70 DDIERN CC(C)OC(=O)CCCNC(=O)N[C@@H]1CCCC[C@H]1CO ZINC000160042358 408452104 /nfs/dbraw/zinc/45/21/04/408452104.db2.gz OZCGCQNCPBKLEX-QWHCGFSZSA-N 0 0 300.399 1.569 10 70 DDIERN CC(C)CCS(=O)(=O)N[C@@H]1CCc2nc(C(C)C)nn2C1 ZINC000159380844 408405650 /nfs/dbraw/zinc/40/56/50/408405650.db2.gz BAHMJMMOOJYJAF-GFCCVEGCSA-N 0 0 314.455 1.682 10 70 DDIERN CC(C)[C@@H](O)CC(=O)N[C@H]1CCCN(c2ccccc2)C1=O ZINC000160142085 408461018 /nfs/dbraw/zinc/46/10/18/408461018.db2.gz SBBCRXHRQQFKRU-GJZGRUSLSA-N 0 0 304.390 1.705 10 70 DDIERN O=C(Nc1ccccc1)C(=O)N1CC[C@@H](Oc2cccnc2)C1 ZINC000161015583 408549494 /nfs/dbraw/zinc/54/94/94/408549494.db2.gz FEGCTJKQYGYGAK-OAHLLOKOSA-N 0 0 311.341 1.700 10 70 DDIERN Cc1noc([C@H]2COCCN2C[C@H](O)CCc2ccccc2)n1 ZINC000161024066 408552442 /nfs/dbraw/zinc/55/24/42/408552442.db2.gz NRILDTRNPGQQJW-HZPDHXFCSA-N 0 0 317.389 1.745 10 70 DDIERN CCOc1cc(F)ccc1NC(=O)N[C@H]1CCc2ncnn2C1 ZINC000161334103 408589862 /nfs/dbraw/zinc/58/98/62/408589862.db2.gz JDUDLQVIWPMECG-NSHDSACASA-N 0 0 319.340 1.952 10 70 DDIERN CN(Cc1ccc(F)c(F)c1)C(=O)N[C@@H]1CCc2ncnn2C1 ZINC000161273871 197479699 /nfs/dbraw/zinc/47/96/99/197479699.db2.gz DWQBWGJSXLQXCE-LLVKDONJSA-N 0 0 321.331 1.713 10 70 DDIERN CN(Cc1ccc(Cl)nc1)C(=O)N[C@@H]1CCc2ncnn2C1 ZINC000161174540 197471673 /nfs/dbraw/zinc/47/16/73/197471673.db2.gz YYVAISCXWHEZAX-LLVKDONJSA-N 0 0 320.784 1.483 10 70 DDIERN CCc1nn(C)c(Cl)c1C(=O)NC[C@H](C)N1CCOCC1 ZINC000159975688 197377857 /nfs/dbraw/zinc/37/78/57/197377857.db2.gz SPBCIWKMBDIPCW-JTQLQIEISA-N 0 0 314.817 1.086 10 70 DDIERN COCCCN(C)C(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(F)cc1 ZINC000160766489 292332127 /nfs/dbraw/zinc/33/21/27/292332127.db2.gz WICVLBUTLCFCBH-GDBMZVCRSA-N 0 0 322.380 1.840 10 70 DDIERN CN(CC(F)(F)F)C(=O)CN1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000160812149 408525907 /nfs/dbraw/zinc/52/59/07/408525907.db2.gz BHRXIELBWJIRHE-DGCLKSJQSA-N 0 0 308.344 1.634 10 70 DDIERN CCn1cnnc1[C@@H]1CCCN(Cc2nc(C3CC3)no2)C1 ZINC000161276096 408581263 /nfs/dbraw/zinc/58/12/63/408581263.db2.gz ZGYPOKDNUSORHQ-GFCCVEGCSA-N 0 0 302.382 1.938 10 70 DDIERN C[C@@H](NC(=O)N1CCN2C(=O)NC[C@@H]2C1)c1ccc(F)c(F)c1 ZINC000161385911 408598395 /nfs/dbraw/zinc/59/83/95/408598395.db2.gz MCPZZXJIQRDZPD-MWLCHTKSSA-N 0 0 324.331 1.445 10 70 DDIERN COCc1nc2n(n1)CCC[C@H]2NC(=O)NCCCSC ZINC000161041954 523222171 /nfs/dbraw/zinc/22/21/71/523222171.db2.gz BVLUMGHTEQBBMZ-SNVBAGLBSA-N 0 0 313.427 1.312 10 70 DDIERN Cc1noc([C@@H]2COCCN2CCCCCn2cccn2)n1 ZINC000161041347 526658292 /nfs/dbraw/zinc/65/82/92/526658292.db2.gz FFTGAGMDDMGVQI-AWEZNQCLSA-N 0 0 305.382 1.818 10 70 DDIERN Cc1nc(C)n(C[C@H]2CCCN(C(=O)C[C@@H](O)C(C)C)C2)n1 ZINC000160311541 526761054 /nfs/dbraw/zinc/76/10/54/526761054.db2.gz BKAODYAQPAOANC-LSDHHAIUSA-N 0 0 308.426 1.541 10 70 DDIERN CC(C)[C@H](C)NC(=O)N(C)CCN1C(=O)c2ccccc2C1=O ZINC000161361539 197488271 /nfs/dbraw/zinc/48/82/71/197488271.db2.gz GRFYFAYOOKELKC-LBPRGKRZSA-N 0 0 317.389 1.969 10 70 DDIERN COc1ccc2c(c1)CCN2C(=O)N[C@@H]1CCc2ncnn2C1 ZINC000160961631 197453075 /nfs/dbraw/zinc/45/30/75/197453075.db2.gz DWQIPNJVXZGBII-GFCCVEGCSA-N 0 0 313.361 1.374 10 70 DDIERN CCS(=O)(=O)CCN(C)C(=O)N[C@@H](C)c1ccc(C)o1 ZINC000160082417 197384265 /nfs/dbraw/zinc/38/42/65/197384265.db2.gz GANJBRCPKPZOMN-NSHDSACASA-N 0 0 302.396 1.725 10 70 DDIERN O=C(CCNC(=O)[C@H]1C[C@H]1C1CCCCC1)N1CCOCC1 ZINC000159979455 408449446 /nfs/dbraw/zinc/44/94/46/408449446.db2.gz XNZKTEBCJOGRGW-GJZGRUSLSA-N 0 0 308.422 1.568 10 70 DDIERN CCc1cc(=O)n2nc(N[C@H]3CCCC[C@H]3C(N)=O)sc2n1 ZINC000159607311 408418451 /nfs/dbraw/zinc/41/84/51/408418451.db2.gz SCFKWZYIBFTRFI-ZJUUUORDSA-N 0 0 321.406 1.169 10 70 DDIERN NS(=O)(=O)c1ccccc1N1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000160688577 408513302 /nfs/dbraw/zinc/51/33/02/408513302.db2.gz NGQMYWZQSGINOG-DOMZBBRYSA-N 0 0 310.419 1.465 10 70 DDIERN O=C(Nc1cccc2c1OCCO2)N[C@@H]1CCc2ncnn2C1 ZINC000161212992 408574810 /nfs/dbraw/zinc/57/48/10/408574810.db2.gz RLINTLLPLPYSFU-SNVBAGLBSA-N 0 0 315.333 1.186 10 70 DDIERN CC(=O)Oc1ccc(CN2CCOC[C@H]2c2nc(C)no2)cc1 ZINC000161227760 408576530 /nfs/dbraw/zinc/57/65/30/408576530.db2.gz CHYZQESCJVIFOC-HNNXBMFYSA-N 0 0 317.345 1.877 10 70 DDIERN C[C@@H](NC(=O)N1CCCN(CC(F)F)CC1)[C@H]1CCCO1 ZINC000160456591 525165097 /nfs/dbraw/zinc/16/50/97/525165097.db2.gz RLJDOZJSLVBHBK-VXGBXAGGSA-N 0 0 305.369 1.536 10 70 DDIERN CC(C)COc1ccc([C@@H](C)NC(=O)[C@@H](C)NC(N)=O)cc1 ZINC000159841332 197368193 /nfs/dbraw/zinc/36/81/93/197368193.db2.gz CTIRMJTYLUFWFQ-VXGBXAGGSA-N 0 0 307.394 1.955 10 70 DDIERN CC(C)[C@@H](O)CC(=O)N(C)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000159839931 408437804 /nfs/dbraw/zinc/43/78/04/408437804.db2.gz MLUBIMJRPXZMSZ-CABCVRRESA-N 0 0 322.380 1.796 10 70 DDIERN CCOCCCCNC(=O)N[C@H](C)c1nnc2n1CCCC2 ZINC000161274231 408581355 /nfs/dbraw/zinc/58/13/55/408581355.db2.gz LPNPPZNMKMYVOQ-GFCCVEGCSA-N 0 0 309.414 1.791 10 70 DDIERN CNC(=O)COc1cccc(CC(=O)N[C@H](C)[C@@H]2CCCO2)c1 ZINC000161446361 197495303 /nfs/dbraw/zinc/49/53/03/197495303.db2.gz OXTGVIJCGCNZPG-DOMZBBRYSA-N 0 0 320.389 1.038 10 70 DDIERN O=C(Nc1ccc(F)c(F)c1F)N[C@@H]1CCc2ncnn2C1 ZINC000161292506 197481832 /nfs/dbraw/zinc/48/18/32/197481832.db2.gz WLUMUYMKGMIYLP-SSDOTTSWSA-N 0 0 311.267 1.832 10 70 DDIERN Cc1cnn(CCNC(=O)N2CCC(c3ccnn3C)CC2)c1 ZINC000160290826 197398546 /nfs/dbraw/zinc/39/85/46/197398546.db2.gz HVEZNMOFLVUTSQ-UHFFFAOYSA-N 0 0 316.409 1.514 10 70 DDIERN NC(=O)C1(CNC(=O)[C@H]2C[C@@H]2C2CCCCC2)CCOCC1 ZINC000160302043 162148380 /nfs/dbraw/zinc/14/83/80/162148380.db2.gz JCXVSHNXOUPROQ-KGLIPLIRSA-N 0 0 308.422 1.601 10 70 DDIERN CC(C)[C@@H](O)CC(=O)NCCCN1C(=O)COc2ccccc21 ZINC000160888798 408534491 /nfs/dbraw/zinc/53/44/91/408534491.db2.gz XVXRAGLHTWQWOF-AWEZNQCLSA-N 0 0 320.389 1.325 10 70 DDIERN CC(=O)N1CCOC[C@@H]1C(=O)NCCc1cc2ccccc2[nH]1 ZINC000161447224 408603160 /nfs/dbraw/zinc/60/31/60/408603160.db2.gz QWDBRKQMMRSRNJ-MRXNPFEDSA-N 0 0 315.373 1.074 10 70 DDIERN Cn1c2cccc(C(=O)N3CCO[C@@H]4CCCC[C@@H]43)c2oc1=O ZINC000160122674 302901266 /nfs/dbraw/zinc/90/12/66/302901266.db2.gz OCENTIWGVORJSO-GXTWGEPZSA-N 0 0 316.357 1.915 10 70 DDIERN COc1ncccc1CNC(=O)N1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000159558839 186126987 /nfs/dbraw/zinc/12/69/87/186126987.db2.gz DJJGORYUFJDKCV-YOEHRIQHSA-N 0 0 319.405 1.927 10 70 DDIERN Cc1cnc(CCN(C)C(=O)N[C@@H]2CCc3ncnn3C2)s1 ZINC000161401896 197492307 /nfs/dbraw/zinc/49/23/07/197492307.db2.gz OEIQDHJJUBUISR-LLVKDONJSA-N 0 0 320.422 1.242 10 70 DDIERN C[C@H]1CC[C@@H](C(=O)NCCCNC(=O)c2cccc(O)c2)O1 ZINC000159694191 408428006 /nfs/dbraw/zinc/42/80/06/408428006.db2.gz DWJXWWHZFDBCNR-FZMZJTMJSA-N 0 0 306.362 1.196 10 70 DDIERN CC(C)[C@H](O)CC(=O)N(C)[C@@H]1CCCN(c2cccnn2)C1 ZINC000160440493 408483106 /nfs/dbraw/zinc/48/31/06/408483106.db2.gz YUFPIDUNSRZUAH-ZIAGYGMSSA-N 0 0 306.410 1.311 10 70 DDIERN CCCOc1cccc(CC(=O)NC[C@H](C)N2CCOCC2)c1 ZINC000160831032 408529907 /nfs/dbraw/zinc/52/99/07/408529907.db2.gz DARUEJDCOZWGAI-HNNXBMFYSA-N 0 0 320.433 1.855 10 70 DDIERN CCc1ncc(NC(=O)N2CC[C@H](c3cnn(C)c3)C2)cn1 ZINC000161214451 408572892 /nfs/dbraw/zinc/57/28/92/408572892.db2.gz UVMLKPYFSODORH-NSHDSACASA-N 0 0 300.366 1.794 10 70 DDIERN CCCn1c(C)nnc1CN1C(=O)CN(C2CCCC2)C1=O ZINC000161362960 408594135 /nfs/dbraw/zinc/59/41/35/408594135.db2.gz MKWVRIGQWGAQOQ-UHFFFAOYSA-N 0 0 305.382 1.703 10 70 DDIERN CCc1noc(C)c1NC(=O)C(=O)N[C@H]1COc2ccccc21 ZINC000160402972 522858138 /nfs/dbraw/zinc/85/81/38/522858138.db2.gz WUVPJWDJDBHJJD-LBPRGKRZSA-N 0 0 315.329 1.734 10 70 DDIERN Cc1noc([C@H]2COCCN2C[C@H](O)Cc2ccccc2)n1 ZINC000161126431 526673100 /nfs/dbraw/zinc/67/31/00/526673100.db2.gz XTJCRFHXKUVWMG-HUUCEWRRSA-N 0 0 303.362 1.355 10 70 DDIERN O=CNc1ccc(C(=O)N2CC[C@@H](Oc3cccnc3)C2)cc1 ZINC000161499733 527143057 /nfs/dbraw/zinc/14/30/57/527143057.db2.gz SYSKUWYKFFKNRM-MRXNPFEDSA-N 0 0 311.341 1.943 10 70 DDIERN C[C@H](CNC(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F)N1CCOCC1 ZINC000160207303 197392696 /nfs/dbraw/zinc/39/26/96/197392696.db2.gz IDXUJJLSLUJGOQ-MRVWCRGKSA-N 0 0 324.371 1.905 10 70 DDIERN CN(C)c1ccccc1NC(=O)N[C@H]1CCc2ncnn2C1 ZINC000161042942 408553537 /nfs/dbraw/zinc/55/35/37/408553537.db2.gz FQXSVGLGGHTNBW-NSHDSACASA-N 0 0 300.366 1.481 10 70 DDIERN Cc1ccc(NS(C)(=O)=O)c(NC(=O)C[C@@H](O)C(C)C)c1 ZINC000160925130 408539445 /nfs/dbraw/zinc/53/94/45/408539445.db2.gz NAIZQHWLGARGCV-CYBMUJFWSA-N 0 0 314.407 1.712 10 70 DDIERN COCCCN(C)C(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccc(F)cc1 ZINC000160766759 284881415 /nfs/dbraw/zinc/88/14/15/284881415.db2.gz WICVLBUTLCFCBH-GOEBONIOSA-N 0 0 322.380 1.840 10 70 DDIERN CC(C)[C@@H](C)NC(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1 ZINC000160831157 408529937 /nfs/dbraw/zinc/52/99/37/408529937.db2.gz HRVJKZYXOUFJQK-GHMZBOCLSA-N 0 0 314.411 1.409 10 70 DDIERN Cc1ccc(C[C@H](C)NC(=O)N[C@@H]2CCc3ncnn3C2)s1 ZINC000161139478 408564022 /nfs/dbraw/zinc/56/40/22/408564022.db2.gz QUOXMUUYOPVJFI-CMPLNLGQSA-N 0 0 319.434 1.893 10 70 DDIERN C[C@@H]1CN(C(=O)CCCNC(=O)c2cccnc2)C[C@@H](C)O1 ZINC000160970730 408544424 /nfs/dbraw/zinc/54/44/24/408544424.db2.gz OOTXFUMJNRLEEV-CHWSQXEVSA-N 0 0 305.378 1.227 10 70 DDIERN CNc1cc(N2CCC[C@@H]2CNC(=O)[C@@H]2CCCCO2)ncn1 ZINC000159792612 197364793 /nfs/dbraw/zinc/36/47/93/197364793.db2.gz DYHPQZKPRKHQSE-OLZOCXBDSA-N 0 0 319.409 1.172 10 70 DDIERN CN1CC[C@@H](Nc2nnc(Cc3ccc(F)cc3)s2)C1=O ZINC000159524770 408413562 /nfs/dbraw/zinc/41/35/62/408413562.db2.gz GSZBNQITZRCZQP-LLVKDONJSA-N 0 0 306.366 1.911 10 70 DDIERN CCn1cnnc1[C@H]1CCCN([C@@H](C)C(=O)NCCCOC)C1 ZINC000161278970 408581790 /nfs/dbraw/zinc/58/17/90/408581790.db2.gz BFHAZFBIHGZWSR-KBPBESRZSA-N 0 0 323.441 1.019 10 70 DDIERN CCn1cnnc1[C@@H]1CCCN(Cc2noc(C3CC3)n2)C1 ZINC000161356081 408591987 /nfs/dbraw/zinc/59/19/87/408591987.db2.gz MJCRPLHSZWQJDD-GFCCVEGCSA-N 0 0 302.382 1.938 10 70 DDIERN COc1ccc(C)cc1NC(=O)N[C@@H]1CCc2ncnn2C1 ZINC000161350379 408592912 /nfs/dbraw/zinc/59/29/12/408592912.db2.gz UPYSRNHSRCNIOA-LLVKDONJSA-N 0 0 301.350 1.732 10 70 DDIERN Cc1noc([C@@H]2COCCN2CCN(C)c2ccccc2)n1 ZINC000161153128 408567253 /nfs/dbraw/zinc/56/72/53/408567253.db2.gz DHLDOBXKTGPUML-HNNXBMFYSA-N 0 0 302.378 1.888 10 70 DDIERN Cc1conc1NC(=O)C(=O)N1CCC(Cn2cccn2)CC1 ZINC000161317197 408587106 /nfs/dbraw/zinc/58/71/06/408587106.db2.gz AWUCLWWGYRLIHG-UHFFFAOYSA-N 0 0 317.349 1.057 10 70 DDIERN CCC[C@@H](NC(=O)[C@@H]1CC(=O)N(CC)C1)C(=O)OC(C)(C)C ZINC000161393057 408597096 /nfs/dbraw/zinc/59/70/96/408597096.db2.gz DYGTVBXVTDAHCX-VXGBXAGGSA-N 0 0 312.410 1.481 10 70 DDIERN CC(C)[C@@H](O)CC(=O)NCCCC(=O)N1CCc2ccccc21 ZINC000159753573 186139690 /nfs/dbraw/zinc/13/96/90/186139690.db2.gz SFMQMCDILQNOKM-INIZCTEOSA-N 0 0 318.417 1.879 10 70 DDIERN O=C(NCCc1cccnc1)N1CC[C@]2(O)CCCC[C@H]2C1 ZINC000159472469 197356090 /nfs/dbraw/zinc/35/60/90/197356090.db2.gz VILKDBNFFLVOBX-DOTOQJQBSA-N 0 0 303.406 1.961 10 70 DDIERN CCn1cnnc1[C@@H]1CCCN(CC(=O)Nc2nccs2)C1 ZINC000161285170 408582596 /nfs/dbraw/zinc/58/25/96/408582596.db2.gz UKQSRISWHMSOAW-LLVKDONJSA-N 0 0 320.422 1.573 10 70 DDIERN Cc1nc(SCC(=O)N2CC[C@@H](Oc3cccnc3)C2)n[nH]1 ZINC000161360202 408594017 /nfs/dbraw/zinc/59/40/17/408594017.db2.gz YAKAOBFWAKCQJN-GFCCVEGCSA-N 0 0 319.390 1.280 10 70 DDIERN CC(C)OC(=O)CCCNC(=O)N1CCC[C@@H](n2cncn2)C1 ZINC000160132704 197388149 /nfs/dbraw/zinc/38/81/49/197388149.db2.gz INVBCRWWNMLRQE-CYBMUJFWSA-N 0 0 323.397 1.356 10 70 DDIERN NC(=O)[C@@H]1CN(C[C@@H]2CC(c3ccc(Cl)cc3)=NO2)CCO1 ZINC000159786562 197364173 /nfs/dbraw/zinc/36/41/73/197364173.db2.gz KGFDHNGJORKVDN-JSGCOSHPSA-N 0 0 323.780 1.019 10 70 DDIERN C[C@H](NC(=O)NC1C[C@@H](C)O[C@H](C)C1)c1nnc2n1CCCC2 ZINC000160076803 408454597 /nfs/dbraw/zinc/45/45/97/408454597.db2.gz ACAPZNSYJHCHFS-UTUOFQBUSA-N 0 0 321.425 1.931 10 70 DDIERN CC(C)OC(=O)CCCNC(=O)NC[C@H]1CCCC[C@H]1O ZINC000160222795 408465319 /nfs/dbraw/zinc/46/53/19/408465319.db2.gz XNYHSJJNXGZAET-CHWSQXEVSA-N 0 0 300.399 1.569 10 70 DDIERN CN(Cc1ccc(F)cc1)C(=O)N[C@H]1CCc2ncnn2C1 ZINC000161051236 408554865 /nfs/dbraw/zinc/55/48/65/408554865.db2.gz QYOTYUIRULPVFF-ZDUSSCGKSA-N 0 0 303.341 1.574 10 70 DDIERN COCCN(Cc1ccco1)C(=O)N[C@@H]1CCc2ncnn2C1 ZINC000161328526 408590418 /nfs/dbraw/zinc/59/04/18/408590418.db2.gz NFKRHOMBNXLLFF-GFCCVEGCSA-N 0 0 319.365 1.044 10 70 DDIERN CCOC(=O)CCCCCN1CCOC[C@H]1c1nc(C)no1 ZINC000160928198 408539640 /nfs/dbraw/zinc/53/96/40/408539640.db2.gz KELAVDQXLQUJNW-ZDUSSCGKSA-N 0 0 311.382 1.875 10 70 DDIERN O=C(Nc1cccc2c1OCCO2)N[C@H]1CCc2ncnn2C1 ZINC000161213078 197474847 /nfs/dbraw/zinc/47/48/47/197474847.db2.gz RLINTLLPLPYSFU-JTQLQIEISA-N 0 0 315.333 1.186 10 70 DDIERN CCN(CC)C(=O)C(=O)Nc1cnn(-c2ccccc2)c1C ZINC000160302286 197399395 /nfs/dbraw/zinc/39/93/95/197399395.db2.gz DYVSTGGWRKQXKL-UHFFFAOYSA-N 0 0 300.362 1.988 10 70 DDIERN Cc1noc([C@H]2COCCN2Cc2ccc3c(c2)OCCO3)n1 ZINC000161069014 408556549 /nfs/dbraw/zinc/55/65/49/408556549.db2.gz PAUGBQPJSQBBCJ-CYBMUJFWSA-N 0 0 317.345 1.723 10 70 DDIERN CC(C)CC(=O)N[C@@H](C(=O)N[C@H](CO)CC(C)C)C(C)C ZINC000160870680 290777560 /nfs/dbraw/zinc/77/75/60/290777560.db2.gz XMNMLJOFUUTFCD-DZGCQCFKSA-N 0 0 300.443 1.697 10 70 DDIERN COc1ccc(C(=O)N2CCO[C@H](c3nccs3)C2)nn1 ZINC000159698637 186136291 /nfs/dbraw/zinc/13/62/91/186136291.db2.gz FQFAYDBBWKJENS-JTQLQIEISA-N 0 0 306.347 1.155 10 70 DDIERN CSCCCNC(=O)N[C@@H]1CCc2nc(C(C)C)nn2C1 ZINC000160373225 162148822 /nfs/dbraw/zinc/14/88/22/162148822.db2.gz VVXLZJZTPMCCIO-LLVKDONJSA-N 0 0 311.455 1.769 10 70 DDIERN COCc1nc2n(n1)CCC[C@@H]2NC(=O)N[C@@H](C)CC(C)C ZINC000160442725 162150242 /nfs/dbraw/zinc/15/02/42/162150242.db2.gz IJQBDDYQCOLDJH-RYUDHWBXSA-N 0 0 309.414 1.993 10 70 DDIERN CC(C)[C@H](O)CC(=O)N[C@H]1CCCN(c2ccccc2)C1=O ZINC000160141962 408458095 /nfs/dbraw/zinc/45/80/95/408458095.db2.gz SBBCRXHRQQFKRU-LSDHHAIUSA-N 0 0 304.390 1.705 10 70 DDIERN COc1ccc(OC)c(CN2CCOC[C@H]2c2nc(C)no2)c1 ZINC000161057157 408554874 /nfs/dbraw/zinc/55/48/74/408554874.db2.gz WQJGVWZHURVQNB-AWEZNQCLSA-N 0 0 319.361 1.969 10 70 DDIERN Cc1noc([C@@H]2COCCN2Cc2cn3cc(C)ccc3n2)n1 ZINC000161093816 408559534 /nfs/dbraw/zinc/55/95/34/408559534.db2.gz OEEQTIGAUYYOOZ-AWEZNQCLSA-N 0 0 313.361 1.908 10 70 DDIERN COc1ccc(NC(=O)N[C@@H]2CCc3ncnn3C2)c(OC)c1 ZINC000161342830 408588758 /nfs/dbraw/zinc/58/87/58/408588758.db2.gz MORIEDQOKSISPB-SNVBAGLBSA-N 0 0 317.349 1.432 10 70 DDIERN CC(=O)Oc1ccc(CN2CCOC[C@@H]2c2nc(C)no2)cc1 ZINC000161227905 519759172 /nfs/dbraw/zinc/75/91/72/519759172.db2.gz CHYZQESCJVIFOC-OAHLLOKOSA-N 0 0 317.345 1.877 10 70 DDIERN CCOCCCCNC(=O)N[C@@H](C)c1nnc2n1CCCC2 ZINC000161274106 521701401 /nfs/dbraw/zinc/70/14/01/521701401.db2.gz LPNPPZNMKMYVOQ-LBPRGKRZSA-N 0 0 309.414 1.791 10 70 DDIERN CC(C)[C@@H](O)CC(=O)Nc1ccccc1-n1ccc(C(N)=O)n1 ZINC000160038867 197381200 /nfs/dbraw/zinc/38/12/00/197381200.db2.gz JVSDKVDBYULZGD-AWEZNQCLSA-N 0 0 316.361 1.317 10 70 DDIERN C[C@@H](C(=O)N1CCO[C@H](Cn2cccn2)C1)c1cccs1 ZINC000159830878 197367348 /nfs/dbraw/zinc/36/73/48/197367348.db2.gz VJXHLSUJXKNMDL-OLZOCXBDSA-N 0 0 305.403 1.976 10 70 DDIERN Cc1noc([C@@H]2COCCN2CCCCn2ccnc2C)n1 ZINC000160821079 408526744 /nfs/dbraw/zinc/52/67/44/408526744.db2.gz YNUQKUIAGMTMGI-AWEZNQCLSA-N 0 0 305.382 1.737 10 70 DDIERN COCc1cccc(NC(=O)N[C@H]2CCc3ncnn3C2)c1 ZINC000161219798 408573381 /nfs/dbraw/zinc/57/33/81/408573381.db2.gz YCZADPPOXHALQA-ZDUSSCGKSA-N 0 0 301.350 1.561 10 70 DDIERN Cc1ccc(N2CC[C@H](NC(=O)C[C@@H](O)C(C)C)C2=O)cc1 ZINC000160871093 408532947 /nfs/dbraw/zinc/53/29/47/408532947.db2.gz ZJMPSURNUGZBKW-LSDHHAIUSA-N 0 0 304.390 1.624 10 70 DDIERN O=CNc1ccc(C(=O)N2CC[C@H](Oc3cccnc3)C2)cc1 ZINC000161499853 408611072 /nfs/dbraw/zinc/61/10/72/408611072.db2.gz SYSKUWYKFFKNRM-INIZCTEOSA-N 0 0 311.341 1.943 10 70 DDIERN CC(C)OC(=O)CCCNC(=O)N1CCC[C@H]1c1cnn(C)c1 ZINC000160178852 197391462 /nfs/dbraw/zinc/39/14/62/197391462.db2.gz QNMLDHWQNPAABC-AWEZNQCLSA-N 0 0 322.409 1.998 10 70 DDIERN COCc1nc2n(n1)CCC[C@H]2NC(=O)c1cc(Cl)cn1C ZINC000159973499 197376975 /nfs/dbraw/zinc/37/69/75/197376975.db2.gz XDOSFCVLMHMIIC-SNVBAGLBSA-N 0 0 323.784 1.681 10 70 DDIERN Cc1cccc([C@H](NC(=O)[C@@H](C)NC(N)=O)c2ccccn2)c1 ZINC000160157060 408459810 /nfs/dbraw/zinc/45/98/10/408459810.db2.gz DDLVDXQDFWUZPK-DOMZBBRYSA-N 0 0 312.373 1.652 10 70 DDIERN CC(C)(C)OC(=O)N[C@H]1CCC[C@@H](C(=O)NC2(CO)CC2)C1 ZINC000160398866 408479247 /nfs/dbraw/zinc/47/92/47/408479247.db2.gz ZCVLDIWNOVMTJM-NEPJUHHUSA-N 0 0 312.410 1.711 10 70 DDIERN Cc1nc(C)n(C[C@@H]2CCCN(C(=O)C[C@@H](O)C(C)C)C2)n1 ZINC000160311414 408470173 /nfs/dbraw/zinc/47/01/73/408470173.db2.gz BKAODYAQPAOANC-HUUCEWRRSA-N 0 0 308.426 1.541 10 70 DDIERN Cc1c(NC(=O)C(=O)N[C@@H]2C[C@@H]2C)cnn1-c1ccccc1F ZINC000161000379 408550482 /nfs/dbraw/zinc/55/04/82/408550482.db2.gz PUMMEDTXSILBJK-JOYOIKCWSA-N 0 0 316.336 1.783 10 70 DDIERN COCc1cccc(NC(=O)N[C@@H]2CCc3ncnn3C2)c1 ZINC000161219676 408574509 /nfs/dbraw/zinc/57/45/09/408574509.db2.gz YCZADPPOXHALQA-CYBMUJFWSA-N 0 0 301.350 1.561 10 70 DDIERN COCc1nc2n(n1)CCC[C@H]2NC(=O)N[C@H](C)CC(C)C ZINC000160442343 162150223 /nfs/dbraw/zinc/15/02/23/162150223.db2.gz IJQBDDYQCOLDJH-VXGBXAGGSA-N 0 0 309.414 1.993 10 70 DDIERN COCCOc1cccc(CC(=O)NC[C@@H]2CCCC[C@@H]2O)c1 ZINC000159958376 408446996 /nfs/dbraw/zinc/44/69/96/408446996.db2.gz VWDNXUDTDMQCPH-RDJZCZTQSA-N 0 0 321.417 1.922 10 70 DDIERN Cn1cnc2cc(C(=O)NCC(=O)NC3CCCCC3)cnc21 ZINC000159656810 408423035 /nfs/dbraw/zinc/42/30/35/408423035.db2.gz QYCQKGYBRAJVPQ-UHFFFAOYSA-N 0 0 315.377 1.147 10 70 DDIERN C[C@@H]1CN(CCN(C)Cc2ccc(F)cc2)CCS1(=O)=O ZINC000159758153 408433216 /nfs/dbraw/zinc/43/32/16/408433216.db2.gz XSSLVGQBTXQMAO-CYBMUJFWSA-N 0 0 314.426 1.376 10 70 DDIERN CC(C)(C)OC(=O)N[C@H]1CCC[C@H](C(=O)NC2(CO)CC2)C1 ZINC000160398593 408478940 /nfs/dbraw/zinc/47/89/40/408478940.db2.gz ZCVLDIWNOVMTJM-RYUDHWBXSA-N 0 0 312.410 1.711 10 70 DDIERN NC(=O)NCC(=O)NC[C@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000160548745 408495585 /nfs/dbraw/zinc/49/55/85/408495585.db2.gz FJRCEUYGQRKTAS-GMSGAONNSA-N 0 0 316.188 1.881 10 70 DDIERN COCC(=O)N1CCN(C(=O)[C@@H]2C[C@H]2C2CCCCC2)CC1 ZINC000160826253 408527843 /nfs/dbraw/zinc/52/78/43/408527843.db2.gz MUFQGIAXDNLUHY-LSDHHAIUSA-N 0 0 308.422 1.520 10 70 DDIERN Cc1noc([C@@H]2COCCN2CCCC(=O)OC(C)(C)C)n1 ZINC000160893706 408536245 /nfs/dbraw/zinc/53/62/45/408536245.db2.gz LMTGAJNIJJDVQU-LBPRGKRZSA-N 0 0 311.382 1.873 10 70 DDIERN CCC(CC)N(CCOC)C(=O)N[C@H]1CCc2ncnn2C1 ZINC000161311278 521555982 /nfs/dbraw/zinc/55/59/82/521555982.db2.gz MPNOWJSBZFVUJH-LBPRGKRZSA-N 0 0 309.414 1.440 10 70 DDIERN Cc1noc([C@@H]2COCCN2C[C@H](O)Cc2ccccc2)n1 ZINC000161126328 526658115 /nfs/dbraw/zinc/65/81/15/526658115.db2.gz XTJCRFHXKUVWMG-CABCVRRESA-N 0 0 303.362 1.355 10 70 DDIERN NC(=O)N[C@H](Cc1ccccc1)C(=O)NCC1(C2CC2)CC1 ZINC000159702875 186136083 /nfs/dbraw/zinc/13/60/83/186136083.db2.gz SKFGXWFLQXJCFT-CQSZACIVSA-N 0 0 301.390 1.572 10 70 DDIERN CCOC(=O)c1[nH]c(C)c(S(=O)(=O)N[C@H]2C[C@H]2C)c1C ZINC000159648629 354235126 /nfs/dbraw/zinc/23/51/26/354235126.db2.gz MPLZRNGOVMUOCS-XCBNKYQSSA-N 0 0 300.380 1.495 10 70 DDIERN CCOc1ccccc1NC(=O)N[C@H]1CCc2ncnn2C1 ZINC000161107731 197466190 /nfs/dbraw/zinc/46/61/90/197466190.db2.gz JWHRIWPKERMJKZ-NSHDSACASA-N 0 0 301.350 1.813 10 70 DDIERN CC(C)CC(=O)N[C@H](C(=O)N[C@H](CO)CC(C)C)C(C)C ZINC000160870958 408531265 /nfs/dbraw/zinc/53/12/65/408531265.db2.gz XMNMLJOFUUTFCD-ZFWWWQNUSA-N 0 0 300.443 1.697 10 70 DDIERN COCCC1(CNC(=O)N2CCO[C@H](c3nnc(C)[nH]3)C2)CC1 ZINC000161165563 408566197 /nfs/dbraw/zinc/56/61/97/408566197.db2.gz BEMGYIBYNXDYBP-LBPRGKRZSA-N 0 0 323.397 1.013 10 70 DDIERN CC(C)[C@@H](O)CC(=O)NCCc1nc2ccc(F)cc2n1C ZINC000159571422 186127533 /nfs/dbraw/zinc/12/75/33/186127533.db2.gz OCPPGQCBVNUCQJ-AWEZNQCLSA-N 0 0 307.369 1.778 10 70 DDIERN O=C(Nc1ccc(-n2cccn2)cc1)N[C@H]1CCc2ncnn2C1 ZINC000160982275 408548406 /nfs/dbraw/zinc/54/84/06/408548406.db2.gz NDJCOKJMESIXLB-ZDUSSCGKSA-N 0 0 323.360 1.600 10 70 DDIERN CN(CCc1ccc(F)cc1)C(=O)N[C@@H]1CCc2ncnn2C1 ZINC000161266870 408578639 /nfs/dbraw/zinc/57/86/39/408578639.db2.gz YGKVEHMFRSSGJD-CQSZACIVSA-N 0 0 317.368 1.616 10 70 DDIERN CC[C@@H](COC)NC(=O)N[C@H]1CCc2nc(C(C)C)nn2C1 ZINC000161432591 408602784 /nfs/dbraw/zinc/60/27/84/408602784.db2.gz GAAOTHNNBJXWRH-RYUDHWBXSA-N 0 0 309.414 1.441 10 70 DDIERN Cn1cnnc1CN1CCCC[C@@H]1c1nnc2n1CCCC2 ZINC000160902061 408537214 /nfs/dbraw/zinc/53/72/14/408537214.db2.gz ZQXQLVCKKBPPRX-GFCCVEGCSA-N 0 0 301.398 1.470 10 70 DDIERN Cc1noc([C@@H]2COCCN2CC(=O)NC(C2CC2)C2CC2)n1 ZINC000160804707 484070075 /nfs/dbraw/zinc/07/00/75/484070075.db2.gz JBHKWQDHHNSVLO-ZDUSSCGKSA-N 0 0 320.393 1.056 10 70 DDIERN CC(C)[C@@H](O)CC(=O)N(C)[C@@H]1CCCN(c2cccnn2)C1 ZINC000160440636 408484739 /nfs/dbraw/zinc/48/47/39/408484739.db2.gz YUFPIDUNSRZUAH-KGLIPLIRSA-N 0 0 306.410 1.311 10 70 DDIERN Cc1noc([C@@H]2COCCN2Cc2c(C)nn(C)c2Cl)n1 ZINC000160787105 408524711 /nfs/dbraw/zinc/52/47/11/408524711.db2.gz HTHHNXDEJYHXTJ-NSHDSACASA-N 0 0 311.773 1.647 10 70 DDIERN Cc1noc([C@H]2COCCN2CCCCn2ccnc2C)n1 ZINC000160821210 408525940 /nfs/dbraw/zinc/52/59/40/408525940.db2.gz YNUQKUIAGMTMGI-CQSZACIVSA-N 0 0 305.382 1.737 10 70 DDIERN Cc1nn(C)c(C)c1CN1CCN(C(=O)C[C@@H](O)C(C)C)CC1 ZINC000160215571 408462888 /nfs/dbraw/zinc/46/28/88/408462888.db2.gz DPIXJULTCZCSMX-MRXNPFEDSA-N 0 0 322.453 1.088 10 70 DDIERN NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCC1=CCCC1 ZINC000161147740 408566491 /nfs/dbraw/zinc/56/64/91/408566491.db2.gz GMUNPUISLUFDLJ-HNNXBMFYSA-N 0 0 301.390 1.883 10 70 DDIERN CCCCNC(=O)[C@H](C)S(=O)(=O)Cc1nccn1C(C)C ZINC000161212480 408573521 /nfs/dbraw/zinc/57/35/21/408573521.db2.gz SFZJMIKNDBEYDG-LBPRGKRZSA-N 0 0 315.439 1.684 10 70 DDIERN CCn1cnnc1[C@@H]1CCCN([C@@H](C)C(=O)NCCCOC)C1 ZINC000161278828 408581953 /nfs/dbraw/zinc/58/19/53/408581953.db2.gz BFHAZFBIHGZWSR-UONOGXRCSA-N 0 0 323.441 1.019 10 70 DDIERN COc1ccc2c(c1)CCN2C(=O)N[C@H]1CCc2ncnn2C1 ZINC000160961751 197452809 /nfs/dbraw/zinc/45/28/09/197452809.db2.gz DWQIPNJVXZGBII-LBPRGKRZSA-N 0 0 313.361 1.374 10 70 DDIERN CCn1cc(C2CCN(C(=O)NCC3(C)COC3)CC2)cn1 ZINC000159851221 197369086 /nfs/dbraw/zinc/36/90/86/197369086.db2.gz OPZJZMBKJUDSEB-UHFFFAOYSA-N 0 0 306.410 1.829 10 70 DDIERN COC(=O)CN1C[C@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000160999073 408549859 /nfs/dbraw/zinc/54/98/59/408549859.db2.gz AREPGVSICPBRPB-VXGBXAGGSA-N 0 0 303.280 1.986 10 70 DDIERN COc1ccc(OC)c(NC(=O)N[C@H]2CCc3ncnn3C2)c1 ZINC000161035993 408551723 /nfs/dbraw/zinc/55/17/23/408551723.db2.gz HQEBOBKYQOEZKW-JTQLQIEISA-N 0 0 317.349 1.432 10 70 DDIERN CCC[C@H](C(=O)N1CCN(Cc2ccccn2)CC1)[NH+](C)C ZINC000161341029 408589651 /nfs/dbraw/zinc/58/96/51/408589651.db2.gz LZDQVSWYFNYSKO-MRXNPFEDSA-N 0 0 304.438 1.456 10 70 DDIERN CCOC(=O)NCCCC(=O)N1CCC[C@@H]1Cn1ccnc1C ZINC000161361067 408594266 /nfs/dbraw/zinc/59/42/66/408594266.db2.gz MDNPBKGNWONDLE-CQSZACIVSA-N 0 0 322.409 1.709 10 70 DDIERN COc1ccccc1CN(C)C(=O)N[C@@H]1CCc2ncnn2C1 ZINC000160933239 408542427 /nfs/dbraw/zinc/54/24/27/408542427.db2.gz PXRQJVCDSXPOSY-CYBMUJFWSA-N 0 0 315.377 1.443 10 70 DDIERN C[C@H]1CN(C(=O)CCCNC(=O)c2cccnc2)C[C@H](C)O1 ZINC000160970598 408544544 /nfs/dbraw/zinc/54/45/44/408544544.db2.gz OOTXFUMJNRLEEV-STQMWFEESA-N 0 0 305.378 1.227 10 70 DDIERN CCC[C@@H](NC(=O)c1cc(C(N)=O)cn1C)C(=O)OC(C)(C)C ZINC000161449695 520751053 /nfs/dbraw/zinc/75/10/53/520751053.db2.gz XGOUKQWATYUKNB-LLVKDONJSA-N 0 0 323.393 1.364 10 70 DDIERN CC(C)C[C@H](CO)NC(=O)[C@@H](C)NC(=O)Nc1ccccc1 ZINC000160834416 408528673 /nfs/dbraw/zinc/52/86/73/408528673.db2.gz KRCKSUCQUZLHQE-TZMCWYRMSA-N 0 0 307.394 1.720 10 70 DDIERN CC(C)OC(=O)CCCNC(=O)N1CC[C@@H](c2cnn(C)c2)C1 ZINC000160224846 408464600 /nfs/dbraw/zinc/46/46/00/408464600.db2.gz BEUPROVABOGQPN-CYBMUJFWSA-N 0 0 322.409 1.651 10 70 DDIERN COC[C@@H](C)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O ZINC000161222246 408572969 /nfs/dbraw/zinc/57/29/69/408572969.db2.gz DXAKOQXEEGMNGD-VXGBXAGGSA-N 0 0 306.362 1.199 10 70 DDIERN COc1cc(F)ccc1NC(=O)N[C@H]1CCc2ncnn2C1 ZINC000161222598 408577500 /nfs/dbraw/zinc/57/75/00/408577500.db2.gz ZBRIHWXPRLSRND-JTQLQIEISA-N 0 0 305.313 1.562 10 70 DDIERN COc1c(F)cc(NC(=O)N[C@@H]2CCc3ncnn3C2)cc1F ZINC000161265295 408579823 /nfs/dbraw/zinc/57/98/23/408579823.db2.gz NPUZFZXAEAVQSQ-MRVPVSSYSA-N 0 0 323.303 1.701 10 70 DDIERN CCOCCC1(CNC(=O)N[C@H]2CCCn3ncnc32)CC1 ZINC000159537174 521687635 /nfs/dbraw/zinc/68/76/35/521687635.db2.gz RSYHEUOCUAJXSH-LBPRGKRZSA-N 0 0 307.398 1.619 10 70 DDIERN Fc1cc(F)c2nccc(NC[C@@H]3CN4CCN3CC4)c2c1 ZINC000160048067 197381875 /nfs/dbraw/zinc/38/18/75/197381875.db2.gz GCNZEXRGPIRACW-GFCCVEGCSA-N 0 0 304.344 1.925 10 70 DDIERN CCc1cc(N2CCC[C@@H](NC(=O)C[C@H](O)C(C)C)C2)ncn1 ZINC000159857572 197369202 /nfs/dbraw/zinc/36/92/02/197369202.db2.gz IVJOBEBUBXFWGN-CABCVRRESA-N 0 0 320.437 1.531 10 70 DDIERN COc1cccc([C@H](O)C(=O)N2CCO[C@H]3CCCC[C@@H]32)c1 ZINC000159970439 408450500 /nfs/dbraw/zinc/45/05/00/408450500.db2.gz VFIXJCLEUTWZRR-JYJNAYRXSA-N 0 0 305.374 1.899 10 70 DDIERN CC(C)c1nc2n(n1)C[C@@H](NS(=O)(=O)c1cccnc1)CC2 ZINC000159394981 408404555 /nfs/dbraw/zinc/40/45/55/408404555.db2.gz KHWLRRBLWFSMTF-NSHDSACASA-N 0 0 321.406 1.090 10 70 DDIERN NS(=O)(=O)c1ccccc1N1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000160688454 408513309 /nfs/dbraw/zinc/51/33/09/408513309.db2.gz NGQMYWZQSGINOG-IUODEOHRSA-N 0 0 310.419 1.465 10 70 DDIERN CCn1cnnc1[C@H]1CCCN(CC(=O)Nc2cc(C)on2)C1 ZINC000161326867 408590566 /nfs/dbraw/zinc/59/05/66/408590566.db2.gz BIWOVKRLOJSAKA-LBPRGKRZSA-N 0 0 318.381 1.413 10 70 DDIERN Cc1ccc(NS(C)(=O)=O)c(NC(=O)C[C@H](O)C(C)C)c1 ZINC000160924979 408538999 /nfs/dbraw/zinc/53/89/99/408538999.db2.gz NAIZQHWLGARGCV-ZDUSSCGKSA-N 0 0 314.407 1.712 10 70 DDIERN CC(C)[C@@H](O)CC(=O)NCCCC(=O)N1Cc2ccccc2C1 ZINC000159727624 186137779 /nfs/dbraw/zinc/13/77/79/186137779.db2.gz GIRBMMFPHTYVQC-INIZCTEOSA-N 0 0 318.417 1.832 10 70 DDIERN COC(=O)[C@@H](c1cccnc1)N1CCC(Cn2cccn2)CC1 ZINC000159978435 197378045 /nfs/dbraw/zinc/37/80/45/197378045.db2.gz UZNPKAHUVZHMRF-MRXNPFEDSA-N 0 0 314.389 1.904 10 70 DDIERN COC(=O)[C@H](c1cccnc1)N1CCC(Cn2cccn2)CC1 ZINC000159978543 197377581 /nfs/dbraw/zinc/37/75/81/197377581.db2.gz UZNPKAHUVZHMRF-INIZCTEOSA-N 0 0 314.389 1.904 10 70 DDIERN COC[C@@H](NC(=O)N[C@H]1CCc2nc(C(C)C)nn2C1)C1CC1 ZINC000160183153 408462553 /nfs/dbraw/zinc/46/25/53/408462553.db2.gz SOIYDHGEIUHOIN-QWHCGFSZSA-N 0 0 321.425 1.441 10 70 DDIERN Cc1noc([C@H]2COCCN2C[C@H](O)c2ccccc2F)n1 ZINC000161144349 408563255 /nfs/dbraw/zinc/56/32/55/408563255.db2.gz UMIPCPLOZHWRSO-KGLIPLIRSA-N 0 0 307.325 1.624 10 70 DDIERN CC(C)Oc1ncccc1NC(=O)N[C@@H]1CCc2ncnn2C1 ZINC000161272266 408581539 /nfs/dbraw/zinc/58/15/39/408581539.db2.gz MWFVLGMJNNDTCQ-LLVKDONJSA-N 0 0 316.365 1.597 10 70 DDIERN COC(=O)c1csc(NC(=O)NCCn2cc(C)cn2)c1 ZINC000160806363 484069510 /nfs/dbraw/zinc/06/95/10/484069510.db2.gz WOWNFQRGLFLKTA-UHFFFAOYSA-N 0 0 308.363 1.861 10 70 DDIERN CCc1n[nH]c(=O)c(CNC(=O)N2CCS[C@@H](C)C2)c1CC ZINC000160455198 197412227 /nfs/dbraw/zinc/41/22/27/197412227.db2.gz BNKPRKUYDAGIQK-JTQLQIEISA-N 0 0 324.450 1.542 10 70 DDIERN Cc1noc([C@@H]2COCCN2CC(=O)N(CC(C)C)C2CC2)n1 ZINC000161006129 408549100 /nfs/dbraw/zinc/54/91/00/408549100.db2.gz XXOMXHLNMGYBSZ-AWEZNQCLSA-N 0 0 322.409 1.398 10 70 DDIERN COCc1nc2n(n1)CCC[C@@H]2NC(=O)NCCCSC ZINC000161041815 408554299 /nfs/dbraw/zinc/55/42/99/408554299.db2.gz BVLUMGHTEQBBMZ-JTQLQIEISA-N 0 0 313.427 1.312 10 70 DDIERN Cc1cnn(CCNC(=O)NCCc2ccc(Cl)nc2)c1 ZINC000161130114 408563635 /nfs/dbraw/zinc/56/36/35/408563635.db2.gz ZMJOEWIQSWXDKD-UHFFFAOYSA-N 0 0 307.785 1.782 10 70 DDIERN Cc1cc(NC(=O)N[C@@H]2CCc3ncnn3C2)ccc1N(C)C ZINC000160930610 408540483 /nfs/dbraw/zinc/54/04/83/408540483.db2.gz IKEVHTYUUJCVDY-CYBMUJFWSA-N 0 0 314.393 1.789 10 70 DDIERN COc1ccccc1CN(C)C(=O)N[C@H]1CCc2ncnn2C1 ZINC000160933360 408541667 /nfs/dbraw/zinc/54/16/67/408541667.db2.gz PXRQJVCDSXPOSY-ZDUSSCGKSA-N 0 0 315.377 1.443 10 70 DDIERN CC(C)C[C@H](CO)NC(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1cccnc1 ZINC000161032033 277487091 /nfs/dbraw/zinc/48/70/91/277487091.db2.gz MZVUFWKFQOKCAW-IIAWOOMASA-N 0 0 319.405 1.124 10 70 DDIERN CNC(=O)[C@@H]1CCCN1C(=O)NCC1(Cc2ccccc2)CC1 ZINC000160131645 197388024 /nfs/dbraw/zinc/38/80/24/197388024.db2.gz VWSZYVYOUMWCNV-HNNXBMFYSA-N 0 0 315.417 1.929 10 70 DDIERN C[C@H]1C(=O)NCCN1C[C@@H]1CC(c2ccc(Cl)cc2)=NO1 ZINC000159795784 197365852 /nfs/dbraw/zinc/36/58/52/197365852.db2.gz HZUXJIZOZPDXBS-GWCFXTLKSA-N 0 0 307.781 1.653 10 70 DDIERN COCCOc1cccc(CC(=O)NC[C@H]2CCCC[C@H]2O)c1 ZINC000159958765 408447590 /nfs/dbraw/zinc/44/75/90/408447590.db2.gz VWDNXUDTDMQCPH-NVXWUHKLSA-N 0 0 321.417 1.922 10 70 DDIERN CC(C)CCn1ccc(NC(=O)NC[C@H](C)N2CCOCC2)n1 ZINC000160719906 408516886 /nfs/dbraw/zinc/51/68/86/408516886.db2.gz BENNDOVZDCCUHH-AWEZNQCLSA-N 0 0 323.441 1.771 10 70 DDIERN COCCOc1cccc(CC(=O)N2C[C@@H](C)O[C@H](C)C2)c1 ZINC000160967602 408545808 /nfs/dbraw/zinc/54/58/08/408545808.db2.gz UNRRKJIZQUSWMB-ZIAGYGMSSA-N 0 0 307.390 1.890 10 70 DDIERN CCc1cc(=O)[nH]c(CN2CCOC[C@H]2c2nc(C)no2)n1 ZINC000161228217 408577361 /nfs/dbraw/zinc/57/73/61/408577361.db2.gz YWVKMKBHURSZLC-NSHDSACASA-N 0 0 305.338 1.010 10 70 DDIERN CC(C)Cc1nnc(NC(=O)N[C@H]2CCc3ncnn3C2)s1 ZINC000161266242 408578668 /nfs/dbraw/zinc/57/86/68/408578668.db2.gz WEYXAEOEMPTABR-VIFPVBQESA-N 0 0 321.410 1.465 10 70 DDIERN CCc1nc(-c2ccccc2NC(=O)[C@H]2C[C@H]2C(=O)OC)n[nH]1 ZINC000161352998 408592306 /nfs/dbraw/zinc/59/23/06/408592306.db2.gz LVBHTHVQCZTBSC-WDEREUQCSA-N 0 0 314.345 1.782 10 70 DDIERN CCCn1c(C)nnc1CN1C[C@@H](C)[C@H](N2CCOCC2)C1 ZINC000160893671 276297105 /nfs/dbraw/zinc/29/71/05/276297105.db2.gz JPQICPDHGPKVHD-UKRRQHHQSA-N 0 0 307.442 1.149 10 70 DDIERN CCOC(=O)c1[nH]c(C)c(S(=O)(=O)N[C@H]2C[C@@H]2C)c1C ZINC000159648338 354235062 /nfs/dbraw/zinc/23/50/62/354235062.db2.gz MPLZRNGOVMUOCS-XVKPBYJWSA-N 0 0 300.380 1.495 10 70 DDIERN CC(C)[C@H](O)CC(=O)N(C)[C@H]1CCCN(c2cccnn2)C1 ZINC000160440734 408485281 /nfs/dbraw/zinc/48/52/81/408485281.db2.gz YUFPIDUNSRZUAH-UONOGXRCSA-N 0 0 306.410 1.311 10 70 DDIERN Cc1noc([C@@H]2COCCN2Cc2ccc3c(c2)OCCO3)n1 ZINC000161068884 408556393 /nfs/dbraw/zinc/55/63/93/408556393.db2.gz PAUGBQPJSQBBCJ-ZDUSSCGKSA-N 0 0 317.345 1.723 10 70 DDIERN CC[N@@H+]1CCC[C@@H](NS(=O)(=O)Cc2c(F)cccc2F)C1 ZINC000161100924 408559225 /nfs/dbraw/zinc/55/92/25/408559225.db2.gz FLFXVHDWGKQREN-LLVKDONJSA-N 0 0 318.389 1.869 10 70 DDIERN O=C(c1ccc2n[nH]nc2c1)N1CC[C@@H](Oc2cccnc2)C1 ZINC000161390539 408596967 /nfs/dbraw/zinc/59/69/67/408596967.db2.gz YCIMMUVNPYEOCI-CYBMUJFWSA-N 0 0 309.329 1.646 10 70 DDIERN CCOC(=O)C[C@@H](C)NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C ZINC000160871507 408534815 /nfs/dbraw/zinc/53/48/15/408534815.db2.gz UROHFVNPDWDZHZ-DOMZBBRYSA-N 0 0 314.426 1.631 10 70 DDIERN CC(C)c1nc2n(n1)C[C@H](NC(=O)N1CCOC(C)(C)C1)CC2 ZINC000161496481 408607711 /nfs/dbraw/zinc/60/77/11/408607711.db2.gz CJLZLWRAKHRXNF-GFCCVEGCSA-N 0 0 321.425 1.537 10 70 DDIERN CC(C)c1nc2n(n1)C[C@H](NS(=O)(=O)c1ccccc1)CC2 ZINC000159384311 408404697 /nfs/dbraw/zinc/40/46/97/408404697.db2.gz HHINIXUPYDLEFV-GFCCVEGCSA-N 0 0 320.418 1.695 10 70 DDIERN Cc1noc([C@H]2COCCN2CC(=O)N(CC(C)C)C2CC2)n1 ZINC000161006268 408549585 /nfs/dbraw/zinc/54/95/85/408549585.db2.gz XXOMXHLNMGYBSZ-CQSZACIVSA-N 0 0 322.409 1.398 10 70 DDIERN CCCC(O)(CCC)CNC(=O)N[C@H]1CCc2ncnn2C1 ZINC000161192718 408571089 /nfs/dbraw/zinc/57/10/89/408571089.db2.gz KLGCANAHCHXVAO-LBPRGKRZSA-N 0 0 309.414 1.223 10 70 DDIERN CCC[C@H](NC(=O)c1ccn(C)c(=O)c1)C(=O)OC(C)(C)C ZINC000161313879 408586284 /nfs/dbraw/zinc/58/62/84/408586284.db2.gz CJYHOXPDSGCMAH-LBPRGKRZSA-N 0 0 308.378 1.626 10 70 DDIERN COCCOc1cccc(CC(=O)N2C[C@H](C)O[C@@H](C)C2)c1 ZINC000160967510 408544196 /nfs/dbraw/zinc/54/41/96/408544196.db2.gz UNRRKJIZQUSWMB-KBPBESRZSA-N 0 0 307.390 1.890 10 70 DDIERN CCC[C@H](NC(=O)c1ccc2nncn2c1)C(=O)OC(C)(C)C ZINC000161474184 197497183 /nfs/dbraw/zinc/49/71/83/197497183.db2.gz HQHQRDMGICFUCG-LBPRGKRZSA-N 0 0 318.377 1.970 10 70 DDIERN COc1nc(C)nc(NC[C@@H](CO)Cc2ccccn2)c1C ZINC000159419881 408408290 /nfs/dbraw/zinc/40/82/90/408408290.db2.gz AFZKXBJFPYMRAS-ZDUSSCGKSA-N 0 0 302.378 1.760 10 70 DDIERN Nc1cccc(S(=O)(=O)N2CC[C@]3(O)CCCC[C@@H]3C2)c1 ZINC000160345008 408472463 /nfs/dbraw/zinc/47/24/63/408472463.db2.gz OMNVIMWGTWBUKT-IUODEOHRSA-N 0 0 310.419 1.585 10 70 DDIERN NC(=O)c1cccc(C(=O)N2CC[C@@H](Oc3cccnc3)C2)c1 ZINC000161396940 408596283 /nfs/dbraw/zinc/59/62/83/408596283.db2.gz NPVPYCDTJDVJIK-OAHLLOKOSA-N 0 0 311.341 1.474 10 70 DDIERN COCCCN(C)C(=O)N[C@@H]1CCc2nc(C(C)C)nn2C1 ZINC000161448174 523206259 /nfs/dbraw/zinc/20/62/59/523206259.db2.gz JDDDDALLQVFQCL-GFCCVEGCSA-N 0 0 309.414 1.394 10 70 DDIERN CS(=O)(=O)CCN1CCCC[C@H]1c1nnc2n1CCCC2 ZINC000160625773 525122279 /nfs/dbraw/zinc/12/22/79/525122279.db2.gz GGKJBTSUDOBOKN-LBPRGKRZSA-N 0 0 312.439 1.186 10 70 DDIERN O=C(CCCNC(=O)c1cccnc1)NC[C@H]1CCCC[C@H]1O ZINC000159956165 197375720 /nfs/dbraw/zinc/37/57/20/197375720.db2.gz GQVQSIIGRXYIHO-UKRRQHHQSA-N 0 0 319.405 1.259 10 70 DDIERN C[C@H](NC(=O)c1ccco1)C(=O)Nc1cc(Cl)c(=O)n(C)c1 ZINC000160438492 162150144 /nfs/dbraw/zinc/15/01/44/162150144.db2.gz SLSPBXZEIPDFSA-QMMMGPOBSA-N 0 0 323.736 1.389 10 70 DDIERN CC(C)[C@H](O)CC(=O)N[C@@H]1CCCN(c2ccccc2)C1=O ZINC000160141696 408457928 /nfs/dbraw/zinc/45/79/28/408457928.db2.gz SBBCRXHRQQFKRU-HUUCEWRRSA-N 0 0 304.390 1.705 10 70 DDIERN Cc1noc([C@H]2COCCN2Cc2cn3c(cccc3C)n2)n1 ZINC000161000714 408550122 /nfs/dbraw/zinc/55/01/22/408550122.db2.gz FVWXYJHKUUXODP-CQSZACIVSA-N 0 0 313.361 1.908 10 70 DDIERN Cc1cc(Oc2ccc(NC(=O)[C@@H](C)NC(N)=O)cc2)n[nH]1 ZINC000160423487 221704805 /nfs/dbraw/zinc/70/48/05/221704805.db2.gz GQWKQCFMWWUDRH-SECBINFHSA-N 0 0 303.322 1.506 10 70 DDIERN C[C@@H](C(=O)N1CCC2(CNc3ccccc32)CC1)n1cncn1 ZINC000217560513 278187879 /nfs/dbraw/zinc/18/78/79/278187879.db2.gz XVWMOVKCQKFHEM-ZDUSSCGKSA-N 0 0 311.389 1.825 10 70 DDIERN COc1cccc(OCCN2CCOC[C@H]2c2nc(C)no2)c1 ZINC000160822203 526232582 /nfs/dbraw/zinc/23/25/82/526232582.db2.gz YWHBHTIICQIICI-HNNXBMFYSA-N 0 0 319.361 1.839 10 70 DDIERN CS(=O)(=O)c1ccc(NC[C@@H](CO)Cc2ccccn2)cc1 ZINC000159419570 408408459 /nfs/dbraw/zinc/40/84/59/408408459.db2.gz IVIGWRKJDXIGEI-ZDUSSCGKSA-N 0 0 320.414 1.748 10 70 DDIERN Cc1ccc(C[C@@H](C)NC(=O)N[C@@H]2CCc3ncnn3C2)s1 ZINC000161139394 408564621 /nfs/dbraw/zinc/56/46/21/408564621.db2.gz QUOXMUUYOPVJFI-ZYHUDNBSSA-N 0 0 319.434 1.893 10 70 DDIERN Cc1noc([C@H]2COCCN2CCC(=O)NC2CCCC2)n1 ZINC000161145756 408564889 /nfs/dbraw/zinc/56/48/89/408564889.db2.gz HFRMTDBUSYDRSB-CYBMUJFWSA-N 0 0 308.382 1.200 10 70 DDIERN Cc1ccc(CN(C)C(=O)N[C@@H]2CCc3ncnn3C2)s1 ZINC000161201448 408571468 /nfs/dbraw/zinc/57/14/68/408571468.db2.gz XAADAPZFYASGHY-LLVKDONJSA-N 0 0 305.407 1.804 10 70 DDIERN Cc1noc([C@H]2COCCN2CC(=O)NCCC(C)(C)C)n1 ZINC000160866591 408532440 /nfs/dbraw/zinc/53/24/40/408532440.db2.gz QFSOLWIGRBRBCR-GFCCVEGCSA-N 0 0 310.398 1.304 10 70 DDIERN C[C@@H]1CC[C@H](NC(=O)c2nccnc2C(N)=O)c2ccccc21 ZINC000159563540 197361487 /nfs/dbraw/zinc/36/14/87/197361487.db2.gz RWEOJHYOBWPWII-MFKMUULPSA-N 0 0 310.357 1.944 10 70 DDIERN COC(=O)N[C@@H](C(=O)N[C@@H]1CCOC2(CCCC2)C1)C(C)C ZINC000160129915 408457147 /nfs/dbraw/zinc/45/71/47/408457147.db2.gz CTGKCGXZANLJBY-CHWSQXEVSA-N 0 0 312.410 1.975 10 70 DDIERN CC(C)CCS(=O)(=O)N[C@H]1CCc2nc(C(C)C)nn2C1 ZINC000159380948 408404277 /nfs/dbraw/zinc/40/42/77/408404277.db2.gz BAHMJMMOOJYJAF-LBPRGKRZSA-N 0 0 314.455 1.682 10 70 DDIERN O=C(N[C@H]1CCc2ncnn2C1)N(Cc1ccccc1)C1CC1 ZINC000161224153 408576869 /nfs/dbraw/zinc/57/68/69/408576869.db2.gz HFSFBKKHBPQNDD-AWEZNQCLSA-N 0 0 311.389 1.967 10 70 DDIERN CN(Cc1ccc(F)c(F)c1)C(=O)N[C@H]1CCc2ncnn2C1 ZINC000161274017 408582345 /nfs/dbraw/zinc/58/23/45/408582345.db2.gz DWQBWGJSXLQXCE-NSHDSACASA-N 0 0 321.331 1.713 10 70 DDIERN CCOC(=O)C[C@@H](C)NC(=O)[C@H](NC(=O)CC(C)C)C(C)C ZINC000160871230 408534272 /nfs/dbraw/zinc/53/42/72/408534272.db2.gz UROHFVNPDWDZHZ-IUODEOHRSA-N 0 0 314.426 1.631 10 70 DDIERN COc1ccc(NC(=O)N[C@H]2CCc3ncnn3C2)cc1F ZINC000160941882 408541448 /nfs/dbraw/zinc/54/14/48/408541448.db2.gz CLIDHEPLRHMRAK-JTQLQIEISA-N 0 0 305.313 1.562 10 70 DDIERN CCOCCN(CC)C(=O)N[C@@H]1CCc2nc(C(C)C)nn2C1 ZINC000161482677 408606976 /nfs/dbraw/zinc/60/69/76/408606976.db2.gz WHFHURATCRYCFY-CYBMUJFWSA-N 0 0 323.441 1.784 10 70 DDIERN O=C(CCNC(=O)[C@@H]1C[C@@H]1C1CCCCC1)N1CCOCC1 ZINC000159979872 526502340 /nfs/dbraw/zinc/50/23/40/526502340.db2.gz XNZKTEBCJOGRGW-HUUCEWRRSA-N 0 0 308.422 1.568 10 70 DDIERN COc1ncccc1CNC(=O)N1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000159558616 186126768 /nfs/dbraw/zinc/12/67/68/186126768.db2.gz DJJGORYUFJDKCV-PBHICJAKSA-N 0 0 319.405 1.927 10 70 DDIERN CC(C)COc1ccc([C@H](C)NC(=O)[C@H](C)NC(N)=O)cc1 ZINC000159841681 197368352 /nfs/dbraw/zinc/36/83/52/197368352.db2.gz CTIRMJTYLUFWFQ-RYUDHWBXSA-N 0 0 307.394 1.955 10 70 DDIERN Cc1cccc([C@H](NC(=O)[C@H]2CNC(=O)C2)c2ccccn2)c1 ZINC000159760191 197361665 /nfs/dbraw/zinc/36/16/65/197361665.db2.gz WCZRDUPSCDEVEH-PBHICJAKSA-N 0 0 309.369 1.732 10 70 DDIERN Cc1cc(NC(=O)CN2CC[C@@]3(O)CCCC[C@@H]3C2)n(C)n1 ZINC000160976143 408544966 /nfs/dbraw/zinc/54/49/66/408544966.db2.gz YOGJJOXSQLHXFO-CJNGLKHVSA-N 0 0 306.410 1.294 10 70 DDIERN COCCCN(C)C(=O)N[C@H]1CCc2nc(C(C)C)nn2C1 ZINC000161448317 408602012 /nfs/dbraw/zinc/60/20/12/408602012.db2.gz JDDDDALLQVFQCL-LBPRGKRZSA-N 0 0 309.414 1.394 10 70 DDIERN COC(=O)CN1C[C@@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000160999176 197455665 /nfs/dbraw/zinc/45/56/65/197455665.db2.gz AREPGVSICPBRPB-NWDGAFQWSA-N 0 0 303.280 1.986 10 70 DDIERN CCN(CC)C(=O)C(=O)Nc1ccccc1-c1nncn1CC ZINC000160157551 197389902 /nfs/dbraw/zinc/38/99/02/197389902.db2.gz IFJCMPTYYAYHRK-UHFFFAOYSA-N 0 0 315.377 1.772 10 70 DDIERN Cn1cnc2cc(C(=O)N(C[C@H]3CCOC3)C3CC3)cnc21 ZINC000159738598 408430784 /nfs/dbraw/zinc/43/07/84/408430784.db2.gz LZLWHVMETLYIFJ-LLVKDONJSA-N 0 0 300.362 1.609 10 70 DDIERN COC[C@H](C)C(=O)Nc1ccc(CS(C)(=O)=O)c(F)c1 ZINC000160590004 408499467 /nfs/dbraw/zinc/49/94/67/408499467.db2.gz VYAADVNFTMGZDJ-VIFPVBQESA-N 0 0 303.355 1.591 10 70 DDIERN Cc1ccc(C[C@@H](C)NC(=O)N[C@H]2CCc3ncnn3C2)s1 ZINC000161139588 408564920 /nfs/dbraw/zinc/56/49/20/408564920.db2.gz QUOXMUUYOPVJFI-PWSUYJOCSA-N 0 0 319.434 1.893 10 70 DDIERN C[C@@H](NC(=O)N1CCN2C(=O)NC[C@H]2C1)c1ccc(F)c(F)c1 ZINC000161386187 408597429 /nfs/dbraw/zinc/59/74/29/408597429.db2.gz MCPZZXJIQRDZPD-KOLCDFICSA-N 0 0 324.331 1.445 10 70 DDIERN COC(=O)CN(C(=O)[C@@H](C)NC(=O)c1ccco1)C1CCCC1 ZINC000160808281 484069118 /nfs/dbraw/zinc/06/91/18/484069118.db2.gz SJVVTXPQWOAKFX-LLVKDONJSA-N 0 0 322.361 1.342 10 70 DDIERN CC(C)c1nc2n(n1)C[C@H](NC(=O)N1CCC(CO)CC1)CC2 ZINC000161390551 519871924 /nfs/dbraw/zinc/87/19/24/519871924.db2.gz DHLXMSLQEHGOPE-CYBMUJFWSA-N 0 0 321.425 1.130 10 70 DDIERN CCCN(CCC)S(=O)(=O)N1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000160590851 539220201 /nfs/dbraw/zinc/22/02/01/539220201.db2.gz RFTCXJPGDRHSIF-CABCVRRESA-N 0 0 318.483 1.980 10 70 DDIERN C[C@@H](NC(=O)N(C)CCC(=O)OC(C)(C)C)[C@@H]1CCCO1 ZINC000160741563 408520432 /nfs/dbraw/zinc/52/04/32/408520432.db2.gz CRSFIPYQNDPJEC-NEPJUHHUSA-N 0 0 300.399 1.927 10 70 DDIERN CC(=O)Nc1ccc(NC(=O)N[C@H]2CCc3ncnn3C2)cc1 ZINC000161185870 408571050 /nfs/dbraw/zinc/57/10/50/408571050.db2.gz GDKBNHWZBPINSR-ZDUSSCGKSA-N 0 0 314.349 1.373 10 70 DDIERN COCCN1CCN(C(=O)C[C@@H](C)c2c(C)n[nH]c2C)C[C@H]1C ZINC000160893947 408537224 /nfs/dbraw/zinc/53/72/24/408537224.db2.gz GJXOGHUXVUVHQC-CHWSQXEVSA-N 0 0 322.453 1.699 10 70 DDIERN COCCOc1cccc(CC(=O)N[C@H](C)[C@H]2CCCO2)c1 ZINC000161447232 408603474 /nfs/dbraw/zinc/60/34/74/408603474.db2.gz ZUGAFSUZSJFOGQ-CZUORRHYSA-N 0 0 307.390 1.938 10 70 DDIERN COC(CN1CCN(c2nc3cc(C)ccc3o2)CC1)OC ZINC000160945448 536506854 /nfs/dbraw/zinc/50/68/54/536506854.db2.gz HOUUYALCWYDOGG-UHFFFAOYSA-N 0 0 305.378 1.877 10 70 DDIERN O=C(Nc1ccccc1-n1cccn1)N[C@@H]1CCc2ncnn2C1 ZINC000161101844 197465061 /nfs/dbraw/zinc/46/50/61/197465061.db2.gz NAOBGIAFNRAHSX-GFCCVEGCSA-N 0 0 323.360 1.600 10 70 DDIERN CCCC1(CNC(=O)[C@H]2CCCN2S(=O)(=O)CCC)CC1 ZINC000160583769 408499459 /nfs/dbraw/zinc/49/94/59/408499459.db2.gz MVYLQSGLUYKOBP-CYBMUJFWSA-N 0 0 316.467 1.887 10 70 DDIERN COCc1ccccc1NC(=O)N[C@H]1CCc2ncnn2C1 ZINC000161040681 408554424 /nfs/dbraw/zinc/55/44/24/408554424.db2.gz WLIFMYCEUGQNEB-LBPRGKRZSA-N 0 0 301.350 1.561 10 70 DDIERN Cc1conc1NC(=O)C(=O)N1CCC(c2cc[nH]n2)CC1 ZINC000161316515 526297067 /nfs/dbraw/zinc/29/70/67/526297067.db2.gz FVNIIKOQLHGQSL-UHFFFAOYSA-N 0 0 303.322 1.051 10 70 DDIERN COCc1nc2n(n1)CCC[C@@H]2NC(=O)c1cc(Cl)cn1C ZINC000159973649 197378055 /nfs/dbraw/zinc/37/80/55/197378055.db2.gz XDOSFCVLMHMIIC-JTQLQIEISA-N 0 0 323.784 1.681 10 70 DDIERN Cc1cnn(-c2ccc(C)cc2NC(=O)C(=O)N[C@H]2C[C@H]2C)c1 ZINC000161002381 408550106 /nfs/dbraw/zinc/55/01/06/408550106.db2.gz ZNPVMSRHXQOPEA-OLZOCXBDSA-N 0 0 312.373 1.952 10 70 DDIERN CCn1cnnc1[C@H]1CCCN(CC(=O)Nc2nccs2)C1 ZINC000161285272 408582545 /nfs/dbraw/zinc/58/25/45/408582545.db2.gz UKQSRISWHMSOAW-NSHDSACASA-N 0 0 320.422 1.573 10 70 DDIERN CCNC(=O)CCCC(=O)N1CC[C@@H](Oc2cccnc2)C1 ZINC000161379013 408596426 /nfs/dbraw/zinc/59/64/26/408596426.db2.gz DFOXGYDTXRVUOH-CQSZACIVSA-N 0 0 305.378 1.368 10 70 DDIERN C[C@H](C(=O)N1CCO[C@H](Cn2cccn2)C1)c1cccs1 ZINC000159830760 197367321 /nfs/dbraw/zinc/36/73/21/197367321.db2.gz VJXHLSUJXKNMDL-STQMWFEESA-N 0 0 305.403 1.976 10 70 DDIERN COc1cc(CNC(=O)N2CC[C@@]3(O)CCCC[C@@H]3C2)ccn1 ZINC000159410772 197351158 /nfs/dbraw/zinc/35/11/58/197351158.db2.gz NPYYLLVKCLYJGN-PBHICJAKSA-N 0 0 319.405 1.927 10 70 DDIERN C[C@@H]1CC[C@@H](C(=O)NCCCNC(=O)c2cccc(O)c2)O1 ZINC000159694068 408426835 /nfs/dbraw/zinc/42/68/35/408426835.db2.gz DWJXWWHZFDBCNR-RISCZKNCSA-N 0 0 306.362 1.196 10 70 DDIERN CC[C@H](c1ccncc1)N(C)C(=O)N[C@@H]1CCc2ncnn2C1 ZINC000161345502 408593365 /nfs/dbraw/zinc/59/33/65/408593365.db2.gz HHVKVUFDAABUNK-ZIAGYGMSSA-N 0 0 314.393 1.781 10 70 DDIERN CCc1noc(C)c1NC(=O)C(=O)N1CCN2CCCC[C@H]2C1 ZINC000160938181 522855599 /nfs/dbraw/zinc/85/55/99/522855599.db2.gz AUXIWAZSJVATLS-LBPRGKRZSA-N 0 0 320.393 1.181 10 70 DDIERN Cc1cnn(CCNC(=O)N2CCC(c3cc[nH]n3)CC2)c1 ZINC000160290120 526262233 /nfs/dbraw/zinc/26/22/33/526262233.db2.gz KPDRZYUSDQVMGS-UHFFFAOYSA-N 0 0 302.382 1.504 10 70 DDIERN Cn1c(S[C@@H]2CCN(C3CC3)C2=O)nnc1-c1ccccn1 ZINC000159539066 527087683 /nfs/dbraw/zinc/08/76/83/527087683.db2.gz OWXNZFSMJGRDTC-GFCCVEGCSA-N 0 0 315.402 1.733 10 70 DDIERN CCc1noc([C@H](C)N2CCN(C(=O)C[C@@H](O)C(C)C)CC2)n1 ZINC000159770755 290762639 /nfs/dbraw/zinc/76/26/39/290762639.db2.gz CWVCGZVJZLMRBK-QWHCGFSZSA-N 0 0 324.425 1.244 10 70 DDIERN CCOCCC1(CNC(=O)N[C@@H]2CCCn3ncnc32)CC1 ZINC000159537093 408417043 /nfs/dbraw/zinc/41/70/43/408417043.db2.gz RSYHEUOCUAJXSH-GFCCVEGCSA-N 0 0 307.398 1.619 10 70 DDIERN CC1CCN(S(=O)(=O)N2CC[C@@]3(O)CCCC[C@@H]3C2)CC1 ZINC000160594390 408499651 /nfs/dbraw/zinc/49/96/51/408499651.db2.gz LGUFXPHDXFDQDP-CABCVRRESA-N 0 0 316.467 1.590 10 70 DDIERN O=C(N[C@@H]1CCc2ncnn2C1)N(Cc1cccnc1)C1CC1 ZINC000161202487 408571800 /nfs/dbraw/zinc/57/18/00/408571800.db2.gz IKNHNHUZBFQCDD-CYBMUJFWSA-N 0 0 312.377 1.362 10 70 DDIERN CC(C)(C)c1nnc(NC(=O)N[C@H]2CCc3ncnn3C2)s1 ZINC000161321748 408586819 /nfs/dbraw/zinc/58/68/19/408586819.db2.gz SPXHBDMBPSUMEA-QMMMGPOBSA-N 0 0 321.410 1.564 10 70 DDIERN CCC[C@H](C(=O)NC1CCN(C(=O)c2ccoc2)CC1)[NH+](C)C ZINC000161411413 408600448 /nfs/dbraw/zinc/60/04/48/408600448.db2.gz RDGJWZWOQJBSGI-OAHLLOKOSA-N 0 0 321.421 1.731 10 70 DDIERN Cc1noc([C@@H]2COCCN2CCC(=O)NC2CCCC2)n1 ZINC000161145644 526657154 /nfs/dbraw/zinc/65/71/54/526657154.db2.gz HFRMTDBUSYDRSB-ZDUSSCGKSA-N 0 0 308.382 1.200 10 70 DDIERN Cc1noc([C@H]2COCCN2CCCC(=O)OC(C)(C)C)n1 ZINC000160893835 526672779 /nfs/dbraw/zinc/67/27/79/526672779.db2.gz LMTGAJNIJJDVQU-GFCCVEGCSA-N 0 0 311.382 1.873 10 70 DDIERN CC(C)C[C@@H](CO)NC(=O)[C@@H](C)NC(=O)Nc1ccccc1 ZINC000160834312 290777839 /nfs/dbraw/zinc/77/78/39/290777839.db2.gz KRCKSUCQUZLHQE-OCCSQVGLSA-N 0 0 307.394 1.720 10 70 DDIERN C[C@H](NC(=O)N1CCN2C(=O)NC[C@@H]2C1)c1ccc(F)c(F)c1 ZINC000161385773 197490243 /nfs/dbraw/zinc/49/02/43/197490243.db2.gz MCPZZXJIQRDZPD-GXSJLCMTSA-N 0 0 324.331 1.445 10 70 DDIERN O=C(Nc1ccccc1-n1cccn1)N[C@H]1CCc2ncnn2C1 ZINC000161101972 197464635 /nfs/dbraw/zinc/46/46/35/197464635.db2.gz NAOBGIAFNRAHSX-LBPRGKRZSA-N 0 0 323.360 1.600 10 70 DDIERN CCn1cnnc1[C@H]1CCCN(CC(=O)Nc2cc(C)no2)C1 ZINC000161287843 408580924 /nfs/dbraw/zinc/58/09/24/408580924.db2.gz FWCLNHOKGMMLJZ-LBPRGKRZSA-N 0 0 318.381 1.413 10 70 DDIERN CCC[C@H](NC(=O)C(=O)c1cnn(CC)c1)C(=O)OC(C)(C)C ZINC000161299495 408584592 /nfs/dbraw/zinc/58/45/92/408584592.db2.gz XMWFDIUVIUOTLH-LBPRGKRZSA-N 0 0 323.393 1.712 10 70 DDIERN CCCNC(=O)CCCC(=O)N1CC[C@H](Oc2cccnc2)C1 ZINC000161379161 408596508 /nfs/dbraw/zinc/59/65/08/408596508.db2.gz MRSOGLBLVUTMLG-HNNXBMFYSA-N 0 0 319.405 1.758 10 70 DDIERN CC(C)[C@@H](O)CC(=O)NCCNC(=O)c1c(F)cccc1F ZINC000159881972 197370552 /nfs/dbraw/zinc/37/05/52/197370552.db2.gz VFKWYYLLSSIVQL-LBPRGKRZSA-N 0 0 314.332 1.218 10 70 DDIERN C[C@H](CNC(=O)[C@H]1C[C@@H]1c1cccc(F)c1F)N1CCOCC1 ZINC000160207559 248312999 /nfs/dbraw/zinc/31/29/99/248312999.db2.gz IDXUJJLSLUJGOQ-BNOWGMLFSA-N 0 0 324.371 1.905 10 70 DDIERN C[C@@H]1C(=O)NCCN1C[C@@H]1CC(c2ccc(Cl)cc2)=NO1 ZINC000159795663 197365384 /nfs/dbraw/zinc/36/53/84/197365384.db2.gz HZUXJIZOZPDXBS-MFKMUULPSA-N 0 0 307.781 1.653 10 70 DDIERN C[C@@H](NC(=O)c1ccco1)C(=O)N(C)c1ccc2c(c1)OCO2 ZINC000160603496 408502515 /nfs/dbraw/zinc/50/25/15/408502515.db2.gz LAXPUQOYIJJMCZ-SNVBAGLBSA-N 0 0 316.313 1.790 10 70 DDIERN CN(C)c1ccccc1NC(=O)N[C@@H]1CCc2ncnn2C1 ZINC000161042807 408553981 /nfs/dbraw/zinc/55/39/81/408553981.db2.gz FQXSVGLGGHTNBW-LLVKDONJSA-N 0 0 300.366 1.481 10 70 DDIERN COC[C@H](C)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O ZINC000161222390 408577528 /nfs/dbraw/zinc/57/75/28/408577528.db2.gz DXAKOQXEEGMNGD-RYUDHWBXSA-N 0 0 306.362 1.199 10 70 DDIERN NC(=O)c1cccc(C(=O)N2CC[C@H](Oc3cccnc3)C2)c1 ZINC000161396804 408598463 /nfs/dbraw/zinc/59/84/63/408598463.db2.gz NPVPYCDTJDVJIK-HNNXBMFYSA-N 0 0 311.341 1.474 10 70 DDIERN CC(=O)N1CCOC[C@H]1C(=O)NCCc1cc2ccccc2[nH]1 ZINC000161447341 519600685 /nfs/dbraw/zinc/60/06/85/519600685.db2.gz QWDBRKQMMRSRNJ-INIZCTEOSA-N 0 0 315.373 1.074 10 70 DDIERN O=C(Nc1ccnn1C[C@@H]1CCOC1)N[C@@H]1CCCC[C@@H]1O ZINC000159636217 408421291 /nfs/dbraw/zinc/42/12/91/408421291.db2.gz IHJUBPLHJMYCQT-XQQFMLRXSA-N 0 0 308.382 1.345 10 70 DDIERN O=C(Nc1ccn(CC(F)(F)F)n1)N[C@@H]1CCCC[C@@H]1O ZINC000160796019 408524053 /nfs/dbraw/zinc/52/40/53/408524053.db2.gz HIARJZUGTPENIH-BDAKNGLRSA-N 0 0 306.288 1.870 10 70 DDIERN COC(=O)c1ccc(N2CCO[C@H](c3nnc(C)[nH]3)C2)nc1C ZINC000160401421 408478270 /nfs/dbraw/zinc/47/82/70/408478270.db2.gz JZOJLDDCFDKXHP-LBPRGKRZSA-N 0 0 317.349 1.181 10 70 DDIERN COC(=O)c1ccc(NC(=O)N[C@H]2CCc3ncnn3C2)cc1 ZINC000161237132 408576412 /nfs/dbraw/zinc/57/64/12/408576412.db2.gz IUVLMPKEQUBHDH-LBPRGKRZSA-N 0 0 315.333 1.201 10 70 DDIERN CCS(=O)(=O)N1CCOc2ccc(Br)cc21 ZINC000217263169 484145559 /nfs/dbraw/zinc/14/55/59/484145559.db2.gz MYSLOMIXQSXBIE-UHFFFAOYSA-N 0 0 306.181 1.998 10 70 DDIERN CC(C)CCn1ccc(NC(=O)NC[C@@H](C)N2CCOCC2)n1 ZINC000160719775 519703474 /nfs/dbraw/zinc/70/34/74/519703474.db2.gz BENNDOVZDCCUHH-CQSZACIVSA-N 0 0 323.441 1.771 10 70 DDIERN CC(C)(NC(=O)N[C@@H]1CCc2ncnn2C1)c1cccc(F)c1 ZINC000161112814 197466062 /nfs/dbraw/zinc/46/60/62/197466062.db2.gz FDSGXVJIWAEYLF-CYBMUJFWSA-N 0 0 317.368 1.967 10 70 DDIERN Cc1conc1NC(=O)C(=O)N1CCC[C@@H]1c1cnn(C)c1 ZINC000161024806 197458493 /nfs/dbraw/zinc/45/84/93/197458493.db2.gz DMVDGSCETFQOBF-LLVKDONJSA-N 0 0 303.322 1.019 10 70 DDIERN COCc1nc2n(n1)CCC[C@H]2NC(=O)c1ccc(C)n1C ZINC000159991930 197378860 /nfs/dbraw/zinc/37/88/60/197378860.db2.gz AZQGZIRJMINATI-LLVKDONJSA-N 0 0 303.366 1.336 10 70 DDIERN COCc1nc2n(n1)CCC[C@H]2NC(=O)c1cc(C(C)C)n[nH]1 ZINC000159962895 197376636 /nfs/dbraw/zinc/37/66/36/197376636.db2.gz MENZSKILCBNIJQ-SNVBAGLBSA-N 0 0 318.381 1.536 10 70 DDIERN COCCCN(C)C(=O)[C@H]1CC(=O)N(C)[C@H]1c1ccc(F)cc1 ZINC000160766888 292332882 /nfs/dbraw/zinc/33/28/82/292332882.db2.gz WICVLBUTLCFCBH-HOCLYGCPSA-N 0 0 322.380 1.840 10 70 DDIERN COCc1nc2n(n1)CCC[C@@H]2NC(=O)N[C@H](C)CC(C)C ZINC000160442606 162150054 /nfs/dbraw/zinc/15/00/54/162150054.db2.gz IJQBDDYQCOLDJH-NEPJUHHUSA-N 0 0 309.414 1.993 10 70 DDIERN CCNC(=O)CCCC(=O)N1CC[C@H](Oc2cccnc2)C1 ZINC000161378877 408596624 /nfs/dbraw/zinc/59/66/24/408596624.db2.gz DFOXGYDTXRVUOH-AWEZNQCLSA-N 0 0 305.378 1.368 10 70 DDIERN CCOCCN(CC)C(=O)N[C@H]1CCc2nc(C(C)C)nn2C1 ZINC000161482809 408608030 /nfs/dbraw/zinc/60/80/30/408608030.db2.gz WHFHURATCRYCFY-ZDUSSCGKSA-N 0 0 323.441 1.784 10 70 DDIERN COCCC1(CNC(=O)N2CCO[C@H](Cn3cccn3)C2)CC1 ZINC000161039010 221712642 /nfs/dbraw/zinc/71/26/42/221712642.db2.gz KCTLFKWJWRWUNG-AWEZNQCLSA-N 0 0 322.409 1.110 10 70 DDIERN COCc1nc2n(n1)CCC[C@H]2NC(=O)NCC1(C2CC2)CC1 ZINC000160448430 162150079 /nfs/dbraw/zinc/15/00/79/162150079.db2.gz OZSMBDZJHLEHBG-GFCCVEGCSA-N 0 0 319.409 1.749 10 70 DDIERN CCOc1cc(F)ccc1NC(=O)N[C@@H]1CCc2ncnn2C1 ZINC000161333960 408588709 /nfs/dbraw/zinc/58/87/09/408588709.db2.gz JDUDLQVIWPMECG-LLVKDONJSA-N 0 0 319.340 1.952 10 70 DDIERN CCN1CCN(C(=O)N[C@@H]2CCc3nc(C(C)C)nn3C2)CC1 ZINC000161432898 408603575 /nfs/dbraw/zinc/60/35/75/408603575.db2.gz WIVHZEQGJZJAMH-CYBMUJFWSA-N 0 0 320.441 1.063 10 70 DDIERN CCc1nn(C)c(Cl)c1C(=O)NC[C@@H](C)N1CCOCC1 ZINC000159975557 197377841 /nfs/dbraw/zinc/37/78/41/197377841.db2.gz SPBCIWKMBDIPCW-SNVBAGLBSA-N 0 0 314.817 1.086 10 70 DDIERN Cn1c(S[C@H]2CCN(C3CC3)C2=O)nnc1-c1ccccn1 ZINC000159539178 408415936 /nfs/dbraw/zinc/41/59/36/408415936.db2.gz OWXNZFSMJGRDTC-LBPRGKRZSA-N 0 0 315.402 1.733 10 70 DDIERN NC(=O)NCC(=O)NC[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000160549003 408495093 /nfs/dbraw/zinc/49/50/93/408495093.db2.gz FJRCEUYGQRKTAS-OIBJUYFYSA-N 0 0 316.188 1.881 10 70 DDIERN COc1ccc(OC)c(NC(=O)N[C@@H]2CCc3ncnn3C2)c1 ZINC000161035877 408551978 /nfs/dbraw/zinc/55/19/78/408551978.db2.gz HQEBOBKYQOEZKW-SNVBAGLBSA-N 0 0 317.349 1.432 10 70 DDIERN CCCCCNC(=O)CN1CCC[C@H](c2nncn2CC)C1 ZINC000161426808 408599227 /nfs/dbraw/zinc/59/92/27/408599227.db2.gz UICMZUGFQPGTRC-AWEZNQCLSA-N 0 0 307.442 1.784 10 70 DDIERN CNC(=O)[C@H]1CCCN1C(=O)NCC1(Cc2ccccc2)CC1 ZINC000160131791 197387813 /nfs/dbraw/zinc/38/78/13/197387813.db2.gz VWSZYVYOUMWCNV-OAHLLOKOSA-N 0 0 315.417 1.929 10 70 DDIERN CCN(CC)C(=O)C(=O)Nc1ccc(N2CCOCC2)nc1C ZINC000160453229 408483801 /nfs/dbraw/zinc/48/38/01/408483801.db2.gz UNODANJMKAUEQL-UHFFFAOYSA-N 0 0 320.393 1.034 10 70 DDIERN CCC[C@@H](NC(=O)CN1CCCCC1=O)C(=O)OC(C)(C)C ZINC000161457429 408604258 /nfs/dbraw/zinc/60/42/58/408604258.db2.gz FLLMVYHJWBDJMF-GFCCVEGCSA-N 0 0 312.410 1.626 10 70 DDIERN CCn1ccnc1CN1CCCN(Cc2nccn2CC)CC1 ZINC000160715084 484067957 /nfs/dbraw/zinc/06/79/57/484067957.db2.gz TXWYYEOIRMHVEF-UHFFFAOYSA-N 0 0 316.453 1.827 10 70 DDIERN CCc1noc(C)c1NC(=O)C(=O)N[C@@H]1COc2ccccc21 ZINC000160402847 522859138 /nfs/dbraw/zinc/85/91/38/522859138.db2.gz WUVPJWDJDBHJJD-GFCCVEGCSA-N 0 0 315.329 1.734 10 70 DDIERN CCc1ncsc1C(=O)N1CCC[C@@H](Cn2cncn2)C1 ZINC000160537716 197420188 /nfs/dbraw/zinc/42/01/88/197420188.db2.gz RGQCTLFDOILEAM-LLVKDONJSA-N 0 0 305.407 1.849 10 70 DDIERN COCc1nc2n(n1)CCC[C@H]2NC(=O)N[C@@H](C)CC(C)C ZINC000160442486 162150083 /nfs/dbraw/zinc/15/00/83/162150083.db2.gz IJQBDDYQCOLDJH-NWDGAFQWSA-N 0 0 309.414 1.993 10 70 DDIERN Cc1noc([C@@H]2COCCN2C[C@H](O)CCc2ccccc2)n1 ZINC000161023926 408551665 /nfs/dbraw/zinc/55/16/65/408551665.db2.gz NRILDTRNPGQQJW-CVEARBPZSA-N 0 0 317.389 1.745 10 70 DDIERN CCc1nc(-c2ccccc2NC(=O)[C@@H]2C[C@H]2C(=O)OC)n[nH]1 ZINC000161352872 408593027 /nfs/dbraw/zinc/59/30/27/408593027.db2.gz LVBHTHVQCZTBSC-GHMZBOCLSA-N 0 0 314.345 1.782 10 70 DDIERN C[C@@H](NC(=O)CCCNC(=O)c1cccnc1)[C@@H]1CCCO1 ZINC000161450681 408604453 /nfs/dbraw/zinc/60/44/53/408604453.db2.gz HBFWBDJJNUHAFU-OCCSQVGLSA-N 0 0 305.378 1.275 10 70 DDIERN Cn1c2cccc(C(=O)N3CCO[C@@H]4CCCC[C@H]43)c2oc1=O ZINC000160122867 294184011 /nfs/dbraw/zinc/18/40/11/294184011.db2.gz OCENTIWGVORJSO-TZMCWYRMSA-N 0 0 316.357 1.915 10 70 DDIERN CC(C)OC(=O)CCCNC(=O)NC[C@@H]1CCCC[C@@H]1O ZINC000160222456 519743251 /nfs/dbraw/zinc/74/32/51/519743251.db2.gz XNYHSJJNXGZAET-STQMWFEESA-N 0 0 300.399 1.569 10 70 DDIERN COCc1nc2n(n1)CCC[C@@H]2NC(=O)c1ccc(C)n1C ZINC000159992059 197378522 /nfs/dbraw/zinc/37/85/22/197378522.db2.gz AZQGZIRJMINATI-NSHDSACASA-N 0 0 303.366 1.336 10 70 DDIERN CC(C)COc1ccc([C@@H](C)NC(=O)[C@H](C)NC(N)=O)cc1 ZINC000159841564 197368579 /nfs/dbraw/zinc/36/85/79/197368579.db2.gz CTIRMJTYLUFWFQ-NEPJUHHUSA-N 0 0 307.394 1.955 10 70 DDIERN O=C(NCCc1cccnc1)N1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000159472195 197356283 /nfs/dbraw/zinc/35/62/83/197356283.db2.gz VILKDBNFFLVOBX-NVXWUHKLSA-N 0 0 303.406 1.961 10 70 DDIERN CC[C@H](O)CN1CCN(CCC(=O)c2ccc(C)cc2)CC1 ZINC000159839658 408439378 /nfs/dbraw/zinc/43/93/78/408439378.db2.gz AOFQDHZUHBWRCN-KRWDZBQOSA-N 0 0 304.434 1.956 10 70 DDIERN Cc1noc([C@@H]2COCCN2Cc2noc(C(C)(C)C)n2)n1 ZINC000160993390 408548213 /nfs/dbraw/zinc/54/82/13/408548213.db2.gz NSPIVVZCVYAYLD-JTQLQIEISA-N 0 0 307.354 1.632 10 70 DDIERN O=C(Nc1nncs1)[C@H]1CCC[C@@H]1C(=O)Nc1nncs1 ZINC000159591170 186129694 /nfs/dbraw/zinc/12/96/94/186129694.db2.gz BVWRGSFUFIQVOJ-BQBZGAKWSA-N 0 0 324.391 1.383 10 70 DDIERN COCc1nc2n(n1)CCC[C@@H]2NC(=O)c1cc(C(C)C)n[nH]1 ZINC000159963026 197376773 /nfs/dbraw/zinc/37/67/73/197376773.db2.gz MENZSKILCBNIJQ-JTQLQIEISA-N 0 0 318.381 1.536 10 70 DDIERN C[C@H]1CC[C@@H](C(=O)Nc2cccnc2N2CCC(CO)CC2)O1 ZINC000159761419 408432259 /nfs/dbraw/zinc/43/22/59/408432259.db2.gz KMTQQEWQAUOADR-WFASDCNBSA-N 0 0 319.405 1.796 10 70 DDIERN Cc1cccc([C@@H](NC(=O)[C@@H](C)NC(N)=O)c2ccccn2)c1 ZINC000160157174 524839333 /nfs/dbraw/zinc/83/93/33/524839333.db2.gz DDLVDXQDFWUZPK-IUODEOHRSA-N 0 0 312.373 1.652 10 70 DDIERN Cc1cc(C)n(C[C@H]2CN(C(=O)C[C@@H](O)C(C)C)CCO2)n1 ZINC000159663130 186134151 /nfs/dbraw/zinc/13/41/51/186134151.db2.gz WLLXWKCWNRFKMZ-HUUCEWRRSA-N 0 0 309.410 1.134 10 70 DDIERN COC(=O)C[C@H](NC(=O)c1cc[nH]c(=O)c1)c1ccccc1 ZINC000160060391 354236739 /nfs/dbraw/zinc/23/67/39/354236739.db2.gz WURIFQHRPDDRSZ-ZDUSSCGKSA-N 0 0 300.314 1.409 10 70 DDIERN CCCCC[C@H](C)NC(=O)CN1CCOC[C@@H]1c1nc(C)no1 ZINC000160833692 162149937 /nfs/dbraw/zinc/14/99/37/162149937.db2.gz XJJDJJXWHZNIDU-GXTWGEPZSA-N 0 0 324.425 1.836 10 70 DDIERN COC(=O)c1ccc(N2CCO[C@@H](c3nnc(C)[nH]3)C2)nc1C ZINC000160401545 408478697 /nfs/dbraw/zinc/47/86/97/408478697.db2.gz JZOJLDDCFDKXHP-GFCCVEGCSA-N 0 0 317.349 1.181 10 70 DDIERN Cc1noc([C@H]2COCCN2Cc2c(C)nn(C)c2Cl)n1 ZINC000160786977 408523793 /nfs/dbraw/zinc/52/37/93/408523793.db2.gz HTHHNXDEJYHXTJ-LLVKDONJSA-N 0 0 311.773 1.647 10 70 DDIERN Cc1noc([C@H]2COCCN2CCCCCn2cccn2)n1 ZINC000161041504 408554358 /nfs/dbraw/zinc/55/43/58/408554358.db2.gz FFTGAGMDDMGVQI-CQSZACIVSA-N 0 0 305.382 1.818 10 70 DDIERN CC(C)[C@@H](C)NC(=O)CS(=O)(=O)Cc1nccn1C(C)C ZINC000161209870 408574694 /nfs/dbraw/zinc/57/46/94/408574694.db2.gz YBELHYPPLQIDGO-GFCCVEGCSA-N 0 0 315.439 1.540 10 70 DDIERN COCCN1CCN(C(=O)C[C@H](C)c2c(C)n[nH]c2C)C[C@H]1C ZINC000160893819 408537093 /nfs/dbraw/zinc/53/70/93/408537093.db2.gz GJXOGHUXVUVHQC-QWHCGFSZSA-N 0 0 322.453 1.699 10 70 DDIERN CC(C)c1nc2n(n1)C[C@H](NC(=O)N1CCS[C@H](C)C1)CC2 ZINC000161508712 408609806 /nfs/dbraw/zinc/60/98/06/408609806.db2.gz ZQIQKAUXVMMUKQ-VXGBXAGGSA-N 0 0 323.466 1.863 10 70 DDIERN NC(=O)C1(CNC(=O)[C@H]2C[C@H]2C2CCCCC2)CCOCC1 ZINC000160301917 303236435 /nfs/dbraw/zinc/23/64/35/303236435.db2.gz JCXVSHNXOUPROQ-KBPBESRZSA-N 0 0 308.422 1.601 10 70 DDIERN CC(C)[C@H](C)NC(=O)CS(=O)(=O)Cc1nccn1C(C)C ZINC000161210000 519812533 /nfs/dbraw/zinc/81/25/33/519812533.db2.gz YBELHYPPLQIDGO-LBPRGKRZSA-N 0 0 315.439 1.540 10 70 DDIERN CCC[C@H](NC(=O)c1cc(C(N)=O)cn1C)C(=O)OC(C)(C)C ZINC000161449572 521141488 /nfs/dbraw/zinc/14/14/88/521141488.db2.gz XGOUKQWATYUKNB-NSHDSACASA-N 0 0 323.393 1.364 10 70 DDIERN CC(C)COc1ccc([C@@H](C)NC(=O)Cn2cnnn2)cc1 ZINC000159567149 186127746 /nfs/dbraw/zinc/12/77/46/186127746.db2.gz SFNFZLWEYQXCKH-GFCCVEGCSA-N 0 0 303.366 1.585 10 70 DDIERN COC(=O)C[C@@H](NC(=O)c1cc[nH]c(=O)c1)c1ccccc1 ZINC000160060525 354237102 /nfs/dbraw/zinc/23/71/02/354237102.db2.gz WURIFQHRPDDRSZ-CYBMUJFWSA-N 0 0 300.314 1.409 10 70 DDIERN CC(=O)Nc1cccc(NC(=O)N[C@@H]2CCc3ncnn3C2)c1 ZINC000161237261 197477425 /nfs/dbraw/zinc/47/74/25/197477425.db2.gz XRWLYTPDJACRIT-CYBMUJFWSA-N 0 0 314.349 1.373 10 70 DDIERN O=C(NCCc1cccnc1)N1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000159472608 197356285 /nfs/dbraw/zinc/35/62/85/197356285.db2.gz VILKDBNFFLVOBX-RDJZCZTQSA-N 0 0 303.406 1.961 10 70 DDIERN O=C1NC[C@@H]2CN(c3ccnc4c(F)cc(F)cc34)CCN12 ZINC000159874504 284901681 /nfs/dbraw/zinc/90/16/81/284901681.db2.gz MEWQSLQDHVIRCN-SNVBAGLBSA-N 0 0 304.300 1.727 10 70 DDIERN C[C@H](NC(=O)N(C)CCC(=O)OC(C)(C)C)[C@H]1CCCO1 ZINC000160741701 408520814 /nfs/dbraw/zinc/52/08/14/408520814.db2.gz CRSFIPYQNDPJEC-NWDGAFQWSA-N 0 0 300.399 1.927 10 70 DDIERN CC(C)[C@H](O)CC(=O)Nc1cccc(N2CCCNC2=O)c1 ZINC000161207059 408570763 /nfs/dbraw/zinc/57/07/63/408570763.db2.gz TWNAKPGGIKUFTH-CQSZACIVSA-N 0 0 305.378 1.952 10 70 DDIERN CCn1cnnc1[C@@H]1CCCN(Cc2nnnn2C(C)C)C1 ZINC000161356928 408591705 /nfs/dbraw/zinc/59/17/05/408591705.db2.gz QWUXMLRPPLVPME-GFCCVEGCSA-N 0 0 304.402 1.245 10 70 DDIERN CC(C)[N@H+]1C[C@H](NC(=O)[C@H](C)NC(=O)OC(C)(C)C)[C@@H](C)C1 ZINC000161348464 408592112 /nfs/dbraw/zinc/59/21/12/408592112.db2.gz KFNKSOJCYDCFRQ-AVGNSLFASA-N 0 0 313.442 1.745 10 70 DDIERN Cc1ccc(C[C@H](C)NC(=O)N[C@H]2CCc3ncnn3C2)s1 ZINC000161139713 408564823 /nfs/dbraw/zinc/56/48/23/408564823.db2.gz QUOXMUUYOPVJFI-JQWIXIFHSA-N 0 0 319.434 1.893 10 70 DDIERN CCCCN(CCO)C(=O)N[C@@H]1CCc2nc(C(C)C)nn2C1 ZINC000161393553 520513284 /nfs/dbraw/zinc/51/32/84/520513284.db2.gz LBEKMMPTWMCDJF-CYBMUJFWSA-N 0 0 323.441 1.520 10 70 DDIERN Cc1nsc(N2CCCN(C(=O)C[C@@H](O)C(C)C)CC2)n1 ZINC000161312403 526711104 /nfs/dbraw/zinc/71/11/04/526711104.db2.gz BCKSANWICUIEHD-GFCCVEGCSA-N 0 0 312.439 1.292 10 70 DDIERN COc1ncccc1CNC(=O)N1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000159558485 186127096 /nfs/dbraw/zinc/12/70/96/186127096.db2.gz DJJGORYUFJDKCV-RHSMWYFYSA-N 0 0 319.405 1.927 10 70 DDIERN Cc1c(NC(=O)C(=O)N[C@H]2C[C@H]2C)cnn1-c1ccccc1F ZINC000161000771 197456381 /nfs/dbraw/zinc/45/63/81/197456381.db2.gz PUMMEDTXSILBJK-SKDRFNHKSA-N 0 0 316.336 1.783 10 70 DDIERN C[C@@H](C(=O)N1CCO[C@@H](Cn2cccn2)C1)c1cccs1 ZINC000159831152 197367047 /nfs/dbraw/zinc/36/70/47/197367047.db2.gz VJXHLSUJXKNMDL-CHWSQXEVSA-N 0 0 305.403 1.976 10 70 DDIERN CCS(=O)(=O)NCc1ccc(C(=O)N[C@@H](C)C(C)C)cc1 ZINC000159529535 197361058 /nfs/dbraw/zinc/36/10/58/197361058.db2.gz DNZGLXIUDVBAGM-LBPRGKRZSA-N 0 0 312.435 1.900 10 70 DDIERN COCCN1CCN(C(=O)NCCc2cscn2)C[C@H]1C ZINC000159384553 408404184 /nfs/dbraw/zinc/40/41/84/408404184.db2.gz OYSBTMUMUHUWQW-GFCCVEGCSA-N 0 0 312.439 1.048 10 70 DDIERN CC(C)[C@H](O)CC(=O)NCc1cccc(NC(=O)N(C)C)c1 ZINC000160828461 408528015 /nfs/dbraw/zinc/52/80/15/408528015.db2.gz VWRPCYOFGNCPFK-CQSZACIVSA-N 0 0 307.394 1.803 10 70 DDIERN Cc1nc(C)n(C[C@@H]2CCCN(C(=O)C[C@H](O)C(C)C)C2)n1 ZINC000160311172 408470666 /nfs/dbraw/zinc/47/06/66/408470666.db2.gz BKAODYAQPAOANC-CABCVRRESA-N 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HRVJKZYXOUFJQK-QWRGUYRKSA-N 0 0 314.411 1.409 10 70 DDIERN Cc1cc(NC(=O)CN2CC[C@]3(O)CCCC[C@@H]3C2)n(C)n1 ZINC000160976008 408545522 /nfs/dbraw/zinc/54/55/22/408545522.db2.gz YOGJJOXSQLHXFO-CZUORRHYSA-N 0 0 306.410 1.294 10 70 DDIERN Cc1cnn(CCNC(=O)NCCOc2ccc(Cl)cn2)c1 ZINC000161128290 408564089 /nfs/dbraw/zinc/56/40/89/408564089.db2.gz QPNUTLNIFINZNQ-UHFFFAOYSA-N 0 0 323.784 1.618 10 70 DDIERN CCC[C@@H](NC(=O)c1ccc(=O)n(C)n1)C(=O)OC(C)(C)C ZINC000161499259 408610836 /nfs/dbraw/zinc/61/08/36/408610836.db2.gz GDJXTNWDTXTZLL-LLVKDONJSA-N 0 0 309.366 1.021 10 70 DDIERN CN(C)C(=O)CN(C)C[C@H]1CC(c2ccc(Cl)cc2)=NO1 ZINC000159730845 186137922 /nfs/dbraw/zinc/13/79/22/186137922.db2.gz YGCFMRDXOFEEJV-CYBMUJFWSA-N 0 0 309.797 1.853 10 70 DDIERN CC(C)c1nc2n(n1)C[C@@H](NS(=O)(=O)c1ccccc1)CC2 ZINC000159384443 408405577 /nfs/dbraw/zinc/40/55/77/408405577.db2.gz HHINIXUPYDLEFV-LBPRGKRZSA-N 0 0 320.418 1.695 10 70 DDIERN CC[C@H](c1ccncc1)N(C)C(=O)N[C@H]1CCc2ncnn2C1 ZINC000161345757 408592854 /nfs/dbraw/zinc/59/28/54/408592854.db2.gz HHVKVUFDAABUNK-UONOGXRCSA-N 0 0 314.393 1.781 10 70 DDIERN CC1(C)C[C@H](NC(=O)CSCC(N)=O)c2ccccc2O1 ZINC000159969269 278379639 /nfs/dbraw/zinc/37/96/39/278379639.db2.gz KCRMCGBOFMOJDT-NSHDSACASA-N 0 0 308.403 1.624 10 70 DDIERN CCc1nc2c(ncnc2N2CCCn3nc(CO)cc3C2)o1 ZINC000217141017 333390007 /nfs/dbraw/zinc/39/00/07/333390007.db2.gz FOLOEZRIANWLCO-UHFFFAOYSA-N 0 0 314.349 1.279 10 70 DDIERN CCOC(=O)CCCCCN1CCOC[C@@H]1c1nc(C)no1 ZINC000160928073 290778443 /nfs/dbraw/zinc/77/84/43/290778443.db2.gz KELAVDQXLQUJNW-CYBMUJFWSA-N 0 0 311.382 1.875 10 70 DDIERN CS(=O)(=O)c1ccc(NC[C@H](CO)Cc2ccccn2)cc1 ZINC000159419454 408407570 /nfs/dbraw/zinc/40/75/70/408407570.db2.gz IVIGWRKJDXIGEI-CYBMUJFWSA-N 0 0 320.414 1.748 10 70 DDIERN CCN(CC)C(=O)[C@@H](C)S(=O)(=O)Cc1nccn1C(C)C ZINC000161213415 408573464 /nfs/dbraw/zinc/57/34/64/408573464.db2.gz ULOVAANWJZCDBI-GFCCVEGCSA-N 0 0 315.439 1.636 10 70 DDIERN CC(C)OC(=O)CCCNC(=O)N[C@H]1CCCC[C@H]1CO ZINC000160042468 519743766 /nfs/dbraw/zinc/74/37/66/519743766.db2.gz OZCGCQNCPBKLEX-STQMWFEESA-N 0 0 300.399 1.569 10 70 DDIERN NC(=O)c1ccc(C(=O)N2CC[C@H](Oc3cccnc3)C2)cc1 ZINC000161504927 527038458 /nfs/dbraw/zinc/03/84/58/527038458.db2.gz MTPWWIWOYUEUEX-HNNXBMFYSA-N 0 0 311.341 1.474 10 70 DDIERN CN(C)C(=O)CN(C)C[C@@H]1CC(c2ccc(Cl)cc2)=NO1 ZINC000159730709 186137820 /nfs/dbraw/zinc/13/78/20/186137820.db2.gz YGCFMRDXOFEEJV-ZDUSSCGKSA-N 0 0 309.797 1.853 10 70 DDIERN COCC(=O)N1CCN(C(=O)[C@H]2C[C@@H]2C2CCCCC2)CC1 ZINC000160826119 408527107 /nfs/dbraw/zinc/52/71/07/408527107.db2.gz MUFQGIAXDNLUHY-CABCVRRESA-N 0 0 308.422 1.520 10 70 DDIERN CCCCCCNC(=O)CN1CCOC[C@@H]1c1nc(C)no1 ZINC000161182512 408569034 /nfs/dbraw/zinc/56/90/34/408569034.db2.gz BYCFOVZDLWOJBQ-CYBMUJFWSA-N 0 0 310.398 1.448 10 70 DDIERN CCC[C@@H](NC(=O)c1ccc2nncn2c1)C(=O)OC(C)(C)C ZINC000161474302 408604940 /nfs/dbraw/zinc/60/49/40/408604940.db2.gz HQHQRDMGICFUCG-GFCCVEGCSA-N 0 0 318.377 1.970 10 70 DDIERN O=C(Nc1nncs1)[C@@H]1CCC[C@@H]1C(=O)Nc1nncs1 ZINC000159591029 186129839 /nfs/dbraw/zinc/12/98/39/186129839.db2.gz BVWRGSFUFIQVOJ-KNVOCYPGSA-N 0 0 324.391 1.383 10 70 DDIERN Cc1cc(C)n(C[C@@H]2CN(C(=O)C[C@@H](O)C(C)C)CCO2)n1 ZINC000159662968 186134211 /nfs/dbraw/zinc/13/42/11/186134211.db2.gz WLLXWKCWNRFKMZ-LSDHHAIUSA-N 0 0 309.410 1.134 10 70 DDIERN CCOc1cccc(CCNC(=O)N2CCC[C@H]2C(=O)NC)c1 ZINC000160119552 197386966 /nfs/dbraw/zinc/38/69/66/197386966.db2.gz OPVYTNIKFCKULJ-HNNXBMFYSA-N 0 0 319.405 1.548 10 70 DDIERN CC(C)[C@H](O)CC(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1 ZINC000160653513 408506919 /nfs/dbraw/zinc/50/69/19/408506919.db2.gz FXUWBCNRTIQMLY-GXTWGEPZSA-N 0 0 318.373 1.237 10 70 DDIERN Cc1c(NC(=O)C(=O)N[C@H]2C[C@@H]2C)cnn1-c1ccccc1F ZINC000161000525 408549192 /nfs/dbraw/zinc/54/91/92/408549192.db2.gz PUMMEDTXSILBJK-CABZTGNLSA-N 0 0 316.336 1.783 10 70 DDIERN Cc1noc([C@@H]2COCCN2C[C@H](O)c2ccccc2F)n1 ZINC000161144221 408564105 /nfs/dbraw/zinc/56/41/05/408564105.db2.gz UMIPCPLOZHWRSO-KBPBESRZSA-N 0 0 307.325 1.624 10 70 DDIERN COC(=O)c1ccc(CN2CCOC[C@@H]2c2nc(C)no2)s1 ZINC000161207494 408570342 /nfs/dbraw/zinc/57/03/42/408570342.db2.gz DUJAXVWCXSQYAM-LLVKDONJSA-N 0 0 323.374 1.800 10 70 DDIERN CCC(C)(C)NC(=O)CS(=O)(=O)Cc1nccn1C(C)C ZINC000161220597 408574590 /nfs/dbraw/zinc/57/45/90/408574590.db2.gz IGLLIKRNNDURTI-UHFFFAOYSA-N 0 0 315.439 1.684 10 70 DDIERN O=C(N[C@@H]1CCc2ncnn2C1)N(Cc1ccccc1)C1CC1 ZINC000161224015 408575567 /nfs/dbraw/zinc/57/55/67/408575567.db2.gz HFSFBKKHBPQNDD-CQSZACIVSA-N 0 0 311.389 1.967 10 70 DDIERN CCC[C@@H](C(=O)N1CCN(Cc2ccccn2)CC1)[NH+](C)C ZINC000161340949 408589344 /nfs/dbraw/zinc/58/93/44/408589344.db2.gz LZDQVSWYFNYSKO-INIZCTEOSA-N 0 0 304.438 1.456 10 70 DDIERN CC(C)CC(=O)N[C@H](C(=O)N[C@@H](CO)CC(C)C)C(C)C ZINC000160871086 290777743 /nfs/dbraw/zinc/77/77/43/290777743.db2.gz XMNMLJOFUUTFCD-HIFRSBDPSA-N 0 0 300.443 1.697 10 70 DDIERN COC[C@H](C)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O ZINC000161222110 197476249 /nfs/dbraw/zinc/47/62/49/197476249.db2.gz DXAKOQXEEGMNGD-NWDGAFQWSA-N 0 0 306.362 1.199 10 70 DDIERN COc1cc(CNC(=O)N2CC[C@]3(O)CCCC[C@@H]3C2)ccn1 ZINC000159410636 286221390 /nfs/dbraw/zinc/22/13/90/286221390.db2.gz NPYYLLVKCLYJGN-RHSMWYFYSA-N 0 0 319.405 1.927 10 70 DDIERN Cc1noc([C@H]2COCCN2CCNC(=O)OC(C)(C)C)n1 ZINC000161021090 408552568 /nfs/dbraw/zinc/55/25/68/408552568.db2.gz ILEWORMODDUJOA-LLVKDONJSA-N 0 0 312.370 1.276 10 70 DDIERN CC(C)[C@@H](O)CC(=O)Nc1cccc(N2CCCNC2=O)c1 ZINC000161207138 408570656 /nfs/dbraw/zinc/57/06/56/408570656.db2.gz TWNAKPGGIKUFTH-AWEZNQCLSA-N 0 0 305.378 1.952 10 70 DDIERN CNC(=O)COc1cccc(CC(=O)N[C@@H](C)[C@H]2CCCO2)c1 ZINC000161446523 408602375 /nfs/dbraw/zinc/60/23/75/408602375.db2.gz OXTGVIJCGCNZPG-SWLSCSKDSA-N 0 0 320.389 1.038 10 70 DDIERN C[C@@H]1CC[C@H](C(=O)NCCCNC(=O)c2cccc(O)c2)O1 ZINC000159693787 524633642 /nfs/dbraw/zinc/63/36/42/524633642.db2.gz DWJXWWHZFDBCNR-BXUZGUMPSA-N 0 0 306.362 1.196 10 70 DDIERN CCC[C@@H](NC(=O)c1ccc(=O)n(C)c1)C(=O)OC(C)(C)C ZINC000161309407 197483709 /nfs/dbraw/zinc/48/37/09/197483709.db2.gz FWEUVZBKERJCIZ-GFCCVEGCSA-N 0 0 308.378 1.626 10 70 DDIERN COCCN1CCN(C(=O)NCCc2cscn2)C[C@@H]1C ZINC000159384682 408404815 /nfs/dbraw/zinc/40/48/15/408404815.db2.gz OYSBTMUMUHUWQW-LBPRGKRZSA-N 0 0 312.439 1.048 10 70 DDIERN C[C@@H]1CC[C@@H](NC(=O)c2[nH]c(=O)[nH]c(=O)c2N)c2ccccc21 ZINC000159448886 408407827 /nfs/dbraw/zinc/40/78/27/408407827.db2.gz AYFVUXSIZRGHND-LDYMZIIASA-N 0 0 314.345 1.014 10 70 DDIERN CC(C)OC(=O)CCCNC(=O)N1CC[C@H](c2cnn(C)c2)C1 ZINC000160224722 408465826 /nfs/dbraw/zinc/46/58/26/408465826.db2.gz BEUPROVABOGQPN-ZDUSSCGKSA-N 0 0 322.409 1.651 10 70 DDIERN NC(=O)C1(CNC(=O)[C@@H]2C[C@@H]2C2CCCCC2)CCOCC1 ZINC000160302280 295031945 /nfs/dbraw/zinc/03/19/45/295031945.db2.gz JCXVSHNXOUPROQ-ZIAGYGMSSA-N 0 0 308.422 1.601 10 70 DDIERN CCc1nc2n(n1)CCC[C@@H]2NC(=O)NC1C[C@@H](C)O[C@H](C)C1 ZINC000159889222 290764319 /nfs/dbraw/zinc/76/43/19/290764319.db2.gz 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/nfs/dbraw/zinc/48/15/48/197481548.db2.gz RVXMCEFDIKTCOR-CYBMUJFWSA-N 0 0 315.377 1.313 10 70 DDIERN CCS(=O)(=O)CCN(C)C(=O)N[C@H](C)c1ccc(C)o1 ZINC000160082540 197384714 /nfs/dbraw/zinc/38/47/14/197384714.db2.gz GANJBRCPKPZOMN-LLVKDONJSA-N 0 0 302.396 1.725 10 70 DDIERN CCc1cc(=O)n2nc(N[C@@H]3CCCC[C@@H]3C(N)=O)sc2n1 ZINC000159606904 408419850 /nfs/dbraw/zinc/41/98/50/408419850.db2.gz SCFKWZYIBFTRFI-VHSXEESVSA-N 0 0 321.406 1.169 10 70 DDIERN Cn1cnc2cc(C(=O)N(C[C@@H]3CCOC3)C3CC3)cnc21 ZINC000159738453 408431031 /nfs/dbraw/zinc/43/10/31/408431031.db2.gz LZLWHVMETLYIFJ-NSHDSACASA-N 0 0 300.362 1.609 10 70 DDIERN COC(=O)c1csc(NC(=O)N[C@@H]2CCCn3ncnc32)c1 ZINC000161145687 408563106 /nfs/dbraw/zinc/56/31/06/408563106.db2.gz ZEMMXQOOCWACAR-SECBINFHSA-N 0 0 321.362 1.783 10 70 DDIERN CC(C)[C@H](O)CC(=O)NCCCC(=O)N1CCc2ccccc21 ZINC000159753428 186140043 /nfs/dbraw/zinc/14/00/43/186140043.db2.gz SFMQMCDILQNOKM-MRXNPFEDSA-N 0 0 318.417 1.879 10 70 DDIERN O=C(CCCNC(=O)c1cccnc1)NC[C@@H]1CCCC[C@@H]1O ZINC000159955785 197375855 /nfs/dbraw/zinc/37/58/55/197375855.db2.gz GQVQSIIGRXYIHO-ZFWWWQNUSA-N 0 0 319.405 1.259 10 70 DDIERN Cc1noc([C@@H]2COCCN2CC(=O)NCCC(C)(C)C)n1 ZINC000160866453 408532041 /nfs/dbraw/zinc/53/20/41/408532041.db2.gz QFSOLWIGRBRBCR-LBPRGKRZSA-N 0 0 310.398 1.304 10 70 DDIERN O=C(Nc1ccc(-n2cccn2)cc1)N[C@@H]1CCc2ncnn2C1 ZINC000160982162 197454833 /nfs/dbraw/zinc/45/48/33/197454833.db2.gz NDJCOKJMESIXLB-CYBMUJFWSA-N 0 0 323.360 1.600 10 70 DDIERN CC(C)N1CC[C@@H](NC(=O)N2CCC(c3cc[nH]n3)CC2)C1=O ZINC000160027778 408452036 /nfs/dbraw/zinc/45/20/36/408452036.db2.gz GMRYBWSKRXMTIQ-CQSZACIVSA-N 0 0 319.409 1.308 10 70 DDIERN Cc1conc1NC(=O)C(=O)N1CCC[C@H]1c1cnn(C)c1 ZINC000161024929 408552808 /nfs/dbraw/zinc/55/28/08/408552808.db2.gz DMVDGSCETFQOBF-NSHDSACASA-N 0 0 303.322 1.019 10 70 DDIERN CC(C)[N@@H+]1C[C@@H](C)[C@@H](NC(=O)[C@H](C)NC(=O)OC(C)(C)C)C1 ZINC000161348343 408591146 /nfs/dbraw/zinc/59/11/46/408591146.db2.gz KFNKSOJCYDCFRQ-AGIUHOORSA-N 0 0 313.442 1.745 10 70 DDIERN Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NC[C@@H](C)N1CCOCC1 ZINC000161274092 302309538 /nfs/dbraw/zinc/30/95/38/302309538.db2.gz KUTWGMVLACVBHE-MCIONIFRSA-N 0 0 308.447 1.997 10 70 DDIERN Cc1nc2cc(NC(=O)N[C@@H]3CCc4ncnn4C3)ccc2o1 ZINC000161048245 408554060 /nfs/dbraw/zinc/55/40/60/408554060.db2.gz DMANTTQUKPQDFT-LLVKDONJSA-N 0 0 312.333 1.864 10 70 DDIERN COc1ccc(CN2CCOC[C@@H]2c2nc(C)no2)cc1OC ZINC000161057000 408554255 /nfs/dbraw/zinc/55/42/55/408554255.db2.gz IJCIIXJFJFDFEZ-CYBMUJFWSA-N 0 0 319.361 1.969 10 70 DDIERN O=C(c1ccc2n[nH]nc2c1)N1CC[C@H](Oc2cccnc2)C1 ZINC000161390671 408597208 /nfs/dbraw/zinc/59/72/08/408597208.db2.gz YCIMMUVNPYEOCI-ZDUSSCGKSA-N 0 0 309.329 1.646 10 70 DDIERN CC(C)c1nc2n(n1)C[C@@H](NC(=O)N1CCC(CO)CC1)CC2 ZINC000161390687 408597706 /nfs/dbraw/zinc/59/77/06/408597706.db2.gz DHLXMSLQEHGOPE-ZDUSSCGKSA-N 0 0 321.425 1.130 10 70 DDIERN CC(C)[C@@H](O)CC(=O)NCC(=O)OCc1ccccc1Cl ZINC000160081592 197384647 /nfs/dbraw/zinc/38/46/47/197384647.db2.gz WPERIWXFBUDKES-ZDUSSCGKSA-N 0 0 313.781 1.906 10 70 DDIERN Cn1cnc2cc(C(=O)N[C@@H]3CC(=O)N(C(C)(C)C)C3)cnc21 ZINC000160685779 408513572 /nfs/dbraw/zinc/51/35/72/408513572.db2.gz JFPUHYSNLLHLHO-LLVKDONJSA-N 0 0 315.377 1.098 10 70 DDIERN CCCS(=O)(=O)N1CCC[C@@H]1C(=O)Nc1cccc(F)n1 ZINC000160758221 408519530 /nfs/dbraw/zinc/51/95/30/408519530.db2.gz BLXLQOQQDADORT-SNVBAGLBSA-N 0 0 315.370 1.363 10 70 DDIERN COCCC1(CNC(=O)N2CCO[C@@H](c3nnc(C)[nH]3)C2)CC1 ZINC000161165683 408565638 /nfs/dbraw/zinc/56/56/38/408565638.db2.gz BEMGYIBYNXDYBP-GFCCVEGCSA-N 0 0 323.397 1.013 10 70 DDIERN CCCCNC(=O)[C@H](C)N1CCC[C@H](c2nncn2CC)C1 ZINC000161282185 408581611 /nfs/dbraw/zinc/58/16/11/408581611.db2.gz WWUDAEKOJPONRY-KBPBESRZSA-N 0 0 307.442 1.782 10 70 DDIERN CC[C@@H](C(=O)N1CC[C@H](Oc2cccnc2)C1)N1CCCC1=O ZINC000161359328 408595490 /nfs/dbraw/zinc/59/54/90/408595490.db2.gz ZNKLEFDANHECCB-GJZGRUSLSA-N 0 0 317.389 1.462 10 70 DDIERN CC(C)[C@H](NC(=O)Nc1cccc(-c2ncn(C)n2)c1)C(N)=O ZINC000161467415 408604772 /nfs/dbraw/zinc/60/47/72/408604772.db2.gz IFQSCXATHQTTRY-LBPRGKRZSA-N 0 0 316.365 1.114 10 70 DDIERN CC(C)(C)CN(CCCO)C(=O)N[C@H]1CCc2ncnn2C1 ZINC000161198873 518661218 /nfs/dbraw/zinc/66/12/18/518661218.db2.gz YWJIFASYEHIYRW-LBPRGKRZSA-N 0 0 309.414 1.033 10 70 DDIERN CC(C)[C@H](O)CC(=O)NCCNC(=O)c1c(F)cccc1F ZINC000159881853 197370659 /nfs/dbraw/zinc/37/06/59/197370659.db2.gz VFKWYYLLSSIVQL-GFCCVEGCSA-N 0 0 314.332 1.218 10 70 DDIERN CN(C)c1nc(CN2CCCN(c3cccnn3)CC2)ns1 ZINC000159879951 408440627 /nfs/dbraw/zinc/44/06/27/408440627.db2.gz QCXFIDHGOKFSQR-UHFFFAOYSA-N 0 0 319.438 1.106 10 70 DDIERN CN(C(=O)CN1CC[C@@]2(O)CCCC[C@@H]2C1)c1nccs1 ZINC000160508444 408490100 /nfs/dbraw/zinc/49/01/00/408490100.db2.gz BCYHNPSLCWSRPR-DOMZBBRYSA-N 0 0 309.435 1.733 10 70 DDIERN CCn1cnnc1[C@@H]1CCCN(CC(=O)Nc2cc(C)no2)C1 ZINC000161287723 408581986 /nfs/dbraw/zinc/58/19/86/408581986.db2.gz FWCLNHOKGMMLJZ-GFCCVEGCSA-N 0 0 318.381 1.413 10 70 DDIERN Cc1cc(NC(=O)N[C@H]2CCc3ncnn3C2)ccc1N(C)C ZINC000160930737 408540252 /nfs/dbraw/zinc/54/02/52/408540252.db2.gz IKEVHTYUUJCVDY-ZDUSSCGKSA-N 0 0 314.393 1.789 10 70 DDIERN COc1ccc(NC(=O)N[C@@H]2CCc3ncnn3C2)cc1F ZINC000160941756 408542418 /nfs/dbraw/zinc/54/24/18/408542418.db2.gz CLIDHEPLRHMRAK-SNVBAGLBSA-N 0 0 305.313 1.562 10 70 DDIERN COC(=O)N[C@@H](C(=O)N[C@H]1CCOC2(CCCC2)C1)C(C)C ZINC000160130182 523457594 /nfs/dbraw/zinc/45/75/94/523457594.db2.gz CTGKCGXZANLJBY-QWHCGFSZSA-N 0 0 312.410 1.975 10 70 DDIERN CN(C)c1ccc(NC(=O)N[C@@H]2CCc3ncnn3C2)cc1 ZINC000161348799 197487780 /nfs/dbraw/zinc/48/77/80/197487780.db2.gz SFWYXQHCXXTGEU-GFCCVEGCSA-N 0 0 300.366 1.481 10 70 DDIERN CC(C)[C@@H](C)NC(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1 ZINC000160831419 408528609 /nfs/dbraw/zinc/52/86/09/408528609.db2.gz HRVJKZYXOUFJQK-MNOVXSKESA-N 0 0 314.411 1.409 10 70 DDIERN CCCC(O)(CCC)CNC(=O)N[C@@H]1CCc2ncnn2C1 ZINC000161192578 408570876 /nfs/dbraw/zinc/57/08/76/408570876.db2.gz KLGCANAHCHXVAO-GFCCVEGCSA-N 0 0 309.414 1.223 10 70 DDIERN CCn1cnnc1[C@@H]1CCCN(Cc2cn3cccnc3n2)C1 ZINC000161285665 408580694 /nfs/dbraw/zinc/58/06/94/408580694.db2.gz RVCZNRLBRLFVCL-CYBMUJFWSA-N 0 0 311.393 1.720 10 70 DDIERN O=C(Nc1ccc(F)c(F)c1F)N[C@H]1CCc2ncnn2C1 ZINC000161292628 408583274 /nfs/dbraw/zinc/58/32/74/408583274.db2.gz WLUMUYMKGMIYLP-ZETCQYMHSA-N 0 0 311.267 1.832 10 70 DDIERN CCCCc1nnc(NC(=O)N[C@@H]2CCc3ncnn3C2)s1 ZINC000161322946 408586932 /nfs/dbraw/zinc/58/69/32/408586932.db2.gz UJVSCXYKFCLYSF-SECBINFHSA-N 0 0 321.410 1.609 10 70 DDIERN Cc1ccc(N2CC[C@@H](NC(=O)C[C@H](O)C(C)C)C2=O)cc1 ZINC000160870972 408532352 /nfs/dbraw/zinc/53/23/52/408532352.db2.gz ZJMPSURNUGZBKW-CABCVRRESA-N 0 0 304.390 1.624 10 70 DDIERN CCN(CCc1ccccc1)C(=O)N[C@@H]1CCc2ncnn2C1 ZINC000161169865 197471690 /nfs/dbraw/zinc/47/16/90/197471690.db2.gz AUTBFWDAFODBGU-OAHLLOKOSA-N 0 0 313.405 1.867 10 70 DDIERN Cn1c2cccc(C(=O)N3CCO[C@H]4CCCC[C@H]43)c2oc1=O ZINC000160122801 197387152 /nfs/dbraw/zinc/38/71/52/197387152.db2.gz OCENTIWGVORJSO-OCCSQVGLSA-N 0 0 316.357 1.915 10 70 DDIERN CC(C)c1nc2n(n1)C[C@H](NS(=O)(=O)c1cccnc1)CC2 ZINC000159394860 408406032 /nfs/dbraw/zinc/40/60/32/408406032.db2.gz KHWLRRBLWFSMTF-LLVKDONJSA-N 0 0 321.406 1.090 10 70 DDIERN Cc1cc(Oc2ccc(NC(=O)[C@H]3CNC(=O)C3)cc2)n[nH]1 ZINC000160413726 408482265 /nfs/dbraw/zinc/48/22/65/408482265.db2.gz JLCFLKQFYTWNHK-SNVBAGLBSA-N 0 0 300.318 1.585 10 70 DDIERN CC(C)[C@H](C)NC(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1 ZINC000160831285 408529779 /nfs/dbraw/zinc/52/97/79/408529779.db2.gz HRVJKZYXOUFJQK-WDEREUQCSA-N 0 0 314.411 1.409 10 70 DDIERN CCc1noc([C@@H](C)N2CCN(C(=O)C[C@@H](O)C(C)C)CC2)n1 ZINC000159770625 290762643 /nfs/dbraw/zinc/76/26/43/290762643.db2.gz CWVCGZVJZLMRBK-CHWSQXEVSA-N 0 0 324.425 1.244 10 70 DDIERN CCCC1(CNC(=O)[C@@H]2CCCN2S(=O)(=O)CCC)CC1 ZINC000160583644 290774060 /nfs/dbraw/zinc/77/40/60/290774060.db2.gz MVYLQSGLUYKOBP-ZDUSSCGKSA-N 0 0 316.467 1.887 10 70 DDIERN CCCC[C@@H](NC(=O)Cc1ccn(C)n1)C(=O)OC(C)(C)C ZINC000161264349 354242834 /nfs/dbraw/zinc/24/28/34/354242834.db2.gz FGPGNOGQKWDSPB-CYBMUJFWSA-N 0 0 309.410 1.979 10 70 DDIERN COCCN(Cc1ccco1)C(=O)N[C@H]1CCc2ncnn2C1 ZINC000161328654 408590561 /nfs/dbraw/zinc/59/05/61/408590561.db2.gz NFKRHOMBNXLLFF-LBPRGKRZSA-N 0 0 319.365 1.044 10 70 DDIERN CC(C)C(=O)NCCCNc1cc(N2CCC[C@H]2CO)ncn1 ZINC000161436630 408603280 /nfs/dbraw/zinc/60/32/80/408603280.db2.gz PMXRNXXLPGNWEF-ZDUSSCGKSA-N 0 0 321.425 1.012 10 70 DDIERN C[C@H](NC(=O)CCCNC(=O)c1cccnc1)[C@H]1CCCO1 ZINC000161450801 197495169 /nfs/dbraw/zinc/49/51/69/197495169.db2.gz HBFWBDJJNUHAFU-GXTWGEPZSA-N 0 0 305.378 1.275 10 70 DDIERN CCc1nnc(CN[C@@H](C)c2ccc(S(C)(=O)=O)cc2)[nH]1 ZINC000160284441 197397662 /nfs/dbraw/zinc/39/76/62/197397662.db2.gz XSQSKMQILZAIQB-JTQLQIEISA-N 0 0 308.407 1.621 10 70 DDIERN CC(C)CN1CCC[C@@H]1CNC(=O)CS(=O)(=O)C(C)(C)C ZINC000160062994 408455359 /nfs/dbraw/zinc/45/53/59/408455359.db2.gz HGZIRZDQZUJYBB-CYBMUJFWSA-N 0 0 318.483 1.436 10 70 DDIERN C[C@H](NC(=O)N(C)CCC(=O)OC(C)(C)C)[C@@H]1CCCO1 ZINC000160741435 408520191 /nfs/dbraw/zinc/52/01/91/408520191.db2.gz CRSFIPYQNDPJEC-RYUDHWBXSA-N 0 0 300.399 1.927 10 70 DDIERN C[C@H](CNC(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F)N1CCOCC1 ZINC000160208555 408463424 /nfs/dbraw/zinc/46/34/24/408463424.db2.gz WSTNRDWRQWVCMG-UXIGCNINSA-N 0 0 324.371 1.905 10 70 DDIERN Cc1cnn(CCNC(=O)[C@@H](C)Oc2cccc(CO)c2)c1 ZINC000161149191 408566403 /nfs/dbraw/zinc/56/64/03/408566403.db2.gz FBNJMZGHSBDXCY-CYBMUJFWSA-N 0 0 303.362 1.268 10 70 DDIERN CC(C)Cc1nnc(NC(=O)N[C@@H]2CCc3ncnn3C2)s1 ZINC000161266108 197479951 /nfs/dbraw/zinc/47/99/51/197479951.db2.gz WEYXAEOEMPTABR-SECBINFHSA-N 0 0 321.410 1.465 10 70 DDIERN CCc1nnc(CN2C[C@@H](O)C[C@@H]2c2cc(F)ccc2F)[nH]1 ZINC000159466787 197355747 /nfs/dbraw/zinc/35/57/47/197355747.db2.gz VVEGUZNKLAGTOS-GXFFZTMASA-N 0 0 308.332 1.953 10 70 DDIERN COCC(=O)N(C)CC(=O)N[C@H](C)c1ccc(F)c(Cl)c1 ZINC000159423495 197352108 /nfs/dbraw/zinc/35/21/08/197352108.db2.gz DOJZMOSPRKSCBW-SECBINFHSA-N 0 0 316.760 1.761 10 70 DDIERN C[C@H]1CC[C@@H](NC(=O)c2[nH]c(=O)[nH]c(=O)c2N)c2ccccc21 ZINC000159449032 408408048 /nfs/dbraw/zinc/40/80/48/408408048.db2.gz AYFVUXSIZRGHND-GZMMTYOYSA-N 0 0 314.345 1.014 10 70 DDIERN CC(C)[C@H](O)CC(=O)N(C)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000159839798 408438985 /nfs/dbraw/zinc/43/89/85/408438985.db2.gz MLUBIMJRPXZMSZ-HUUCEWRRSA-N 0 0 322.380 1.796 10 70 DDIERN CCCCCCNC(=O)CN1CCOC[C@H]1c1nc(C)no1 ZINC000161182636 408569923 /nfs/dbraw/zinc/56/99/23/408569923.db2.gz BYCFOVZDLWOJBQ-ZDUSSCGKSA-N 0 0 310.398 1.448 10 70 DDIERN CCOC(=O)C[C@H](C)NC(=O)[C@H](NC(=O)CC(C)C)C(C)C ZINC000160871367 408533536 /nfs/dbraw/zinc/53/35/36/408533536.db2.gz UROHFVNPDWDZHZ-SWLSCSKDSA-N 0 0 314.426 1.631 10 70 DDIERN NC(=O)C1(CNC(=O)[C@@H]2C[C@H]2C2CCCCC2)CCOCC1 ZINC000160302171 526847412 /nfs/dbraw/zinc/84/74/12/526847412.db2.gz JCXVSHNXOUPROQ-UONOGXRCSA-N 0 0 308.422 1.601 10 70 DDIERN C[C@@H]1CC[C@H](C(=O)Nc2cccnc2N2CCC(CO)CC2)O1 ZINC000159761014 290762263 /nfs/dbraw/zinc/76/22/63/290762263.db2.gz KMTQQEWQAUOADR-IUODEOHRSA-N 0 0 319.405 1.796 10 70 DDIERN Cc1cnn(C[C@@H]2CN(Cc3cnc4ccccn34)CCO2)c1 ZINC000160096122 408455630 /nfs/dbraw/zinc/45/56/30/408455630.db2.gz RXTSYYZRODEMPE-INIZCTEOSA-N 0 0 311.389 1.740 10 70 DDIERN CCCCNC(=O)[C@@H](C)N1CCC[C@H](c2nncn2CC)C1 ZINC000161282079 408581665 /nfs/dbraw/zinc/58/16/65/408581665.db2.gz WWUDAEKOJPONRY-KGLIPLIRSA-N 0 0 307.442 1.782 10 70 DDIERN COCCOc1cccc(CC(=O)N[C@@H](C)[C@H]2CCCO2)c1 ZINC000161447101 408602480 /nfs/dbraw/zinc/60/24/80/408602480.db2.gz ZUGAFSUZSJFOGQ-XJKSGUPXSA-N 0 0 307.390 1.938 10 70 DDIERN CCCn1c(C)nnc1CN1C[C@H](C)[C@H](N2CCOCC2)C1 ZINC000160893513 408538426 /nfs/dbraw/zinc/53/84/26/408538426.db2.gz JPQICPDHGPKVHD-DZGCQCFKSA-N 0 0 307.442 1.149 10 70 DDIERN CC[C@H](C(=O)N1CC[C@H](Oc2cccnc2)C1)N1CCCC1=O ZINC000161359438 523767003 /nfs/dbraw/zinc/76/70/03/523767003.db2.gz ZNKLEFDANHECCB-LSDHHAIUSA-N 0 0 317.389 1.462 10 70 DDIERN C[C@@H](NC(=O)N[C@@H](C)c1nnc2n1CCCC2)[C@@H]1CCCO1 ZINC000159792804 525225922 /nfs/dbraw/zinc/22/59/22/525225922.db2.gz YZPAKJMPGZWVLR-WOPDTQHZSA-N 0 0 307.398 1.542 10 70 DDIERN Cc1noc([C@H]2COCCN2Cc2noc(C(C)(C)C)n2)n1 ZINC000160993524 526673696 /nfs/dbraw/zinc/67/36/96/526673696.db2.gz NSPIVVZCVYAYLD-SNVBAGLBSA-N 0 0 307.354 1.632 10 70 DDIERN Cc1nc(CN(C)C(=O)N[C@@H]2CCc3ncnn3C2)cs1 ZINC000161317169 197484405 /nfs/dbraw/zinc/48/44/05/197484405.db2.gz UADJKTDFPTWFNH-SNVBAGLBSA-N 0 0 306.395 1.199 10 70 DDIERN Fc1cc(F)c2nccc(NC[C@H]3CN4CCN3CC4)c2c1 ZINC000160048190 197382076 /nfs/dbraw/zinc/38/20/76/197382076.db2.gz GCNZEXRGPIRACW-LBPRGKRZSA-N 0 0 304.344 1.925 10 70 DDIERN CC(C)C[C@@H](CO)NC(=O)[C@H](C)NC(=O)Nc1ccccc1 ZINC000160834534 408529128 /nfs/dbraw/zinc/52/91/28/408529128.db2.gz KRCKSUCQUZLHQE-JSGCOSHPSA-N 0 0 307.394 1.720 10 70 DDIERN COCc1ccccc1NC(=O)N[C@@H]1CCc2ncnn2C1 ZINC000161040556 408553710 /nfs/dbraw/zinc/55/37/10/408553710.db2.gz WLIFMYCEUGQNEB-GFCCVEGCSA-N 0 0 301.350 1.561 10 70 DDIERN Cc1nc2cc(NC(=O)N[C@H]3CCc4ncnn4C3)ccc2o1 ZINC000161048371 408555212 /nfs/dbraw/zinc/55/52/12/408555212.db2.gz DMANTTQUKPQDFT-NSHDSACASA-N 0 0 312.333 1.864 10 70 DDIERN CCn1cnnc1[C@H]1CCCN(Cc2nnnn2C(C)C)C1 ZINC000161357043 408592656 /nfs/dbraw/zinc/59/26/56/408592656.db2.gz QWUXMLRPPLVPME-LBPRGKRZSA-N 0 0 304.402 1.245 10 70 DDIERN Cc1noc([C@H]2COCCN2CCN(C)c2ccccc2)n1 ZINC000161153251 526672710 /nfs/dbraw/zinc/67/27/10/526672710.db2.gz DHLDOBXKTGPUML-OAHLLOKOSA-N 0 0 302.378 1.888 10 70 DDIERN COCC(=O)N1CCN(C(=O)[C@H]2C[C@H]2C2CCCCC2)CC1 ZINC000160826387 408526277 /nfs/dbraw/zinc/52/62/77/408526277.db2.gz MUFQGIAXDNLUHY-GJZGRUSLSA-N 0 0 308.422 1.520 10 70 DDIERN Cc1noc([C@@H]2COCCN2Cc2nc3ccccc3n2C)n1 ZINC000161019744 408549610 /nfs/dbraw/zinc/54/96/10/408549610.db2.gz IJYKPNSCVPDSKT-AWEZNQCLSA-N 0 0 313.361 1.838 10 70 DDIERN CC(C)c1nc2n(n1)C[C@@H](NC(=O)N1CCS[C@@H](C)C1)CC2 ZINC000161509047 408610767 /nfs/dbraw/zinc/61/07/67/408610767.db2.gz ZQIQKAUXVMMUKQ-RYUDHWBXSA-N 0 0 323.466 1.863 10 70 DDIERN Cc1noc([C@H]2COCCN2Cc2ncnn2CC(C)C)n1 ZINC000160826033 526674770 /nfs/dbraw/zinc/67/47/70/526674770.db2.gz YYCZQDNACWRUDS-GFCCVEGCSA-N 0 0 306.370 1.199 10 70 DDIERN CN(Cc1cccc(F)c1)C(=O)N[C@@H]1CCc2ncnn2C1 ZINC000160990873 197455528 /nfs/dbraw/zinc/45/55/28/197455528.db2.gz QETNEGALGOAPMH-CYBMUJFWSA-N 0 0 303.341 1.574 10 70 DDIERN CCc1cc(=O)n2nc(N[C@H]3CCCC[C@@H]3C(N)=O)sc2n1 ZINC000159607033 408418925 /nfs/dbraw/zinc/41/89/25/408418925.db2.gz SCFKWZYIBFTRFI-UWVGGRQHSA-N 0 0 321.406 1.169 10 70 DDIERN COC[C@@H](C)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O ZINC000161222500 408576570 /nfs/dbraw/zinc/57/65/70/408576570.db2.gz DXAKOQXEEGMNGD-NEPJUHHUSA-N 0 0 306.362 1.199 10 70 DDIERN O=C(NCCCNc1ccccc1)N[C@@H]1CCc2ncnn2C1 ZINC000161251443 408580028 /nfs/dbraw/zinc/58/00/28/408580028.db2.gz OHEUCFDQABLGQD-CQSZACIVSA-N 0 0 314.393 1.394 10 70 DDIERN Cc1conc1NC(=O)C(=O)N1CCC(c2ccnn2C)CC1 ZINC000161316113 408586533 /nfs/dbraw/zinc/58/65/33/408586533.db2.gz MTZJQVITMWFURP-UHFFFAOYSA-N 0 0 317.349 1.061 10 70 DDIERN COc1cc(C)cc(CNC(=O)N[C@H]2CCCn3ncnc32)c1 ZINC000159536951 186125856 /nfs/dbraw/zinc/12/58/56/186125856.db2.gz KUYJFHXATKGSJC-AWEZNQCLSA-N 0 0 315.377 1.929 10 70 DDIERN C[C@H](CNC(=O)c1c(F)cc(F)cc1F)N1CCOCC1 ZINC000160205325 197392721 /nfs/dbraw/zinc/39/27/21/197392721.db2.gz ILWDUIGHXOLCRA-SECBINFHSA-N 0 0 302.296 1.554 10 70 DDIERN Cc1cccc([C@@H](NC(=O)[C@H]2CNC(=O)C2)c2ccccn2)c1 ZINC000159760295 197362420 /nfs/dbraw/zinc/36/24/20/197362420.db2.gz WCZRDUPSCDEVEH-RHSMWYFYSA-N 0 0 309.369 1.732 10 70 DDIERN Cn1cc(C[N@@H+]2CCCN(Cc3cnc4ccccn34)CC2)cn1 ZINC000160053709 408452607 /nfs/dbraw/zinc/45/26/07/408452607.db2.gz OIKFTSIFXGLWIE-UHFFFAOYSA-N 0 0 324.432 1.776 10 70 DDIERN C[C@H]1CC[C@H](NC(=O)c2[nH]c(=O)[nH]c(=O)c2N)c2ccccc21 ZINC000159448733 408407916 /nfs/dbraw/zinc/40/79/16/408407916.db2.gz AYFVUXSIZRGHND-KWQFWETISA-N 0 0 314.345 1.014 10 70 DDIERN Cc1cc(Oc2ccc(NC(=O)[C@@H]3CNC(=O)C3)cc2)n[nH]1 ZINC000160413857 408482855 /nfs/dbraw/zinc/48/28/55/408482855.db2.gz JLCFLKQFYTWNHK-JTQLQIEISA-N 0 0 300.318 1.585 10 70 DDIERN Cc1noc([C@@H]2COCCN2Cc2cn3c(cccc3C)n2)n1 ZINC000161000854 408548957 /nfs/dbraw/zinc/54/89/57/408548957.db2.gz FVWXYJHKUUXODP-AWEZNQCLSA-N 0 0 313.361 1.908 10 70 DDIERN O=C(Nc1ccccc1)C(=O)N1CC[C@H](Oc2cccnc2)C1 ZINC000161015495 408549910 /nfs/dbraw/zinc/54/99/10/408549910.db2.gz FEGCTJKQYGYGAK-HNNXBMFYSA-N 0 0 311.341 1.700 10 70 DDIERN COC(=O)c1[nH]c(C)c(C(=O)NCCn2cc(C)cn2)c1C ZINC000161068969 408556406 /nfs/dbraw/zinc/55/64/06/408556406.db2.gz MTCUXLMXIFRBGS-UHFFFAOYSA-N 0 0 304.350 1.353 10 70 DDIERN CCC[C@H](NC(=O)CN1CCCCC1=O)C(=O)OC(C)(C)C ZINC000161457319 408604708 /nfs/dbraw/zinc/60/47/08/408604708.db2.gz FLLMVYHJWBDJMF-LBPRGKRZSA-N 0 0 312.410 1.626 10 70 DDIERN CCCCCNC(=O)CN1CCC[C@@H](c2nncn2CC)C1 ZINC000161426922 520193971 /nfs/dbraw/zinc/19/39/71/520193971.db2.gz UICMZUGFQPGTRC-CQSZACIVSA-N 0 0 307.442 1.784 10 70 DDIERN CC(C)[C@H](C)NC(=O)c1cc(S(N)(=O)=O)cc(Cl)c1F ZINC000161261996 197479058 /nfs/dbraw/zinc/47/90/58/197479058.db2.gz QJKQLFDRWMMJSV-ZETCQYMHSA-N 0 0 322.789 1.901 10 70 DDIERN CN(C)c1nc(CN2CCC(Cc3nccn3C)CC2)ns1 ZINC000159967067 408449896 /nfs/dbraw/zinc/44/98/96/408449896.db2.gz BSBRXURMIRWVKR-UHFFFAOYSA-N 0 0 320.466 1.792 10 70 DDIERN C[C@H]1CC[C@H](C(=O)NCCCNC(=O)c2cccc(O)c2)O1 ZINC000159693932 408427207 /nfs/dbraw/zinc/42/72/07/408427207.db2.gz DWJXWWHZFDBCNR-SMDDNHRTSA-N 0 0 306.362 1.196 10 70 DDIERN C[C@H]1CC[C@H](C(=O)Nc2cccnc2N2CCC(CO)CC2)O1 ZINC000159761133 408433525 /nfs/dbraw/zinc/43/35/25/408433525.db2.gz KMTQQEWQAUOADR-SWLSCSKDSA-N 0 0 319.405 1.796 10 70 DDIERN CCOC(=O)c1ccc(CN2CCOC[C@H]2c2nc(C)no2)o1 ZINC000161076510 408557513 /nfs/dbraw/zinc/55/75/13/408557513.db2.gz KEZBRKPNEPWGMZ-LBPRGKRZSA-N 0 0 321.333 1.721 10 70 DDIERN CC(C)[C@H](O)CC(=O)NCCCN1C(=O)COc2ccccc21 ZINC000160888667 408534198 /nfs/dbraw/zinc/53/41/98/408534198.db2.gz XVXRAGLHTWQWOF-CQSZACIVSA-N 0 0 320.389 1.325 10 70 DDIERN CC(C)[C@H](O)CC(=O)NCCc1nc2ccc(F)cc2n1C ZINC000159571252 186127875 /nfs/dbraw/zinc/12/78/75/186127875.db2.gz OCPPGQCBVNUCQJ-CQSZACIVSA-N 0 0 307.369 1.778 10 70 DDIERN Cc1cc(C)n(C[C@H]2CN(C(=O)C[C@H](O)C(C)C)CCO2)n1 ZINC000159662829 186134168 /nfs/dbraw/zinc/13/41/68/186134168.db2.gz WLLXWKCWNRFKMZ-CABCVRRESA-N 0 0 309.410 1.134 10 70 DDIERN O=C(N[C@H]1CCc2ncnn2C1)NC1(c2ccccc2F)CC1 ZINC000161003103 408549197 /nfs/dbraw/zinc/54/91/97/408549197.db2.gz KEBMSHHMXCRHBK-NSHDSACASA-N 0 0 315.352 1.721 10 70 DDIERN CN(Cc1ccccc1F)C(=O)N[C@@H]1CCc2ncnn2C1 ZINC000161212012 408574089 /nfs/dbraw/zinc/57/40/89/408574089.db2.gz GYKHKFJVPPJTJX-GFCCVEGCSA-N 0 0 303.341 1.574 10 70 DDIERN CN(CCc1ccc(F)cc1)C(=O)N[C@H]1CCc2ncnn2C1 ZINC000161266986 408579571 /nfs/dbraw/zinc/57/95/71/408579571.db2.gz YGKVEHMFRSSGJD-AWEZNQCLSA-N 0 0 317.368 1.616 10 70 DDIERN COC[C@H](NC(=O)N[C@H]1CCc2nc(C(C)C)nn2C1)C1CC1 ZINC000160182874 290767533 /nfs/dbraw/zinc/76/75/33/290767533.db2.gz SOIYDHGEIUHOIN-STQMWFEESA-N 0 0 321.425 1.441 10 70 DDIERN O=C(Nc1nncs1)[C@@H]1CCC[C@H]1C(=O)Nc1nncs1 ZINC000159591308 186129416 /nfs/dbraw/zinc/12/94/16/186129416.db2.gz BVWRGSFUFIQVOJ-RNFRBKRXSA-N 0 0 324.391 1.383 10 70 DDIERN Cc1ccc(N2CC[C@H](NC(=O)C[C@H](O)C(C)C)C2=O)cc1 ZINC000160870818 197445822 /nfs/dbraw/zinc/44/58/22/197445822.db2.gz ZJMPSURNUGZBKW-GJZGRUSLSA-N 0 0 304.390 1.624 10 70 DDIERN C[C@@H](NC(=O)c1ccco1)C(=O)Nc1cc(Cl)c(=O)n(C)c1 ZINC000160438608 162150193 /nfs/dbraw/zinc/15/01/93/162150193.db2.gz SLSPBXZEIPDFSA-MRVPVSSYSA-N 0 0 323.736 1.389 10 70 DDIERN Cc1noc([C@H]2COCCN2Cc2cn3cc(C)ccc3n2)n1 ZINC000161093680 408558451 /nfs/dbraw/zinc/55/84/51/408558451.db2.gz OEEQTIGAUYYOOZ-CQSZACIVSA-N 0 0 313.361 1.908 10 70 DDIERN CC(C)CNC(=O)CS(=O)(=O)Cc1nccn1C(C)C ZINC000161211566 408574701 /nfs/dbraw/zinc/57/47/01/408574701.db2.gz GSIFXVXUQQDSDS-UHFFFAOYSA-N 0 0 301.412 1.151 10 70 DDIERN CCC[C@@H](NC(=O)c1ccn(C)c(=O)c1)C(=O)OC(C)(C)C ZINC000161314070 408587552 /nfs/dbraw/zinc/58/75/52/408587552.db2.gz CJYHOXPDSGCMAH-GFCCVEGCSA-N 0 0 308.378 1.626 10 70 DDIERN CC[C@@H](c1ccncc1)N(C)C(=O)N[C@H]1CCc2ncnn2C1 ZINC000161345635 408591467 /nfs/dbraw/zinc/59/14/67/408591467.db2.gz HHVKVUFDAABUNK-KBPBESRZSA-N 0 0 314.393 1.781 10 70 DDIERN CC(C)c1nc2n(n1)C[C@@H](NC(=O)N1CCOC(C)(C)C1)CC2 ZINC000161496616 408607909 /nfs/dbraw/zinc/60/79/09/408607909.db2.gz CJLZLWRAKHRXNF-LBPRGKRZSA-N 0 0 321.425 1.537 10 70 DDIERN COCCC1(CNC(=O)N2CCO[C@@H](Cn3cccn3)C2)CC1 ZINC000161039119 221712769 /nfs/dbraw/zinc/71/27/69/221712769.db2.gz KCTLFKWJWRWUNG-CQSZACIVSA-N 0 0 322.409 1.110 10 70 DDIERN COc1ccc(CN2CCOC[C@H]2c2nc(C)no2)cc1OC ZINC000161056857 524035821 /nfs/dbraw/zinc/03/58/21/524035821.db2.gz IJCIIXJFJFDFEZ-ZDUSSCGKSA-N 0 0 319.361 1.969 10 70 DDIERN COc1cc(C)cc(CNC(=O)N[C@@H]2CCCn3ncnc32)c1 ZINC000159536879 186125783 /nfs/dbraw/zinc/12/57/83/186125783.db2.gz KUYJFHXATKGSJC-CQSZACIVSA-N 0 0 315.377 1.929 10 70 DDIERN CCOc1cccc(NC(=O)N[C@@H]2CCc3ncnn3C2)c1 ZINC000161166823 197471401 /nfs/dbraw/zinc/47/14/01/197471401.db2.gz PSXVJXGGPCLTSL-GFCCVEGCSA-N 0 0 301.350 1.813 10 70 DDIERN CCS(=O)(=O)CCN(C)C(=O)N[C@H]1COc2ccccc21 ZINC000160775265 197438114 /nfs/dbraw/zinc/43/81/14/197438114.db2.gz QEFQBOWCFFGQTI-LBPRGKRZSA-N 0 0 312.391 1.196 10 70 DDIERN CNC(=O)[C@@H]1CCCN1C(=O)NCCc1ccc(Cl)nc1 ZINC000159893474 197372041 /nfs/dbraw/zinc/37/20/41/197372041.db2.gz JVWWGCOWNFCAEZ-NSHDSACASA-N 0 0 310.785 1.198 10 70 DDIERN C[C@H]1CN(CCN(C)Cc2ccc(F)cc2)CCS1(=O)=O ZINC000159758290 408433539 /nfs/dbraw/zinc/43/35/39/408433539.db2.gz XSSLVGQBTXQMAO-ZDUSSCGKSA-N 0 0 314.426 1.376 10 70 DDIERN Cc1cnc(CCN(C)C(=O)N[C@H]2CCc3ncnn3C2)s1 ZINC000161402040 408599618 /nfs/dbraw/zinc/59/96/18/408599618.db2.gz OEIQDHJJUBUISR-NSHDSACASA-N 0 0 320.422 1.242 10 70 DDIERN CCOCCN1CCN([C@H](C(=O)OC)c2cccnc2)C[C@@H]1C ZINC000159923648 354236191 /nfs/dbraw/zinc/23/61/91/354236191.db2.gz WGGNUNOSMGLCCL-HOCLYGCPSA-N 0 0 321.421 1.338 10 70 DDIERN CC(=O)Nc1ccc(NC(=O)N[C@@H]2CCc3ncnn3C2)cc1 ZINC000161185745 197472729 /nfs/dbraw/zinc/47/27/29/197472729.db2.gz GDKBNHWZBPINSR-CYBMUJFWSA-N 0 0 314.349 1.373 10 70 DDIERN CSCCCNC(=O)N[C@H]1CCc2nc(C(C)C)nn2C1 ZINC000160373335 162148420 /nfs/dbraw/zinc/14/84/20/162148420.db2.gz VVXLZJZTPMCCIO-NSHDSACASA-N 0 0 311.455 1.769 10 70 DDIERN CC(C)[C@@H](O)CC(=O)N[C@@H]1CCCN(c2ccccc2)C1=O ZINC000160141821 408456966 /nfs/dbraw/zinc/45/69/66/408456966.db2.gz SBBCRXHRQQFKRU-CABCVRRESA-N 0 0 304.390 1.705 10 70 DDIERN C[C@H](NC(=O)N1CCN2C(=O)NC[C@H]2C1)c1ccc(F)c(F)c1 ZINC000161386057 408596782 /nfs/dbraw/zinc/59/67/82/408596782.db2.gz MCPZZXJIQRDZPD-ONGXEEELSA-N 0 0 324.331 1.445 10 70 DDIERN CC(C)C(=O)NCCCNc1cc(N2CCC[C@@H]2CO)ncn1 ZINC000161436504 408602930 /nfs/dbraw/zinc/60/29/30/408602930.db2.gz PMXRNXXLPGNWEF-CYBMUJFWSA-N 0 0 321.425 1.012 10 70 DDIERN NC(=O)NCC(=O)NC[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000160549112 526931287 /nfs/dbraw/zinc/93/12/87/526931287.db2.gz FJRCEUYGQRKTAS-XVKPBYJWSA-N 0 0 316.188 1.881 10 70 DDIERN CNc1cc(N2CCC[C@H]2CNC(=O)[C@@H]2CCCCO2)ncn1 ZINC000159792752 197364231 /nfs/dbraw/zinc/36/42/31/197364231.db2.gz DYHPQZKPRKHQSE-STQMWFEESA-N 0 0 319.409 1.172 10 70 DDIERN CN1CC[C@H](Nc2nnc(Cc3ccc(F)cc3)s2)C1=O ZINC000159524633 408413232 /nfs/dbraw/zinc/41/32/32/408413232.db2.gz GSZBNQITZRCZQP-NSHDSACASA-N 0 0 306.366 1.911 10 70 DDIERN C[C@@H]1CN(C(=O)Nc2ccnn2C[C@@H]2CCOC2)C[C@@H](C)O1 ZINC000159601201 408418311 /nfs/dbraw/zinc/41/83/11/408418311.db2.gz LBBRISVRCHTTJD-UPJWGTAASA-N 0 0 308.382 1.561 10 70 DDIERN O=c1nc(CCCNc2ccnc3c(F)cc(F)cc23)[nH][nH]1 ZINC000159775980 408431984 /nfs/dbraw/zinc/43/19/84/408431984.db2.gz UAKJNHVWNGGPHC-UHFFFAOYSA-N 0 0 305.288 1.969 10 70 DDIERN C[C@@H](NC(=O)N1CCCN(CC(F)F)CC1)[C@@H]1CCCO1 ZINC000160456343 525165320 /nfs/dbraw/zinc/16/53/20/525165320.db2.gz RLJDOZJSLVBHBK-NEPJUHHUSA-N 0 0 305.369 1.536 10 70 DDIERN CCOC(=O)c1n[nH]c(CNC(=O)OCc2ccccc2)n1 ZINC000216636666 354312938 /nfs/dbraw/zinc/31/29/38/354312938.db2.gz UGNOVBQNSNPTOX-UHFFFAOYSA-N 0 0 304.306 1.408 10 70 DDIERN CCOc1cccc(CCNC(=O)N2CCC[C@@H]2C(=O)NC)c1 ZINC000160119431 197387270 /nfs/dbraw/zinc/38/72/70/197387270.db2.gz OPVYTNIKFCKULJ-OAHLLOKOSA-N 0 0 319.405 1.548 10 70 DDIERN C[C@@H]1CC[C@@H](C(=O)Nc2cccnc2N2CCC(CO)CC2)O1 ZINC000159761279 408433310 /nfs/dbraw/zinc/43/33/10/408433310.db2.gz KMTQQEWQAUOADR-DOMZBBRYSA-N 0 0 319.405 1.796 10 70 DDIERN CCc1nnc([C@@H]2CN(c3ncnc(CC)c3F)CCO2)[nH]1 ZINC000160605362 408503468 /nfs/dbraw/zinc/50/34/68/408503468.db2.gz LDSDYBILHGAKOO-JTQLQIEISA-N 0 0 306.345 1.437 10 70 DDIERN COCC(=O)N1CCN(C(=O)[C@@H]2C[C@@H]2C2CCCCC2)CC1 ZINC000160826023 408525882 /nfs/dbraw/zinc/52/58/82/408525882.db2.gz MUFQGIAXDNLUHY-HUUCEWRRSA-N 0 0 308.422 1.520 10 70 DDIERN CN(C)c1ccc(NC(=O)N[C@H]2CCc3ncnn3C2)cc1 ZINC000161348918 408592026 /nfs/dbraw/zinc/59/20/26/408592026.db2.gz SFWYXQHCXXTGEU-LBPRGKRZSA-N 0 0 300.366 1.481 10 70 DDIERN CCC[C@@H](C(=O)NC1CCN(C(=O)c2ccoc2)CC1)[NH+](C)C ZINC000161411274 408598942 /nfs/dbraw/zinc/59/89/42/408598942.db2.gz RDGJWZWOQJBSGI-HNNXBMFYSA-N 0 0 321.421 1.731 10 70 DDIERN Cc1noc([C@H]2COCCN2CC(=O)NC(C2CC2)C2CC2)n1 ZINC000160804813 484069943 /nfs/dbraw/zinc/06/99/43/484069943.db2.gz JBHKWQDHHNSVLO-CYBMUJFWSA-N 0 0 320.393 1.056 10 70 DDIERN CCC[C@@H](NC(=O)[C@H]1CC(=O)N(CC)C1)C(=O)OC(C)(C)C ZINC000161393319 520748081 /nfs/dbraw/zinc/74/80/81/520748081.db2.gz DYGTVBXVTDAHCX-NWDGAFQWSA-N 0 0 312.410 1.481 10 70 DDIERN CNC(=O)[C@H]1CCCN1C(=O)NCCc1ccc(Cl)nc1 ZINC000159893619 197371880 /nfs/dbraw/zinc/37/18/80/197371880.db2.gz JVWWGCOWNFCAEZ-LLVKDONJSA-N 0 0 310.785 1.198 10 70 DDIERN Cc1cccc([C@@H](NC(=O)[C@@H]2CNC(=O)C2)c2ccccn2)c1 ZINC000159760567 197362493 /nfs/dbraw/zinc/36/24/93/197362493.db2.gz WCZRDUPSCDEVEH-WMLDXEAASA-N 0 0 309.369 1.732 10 70 DDIERN CNC(=O)[C@H]1CCCN1C(=O)NCCOCc1ccccc1 ZINC000159419069 197351988 /nfs/dbraw/zinc/35/19/88/197351988.db2.gz CLNJAEXMZUKUST-CQSZACIVSA-N 0 0 305.378 1.123 10 70 DDIERN COC[C@H](NC(=O)N[C@@H]1CCc2nc(C(C)C)nn2C1)C1CC1 ZINC000160182745 408463226 /nfs/dbraw/zinc/46/32/26/408463226.db2.gz SOIYDHGEIUHOIN-OLZOCXBDSA-N 0 0 321.425 1.441 10 70 DDIERN CCC(CC)N(CCOC)C(=O)N[C@@H]1CCc2ncnn2C1 ZINC000161311161 408587743 /nfs/dbraw/zinc/58/77/43/408587743.db2.gz MPNOWJSBZFVUJH-GFCCVEGCSA-N 0 0 309.414 1.440 10 70 DDIERN C[C@@H](NC(=O)CCCNC(=O)c1cccnc1)[C@H]1CCCO1 ZINC000161450921 408605919 /nfs/dbraw/zinc/60/59/19/408605919.db2.gz HBFWBDJJNUHAFU-TZMCWYRMSA-N 0 0 305.378 1.275 10 70 DDIERN CCC(CC)(CNC(=O)N[C@@H]1CCCn2ncnc21)C(=O)OC ZINC000159542231 282104216 /nfs/dbraw/zinc/10/42/16/282104216.db2.gz RRWNNWVFAMFZGK-LLVKDONJSA-N 0 0 323.397 1.392 10 70 DDIERN CCc1nc(C)ccc1OCC(=O)NCCc1nnc(C)s1 ZINC000217079169 201508724 /nfs/dbraw/zinc/50/87/24/201508724.db2.gz IOSCNVXBURSYJX-UHFFFAOYSA-N 0 0 320.418 1.850 10 70 DDIERN COc1cc(F)ccc1NC(=O)N[C@@H]1CCc2ncnn2C1 ZINC000161222494 197476289 /nfs/dbraw/zinc/47/62/89/197476289.db2.gz ZBRIHWXPRLSRND-SNVBAGLBSA-N 0 0 305.313 1.562 10 70 DDIERN CCc1cc(N2CCC[C@H](NC(=O)C[C@H](O)C(C)C)C2)ncn1 ZINC000159857441 197369151 /nfs/dbraw/zinc/36/91/51/197369151.db2.gz IVJOBEBUBXFWGN-GJZGRUSLSA-N 0 0 320.437 1.531 10 70 DDIERN COC(=O)c1ccc(CN2CCOC[C@H]2c2nc(C)no2)s1 ZINC000161207394 408572099 /nfs/dbraw/zinc/57/20/99/408572099.db2.gz DUJAXVWCXSQYAM-NSHDSACASA-N 0 0 323.374 1.800 10 70 DDIERN Cc1ccsc1[C@@H]1C[C@H]1C(=O)NC[C@@H](C)N1CCOCC1 ZINC000161274351 408580948 /nfs/dbraw/zinc/58/09/48/408580948.db2.gz KUTWGMVLACVBHE-MGPQQGTHSA-N 0 0 308.447 1.997 10 70 DDIERN COc1ccc(C)cc1NC(=O)N[C@H]1CCc2ncnn2C1 ZINC000161350488 197487241 /nfs/dbraw/zinc/48/72/41/197487241.db2.gz UPYSRNHSRCNIOA-NSHDSACASA-N 0 0 301.350 1.732 10 70 DDIERN CC(C)[C@@H](O)CC(=O)NCc1cccc(NC(=O)N(C)C)c1 ZINC000160828572 408527826 /nfs/dbraw/zinc/52/78/26/408527826.db2.gz VWRPCYOFGNCPFK-AWEZNQCLSA-N 0 0 307.394 1.803 10 70 DDIERN CCCOc1cccc(CC(=O)NC[C@@H](C)N2CCOCC2)c1 ZINC000160830933 408529446 /nfs/dbraw/zinc/52/94/46/408529446.db2.gz DARUEJDCOZWGAI-OAHLLOKOSA-N 0 0 320.433 1.855 10 70 DDIERN CC(C)C[C@H](CO)NC(=O)[C@H](C)NC(=O)Nc1ccccc1 ZINC000160834660 408529896 /nfs/dbraw/zinc/52/98/96/408529896.db2.gz KRCKSUCQUZLHQE-GXTWGEPZSA-N 0 0 307.394 1.720 10 70 DDIERN CC[C@H](C(=O)N1CC[C@@H](Oc2cccnc2)C1)N1CCCC1=O ZINC000161359673 408594196 /nfs/dbraw/zinc/59/41/96/408594196.db2.gz ZNKLEFDANHECCB-HUUCEWRRSA-N 0 0 317.389 1.462 10 70 DDIERN CCc1noc([C@H](C)N2CCN(C(=O)C[C@H](O)C(C)C)CC2)n1 ZINC000159770491 290762616 /nfs/dbraw/zinc/76/26/16/290762616.db2.gz CWVCGZVJZLMRBK-STQMWFEESA-N 0 0 324.425 1.244 10 70 DDIERN Cc1nc2n(n1)CCC[C@@H]2NC(=O)NCCCC(=O)OC(C)C ZINC000159816886 197366585 /nfs/dbraw/zinc/36/65/85/197366585.db2.gz ULMZVBZJXWCMRY-LBPRGKRZSA-N 0 0 323.397 1.452 10 70 DDIERN CCn1cc(CN(C)C(=O)Cn2nc3ccccc3n2)c(C)n1 ZINC000218209433 407515775 /nfs/dbraw/zinc/51/57/75/407515775.db2.gz KXVWGHRDCHFOOB-UHFFFAOYSA-N 0 0 312.377 1.615 10 70 DDIERN COCCOc1cccc(CC(=O)N[C@@H](C)[C@@H]2CCCO2)c1 ZINC000161446838 408603597 /nfs/dbraw/zinc/60/35/97/408603597.db2.gz ZUGAFSUZSJFOGQ-BBRMVZONSA-N 0 0 307.390 1.938 10 70 DDIERN Cc1cnn(C[C@H]2CN(Cc3cnc4ccccn34)CCO2)c1 ZINC000160096266 408454557 /nfs/dbraw/zinc/45/45/57/408454557.db2.gz RXTSYYZRODEMPE-MRXNPFEDSA-N 0 0 311.389 1.740 10 70 DDIERN CCc1nnc([C@H]2CN(c3ncnc(CC)c3F)CCO2)[nH]1 ZINC000160605510 408503142 /nfs/dbraw/zinc/50/31/42/408503142.db2.gz LDSDYBILHGAKOO-SNVBAGLBSA-N 0 0 306.345 1.437 10 70 DDIERN CC(C)[C@H](O)CC(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1 ZINC000160653234 408507387 /nfs/dbraw/zinc/50/73/87/408507387.db2.gz FXUWBCNRTIQMLY-TZMCWYRMSA-N 0 0 318.373 1.237 10 70 DDIERN CCCn1c(C)nnc1Cn1nnc(Cc2ccccc2C)n1 ZINC000161427782 408599808 /nfs/dbraw/zinc/59/98/08/408599808.db2.gz KQQJYBYAXIYPCW-UHFFFAOYSA-N 0 0 311.393 1.931 10 70 DDIERN Cc1ccc(N2CC[C@@H](NC(=O)C[C@@H](O)C(C)C)C2=O)cc1 ZINC000160871220 408535291 /nfs/dbraw/zinc/53/52/91/408535291.db2.gz ZJMPSURNUGZBKW-HUUCEWRRSA-N 0 0 304.390 1.624 10 70 DDIERN Cc1cc(C)n(C[C@@H]2CN(C(=O)C[C@H](O)C(C)C)CCO2)n1 ZINC000159662714 186134068 /nfs/dbraw/zinc/13/40/68/186134068.db2.gz WLLXWKCWNRFKMZ-GJZGRUSLSA-N 0 0 309.410 1.134 10 70 DDIERN COc1cccc(OCCN2CCOC[C@@H]2c2nc(C)no2)c1 ZINC000160822344 408526774 /nfs/dbraw/zinc/52/67/74/408526774.db2.gz YWHBHTIICQIICI-OAHLLOKOSA-N 0 0 319.361 1.839 10 70 DDIERN Cc1noc([C@@H]2COCCN2Cc2ncnn2CC(C)C)n1 ZINC000160825887 408527380 /nfs/dbraw/zinc/52/73/80/408527380.db2.gz YYCZQDNACWRUDS-LBPRGKRZSA-N 0 0 306.370 1.199 10 70 DDIERN COc1ccc(NC(=O)N[C@H]2CCc3ncnn3C2)cc1OC ZINC000161107211 408560861 /nfs/dbraw/zinc/56/08/61/408560861.db2.gz IMWFRROICQANDS-NSHDSACASA-N 0 0 317.349 1.432 10 70 DDIERN CCn1cnnc1[C@H]1CCCN(Cc2nc(C3CC3)no2)C1 ZINC000161276219 408582319 /nfs/dbraw/zinc/58/23/19/408582319.db2.gz ZGYPOKDNUSORHQ-LBPRGKRZSA-N 0 0 302.382 1.938 10 70 DDIERN CCn1cnnc1[C@H]1CCCN(Cc2noc(C3CC3)n2)C1 ZINC000161356206 408593044 /nfs/dbraw/zinc/59/30/44/408593044.db2.gz MJCRPLHSZWQJDD-LBPRGKRZSA-N 0 0 302.382 1.938 10 70 DDIERN CC(C)(C)CN(CCCO)C(=O)N[C@@H]1CCc2ncnn2C1 ZINC000161198743 518661091 /nfs/dbraw/zinc/66/10/91/518661091.db2.gz YWJIFASYEHIYRW-GFCCVEGCSA-N 0 0 309.414 1.033 10 70 DDIERN CC(C)c1nc2n(n1)C[C@H](NC(=O)N1CCS[C@@H](C)C1)CC2 ZINC000161508831 519871815 /nfs/dbraw/zinc/87/18/15/519871815.db2.gz ZQIQKAUXVMMUKQ-NWDGAFQWSA-N 0 0 323.466 1.863 10 70 DDIERN C[C@@H]1CC[C@H](NC(=O)c2[nH]c(=O)[nH]c(=O)c2N)c2ccccc21 ZINC000159448606 197354172 /nfs/dbraw/zinc/35/41/72/197354172.db2.gz AYFVUXSIZRGHND-KCJUWKMLSA-N 0 0 314.345 1.014 10 70 DDIERN COc1cc(CNC(=O)N2CC[C@@]3(O)CCCC[C@H]3C2)ccn1 ZINC000159411004 197351805 /nfs/dbraw/zinc/35/18/05/197351805.db2.gz NPYYLLVKCLYJGN-YOEHRIQHSA-N 0 0 319.405 1.927 10 70 DDIERN Cn1cnc2cc(C(=O)N[C@H]3CC(=O)N(C(C)(C)C)C3)cnc21 ZINC000160685942 408512534 /nfs/dbraw/zinc/51/25/34/408512534.db2.gz JFPUHYSNLLHLHO-NSHDSACASA-N 0 0 315.377 1.098 10 70 DDIERN Cc1ccc(F)c(OCC(=O)N2CCC[C@@H]2C(=O)N(C)C)c1 ZINC000160316478 408471618 /nfs/dbraw/zinc/47/16/18/408471618.db2.gz ACFBTLDSXHMQPR-CYBMUJFWSA-N 0 0 308.353 1.592 10 70 DDIERN COC(=O)c1ccc(NC(=O)N[C@@H]2CCc3ncnn3C2)cc1 ZINC000161237005 408575977 /nfs/dbraw/zinc/57/59/77/408575977.db2.gz IUVLMPKEQUBHDH-GFCCVEGCSA-N 0 0 315.333 1.201 10 70 DDIERN NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCC1=CCCC1 ZINC000161147840 197469419 /nfs/dbraw/zinc/46/94/19/197469419.db2.gz GMUNPUISLUFDLJ-OAHLLOKOSA-N 0 0 301.390 1.883 10 70 DDIERN CC[C@@H](O)CN1CCN(CCC(=O)c2ccc(C)cc2)CC1 ZINC000159839775 408438617 /nfs/dbraw/zinc/43/86/17/408438617.db2.gz AOFQDHZUHBWRCN-QGZVFWFLSA-N 0 0 304.434 1.956 10 70 DDIERN CCn1c(C)nnc1CN1CC[C@H](CNc2ccccn2)C1 ZINC000160909599 408536956 /nfs/dbraw/zinc/53/69/56/408536956.db2.gz CRSGMYLVZFEOHZ-CQSZACIVSA-N 0 0 300.410 1.935 10 70 DDIERN CC(C)[C@H](O)CC(=O)NCC(=O)OCc1ccccc1Cl ZINC000160081472 197384146 /nfs/dbraw/zinc/38/41/46/197384146.db2.gz WPERIWXFBUDKES-CYBMUJFWSA-N 0 0 313.781 1.906 10 70 DDIERN CC(C)[C@H](O)CC(=O)N(C)[C@H]1CCN(c2ccccc2F)C1=O ZINC000159840065 408437987 /nfs/dbraw/zinc/43/79/87/408437987.db2.gz MLUBIMJRPXZMSZ-LSDHHAIUSA-N 0 0 322.380 1.796 10 70 DDIERN CCCCNC(=O)[C@@H](C)S(=O)(=O)Cc1nccn1C(C)C ZINC000161212365 408574849 /nfs/dbraw/zinc/57/48/49/408574849.db2.gz SFZJMIKNDBEYDG-GFCCVEGCSA-N 0 0 315.439 1.684 10 70 DDIERN COC[C@@H](C)C(=O)Nc1ccc(CS(C)(=O)=O)c(F)c1 ZINC000160590106 197425087 /nfs/dbraw/zinc/42/50/87/197425087.db2.gz VYAADVNFTMGZDJ-SECBINFHSA-N 0 0 303.355 1.591 10 70 DDIERN CCCCN(CCO)C(=O)N[C@H]1CCc2nc(C(C)C)nn2C1 ZINC000161393695 520513019 /nfs/dbraw/zinc/51/30/19/520513019.db2.gz LBEKMMPTWMCDJF-ZDUSSCGKSA-N 0 0 323.441 1.520 10 70 DDIERN O=C(N[C@H]1CCc2ncnn2C1)N(Cc1cccnc1)C1CC1 ZINC000161202619 197474581 /nfs/dbraw/zinc/47/45/81/197474581.db2.gz IKNHNHUZBFQCDD-ZDUSSCGKSA-N 0 0 312.377 1.362 10 70 DDIERN Cc1noc([C@@H]2COCCN2CCNC(=O)OC(C)(C)C)n1 ZINC000161020958 408552452 /nfs/dbraw/zinc/55/24/52/408552452.db2.gz ILEWORMODDUJOA-NSHDSACASA-N 0 0 312.370 1.276 10 70 DDIERN COc1ccc(NC(=O)N[C@@H]2CCc3ncnn3C2)cc1OC ZINC000161107119 408562060 /nfs/dbraw/zinc/56/20/60/408562060.db2.gz IMWFRROICQANDS-LLVKDONJSA-N 0 0 317.349 1.432 10 70 DDIERN COC(=O)c1csc(NC(=O)N[C@H]2CCCn3ncnc32)c1 ZINC000161145782 408564701 /nfs/dbraw/zinc/56/47/01/408564701.db2.gz ZEMMXQOOCWACAR-VIFPVBQESA-N 0 0 321.362 1.783 10 70 DDIERN CCn1cnnc1[C@@H]1CCCN(CC(=O)Nc2cc(C)on2)C1 ZINC000161326750 408588858 /nfs/dbraw/zinc/58/88/58/408588858.db2.gz BIWOVKRLOJSAKA-GFCCVEGCSA-N 0 0 318.381 1.413 10 70 DDIERN COc1ccc(C(=O)N2CCO[C@@H](c3nccs3)C2)nn1 ZINC000159698775 186136210 /nfs/dbraw/zinc/13/62/10/186136210.db2.gz FQFAYDBBWKJENS-SNVBAGLBSA-N 0 0 306.347 1.155 10 70 DDIERN CCc1noc([C@@H](C)N2CCN(C(=O)C[C@H](O)C(C)C)CC2)n1 ZINC000159770378 408432836 /nfs/dbraw/zinc/43/28/36/408432836.db2.gz CWVCGZVJZLMRBK-OLZOCXBDSA-N 0 0 324.425 1.244 10 70 DDIERN CC(C)[C@H](NC(=O)Nc1ccc(-c2ncn(C)n2)cc1)C(N)=O ZINC000160573897 408496985 /nfs/dbraw/zinc/49/69/85/408496985.db2.gz SZEQYCMSNLUYKZ-LBPRGKRZSA-N 0 0 316.365 1.114 10 70 DDIERN CNC(=O)COc1cccc(CC(=O)N[C@H](C)[C@H]2CCCO2)c1 ZINC000161446663 408601858 /nfs/dbraw/zinc/60/18/58/408601858.db2.gz OXTGVIJCGCNZPG-IUODEOHRSA-N 0 0 320.389 1.038 10 70 DDIERN CC(=O)Nc1cccc(NC(=O)N[C@H]2CCc3ncnn3C2)c1 ZINC000161237369 408576913 /nfs/dbraw/zinc/57/69/13/408576913.db2.gz XRWLYTPDJACRIT-ZDUSSCGKSA-N 0 0 314.349 1.373 10 70 DDIERN CCC[C@H](NC(=O)c1ccc(=O)n(C)c1)C(=O)OC(C)(C)C ZINC000161309276 408587607 /nfs/dbraw/zinc/58/76/07/408587607.db2.gz FWEUVZBKERJCIZ-LBPRGKRZSA-N 0 0 308.378 1.626 10 70 DDIERN Cc1nc(SCC(=O)N2CC[C@H](Oc3cccnc3)C2)n[nH]1 ZINC000161360084 408595459 /nfs/dbraw/zinc/59/54/59/408595459.db2.gz YAKAOBFWAKCQJN-LBPRGKRZSA-N 0 0 319.390 1.280 10 70 DDIERN CCOC(=O)c1ccc(CN2CCOC[C@@H]2c2nc(C)no2)o1 ZINC000161076375 290780400 /nfs/dbraw/zinc/78/04/00/290780400.db2.gz KEZBRKPNEPWGMZ-GFCCVEGCSA-N 0 0 321.333 1.721 10 70 DDIERN Cc1cnn(CCNC(=O)NCCOc2ncccc2Cl)c1 ZINC000161129976 197467975 /nfs/dbraw/zinc/46/79/75/197467975.db2.gz QRJLVKPEPOMPQT-UHFFFAOYSA-N 0 0 323.784 1.618 10 70 DDIERN CCc1nnc(CN[C@H](C)c2ccc(S(C)(=O)=O)cc2)[nH]1 ZINC000160284593 197397654 /nfs/dbraw/zinc/39/76/54/197397654.db2.gz XSQSKMQILZAIQB-SNVBAGLBSA-N 0 0 308.407 1.621 10 70 DDIERN CC(C)OC(=O)CCCNC(=O)N1CCC[C@@H]1c1cnn(C)c1 ZINC000160178711 197391725 /nfs/dbraw/zinc/39/17/25/197391725.db2.gz QNMLDHWQNPAABC-CQSZACIVSA-N 0 0 322.409 1.998 10 70 DDIERN Cc1nc2n(n1)CCC[C@H]2NC(=O)NCCCC(=O)OC(C)C ZINC000159817031 197366733 /nfs/dbraw/zinc/36/67/33/197366733.db2.gz ULMZVBZJXWCMRY-GFCCVEGCSA-N 0 0 323.397 1.452 10 70 DDIERN CC(C)OC(=O)CCCNC(=O)N[C@@H]1CCCC[C@@H]1CO ZINC000160042090 408450962 /nfs/dbraw/zinc/45/09/62/408450962.db2.gz OZCGCQNCPBKLEX-CHWSQXEVSA-N 0 0 300.399 1.569 10 70 DDIERN CC(C)N1CC[C@H](NC(=O)N2CCC(c3cc[nH]n3)CC2)C1=O ZINC000160027655 408453219 /nfs/dbraw/zinc/45/32/19/408453219.db2.gz GMRYBWSKRXMTIQ-AWEZNQCLSA-N 0 0 319.409 1.308 10 70 DDIERN CC(C)c1nc2n(n1)C[C@H](NC(=O)NCC1(C)COC1)CC2 ZINC000159852509 408437296 /nfs/dbraw/zinc/43/72/96/408437296.db2.gz RZEUFZGWYAQLGI-LLVKDONJSA-N 0 0 307.398 1.052 10 70 DDIERN C[C@H](CNC(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F)N1CCOCC1 ZINC000160208759 408462664 /nfs/dbraw/zinc/46/26/64/408462664.db2.gz WSTNRDWRQWVCMG-KYOSRNDESA-N 0 0 324.371 1.905 10 70 DDIERN Cc1csc(C(C)(C)NC(=O)N[C@H]2CCc3ncnn3C2)n1 ZINC000161353633 408591915 /nfs/dbraw/zinc/59/19/15/408591915.db2.gz NRNBKNIZDGWMHJ-JTQLQIEISA-N 0 0 320.422 1.592 10 70 DDIERN O=C(CSc1ccc(F)cc1)N1CC[C@@H](n2ccnn2)C1 ZINC000217686848 418560715 /nfs/dbraw/zinc/56/07/15/418560715.db2.gz XAHLUMDGFHWBIL-GFCCVEGCSA-N 0 0 306.366 1.983 10 70 DDIERN CC(C)(NC(=O)N[C@H]1CCc2ncnn2C1)c1cccc(F)c1 ZINC000161112885 408561280 /nfs/dbraw/zinc/56/12/80/408561280.db2.gz FDSGXVJIWAEYLF-ZDUSSCGKSA-N 0 0 317.368 1.967 10 70 DDIERN C[C@H](C(=O)N1CCO[C@@H](Cn2cccn2)C1)c1cccs1 ZINC000159831008 197366981 /nfs/dbraw/zinc/36/69/81/197366981.db2.gz VJXHLSUJXKNMDL-QWHCGFSZSA-N 0 0 305.403 1.976 10 70 DDIERN CN(C)c1nc(CN2CCC(Nc3cccnn3)CC2)ns1 ZINC000159890458 408441178 /nfs/dbraw/zinc/44/11/78/408441178.db2.gz ZNJJOOYGFLRZDC-UHFFFAOYSA-N 0 0 319.438 1.471 10 70 DDIERN CC1CCN(S(=O)(=O)N2CC[C@]3(O)CCCC[C@@H]3C2)CC1 ZINC000160594254 408501033 /nfs/dbraw/zinc/50/10/33/408501033.db2.gz LGUFXPHDXFDQDP-HUUCEWRRSA-N 0 0 316.467 1.590 10 70 DDIERN CCCS(=O)(=O)N1CCC[C@H]1C(=O)Nc1cccc(F)n1 ZINC000160758362 408520415 /nfs/dbraw/zinc/52/04/15/408520415.db2.gz BLXLQOQQDADORT-JTQLQIEISA-N 0 0 315.370 1.363 10 70 DDIERN COCCC1(CNC(=O)N2CCC[C@H](n3cncn3)C2)CC1 ZINC000161032804 408551466 /nfs/dbraw/zinc/55/14/66/408551466.db2.gz VCUUIIOEJDVQMI-ZDUSSCGKSA-N 0 0 307.398 1.441 10 70 DDIERN CC(C)(C)c1nnc(NC(=O)N[C@@H]2CCc3ncnn3C2)s1 ZINC000161321620 408586121 /nfs/dbraw/zinc/58/61/21/408586121.db2.gz SPXHBDMBPSUMEA-MRVPVSSYSA-N 0 0 321.410 1.564 10 70 DDIERN CC(C)[C@@H](O)CC(=O)N1CCN(Cc2cccc(F)c2)C(=O)C1 ZINC000160869354 408532335 /nfs/dbraw/zinc/53/23/35/408532335.db2.gz ZSHWAIWDRHLNCU-HNNXBMFYSA-N 0 0 322.380 1.404 10 70 DDIERN COC(=O)c1cc(CN2CCOC[C@@H]2c2nc(C)no2)oc1C ZINC000160907223 408537887 /nfs/dbraw/zinc/53/78/87/408537887.db2.gz RUBCHBOHBSOWLG-CYBMUJFWSA-N 0 0 321.333 1.640 10 70 DDIERN CCC[C@H](NC(=O)c1ccc(=O)n(C)n1)C(=O)OC(C)(C)C ZINC000161499162 408610722 /nfs/dbraw/zinc/61/07/22/408610722.db2.gz GDJXTNWDTXTZLL-NSHDSACASA-N 0 0 309.366 1.021 10 70 DDIERN CC[C@@H](COC)NC(=O)N[C@@H]1CCc2nc(C(C)C)nn2C1 ZINC000161432332 522588134 /nfs/dbraw/zinc/58/81/34/522588134.db2.gz GAAOTHNNBJXWRH-NWDGAFQWSA-N 0 0 309.414 1.441 10 70 DDIERN COc1ccc(C(=O)Nc2cnoc2C)cc1N1CCNC1=O ZINC000161063413 354241456 /nfs/dbraw/zinc/24/14/56/354241456.db2.gz ZXTHMNXSGUQCIN-UHFFFAOYSA-N 0 0 316.317 1.774 10 70 DDIERN Cc1nc(CN(C)C(=O)N[C@H]2CCc3ncnn3C2)cs1 ZINC000161317311 197484634 /nfs/dbraw/zinc/48/46/34/197484634.db2.gz UADJKTDFPTWFNH-JTQLQIEISA-N 0 0 306.395 1.199 10 70 DDIERN CCc1ncsc1C(=O)N1CCC[C@H](Cn2cncn2)C1 ZINC000160537588 197420431 /nfs/dbraw/zinc/42/04/31/197420431.db2.gz RGQCTLFDOILEAM-NSHDSACASA-N 0 0 305.407 1.849 10 70 DDIERN Cn1c2cccc(C(=O)N3CCO[C@H]4CCCC[C@@H]43)c2oc1=O ZINC000160122547 197386841 /nfs/dbraw/zinc/38/68/41/197386841.db2.gz OCENTIWGVORJSO-JSGCOSHPSA-N 0 0 316.357 1.915 10 70 DDIERN CCOc1ccccc1NC(=O)N[C@@H]1CCc2ncnn2C1 ZINC000161107618 197465631 /nfs/dbraw/zinc/46/56/31/197465631.db2.gz JWHRIWPKERMJKZ-LLVKDONJSA-N 0 0 301.350 1.813 10 70 DDIERN CCC[C@@H](C(=O)NCCNC(=O)c1ccc(C)c(F)c1)[NH+](C)C ZINC000161421154 408599364 /nfs/dbraw/zinc/59/93/64/408599364.db2.gz OCMUGQBJNVXXSQ-HNNXBMFYSA-N 0 0 323.412 1.710 10 70 DDIERN NC(=O)NCC(=O)NC[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl ZINC000160548882 408493625 /nfs/dbraw/zinc/49/36/25/408493625.db2.gz FJRCEUYGQRKTAS-XCBNKYQSSA-N 0 0 316.188 1.881 10 70 DDIERN Cc1cnn(-c2ccc(C)cc2NC(=O)C(=O)N[C@H]2C[C@@H]2C)c1 ZINC000161002115 408548984 /nfs/dbraw/zinc/54/89/84/408548984.db2.gz ZNPVMSRHXQOPEA-STQMWFEESA-N 0 0 312.373 1.952 10 70 DDIERN COc1ncccc1CNC(=O)N1CC[C@]2(O)CCCC[C@H]2C1 ZINC000159558727 186127042 /nfs/dbraw/zinc/12/70/42/186127042.db2.gz DJJGORYUFJDKCV-WMLDXEAASA-N 0 0 319.405 1.927 10 70 DDIERN CC(C)[C@H](O)CC(=O)NCCCC(=O)N1Cc2ccccc2C1 ZINC000159727514 186138134 /nfs/dbraw/zinc/13/81/34/186138134.db2.gz GIRBMMFPHTYVQC-MRXNPFEDSA-N 0 0 318.417 1.832 10 70 DDIERN CC(=O)N1CCN(C[C@@H]2CC(c3ccc(Cl)cc3)=NO2)CC1 ZINC000159726473 186138163 /nfs/dbraw/zinc/13/81/63/186138163.db2.gz BSSKIMUAEWIBFY-HNNXBMFYSA-N 0 0 321.808 1.997 10 70 DDIERN O=C(Nc1ccnn1C[C@@H]1CCOC1)N[C@H]1CCCC[C@H]1O ZINC000159636637 354235319 /nfs/dbraw/zinc/23/53/19/354235319.db2.gz IHJUBPLHJMYCQT-RWMBFGLXSA-N 0 0 308.382 1.345 10 70 DDIERN CCCCS(=O)(=O)N[C@H]1CCc2nc(C(C)C)nn2C1 ZINC000159395262 408404929 /nfs/dbraw/zinc/40/49/29/408404929.db2.gz DCXOLHNMJBRNQW-NSHDSACASA-N 0 0 300.428 1.436 10 70 DDIERN COc1cc(C)ccc1NC(=O)N[C@H]1CCc2ncnn2C1 ZINC000160968249 408545243 /nfs/dbraw/zinc/54/52/43/408545243.db2.gz WGDYZFWKRFMWED-NSHDSACASA-N 0 0 301.350 1.732 10 70 DDIERN Cc1noc([C@H]2COCCN2Cc2nc3ccccc3n2C)n1 ZINC000161019826 408552830 /nfs/dbraw/zinc/55/28/30/408552830.db2.gz IJYKPNSCVPDSKT-CQSZACIVSA-N 0 0 313.361 1.838 10 70 DDIERN CCN(CC)C(=O)[C@H](C)S(=O)(=O)Cc1nccn1C(C)C ZINC000161213554 408573424 /nfs/dbraw/zinc/57/34/24/408573424.db2.gz ULOVAANWJZCDBI-LBPRGKRZSA-N 0 0 315.439 1.636 10 70 DDIERN CCn1cnnc1[C@H]1CCCN(Cc2cn3cccnc3n2)C1 ZINC000161285773 408580869 /nfs/dbraw/zinc/58/08/69/408580869.db2.gz RVCZNRLBRLFVCL-ZDUSSCGKSA-N 0 0 311.393 1.720 10 70 DDIERN Cc1csc(C(C)(C)NC(=O)N[C@@H]2CCc3ncnn3C2)n1 ZINC000161353508 293026606 /nfs/dbraw/zinc/02/66/06/293026606.db2.gz NRNBKNIZDGWMHJ-SNVBAGLBSA-N 0 0 320.422 1.592 10 70 DDIERN CNc1ncc(C(=O)N[C@@H]2CCCN(c3cccnn3)C2)s1 ZINC000160482279 522699317 /nfs/dbraw/zinc/69/93/17/522699317.db2.gz LXTKFQVDWRJQEX-SNVBAGLBSA-N 0 0 318.406 1.374 10 70 DDIERN CNC(=O)[C@H]1CCCN1C(=O)NC1CCC(OC(C)C)CC1 ZINC000160238053 539219783 /nfs/dbraw/zinc/21/97/83/539219783.db2.gz PWZHSXOYIMEZSZ-JXQTWKCFSA-N 0 0 311.426 1.643 10 70 DDIERN Nc1cccc(S(=O)(=O)N2CC[C@@]3(O)CCCC[C@@H]3C2)c1 ZINC000160345153 408473670 /nfs/dbraw/zinc/47/36/70/408473670.db2.gz OMNVIMWGTWBUKT-DOMZBBRYSA-N 0 0 310.419 1.585 10 70 DDIERN COc1cc(C)ccc1NC(=O)N[C@@H]1CCc2ncnn2C1 ZINC000160968114 408545219 /nfs/dbraw/zinc/54/52/19/408545219.db2.gz WGDYZFWKRFMWED-LLVKDONJSA-N 0 0 301.350 1.732 10 70 DDIERN C[C@@H](NC(=O)N(C)CCC(=O)OC(C)(C)C)[C@H]1CCCO1 ZINC000160741881 290776155 /nfs/dbraw/zinc/77/61/55/290776155.db2.gz CRSFIPYQNDPJEC-VXGBXAGGSA-N 0 0 300.399 1.927 10 70 DDIERN Cc1cnn(-c2ccc(C)cc2NC(=O)C(=O)N[C@@H]2C[C@@H]2C)c1 ZINC000161001948 408549567 /nfs/dbraw/zinc/54/95/67/408549567.db2.gz ZNPVMSRHXQOPEA-QWHCGFSZSA-N 0 0 312.373 1.952 10 70 DDIERN C[C@H](NC(=O)N1CCCN(CC(F)F)CC1)[C@@H]1CCCO1 ZINC000160456230 525021097 /nfs/dbraw/zinc/02/10/97/525021097.db2.gz RLJDOZJSLVBHBK-RYUDHWBXSA-N 0 0 305.369 1.536 10 70 DDIERN CNC(=O)COc1cccc(CC(=O)N[C@@H](C)[C@@H]2CCCO2)c1 ZINC000161446226 197495633 /nfs/dbraw/zinc/49/56/33/197495633.db2.gz OXTGVIJCGCNZPG-WFASDCNBSA-N 0 0 320.389 1.038 10 70 DDIERN CNC(=O)[C@@H]1CCCN1C(=O)NCCOCc1ccccc1 ZINC000159418927 197352637 /nfs/dbraw/zinc/35/26/37/197352637.db2.gz CLNJAEXMZUKUST-AWEZNQCLSA-N 0 0 305.378 1.123 10 70 DDIERN CCOC(=O)c1sc(NCC(C)(C)S(C)(=O)=O)nc1C ZINC000159952317 162148890 /nfs/dbraw/zinc/14/88/90/162148890.db2.gz WSLXYMKUEWTDNL-UHFFFAOYSA-N 0 0 320.436 1.863 10 70 DDIERN CC(C)[C@@H](O)CC(=O)N(C)[C@H]1CCN(c2ccccc2F)C1=O ZINC000159840195 408438919 /nfs/dbraw/zinc/43/89/19/408438919.db2.gz MLUBIMJRPXZMSZ-GJZGRUSLSA-N 0 0 322.380 1.796 10 70 DDIERN CC(C)c1nc(N(C)C)nc(N2CCC[C@@H]2Cn2ccnc2)n1 ZINC000160388793 408478800 /nfs/dbraw/zinc/47/88/00/408478800.db2.gz OKYCDRRMZQEIDD-CYBMUJFWSA-N 0 0 315.425 1.927 10 70 DDIERN CC(C)[C@H](O)CC(=O)N1CCN(Cc2cccc(F)c2)C(=O)C1 ZINC000160869226 519822563 /nfs/dbraw/zinc/82/25/63/519822563.db2.gz ZSHWAIWDRHLNCU-OAHLLOKOSA-N 0 0 322.380 1.404 10 70 DDIERN CC(C)C[C@@H]1COCCN1C(=O)c1cnc2c(c1)ncn2C ZINC000159846429 279041145 /nfs/dbraw/zinc/04/11/45/279041145.db2.gz SYBAVILMRKOLDU-CYBMUJFWSA-N 0 0 302.378 1.855 10 70 DDIERN CCS(=O)(=O)NCc1ccc(C(=O)N[C@H](C)C(C)C)cc1 ZINC000159529634 186125446 /nfs/dbraw/zinc/12/54/46/186125446.db2.gz DNZGLXIUDVBAGM-GFCCVEGCSA-N 0 0 312.435 1.900 10 70 DDIERN C[C@@H](CNC(=O)c1c(F)cc(F)cc1F)N1CCOCC1 ZINC000160205184 197392442 /nfs/dbraw/zinc/39/24/42/197392442.db2.gz ILWDUIGHXOLCRA-VIFPVBQESA-N 0 0 302.296 1.554 10 70 DDIERN CCCCN(C)S(=O)(=O)N1CCC(Cn2cccn2)CC1 ZINC000159427693 408409189 /nfs/dbraw/zinc/40/91/89/408409189.db2.gz VNHVCAWBKXAXPX-UHFFFAOYSA-N 0 0 314.455 1.572 10 70 DDIERN Cc1cnn(CCNC(=O)C(=O)Nc2cnc(Cl)cc2C)c1 ZINC000160436640 408483876 /nfs/dbraw/zinc/48/38/76/408483876.db2.gz AQOXKLHGZRFNSD-UHFFFAOYSA-N 0 0 321.768 1.303 10 70 DDIERN O=C(CSc1ccc(F)cc1)N1CC[C@H](n2ccnn2)C1 ZINC000217686766 418560756 /nfs/dbraw/zinc/56/07/56/418560756.db2.gz XAHLUMDGFHWBIL-LBPRGKRZSA-N 0 0 306.366 1.983 10 70 DDIERN CC(C)Cc1ccc([C@@H](C)C(=O)NCCS(N)(=O)=O)cc1 ZINC000161215610 279242148 /nfs/dbraw/zinc/24/21/48/279242148.db2.gz FDWMQXOAKMHLQU-GFCCVEGCSA-N 0 0 312.435 1.393 10 70 DDIERN Cc1nc(C)n(C[C@H]2CCCN(C(=O)C[C@H](O)C(C)C)C2)n1 ZINC000160311287 526762199 /nfs/dbraw/zinc/76/21/99/526762199.db2.gz BKAODYAQPAOANC-GJZGRUSLSA-N 0 0 308.426 1.541 10 70 DDIERN CCC[C@@H](NC(=O)C(=O)c1cnn(CC)c1)C(=O)OC(C)(C)C ZINC000161299578 197482950 /nfs/dbraw/zinc/48/29/50/197482950.db2.gz XMWFDIUVIUOTLH-GFCCVEGCSA-N 0 0 323.393 1.712 10 70 DDIERN Cc1cccc([C@H](NC(=O)[C@@H]2CNC(=O)C2)c2ccccn2)c1 ZINC000159760438 197362543 /nfs/dbraw/zinc/36/25/43/197362543.db2.gz WCZRDUPSCDEVEH-YOEHRIQHSA-N 0 0 309.369 1.732 10 70 DDIERN CC(C)c1nc(N(C)C)nc(N2CCC[C@H]2Cn2ccnc2)n1 ZINC000160388927 408478112 /nfs/dbraw/zinc/47/81/12/408478112.db2.gz OKYCDRRMZQEIDD-ZDUSSCGKSA-N 0 0 315.425 1.927 10 70 DDIERN CN(Cc1ccccc1F)C(=O)N[C@H]1CCc2ncnn2C1 ZINC000161212125 408574015 /nfs/dbraw/zinc/57/40/15/408574015.db2.gz GYKHKFJVPPJTJX-LBPRGKRZSA-N 0 0 303.341 1.574 10 70 DDIERN Cc1nsc(N2CCCN(C(=O)C[C@H](O)C(C)C)CC2)n1 ZINC000161312272 408587817 /nfs/dbraw/zinc/58/78/17/408587817.db2.gz BCKSANWICUIEHD-LBPRGKRZSA-N 0 0 312.439 1.292 10 70 DDIERN CCC[C@H](C(=O)NCCNC(=O)c1ccc(C)c(F)c1)[NH+](C)C ZINC000161421287 408601098 /nfs/dbraw/zinc/60/10/98/408601098.db2.gz OCMUGQBJNVXXSQ-OAHLLOKOSA-N 0 0 323.412 1.710 10 70 DDIERN CNc1ncc(C(=O)N[C@H]2CCCN(c3cccnn3)C2)s1 ZINC000160482405 522699808 /nfs/dbraw/zinc/69/98/08/522699808.db2.gz LXTKFQVDWRJQEX-JTQLQIEISA-N 0 0 318.406 1.374 10 70 DDIERN