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/nfs/dbraw/zinc/14/15/36/530141536.db2.gz NBISMKNTFKFXAQ-RQJABVFESA-N -1 3 397.519 -1.572 20 0 GAADHM C[C@@H]1CN(S(=O)(=O)[N-][C@@H]2CS(=O)(=O)C[C@@H]2N2CCOCC2)C[C@@H](C)O1 ZINC000508148647 530141990 /nfs/dbraw/zinc/14/19/90/530141990.db2.gz NBISMKNTFKFXAQ-SYQHCUMBSA-N -1 3 397.519 -1.572 20 0 GAADHM C[C@@H]1CN(S(=O)(=O)[N-][C@@H]2CS(=O)(=O)C[C@H]2N2CCOCC2)C[C@H](C)O1 ZINC000508148648 530141871 /nfs/dbraw/zinc/14/18/71/530141871.db2.gz NBISMKNTFKFXAQ-XJFOESAGSA-N -1 3 397.519 -1.572 20 0 GAADHM Cc1noc(C)c1S(=O)(=O)[N-][C@@H](C)C(=O)N[C@H](CO)CN1CCOCC1 ZINC000508338047 1074193816 /nfs/dbraw/zinc/19/38/16/1074193816.db2.gz FQRSXAZMCRGXSO-AAEUAGOBSA-N -1 3 390.462 -1.232 20 0 GAADHM Cc1noc(C)c1S(=O)(=O)[N-][C@@H](C)C(=O)N[C@@H](CO)CN1CCOCC1 ZINC000508338050 1074193726 /nfs/dbraw/zinc/19/37/26/1074193726.db2.gz FQRSXAZMCRGXSO-WCQYABFASA-N -1 3 390.462 -1.232 20 0 GAADHM NC(=O)[C@]1(O)CCN(S(=O)(=O)c2ccccc2S(=O)(=O)[N-]C2CC2)C1 ZINC000510005019 530141572 /nfs/dbraw/zinc/14/15/72/530141572.db2.gz AFWXQZVLQFPUOU-AWEZNQCLSA-N -1 3 389.455 -1.262 20 0 GAADHM NC(=O)[C@@]1(O)CCN(S(=O)(=O)c2ccccc2S(=O)(=O)[N-]C2CC2)C1 ZINC000510005020 530141664 /nfs/dbraw/zinc/14/16/64/530141664.db2.gz AFWXQZVLQFPUOU-CQSZACIVSA-N -1 3 389.455 -1.262 20 0 GAADHM Cc1nc(S(=O)(=O)[N-]CC(=O)NC[C@H]2CCCN2S(C)(=O)=O)cn1C ZINC000510200730 530142327 /nfs/dbraw/zinc/14/23/27/530142327.db2.gz NLMKBICNSUXUEY-LLVKDONJSA-N -1 3 393.491 -1.453 20 0 GAADHM Cn1c(=O)[n-]c(=O)c2cc(S(=O)(=O)N[C@@H]3CCCS(=O)(=O)C3)cnc21 ZINC000510223820 530142336 /nfs/dbraw/zinc/14/23/36/530142336.db2.gz RFQPIOKSSUSCRG-MRVPVSSYSA-N -1 3 388.427 -1.110 20 0 GAADHM Cn1c(=O)[n-]c(=O)c2cc(S(=O)(=O)N[C@H]3CCCS(=O)(=O)C3)cnc21 ZINC000510223821 530142546 /nfs/dbraw/zinc/14/25/46/530142546.db2.gz RFQPIOKSSUSCRG-QMMMGPOBSA-N -1 3 388.427 -1.110 20 0 GAADHM CCS(=O)(=O)NCCS(=O)(=O)N1CCC[C@H]1C[C@]1(C)NC(=O)[N-]C1=O ZINC000510557964 530142619 /nfs/dbraw/zinc/14/26/19/530142619.db2.gz HGDBLBRGOXQIBI-GWCFXTLKSA-N -1 3 396.491 -1.292 20 0 GAADHM CCS(=O)(=O)NCCS(=O)(=O)N1CCC[C@H]1C[C@@]1(C)NC(=O)[N-]C1=O ZINC000510557965 530142321 /nfs/dbraw/zinc/14/23/21/530142321.db2.gz HGDBLBRGOXQIBI-GXFFZTMASA-N -1 3 396.491 -1.292 20 0 GAADHM CCS(=O)(=O)NCCS(=O)(=O)N1CCC[C@@H]1C[C@]1(C)NC(=O)[N-]C1=O ZINC000510557966 530142354 /nfs/dbraw/zinc/14/23/54/530142354.db2.gz HGDBLBRGOXQIBI-MFKMUULPSA-N -1 3 396.491 -1.292 20 0 GAADHM CCS(=O)(=O)NCCS(=O)(=O)N1CCC[C@@H]1C[C@@]1(C)NC(=O)[N-]C1=O ZINC000510557967 530142251 /nfs/dbraw/zinc/14/22/51/530142251.db2.gz HGDBLBRGOXQIBI-ZWNOBZJWSA-N -1 3 396.491 -1.292 20 0 GAADHM Cc1nc(S(=O)(=O)[N-]CCC(=O)NCCCNS(C)(=O)=O)cn1C ZINC000510780409 530142266 /nfs/dbraw/zinc/14/22/66/530142266.db2.gz FSCHUJDDKHGPCW-UHFFFAOYSA-N -1 3 381.480 -1.548 20 0 GAADHM Cc1nc(S(=O)(=O)[N-]CC(=O)NCCN2CCS(=O)(=O)CC2)cn1C ZINC000510821414 530142283 /nfs/dbraw/zinc/14/22/83/530142283.db2.gz PBNPBQUNTCVXKT-UHFFFAOYSA-N -1 3 393.491 -2.147 20 0 GAADHM CCS(=O)(=O)N(C)CCCNC(=O)C[N-]S(=O)(=O)c1cn(C)c(C)n1 ZINC000510843911 530142651 /nfs/dbraw/zinc/14/26/51/530142651.db2.gz OXUUDJCNZRVKQY-UHFFFAOYSA-N -1 3 395.507 -1.205 20 0 GAADHM Cc1nc(S(=O)(=O)[N-]CC(=O)N2CCC[C@H]2CS(N)(=O)=O)cn1C ZINC000511092237 530142522 /nfs/dbraw/zinc/14/25/22/530142522.db2.gz HQKDMLVKPSLZCB-JTQLQIEISA-N -1 3 379.464 -1.714 20 0 GAADHM Cc1nc(S(=O)(=O)[N-]CC(=O)N2CCC[C@@H]2CS(N)(=O)=O)cn1C ZINC000511092247 530142612 /nfs/dbraw/zinc/14/26/12/530142612.db2.gz HQKDMLVKPSLZCB-SNVBAGLBSA-N -1 3 379.464 -1.714 20 0 GAADHM NS(=O)(=O)C[C@H]1CCCN1C(=O)Cn1cc(Br)c(=O)[n-]c1=O ZINC000511099726 530142625 /nfs/dbraw/zinc/14/26/25/530142625.db2.gz RQFNHFQPPDARLH-SSDOTTSWSA-N -1 3 395.235 -1.009 20 0 GAADHM NS(=O)(=O)C[C@@H]1CCCN1C(=O)Cn1cc(Br)c(=O)[n-]c1=O ZINC000511099728 530142372 /nfs/dbraw/zinc/14/23/72/530142372.db2.gz RQFNHFQPPDARLH-ZETCQYMHSA-N -1 3 395.235 -1.009 20 0 GAADHM Cc1nc(S(=O)(=O)[N-]CCC(=O)N2CCC[C@@H]2CS(N)(=O)=O)cn1C ZINC000511106063 530142205 /nfs/dbraw/zinc/14/22/05/530142205.db2.gz BXSDTKYULNRGGF-LLVKDONJSA-N -1 3 393.491 -1.324 20 0 GAADHM Cc1nc(S(=O)(=O)[N-]CCC(=O)N2CCC[C@H]2CS(N)(=O)=O)cn1C ZINC000511106064 530142431 /nfs/dbraw/zinc/14/24/31/530142431.db2.gz BXSDTKYULNRGGF-NSHDSACASA-N -1 3 393.491 -1.324 20 0 GAADHM CCS(=O)(=O)NCCNC(=O)CC[N-]S(=O)(=O)c1cn(C)c(C)n1 ZINC000511242592 530142168 /nfs/dbraw/zinc/14/21/68/530142168.db2.gz RSWXUVUBEYXNLZ-UHFFFAOYSA-N -1 3 381.480 -1.548 20 0 GAADHM NC(=O)[C@H](CO)[N-]S(=O)(=O)c1ccccc1S(=O)(=O)N1CCCC1 ZINC000511262483 530142599 /nfs/dbraw/zinc/14/25/99/530142599.db2.gz TYLAGMNVRGIKNM-JTQLQIEISA-N -1 3 377.444 -1.404 20 0 GAADHM Cc1nc(S(=O)(=O)[N-]CC(=O)N2CCCN(S(C)(=O)=O)CC2)cn1C ZINC000511406265 530143510 /nfs/dbraw/zinc/14/35/10/530143510.db2.gz VWWAZMKMCFPIEF-UHFFFAOYSA-N -1 3 393.491 -1.499 20 0 GAADHM Cc1nc(S(=O)(=O)[N-]CC(=O)N2CCN(S(C)(=O)=O)CC2)cn1C ZINC000511744225 530143514 /nfs/dbraw/zinc/14/35/14/530143514.db2.gz KURWEELMGGTWBZ-UHFFFAOYSA-N -1 3 379.464 -1.889 20 0 GAADHM Cc1nc(S(=O)(=O)[N-]CCC(=O)N2CCN(S(C)(=O)=O)CC2)cn1C ZINC000511747352 530143338 /nfs/dbraw/zinc/14/33/38/530143338.db2.gz ZDKXTBKPEPAPMZ-UHFFFAOYSA-N -1 3 393.491 -1.499 20 0 GAADHM COCCCNC(=O)CN(C)C(=O)C[N-]S(=O)(=O)c1cn(C)c(C)n1 ZINC000511766068 530143249 /nfs/dbraw/zinc/14/32/49/530143249.db2.gz AHRSBVNXFOTONG-UHFFFAOYSA-N -1 3 375.451 -1.382 20 0 GAADHM CCN(CCCNC(=O)C[N-]S(=O)(=O)c1cn(C)c(C)n1)S(C)(=O)=O ZINC000511784586 530143264 /nfs/dbraw/zinc/14/32/64/530143264.db2.gz HAMCVNDYWDZTSU-UHFFFAOYSA-N -1 3 395.507 -1.205 20 0 GAADHM Cc1nc(S(=O)(=O)[N-]CC(=O)NCCN2CCCS2(=O)=O)cn1C ZINC000512038554 530143159 /nfs/dbraw/zinc/14/31/59/530143159.db2.gz GRNFJKOQHVXYDF-UHFFFAOYSA-N -1 3 379.464 -1.841 20 0 GAADHM Cc1nc(S(=O)(=O)[N-]CCC(=O)NCCN2CCCS2(=O)=O)cn1C ZINC000512043286 530143359 /nfs/dbraw/zinc/14/33/59/530143359.db2.gz YEHGYPGWCVWUTI-UHFFFAOYSA-N -1 3 393.491 -1.451 20 0 GAADHM Cc1nc(S(=O)(=O)[N-]CCC(=O)NCCS(=O)(=O)NC(C)C)cn1C ZINC000512060232 530143423 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COC(=O)C[C@@H]1C(=O)NCCN1C(=O)C[N-]S(=O)(=O)c1cccs1 ZINC000512800796 530143478 /nfs/dbraw/zinc/14/34/78/530143478.db2.gz AJEIUVIYNKVICA-SECBINFHSA-N -1 3 375.428 -1.084 20 0 GAADHM COC(=O)C[C@H]1C(=O)NCCN1C(=O)C[N-]S(=O)(=O)c1cccs1 ZINC000512800800 530143431 /nfs/dbraw/zinc/14/34/31/530143431.db2.gz AJEIUVIYNKVICA-VIFPVBQESA-N -1 3 375.428 -1.084 20 0 GAADHM Cc1noc(C)c1S(=O)(=O)[N-][C@@H](C)C(=O)NCCNS(=O)(=O)N(C)C ZINC000513128646 530142944 /nfs/dbraw/zinc/14/29/44/530142944.db2.gz SBRXFVDLEFDQLR-VIFPVBQESA-N -1 3 397.479 -1.530 20 0 GAADHM O=C(C[N-]S(=O)(=O)c1c(F)cccc1F)NCC(=O)N1CCNCC1 ZINC000514604461 530103360 /nfs/dbraw/zinc/10/33/60/530103360.db2.gz ZJIWHOQKLMQOAW-UHFFFAOYSA-N -1 3 376.385 -1.209 20 0 GAADHM Cc1cc(NS(=O)(=O)CCCS(=O)(=O)[N-][C@@H]2COC[C@H]2O)c(C)cn1 ZINC000514677588 530107759 /nfs/dbraw/zinc/10/77/59/530107759.db2.gz JECLNNSBEIVONU-ZIAGYGMSSA-N -1 3 393.487 -1.069 20 0 GAADHM CCN(CC)CCS(=O)(=O)[N-][C@H]1CS(=O)(=O)C[C@@H]1N1CCOCC1 ZINC000514820407 530116316 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/nfs/dbraw/zinc/15/37/58/530153758.db2.gz VRROTFFNGOAHFF-NSHDSACASA-N -1 3 393.491 -1.371 20 0 GAADHM Cc1nc(S(=O)(=O)[N-]CC(=O)N2CCC[C@@H](CS(N)(=O)=O)C2)cn1C ZINC000554295806 530153536 /nfs/dbraw/zinc/15/35/36/530153536.db2.gz DEQZKHTWSKCCKA-LLVKDONJSA-N -1 3 393.491 -1.466 20 0 GAADHM Cc1nc(S(=O)(=O)[N-]CC(=O)N2CCC[C@H](CS(N)(=O)=O)C2)cn1C ZINC000554295807 530153747 /nfs/dbraw/zinc/15/37/47/530153747.db2.gz DEQZKHTWSKCCKA-NSHDSACASA-N -1 3 393.491 -1.466 20 0 GAADHM CN(C)c1nc(C(=O)N2CCN(C(=O)CN3C(=O)CCC3=O)CC2)cc(=O)[n-]1 ZINC000555239618 1074401479 /nfs/dbraw/zinc/40/14/79/1074401479.db2.gz NVCGBTDWSFUULK-UHFFFAOYSA-N -1 3 390.400 -1.318 20 0 GAADHM CN(C)c1nc(C(=O)N2CCN(S(=O)(=O)c3nc[nH]n3)CC2)cc(=O)[n-]1 ZINC000555243410 1074401750 /nfs/dbraw/zinc/40/17/50/1074401750.db2.gz SLIXIKBDLQLPPM-UHFFFAOYSA-N -1 3 382.406 -1.487 20 0 GAADHM NS(=O)(=O)N1CCN(C(=O)CC[N-]S(=O)(=O)c2ccccc2F)CC1 ZINC000558118893 530075306 /nfs/dbraw/zinc/07/53/06/530075306.db2.gz BOAUKVIZIYRDGK-UHFFFAOYSA-N -1 3 394.450 -1.158 20 0 GAADHM Cn1cnc(S(=O)(=O)[N-]CC(=O)N2CCC[C@H](CS(N)(=O)=O)C2)c1 ZINC000558525788 530075161 /nfs/dbraw/zinc/07/51/61/530075161.db2.gz DXTBTZSMWYOAFM-JTQLQIEISA-N -1 3 379.464 -1.775 20 0 GAADHM Cn1cnc(S(=O)(=O)[N-]CC(=O)N2CCC[C@@H](CS(N)(=O)=O)C2)c1 ZINC000558525790 530075195 /nfs/dbraw/zinc/07/51/95/530075195.db2.gz DXTBTZSMWYOAFM-SNVBAGLBSA-N -1 3 379.464 -1.775 20 0 GAADHM Cc1noc(C)c1S(=O)(=O)[N-]CC(=O)N1CCC[C@H]1CS(N)(=O)=O ZINC000558529294 530075078 /nfs/dbraw/zinc/07/50/78/530075078.db2.gz YOFSJCJHLWZFLT-JTQLQIEISA-N -1 3 380.448 -1.151 20 0 GAADHM Cc1noc(C)c1S(=O)(=O)[N-]CC(=O)N1CCC[C@@H]1CS(N)(=O)=O ZINC000558529295 530075091 /nfs/dbraw/zinc/07/50/91/530075091.db2.gz YOFSJCJHLWZFLT-SNVBAGLBSA-N -1 3 380.448 -1.151 20 0 GAADHM CNC(=O)Cn1nc(NC(=O)C[N-]S(=O)(=O)c2c(C)noc2C)cc1C ZINC000558557350 1075698718 /nfs/dbraw/zinc/69/87/18/1075698718.db2.gz XJBNJGAWFXHQPV-UHFFFAOYSA-N -1 3 384.418 -0.541 20 0 GAADHM CN(C)c1nc(C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)cc(=O)[n-]1 ZINC000558937772 1075701402 /nfs/dbraw/zinc/70/14/02/1075701402.db2.gz PTWZWGHAMBOPKI-UHFFFAOYSA-N -1 3 378.433 -1.135 20 0 GAADHM CN(C)C(=O)Cn1nc2n(c1=O)CCN(C(=O)c1cc(=O)[n-]c(N(C)C)n1)C2 ZINC000559038339 1075701832 /nfs/dbraw/zinc/70/18/32/1075701832.db2.gz GGICHYOHQFZZIT-UHFFFAOYSA-N -1 3 390.404 -1.649 20 0 GAADHM Nc1nc(C(=O)NCCNC(=O)c2ccc([O-])cc2)nc(N2CCOCC2)n1 ZINC000561164070 1075711238 /nfs/dbraw/zinc/71/12/38/1075711238.db2.gz QRDUKPOLXIAOGH-UHFFFAOYSA-N -1 3 387.400 -0.844 20 0 GAADHM COC(=O)CNC(=O)CNC(=O)CC[N-]S(=O)(=O)c1ccccc1F ZINC000561522365 530079245 /nfs/dbraw/zinc/07/92/45/530079245.db2.gz DYJBKMCIUZFBIV-UHFFFAOYSA-N -1 3 375.378 -1.101 20 0 GAADHM Cn1cnc(S(=O)(=O)[N-]CC(=O)N2CCC[C@@H](CS(C)(=O)=O)C2)c1 ZINC000562144298 530079664 /nfs/dbraw/zinc/07/96/64/530079664.db2.gz AUAFDCHHORGDIU-LLVKDONJSA-N -1 3 378.476 -1.018 20 0 GAADHM Cn1cnc(S(=O)(=O)[N-]CC(=O)N2CCC[C@H](CS(C)(=O)=O)C2)c1 ZINC000562144300 530079668 /nfs/dbraw/zinc/07/96/68/530079668.db2.gz AUAFDCHHORGDIU-NSHDSACASA-N -1 3 378.476 -1.018 20 0 GAADHM CN(C)C(=O)Cn1cc([N-]S(=O)(=O)CCCS(=O)(=O)N(C)C)cn1 ZINC000562227347 530079677 /nfs/dbraw/zinc/07/96/77/530079677.db2.gz WWDLEZSICGBCFR-UHFFFAOYSA-N -1 3 381.480 -1.006 20 0 GAADHM COC(=O)CNC(=O)C[N-]S(=O)(=O)c1ccccc1S(=O)(=O)N(C)C ZINC000562534126 530079608 /nfs/dbraw/zinc/07/96/08/530079608.db2.gz ZDQGYIIZVSMJAN-UHFFFAOYSA-N -1 3 393.443 -1.496 20 0 GAADHM Cn1cnc(NC(=O)C(=O)NCC[N-]S(=O)(=O)c2ccc(F)cc2F)n1 ZINC000562837626 1074872130 /nfs/dbraw/zinc/87/21/30/1074872130.db2.gz RUTBHMGIIROEFX-UHFFFAOYSA-N -1 3 388.356 -0.874 20 0 GAADHM NC(=O)[C@H](CO)NC(=O)C[N-]S(=O)(=O)c1ccc(Br)s1 ZINC000562866588 530080177 /nfs/dbraw/zinc/08/01/77/530080177.db2.gz LSXZGKAQWCAQIL-YFKPBYRVSA-N -1 3 386.249 -1.249 20 0 GAADHM CN(C)S(=O)(=O)NCCNC(=O)C[N-]S(=O)(=O)c1ccccc1F ZINC000563193935 530091692 /nfs/dbraw/zinc/09/16/92/530091692.db2.gz ISXWRPLLSPHYMK-UHFFFAOYSA-N -1 3 382.439 -1.384 20 0 GAADHM COC(=O)c1nc[n-]c1NC(=O)CCn1cnc2c1c(=O)n(C)c(=O)n2C ZINC000563360080 1073595779 /nfs/dbraw/zinc/59/57/79/1073595779.db2.gz YIQOAAVZTXMXGP-UHFFFAOYSA-N -1 3 375.345 -1.028 20 0 GAADHM COC(=O)c1[n-]cnc1NC(=O)CCn1cnc2c1c(=O)n(C)c(=O)n2C ZINC000563360080 1073595768 /nfs/dbraw/zinc/59/57/68/1073595768.db2.gz YIQOAAVZTXMXGP-UHFFFAOYSA-N -1 3 375.345 -1.028 20 0 GAADHM Cc1nc(S(=O)(=O)[N-]CC(=O)N[C@H]2CCN(S(C)(=O)=O)C2)cn1C ZINC000563721741 530101070 /nfs/dbraw/zinc/10/10/70/530101070.db2.gz JQFSQPIRECOFCV-JTQLQIEISA-N -1 3 379.464 -1.843 20 0 GAADHM Cc1nc(S(=O)(=O)[N-]CC(=O)N[C@@H]2CCN(S(C)(=O)=O)C2)cn1C ZINC000563721770 530101008 /nfs/dbraw/zinc/10/10/08/530101008.db2.gz JQFSQPIRECOFCV-SNVBAGLBSA-N -1 3 379.464 -1.843 20 0 GAADHM CC(=O)NCc1ccc(S(=O)(=O)[N-]CC(=O)N2CC(C)(C(N)=O)C2)s1 ZINC000563888128 530101078 /nfs/dbraw/zinc/10/10/78/530101078.db2.gz DUWSGBBAEJFSCP-UHFFFAOYSA-N -1 3 388.471 -1.004 20 0 GAADHM C[N-]S(=O)(=O)c1ccccc1S(=O)(=O)N(CCO)CCOCCO ZINC000564351846 530151198 /nfs/dbraw/zinc/15/11/98/530151198.db2.gz QKQWKBCYWWXGGT-UHFFFAOYSA-N -1 3 382.460 -1.413 20 0 GAADHM Cc1nc(S(=O)(=O)[N-]CCC(=O)N[C@@H]2CS(=O)(=O)C[C@@H]2C)cn1C ZINC000564537385 530154436 /nfs/dbraw/zinc/15/44/36/530154436.db2.gz SXHIYZBUSNSDGL-GXSJLCMTSA-N -1 3 378.476 -1.054 20 0 GAADHM Cn1ccc(NCCN=c2cc(NCCNc3ccn(C)n3)n3[n-]cnc3n2)n1 ZINC000564794960 1075728274 /nfs/dbraw/zinc/72/82/74/1075728274.db2.gz DRTRENKHFWRRAH-UHFFFAOYSA-N -1 3 396.463 -1.095 20 0 GAADHM CCS(=O)(=O)N1CCN(C(=O)C[N-]S(=O)(=O)c2cn(C)cn2)[C@H](C)C1 ZINC000565081259 530154260 /nfs/dbraw/zinc/15/42/60/530154260.db2.gz MOHCYLDYYBRRNA-LLVKDONJSA-N -1 3 393.491 -1.419 20 0 GAADHM CS(=O)(=O)c1ccc(S(=O)(=O)[N-][C@@H]2CCN(S(C)(=O)=O)C2)cn1 ZINC000565082658 530154383 /nfs/dbraw/zinc/15/43/83/530154383.db2.gz GOVOIUKOWCEQKM-SECBINFHSA-N -1 3 383.473 -1.203 20 0 GAADHM CS(=O)(=O)c1ccc(S(=O)(=O)[N-][C@H]2CCN(S(C)(=O)=O)C2)cn1 ZINC000565082662 530154073 /nfs/dbraw/zinc/15/40/73/530154073.db2.gz GOVOIUKOWCEQKM-VIFPVBQESA-N -1 3 383.473 -1.203 20 0 GAADHM CCNS(=O)(=O)c1ccccc1S(=O)(=O)[N-][C@]1(C(N)=O)CCOC1 ZINC000565219949 530154800 /nfs/dbraw/zinc/15/48/00/530154800.db2.gz CCLLKDVIXMXBJK-CYBMUJFWSA-N -1 3 377.444 -1.093 20 0 GAADHM CCNS(=O)(=O)c1ccccc1S(=O)(=O)[N-][C@@]1(C(N)=O)CCOC1 ZINC000565219952 530155061 /nfs/dbraw/zinc/15/50/61/530155061.db2.gz CCLLKDVIXMXBJK-ZDUSSCGKSA-N -1 3 377.444 -1.093 20 0 GAADHM CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)[N-]C[C@@H](O)Cn1ccnn1 ZINC000565236985 530154938 /nfs/dbraw/zinc/15/49/38/530154938.db2.gz XUSHZWQNQCZGCA-LLVKDONJSA-N -1 3 389.459 -1.132 20 0 GAADHM CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)[N-]C[C@H](O)Cn1ccnn1 ZINC000565236988 530155141 /nfs/dbraw/zinc/15/51/41/530155141.db2.gz XUSHZWQNQCZGCA-NSHDSACASA-N -1 3 389.459 -1.132 20 0 GAADHM Cn1c(=O)cc(Cn2cc(I)c(=O)[n-]c2=O)n(C)c1=O ZINC000565430756 530155089 /nfs/dbraw/zinc/15/50/89/530155089.db2.gz GASZNLUFLXGQQJ-UHFFFAOYSA-N -1 3 390.137 -1.001 20 0 GAADHM C[N-]S(=O)(=O)c1ccc(C(=O)N2CCC(NS(=O)(=O)NC)CC2)cn1 ZINC000565486269 530154772 /nfs/dbraw/zinc/15/47/72/530154772.db2.gz JTTQQIGEJOADEA-UHFFFAOYSA-N -1 3 391.475 -1.352 20 0 GAADHM CN(C)S(=O)(=O)NCCNC(=O)Cn1cc(Br)c(=O)[n-]c1=O ZINC000565795555 530154822 /nfs/dbraw/zinc/15/48/22/530154822.db2.gz NXHKDRJOHHMUNN-UHFFFAOYSA-N -1 3 398.239 -1.776 20 0 GAADHM COC(=O)CNC(=O)CNC(=O)Cn1cc(Br)c(=O)[n-]c1=O ZINC000565880424 530154957 /nfs/dbraw/zinc/15/49/57/530154957.db2.gz KJVAAQXLDFXFFO-UHFFFAOYSA-N -1 3 377.151 -1.883 20 0 GAADHM CS(=O)(=O)N1CC[C@@H](NC(=O)Cn2cc(Br)c(=O)[n-]c2=O)C1 ZINC000566074284 530154907 /nfs/dbraw/zinc/15/49/07/530154907.db2.gz VFCBFQDAZSISPR-SSDOTTSWSA-N -1 3 395.235 -1.139 20 0 GAADHM CS(=O)(=O)N1CC[C@H](NC(=O)Cn2cc(Br)c(=O)[n-]c2=O)C1 ZINC000566074285 530154975 /nfs/dbraw/zinc/15/49/75/530154975.db2.gz VFCBFQDAZSISPR-ZETCQYMHSA-N -1 3 395.235 -1.139 20 0 GAADHM C[N-]S(=O)(=O)c1ccc(C(=O)N2CC(S(=O)(=O)N3CCNCC3)C2)o1 ZINC000566209789 530077268 /nfs/dbraw/zinc/07/72/68/530077268.db2.gz ZIYYHTDBQUZGBF-UHFFFAOYSA-N -1 3 392.459 -1.753 20 0 GAADHM CCN1CCN(C(=O)CNC(=O)C[N-]S(=O)(=O)c2c(C)noc2C)CC1 ZINC000566286521 1075733259 /nfs/dbraw/zinc/73/32/59/1075733259.db2.gz LMUDYIJUGJVXBZ-UHFFFAOYSA-N -1 3 387.462 -1.150 20 0 GAADHM Cc1nc(S(=O)(=O)[N-]CCC(=O)NCCNS(=O)(=O)N(C)C)cn1C ZINC000566402844 530154917 /nfs/dbraw/zinc/15/49/17/530154917.db2.gz ICMQPDFHEKQZGJ-UHFFFAOYSA-N -1 3 396.495 -2.091 20 0 GAADHM NC(=O)[C@@]1([N-]S(=O)(=O)CCNS(=O)(=O)c2ccccc2)CCOC1 ZINC000566478434 530078882 /nfs/dbraw/zinc/07/88/82/530078882.db2.gz PTBIHZVWYPPKRN-CYBMUJFWSA-N -1 3 377.444 -1.471 20 0 GAADHM NC(=O)[C@]1([N-]S(=O)(=O)CCNS(=O)(=O)c2ccccc2)CCOC1 ZINC000566478442 530079103 /nfs/dbraw/zinc/07/91/03/530079103.db2.gz PTBIHZVWYPPKRN-ZDUSSCGKSA-N -1 3 377.444 -1.471 20 0 GAADHM Cn1cnc(S(=O)(=O)[N-]CC(=O)N(CCNS(C)(=O)=O)C2CC2)c1 ZINC000566705050 530155880 /nfs/dbraw/zinc/15/58/80/530155880.db2.gz BYHIYFRGDPSITE-UHFFFAOYSA-N -1 3 379.464 -1.761 20 0 GAADHM Cn1cc(NC(=O)Cn2cc(Br)c(=O)[n-]c2=O)c(=O)n(C)c1=O ZINC000566765408 530155665 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WAYKJHYVLHKPLS-GHMZBOCLSA-N -1 3 384.400 -1.164 20 0 GAADHM C[C@H](C(=O)Nc1ccccc1-c1nnn[n-]1)N1CCN2C(=O)C(=O)NC[C@@H]2C1 ZINC000819877436 606153162 /nfs/dbraw/zinc/15/31/62/606153162.db2.gz WAYKJHYVLHKPLS-GHMZBOCLSA-N -1 3 384.400 -1.164 20 0 GAADHM C[C@H](C(=O)Nc1ccccc1-c1nn[n-]n1)N1CCN2C(=O)C(=O)NC[C@H]2C1 ZINC000819877437 606153024 /nfs/dbraw/zinc/15/30/24/606153024.db2.gz WAYKJHYVLHKPLS-MNOVXSKESA-N -1 3 384.400 -1.164 20 0 GAADHM C[C@H](C(=O)Nc1ccccc1-c1nnn[n-]1)N1CCN2C(=O)C(=O)NC[C@H]2C1 ZINC000819877437 606153023 /nfs/dbraw/zinc/15/30/23/606153023.db2.gz WAYKJHYVLHKPLS-MNOVXSKESA-N -1 3 384.400 -1.164 20 0 GAADHM C[C@@H](C(=O)Nc1ccccc1-c1nn[n-]n1)N1CCN2C(=O)C(=O)NC[C@H]2C1 ZINC000819877438 606153099 /nfs/dbraw/zinc/15/30/99/606153099.db2.gz WAYKJHYVLHKPLS-QWRGUYRKSA-N -1 3 384.400 -1.164 20 0 GAADHM C[C@@H](C(=O)Nc1ccccc1-c1nnn[n-]1)N1CCN2C(=O)C(=O)NC[C@H]2C1 ZINC000819877438 606153098 /nfs/dbraw/zinc/15/30/98/606153098.db2.gz WAYKJHYVLHKPLS-QWRGUYRKSA-N -1 3 384.400 -1.164 20 0 GAADHM C[C@@H](C(=O)Nc1ccccc1-c1nn[n-]n1)N1CCN2C(=O)C(=O)NC[C@@H]2C1 ZINC000819877439 606152955 /nfs/dbraw/zinc/15/29/55/606152955.db2.gz WAYKJHYVLHKPLS-WDEREUQCSA-N -1 3 384.400 -1.164 20 0 GAADHM C[C@@H](C(=O)Nc1ccccc1-c1nnn[n-]1)N1CCN2C(=O)C(=O)NC[C@@H]2C1 ZINC000819877439 606152953 /nfs/dbraw/zinc/15/29/53/606152953.db2.gz WAYKJHYVLHKPLS-WDEREUQCSA-N -1 3 384.400 -1.164 20 0 GAADHM C[C@@H](C(=O)Nc1cccc(-c2nn[n-]n2)c1)N1CCN2C(=O)C(=O)NC[C@H]2C1 ZINC000819877635 606153048 /nfs/dbraw/zinc/15/30/48/606153048.db2.gz ZKWPPQYHSNAXOR-GWCFXTLKSA-N -1 3 384.400 -1.164 20 0 GAADHM C[C@@H](C(=O)Nc1cccc(-c2nnn[n-]2)c1)N1CCN2C(=O)C(=O)NC[C@H]2C1 ZINC000819877635 606153047 /nfs/dbraw/zinc/15/30/47/606153047.db2.gz ZKWPPQYHSNAXOR-GWCFXTLKSA-N -1 3 384.400 -1.164 20 0 GAADHM C[C@@H](C(=O)Nc1cccc(-c2nn[n-]n2)c1)N1CCN2C(=O)C(=O)NC[C@@H]2C1 ZINC000819877637 606153145 /nfs/dbraw/zinc/15/31/45/606153145.db2.gz ZKWPPQYHSNAXOR-GXFFZTMASA-N -1 3 384.400 -1.164 20 0 GAADHM C[C@@H](C(=O)Nc1cccc(-c2nnn[n-]2)c1)N1CCN2C(=O)C(=O)NC[C@@H]2C1 ZINC000819877637 606153144 /nfs/dbraw/zinc/15/31/44/606153144.db2.gz ZKWPPQYHSNAXOR-GXFFZTMASA-N -1 3 384.400 -1.164 20 0 GAADHM C[C@H](C(=O)Nc1cccc(-c2nn[n-]n2)c1)N1CCN2C(=O)C(=O)NC[C@H]2C1 ZINC000819877638 606153012 /nfs/dbraw/zinc/15/30/12/606153012.db2.gz ZKWPPQYHSNAXOR-MFKMUULPSA-N -1 3 384.400 -1.164 20 0 GAADHM C[C@H](C(=O)Nc1cccc(-c2nnn[n-]2)c1)N1CCN2C(=O)C(=O)NC[C@H]2C1 ZINC000819877638 606153011 /nfs/dbraw/zinc/15/30/11/606153011.db2.gz ZKWPPQYHSNAXOR-MFKMUULPSA-N -1 3 384.400 -1.164 20 0 GAADHM C[C@H](C(=O)Nc1cccc(-c2nn[n-]n2)c1)N1CCN2C(=O)C(=O)NC[C@@H]2C1 ZINC000819877640 606153179 /nfs/dbraw/zinc/15/31/79/606153179.db2.gz ZKWPPQYHSNAXOR-ZWNOBZJWSA-N -1 3 384.400 -1.164 20 0 GAADHM C[C@H](C(=O)Nc1cccc(-c2nnn[n-]2)c1)N1CCN2C(=O)C(=O)NC[C@@H]2C1 ZINC000819877640 606153177 /nfs/dbraw/zinc/15/31/77/606153177.db2.gz ZKWPPQYHSNAXOR-ZWNOBZJWSA-N -1 3 384.400 -1.164 20 0 GAADHM CC(C)(C(N)=O)N1CCN(c2ccc(S(N)(=O)=O)cc2-c2nn[n-]n2)CC1 ZINC000819891612 606197952 /nfs/dbraw/zinc/19/79/52/606197952.db2.gz DGDZIYXXHCLZHI-UHFFFAOYSA-N -1 3 394.461 -1.100 20 0 GAADHM CC(C)(C(N)=O)N1CCN(c2ccc(S(N)(=O)=O)cc2-c2nnn[n-]2)CC1 ZINC000819891612 606197951 /nfs/dbraw/zinc/19/79/51/606197951.db2.gz DGDZIYXXHCLZHI-UHFFFAOYSA-N -1 3 394.461 -1.100 20 0 GAADHM CC(C)Oc1ccc(-c2nn[n-]n2)cc1NC(=O)C(=O)NCCS(N)(=O)=O ZINC000820151415 606174113 /nfs/dbraw/zinc/17/41/13/606174113.db2.gz GUWVEARGCXQMCN-UHFFFAOYSA-N -1 3 397.417 -1.003 20 0 GAADHM CC(C)Oc1ccc(-c2nnn[n-]2)cc1NC(=O)C(=O)NCCS(N)(=O)=O ZINC000820151415 606174112 /nfs/dbraw/zinc/17/41/12/606174112.db2.gz GUWVEARGCXQMCN-UHFFFAOYSA-N -1 3 397.417 -1.003 20 0 GAADHM C[C@H](CC(N)=O)NC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000820225196 607044378 /nfs/dbraw/zinc/04/43/78/607044378.db2.gz CYGQGUVHOXJHFE-BDAKNGLRSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@H](CC(N)=O)NC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000820225196 607044376 /nfs/dbraw/zinc/04/43/76/607044376.db2.gz CYGQGUVHOXJHFE-BDAKNGLRSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H](C)CC(N)=O ZINC000820225197 607044150 /nfs/dbraw/zinc/04/41/50/607044150.db2.gz CYGQGUVHOXJHFE-DTWKUNHWSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H](C)CC(N)=O ZINC000820225197 607044148 /nfs/dbraw/zinc/04/41/48/607044148.db2.gz CYGQGUVHOXJHFE-DTWKUNHWSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@@H](CC(N)=O)NC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000820225198 607044144 /nfs/dbraw/zinc/04/41/44/607044144.db2.gz CYGQGUVHOXJHFE-IUCAKERBSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@@H](CC(N)=O)NC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000820225198 607044142 /nfs/dbraw/zinc/04/41/42/607044142.db2.gz CYGQGUVHOXJHFE-IUCAKERBSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@H](CC(N)=O)NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000820225199 607044361 /nfs/dbraw/zinc/04/43/61/607044361.db2.gz CYGQGUVHOXJHFE-RKDXNWHRSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@H](CC(N)=O)NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000820225199 607044358 /nfs/dbraw/zinc/04/43/58/607044358.db2.gz CYGQGUVHOXJHFE-RKDXNWHRSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@H](CC(N)=O)NC(=O)[C@H](C)NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000820225598 607044173 /nfs/dbraw/zinc/04/41/73/607044173.db2.gz MJQILAJYAVKRSU-BDAKNGLRSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@H](CC(N)=O)NC(=O)[C@H](C)NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000820225598 607044170 /nfs/dbraw/zinc/04/41/70/607044170.db2.gz MJQILAJYAVKRSU-BDAKNGLRSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@@H](C)CC(N)=O ZINC000820225599 607044201 /nfs/dbraw/zinc/04/42/01/607044201.db2.gz MJQILAJYAVKRSU-DTWKUNHWSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@@H](C)CC(N)=O ZINC000820225599 607044199 /nfs/dbraw/zinc/04/41/99/607044199.db2.gz MJQILAJYAVKRSU-DTWKUNHWSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@@H](CC(N)=O)NC(=O)[C@H](C)NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000820225600 607044043 /nfs/dbraw/zinc/04/40/43/607044043.db2.gz MJQILAJYAVKRSU-IUCAKERBSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@@H](CC(N)=O)NC(=O)[C@H](C)NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000820225600 607044042 /nfs/dbraw/zinc/04/40/42/607044042.db2.gz MJQILAJYAVKRSU-IUCAKERBSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@H](CC(N)=O)NC(=O)[C@@H](C)NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000820225601 607044277 /nfs/dbraw/zinc/04/42/77/607044277.db2.gz MJQILAJYAVKRSU-RKDXNWHRSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@H](CC(N)=O)NC(=O)[C@@H](C)NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000820225601 607044275 /nfs/dbraw/zinc/04/42/75/607044275.db2.gz MJQILAJYAVKRSU-RKDXNWHRSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@@H](NC(=O)c1cc(-c2nn[n-]n2)cn1C)C(=O)N1CCS(=O)(=O)CC1 ZINC000820386350 606285143 /nfs/dbraw/zinc/28/51/43/606285143.db2.gz YIIGEOUSCQSUEV-SECBINFHSA-N -1 3 381.418 -1.420 20 0 GAADHM C[C@@H](NC(=O)c1cc(-c2nnn[n-]2)cn1C)C(=O)N1CCS(=O)(=O)CC1 ZINC000820386350 606285142 /nfs/dbraw/zinc/28/51/42/606285142.db2.gz YIIGEOUSCQSUEV-SECBINFHSA-N -1 3 381.418 -1.420 20 0 GAADHM C[C@H](NC(=O)c1cc(-c2nn[n-]n2)cn1C)C(=O)N1CCS(=O)(=O)CC1 ZINC000820386351 606285781 /nfs/dbraw/zinc/28/57/81/606285781.db2.gz YIIGEOUSCQSUEV-VIFPVBQESA-N -1 3 381.418 -1.420 20 0 GAADHM C[C@H](NC(=O)c1cc(-c2nnn[n-]2)cn1C)C(=O)N1CCS(=O)(=O)CC1 ZINC000820386351 606285780 /nfs/dbraw/zinc/28/57/80/606285780.db2.gz YIIGEOUSCQSUEV-VIFPVBQESA-N -1 3 381.418 -1.420 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CC[C@@H](C(N)=O)C1 ZINC000820437597 607022326 /nfs/dbraw/zinc/02/23/26/607022326.db2.gz AFSUAXWVZLTWMV-GXSJLCMTSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CC[C@@H](C(N)=O)C1 ZINC000820437597 607022324 /nfs/dbraw/zinc/02/23/24/607022324.db2.gz AFSUAXWVZLTWMV-GXSJLCMTSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CC[C@H](C(N)=O)C1 ZINC000820437598 607022728 /nfs/dbraw/zinc/02/27/28/607022728.db2.gz AFSUAXWVZLTWMV-KOLCDFICSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CC[C@H](C(N)=O)C1 ZINC000820437598 607022727 /nfs/dbraw/zinc/02/27/27/607022727.db2.gz AFSUAXWVZLTWMV-KOLCDFICSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CC[C@@H](C(N)=O)C1 ZINC000820437599 607022585 /nfs/dbraw/zinc/02/25/85/607022585.db2.gz AFSUAXWVZLTWMV-MWLCHTKSSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CC[C@@H](C(N)=O)C1 ZINC000820437599 607022583 /nfs/dbraw/zinc/02/25/83/607022583.db2.gz AFSUAXWVZLTWMV-MWLCHTKSSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CC[C@H](C(N)=O)C1 ZINC000820437600 607022692 /nfs/dbraw/zinc/02/26/92/607022692.db2.gz AFSUAXWVZLTWMV-ONGXEEELSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CC[C@H](C(N)=O)C1 ZINC000820437600 607022691 /nfs/dbraw/zinc/02/26/91/607022691.db2.gz AFSUAXWVZLTWMV-ONGXEEELSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCNC(=O)C1 ZINC000820437848 606981427 /nfs/dbraw/zinc/98/14/27/606981427.db2.gz DXIYTCIJSJWLDT-SECBINFHSA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CCNC(=O)C1 ZINC000820437848 606981425 /nfs/dbraw/zinc/98/14/25/606981425.db2.gz DXIYTCIJSJWLDT-SECBINFHSA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCNC(=O)C1 ZINC000820437849 606981718 /nfs/dbraw/zinc/98/17/18/606981718.db2.gz DXIYTCIJSJWLDT-VIFPVBQESA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CCNC(=O)C1 ZINC000820437849 606981716 /nfs/dbraw/zinc/98/17/16/606981716.db2.gz DXIYTCIJSJWLDT-VIFPVBQESA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NC1(C(N)=O)CC1 ZINC000820437964 607222984 /nfs/dbraw/zinc/22/29/84/607222984.db2.gz FGKMRUOXYKSUCB-MRVPVSSYSA-N -1 3 379.402 -1.332 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NC1(C(N)=O)CC1 ZINC000820437964 607222983 /nfs/dbraw/zinc/22/29/83/607222983.db2.gz FGKMRUOXYKSUCB-MRVPVSSYSA-N -1 3 379.402 -1.332 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NC1(C(N)=O)CC1 ZINC000820437965 607222875 /nfs/dbraw/zinc/22/28/75/607222875.db2.gz FGKMRUOXYKSUCB-QMMMGPOBSA-N -1 3 379.402 -1.332 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NC1(C(N)=O)CC1 ZINC000820437965 607222874 /nfs/dbraw/zinc/22/28/74/607222874.db2.gz FGKMRUOXYKSUCB-QMMMGPOBSA-N -1 3 379.402 -1.332 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CC(=O)N(C)C1 ZINC000820438010 607019787 /nfs/dbraw/zinc/01/97/87/607019787.db2.gz GGADOIVHMZVAHQ-GXSJLCMTSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CC(=O)N(C)C1 ZINC000820438010 607019786 /nfs/dbraw/zinc/01/97/86/607019786.db2.gz GGADOIVHMZVAHQ-GXSJLCMTSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1CC(=O)N(C)C1 ZINC000820438011 607019907 /nfs/dbraw/zinc/01/99/07/607019907.db2.gz GGADOIVHMZVAHQ-KOLCDFICSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1CC(=O)N(C)C1 ZINC000820438011 607019906 /nfs/dbraw/zinc/01/99/06/607019906.db2.gz GGADOIVHMZVAHQ-KOLCDFICSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CC(=O)N(C)C1 ZINC000820438012 607019842 /nfs/dbraw/zinc/01/98/42/607019842.db2.gz GGADOIVHMZVAHQ-MWLCHTKSSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CC(=O)N(C)C1 ZINC000820438012 607019841 /nfs/dbraw/zinc/01/98/41/607019841.db2.gz GGADOIVHMZVAHQ-MWLCHTKSSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1CC(=O)N(C)C1 ZINC000820438013 607019899 /nfs/dbraw/zinc/01/98/99/607019899.db2.gz GGADOIVHMZVAHQ-ONGXEEELSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1CC(=O)N(C)C1 ZINC000820438013 607019897 /nfs/dbraw/zinc/01/98/97/607019897.db2.gz GGADOIVHMZVAHQ-ONGXEEELSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NC(C)(C)C(N)=O ZINC000820438036 945448835 /nfs/dbraw/zinc/44/88/35/945448835.db2.gz GOYCYQBNMNGFJG-MRVPVSSYSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NC(C)(C)C(N)=O ZINC000820438036 945448830 /nfs/dbraw/zinc/44/88/30/945448830.db2.gz GOYCYQBNMNGFJG-MRVPVSSYSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NC(C)(C)C(N)=O ZINC000820438037 945449384 /nfs/dbraw/zinc/44/93/84/945449384.db2.gz GOYCYQBNMNGFJG-QMMMGPOBSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NC(C)(C)C(N)=O ZINC000820438037 945449378 /nfs/dbraw/zinc/44/93/78/945449378.db2.gz GOYCYQBNMNGFJG-QMMMGPOBSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCNC(=O)[C@H]1C ZINC000820438136 607019819 /nfs/dbraw/zinc/01/98/19/607019819.db2.gz JDPQUEIRVANEGQ-NXEZZACHSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CCNC(=O)[C@H]1C ZINC000820438136 607019817 /nfs/dbraw/zinc/01/98/17/607019817.db2.gz JDPQUEIRVANEGQ-NXEZZACHSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCNC(=O)[C@@H]1C ZINC000820438137 607019621 /nfs/dbraw/zinc/01/96/21/607019621.db2.gz JDPQUEIRVANEGQ-UWVGGRQHSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CCNC(=O)[C@@H]1C ZINC000820438137 607019620 /nfs/dbraw/zinc/01/96/20/607019620.db2.gz JDPQUEIRVANEGQ-UWVGGRQHSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCNC(=O)[C@H]1C ZINC000820438138 607019702 /nfs/dbraw/zinc/01/97/02/607019702.db2.gz JDPQUEIRVANEGQ-VHSXEESVSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CCNC(=O)[C@H]1C ZINC000820438138 607019701 /nfs/dbraw/zinc/01/97/01/607019701.db2.gz JDPQUEIRVANEGQ-VHSXEESVSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCNC(=O)[C@@H]1C ZINC000820438139 607019669 /nfs/dbraw/zinc/01/96/69/607019669.db2.gz JDPQUEIRVANEGQ-ZJUUUORDSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CCNC(=O)[C@@H]1C ZINC000820438139 607019668 /nfs/dbraw/zinc/01/96/68/607019668.db2.gz JDPQUEIRVANEGQ-ZJUUUORDSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1C[C@H](O)C[C@H](O)C1 ZINC000820438280 607052348 /nfs/dbraw/zinc/05/23/48/607052348.db2.gz LZZFMLYNAQGZDS-JLLWLGSASA-N -1 3 396.429 -1.512 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1C[C@H](O)C[C@H](O)C1 ZINC000820438280 607052347 /nfs/dbraw/zinc/05/23/47/607052347.db2.gz LZZFMLYNAQGZDS-JLLWLGSASA-N -1 3 396.429 -1.512 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1C[C@H](O)C[C@H](O)C1 ZINC000820438281 607052441 /nfs/dbraw/zinc/05/24/41/607052441.db2.gz LZZFMLYNAQGZDS-ZMLRMANQSA-N -1 3 396.429 -1.512 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1C[C@H](O)C[C@H](O)C1 ZINC000820438281 607052439 /nfs/dbraw/zinc/05/24/39/607052439.db2.gz LZZFMLYNAQGZDS-ZMLRMANQSA-N -1 3 396.429 -1.512 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CCN(C)C1=O ZINC000820438282 607041479 /nfs/dbraw/zinc/04/14/79/607041479.db2.gz MARLKIHDNNKKOD-BXKDBHETSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CCN(C)C1=O ZINC000820438282 607041477 /nfs/dbraw/zinc/04/14/77/607041477.db2.gz MARLKIHDNNKKOD-BXKDBHETSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1CCN(C)C1=O ZINC000820438283 607041462 /nfs/dbraw/zinc/04/14/62/607041462.db2.gz MARLKIHDNNKKOD-CABZTGNLSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1CCN(C)C1=O ZINC000820438283 607041460 /nfs/dbraw/zinc/04/14/60/607041460.db2.gz MARLKIHDNNKKOD-CABZTGNLSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CCN(C)C1=O ZINC000820438284 607041525 /nfs/dbraw/zinc/04/15/25/607041525.db2.gz MARLKIHDNNKKOD-JOYOIKCWSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CCN(C)C1=O ZINC000820438284 607041523 /nfs/dbraw/zinc/04/15/23/607041523.db2.gz MARLKIHDNNKKOD-JOYOIKCWSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1CCN(C)C1=O ZINC000820438285 607041202 /nfs/dbraw/zinc/04/12/02/607041202.db2.gz MARLKIHDNNKKOD-SKDRFNHKSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1CCN(C)C1=O ZINC000820438285 607041201 /nfs/dbraw/zinc/04/12/01/607041201.db2.gz MARLKIHDNNKKOD-SKDRFNHKSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCN(C)C(=O)C1 ZINC000820438452 607042305 /nfs/dbraw/zinc/04/23/05/607042305.db2.gz PXBYHFLCJSZVMN-JTQLQIEISA-N -1 3 393.429 -1.166 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CCN(C)C(=O)C1 ZINC000820438452 607042303 /nfs/dbraw/zinc/04/23/03/607042303.db2.gz PXBYHFLCJSZVMN-JTQLQIEISA-N -1 3 393.429 -1.166 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCN(C)C(=O)C1 ZINC000820438453 607042492 /nfs/dbraw/zinc/04/24/92/607042492.db2.gz PXBYHFLCJSZVMN-SNVBAGLBSA-N -1 3 393.429 -1.166 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CCN(C)C(=O)C1 ZINC000820438453 607042491 /nfs/dbraw/zinc/04/24/91/607042491.db2.gz PXBYHFLCJSZVMN-SNVBAGLBSA-N -1 3 393.429 -1.166 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCC(=O)N(C)C ZINC000820438652 606983681 /nfs/dbraw/zinc/98/36/81/606983681.db2.gz UCBOIAFAQXGNBA-SECBINFHSA-N -1 3 381.418 -1.262 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCC(=O)N(C)C ZINC000820438652 606983679 /nfs/dbraw/zinc/98/36/79/606983679.db2.gz UCBOIAFAQXGNBA-SECBINFHSA-N -1 3 381.418 -1.262 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCC(=O)N(C)C ZINC000820438653 606983687 /nfs/dbraw/zinc/98/36/87/606983687.db2.gz UCBOIAFAQXGNBA-VIFPVBQESA-N -1 3 381.418 -1.262 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCC(=O)N(C)C ZINC000820438653 606983686 /nfs/dbraw/zinc/98/36/86/606983686.db2.gz UCBOIAFAQXGNBA-VIFPVBQESA-N -1 3 381.418 -1.262 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCO[C@@H](CO)C1 ZINC000820438664 607234233 /nfs/dbraw/zinc/23/42/33/607234233.db2.gz UJYKVTJWXDYTLU-CMPLNLGQSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CCO[C@@H](CO)C1 ZINC000820438664 607234232 /nfs/dbraw/zinc/23/42/32/607234232.db2.gz UJYKVTJWXDYTLU-CMPLNLGQSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCO[C@H](CO)C1 ZINC000820438665 607234005 /nfs/dbraw/zinc/23/40/05/607234005.db2.gz UJYKVTJWXDYTLU-JQWIXIFHSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CCO[C@H](CO)C1 ZINC000820438665 607234004 /nfs/dbraw/zinc/23/40/04/607234004.db2.gz UJYKVTJWXDYTLU-JQWIXIFHSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCO[C@H](CO)C1 ZINC000820438666 607233952 /nfs/dbraw/zinc/23/39/52/607233952.db2.gz UJYKVTJWXDYTLU-PWSUYJOCSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CCO[C@H](CO)C1 ZINC000820438666 607233951 /nfs/dbraw/zinc/23/39/51/607233951.db2.gz UJYKVTJWXDYTLU-PWSUYJOCSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCO[C@@H](CO)C1 ZINC000820438667 607233966 /nfs/dbraw/zinc/23/39/66/607233966.db2.gz UJYKVTJWXDYTLU-ZYHUDNBSSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CCO[C@@H](CO)C1 ZINC000820438667 607233965 /nfs/dbraw/zinc/23/39/65/607233965.db2.gz UJYKVTJWXDYTLU-ZYHUDNBSSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NC1=NCC(=O)N1 ZINC000820438686 607025715 /nfs/dbraw/zinc/02/57/15/607025715.db2.gz UUCNIIAQMVAFKI-SSDOTTSWSA-N -1 3 378.374 -1.865 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NC1=NCC(=O)N1 ZINC000820438686 607025714 /nfs/dbraw/zinc/02/57/14/607025714.db2.gz UUCNIIAQMVAFKI-SSDOTTSWSA-N -1 3 378.374 -1.865 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NC1=NCC(=O)N1 ZINC000820438687 607025796 /nfs/dbraw/zinc/02/57/96/607025796.db2.gz UUCNIIAQMVAFKI-ZETCQYMHSA-N -1 3 378.374 -1.865 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NC1=NCC(=O)N1 ZINC000820438687 607025794 /nfs/dbraw/zinc/02/57/94/607025794.db2.gz UUCNIIAQMVAFKI-ZETCQYMHSA-N -1 3 378.374 -1.865 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CCCNC1=O ZINC000820438796 607016232 /nfs/dbraw/zinc/01/62/32/607016232.db2.gz WTMPMPJZRTWSTF-BXKDBHETSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CCCNC1=O ZINC000820438796 607016230 /nfs/dbraw/zinc/01/62/30/607016230.db2.gz WTMPMPJZRTWSTF-BXKDBHETSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1CCCNC1=O ZINC000820438797 607016516 /nfs/dbraw/zinc/01/65/16/607016516.db2.gz WTMPMPJZRTWSTF-CABZTGNLSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1CCCNC1=O ZINC000820438797 607016513 /nfs/dbraw/zinc/01/65/13/607016513.db2.gz WTMPMPJZRTWSTF-CABZTGNLSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CCCNC1=O ZINC000820438798 607016370 /nfs/dbraw/zinc/01/63/70/607016370.db2.gz WTMPMPJZRTWSTF-JOYOIKCWSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CCCNC1=O ZINC000820438798 607016368 /nfs/dbraw/zinc/01/63/68/607016368.db2.gz WTMPMPJZRTWSTF-JOYOIKCWSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1CCCNC1=O ZINC000820438799 607016431 /nfs/dbraw/zinc/01/64/31/607016431.db2.gz WTMPMPJZRTWSTF-SKDRFNHKSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1CCCNC1=O ZINC000820438799 607016429 /nfs/dbraw/zinc/01/64/29/607016429.db2.gz WTMPMPJZRTWSTF-SKDRFNHKSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCNC(=O)CC1 ZINC000820438820 945449101 /nfs/dbraw/zinc/44/91/01/945449101.db2.gz XIRRQHNSUOJAMB-JTQLQIEISA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CCNC(=O)CC1 ZINC000820438820 945449092 /nfs/dbraw/zinc/44/90/92/945449092.db2.gz XIRRQHNSUOJAMB-JTQLQIEISA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCNC(=O)CC1 ZINC000820438821 945449489 /nfs/dbraw/zinc/44/94/89/945449489.db2.gz XIRRQHNSUOJAMB-SNVBAGLBSA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CCNC(=O)CC1 ZINC000820438821 945449485 /nfs/dbraw/zinc/44/94/85/945449485.db2.gz XIRRQHNSUOJAMB-SNVBAGLBSA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCC(=O)NC1CC1 ZINC000820438844 606983570 /nfs/dbraw/zinc/98/35/70/606983570.db2.gz XWKPDFJOPDMTOI-SECBINFHSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCC(=O)NC1CC1 ZINC000820438844 606983569 /nfs/dbraw/zinc/98/35/69/606983569.db2.gz XWKPDFJOPDMTOI-SECBINFHSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCC(=O)NC1CC1 ZINC000820438845 606983578 /nfs/dbraw/zinc/98/35/78/606983578.db2.gz XWKPDFJOPDMTOI-VIFPVBQESA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCC(=O)NC1CC1 ZINC000820438845 606983577 /nfs/dbraw/zinc/98/35/77/606983577.db2.gz XWKPDFJOPDMTOI-VIFPVBQESA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCCNC(=O)C1 ZINC000820438872 607019994 /nfs/dbraw/zinc/01/99/94/607019994.db2.gz YLQMTOZNAHPHNE-JTQLQIEISA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CCCNC(=O)C1 ZINC000820438872 607019992 /nfs/dbraw/zinc/01/99/92/607019992.db2.gz YLQMTOZNAHPHNE-JTQLQIEISA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCCNC(=O)C1 ZINC000820438873 607019826 /nfs/dbraw/zinc/01/98/26/607019826.db2.gz YLQMTOZNAHPHNE-SNVBAGLBSA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CCCNC(=O)C1 ZINC000820438873 607019824 /nfs/dbraw/zinc/01/98/24/607019824.db2.gz YLQMTOZNAHPHNE-SNVBAGLBSA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CCNC(=O)C1 ZINC000820443883 606981702 /nfs/dbraw/zinc/98/17/02/606981702.db2.gz ALODHTQTIPBDOC-SECBINFHSA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CCNC(=O)C1 ZINC000820443883 606981700 /nfs/dbraw/zinc/98/17/00/606981700.db2.gz ALODHTQTIPBDOC-SECBINFHSA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CCNC(=O)C1 ZINC000820443884 606981655 /nfs/dbraw/zinc/98/16/55/606981655.db2.gz ALODHTQTIPBDOC-VIFPVBQESA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CCNC(=O)C1 ZINC000820443884 606981654 /nfs/dbraw/zinc/98/16/54/606981654.db2.gz ALODHTQTIPBDOC-VIFPVBQESA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCCn1cncn1 ZINC000820443891 607019632 /nfs/dbraw/zinc/01/96/32/607019632.db2.gz ANCKBBVQUHAWIY-JTQLQIEISA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCCn1cncn1 ZINC000820443891 607019631 /nfs/dbraw/zinc/01/96/31/607019631.db2.gz ANCKBBVQUHAWIY-JTQLQIEISA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCCn1cncn1 ZINC000820443892 607019740 /nfs/dbraw/zinc/01/97/40/607019740.db2.gz ANCKBBVQUHAWIY-SNVBAGLBSA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCCn1cncn1 ZINC000820443892 607019739 /nfs/dbraw/zinc/01/97/39/607019739.db2.gz ANCKBBVQUHAWIY-SNVBAGLBSA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CCN(C)C(=O)C1 ZINC000820443905 607042553 /nfs/dbraw/zinc/04/25/53/607042553.db2.gz ATACPGSVRWSQNU-JTQLQIEISA-N -1 3 393.429 -1.166 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CCN(C)C(=O)C1 ZINC000820443905 607042552 /nfs/dbraw/zinc/04/25/52/607042552.db2.gz ATACPGSVRWSQNU-JTQLQIEISA-N -1 3 393.429 -1.166 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CCN(C)C(=O)C1 ZINC000820443906 607042450 /nfs/dbraw/zinc/04/24/50/607042450.db2.gz ATACPGSVRWSQNU-SNVBAGLBSA-N -1 3 393.429 -1.166 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CCN(C)C(=O)C1 ZINC000820443906 607042449 /nfs/dbraw/zinc/04/24/49/607042449.db2.gz ATACPGSVRWSQNU-SNVBAGLBSA-N -1 3 393.429 -1.166 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1C[C@H](O)C[C@H](O)C1 ZINC000820443959 607052131 /nfs/dbraw/zinc/05/21/31/607052131.db2.gz CEKXXRBRILHVBF-JLLWLGSASA-N -1 3 396.429 -1.512 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1C[C@H](O)C[C@H](O)C1 ZINC000820443959 607052129 /nfs/dbraw/zinc/05/21/29/607052129.db2.gz CEKXXRBRILHVBF-JLLWLGSASA-N -1 3 396.429 -1.512 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1C[C@H](O)C[C@H](O)C1 ZINC000820443960 607051980 /nfs/dbraw/zinc/05/19/80/607051980.db2.gz CEKXXRBRILHVBF-ZMLRMANQSA-N -1 3 396.429 -1.512 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1C[C@H](O)C[C@H](O)C1 ZINC000820443960 607051978 /nfs/dbraw/zinc/05/19/78/607051978.db2.gz CEKXXRBRILHVBF-ZMLRMANQSA-N -1 3 396.429 -1.512 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCCCC(N)=O ZINC000820444059 606995407 /nfs/dbraw/zinc/99/54/07/606995407.db2.gz FCQZLBNKZVUAEV-SECBINFHSA-N -1 3 381.418 -1.085 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCCCC(N)=O ZINC000820444059 606995406 /nfs/dbraw/zinc/99/54/06/606995406.db2.gz FCQZLBNKZVUAEV-SECBINFHSA-N -1 3 381.418 -1.085 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCCCC(N)=O ZINC000820444060 606995347 /nfs/dbraw/zinc/99/53/47/606995347.db2.gz FCQZLBNKZVUAEV-VIFPVBQESA-N -1 3 381.418 -1.085 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCCCC(N)=O ZINC000820444060 606995346 /nfs/dbraw/zinc/99/53/46/606995346.db2.gz FCQZLBNKZVUAEV-VIFPVBQESA-N -1 3 381.418 -1.085 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CC[C@@H](C(N)=O)C1 ZINC000820444065 607022682 /nfs/dbraw/zinc/02/26/82/607022682.db2.gz FINMVSNYRVWYKT-GXSJLCMTSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CC[C@@H](C(N)=O)C1 ZINC000820444065 607022681 /nfs/dbraw/zinc/02/26/81/607022681.db2.gz FINMVSNYRVWYKT-GXSJLCMTSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CC[C@H](C(N)=O)C1 ZINC000820444066 607022590 /nfs/dbraw/zinc/02/25/90/607022590.db2.gz FINMVSNYRVWYKT-KOLCDFICSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CC[C@H](C(N)=O)C1 ZINC000820444066 607022589 /nfs/dbraw/zinc/02/25/89/607022589.db2.gz FINMVSNYRVWYKT-KOLCDFICSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CC[C@@H](C(N)=O)C1 ZINC000820444067 607022304 /nfs/dbraw/zinc/02/23/04/607022304.db2.gz FINMVSNYRVWYKT-MWLCHTKSSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CC[C@@H](C(N)=O)C1 ZINC000820444067 607022302 /nfs/dbraw/zinc/02/23/02/607022302.db2.gz FINMVSNYRVWYKT-MWLCHTKSSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CC[C@H](C(N)=O)C1 ZINC000820444068 607022396 /nfs/dbraw/zinc/02/23/96/607022396.db2.gz FINMVSNYRVWYKT-ONGXEEELSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CC[C@H](C(N)=O)C1 ZINC000820444068 607022394 /nfs/dbraw/zinc/02/23/94/607022394.db2.gz FINMVSNYRVWYKT-ONGXEEELSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCCn1ncnn1 ZINC000820444073 607356829 /nfs/dbraw/zinc/35/68/29/607356829.db2.gz FLSLJEFYHYESFH-SECBINFHSA-N -1 3 392.405 -1.664 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCCn1ncnn1 ZINC000820444073 607356827 /nfs/dbraw/zinc/35/68/27/607356827.db2.gz FLSLJEFYHYESFH-SECBINFHSA-N -1 3 392.405 -1.664 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCCn1ncnn1 ZINC000820444074 607357215 /nfs/dbraw/zinc/35/72/15/607357215.db2.gz FLSLJEFYHYESFH-VIFPVBQESA-N -1 3 392.405 -1.664 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCCn1ncnn1 ZINC000820444074 607357214 /nfs/dbraw/zinc/35/72/14/607357214.db2.gz FLSLJEFYHYESFH-VIFPVBQESA-N -1 3 392.405 -1.664 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC1(C(N)=O)CC1 ZINC000820444081 607222899 /nfs/dbraw/zinc/22/28/99/607222899.db2.gz FOBCOMTWPOWSNX-MRVPVSSYSA-N -1 3 379.402 -1.332 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NC1(C(N)=O)CC1 ZINC000820444081 607222898 /nfs/dbraw/zinc/22/28/98/607222898.db2.gz FOBCOMTWPOWSNX-MRVPVSSYSA-N -1 3 379.402 -1.332 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC1(C(N)=O)CC1 ZINC000820444082 607222829 /nfs/dbraw/zinc/22/28/29/607222829.db2.gz FOBCOMTWPOWSNX-QMMMGPOBSA-N -1 3 379.402 -1.332 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NC1(C(N)=O)CC1 ZINC000820444082 607222828 /nfs/dbraw/zinc/22/28/28/607222828.db2.gz FOBCOMTWPOWSNX-QMMMGPOBSA-N -1 3 379.402 -1.332 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCCOCCO ZINC000820444113 607506841 /nfs/dbraw/zinc/50/68/41/607506841.db2.gz GMCOSHVUPSQJKM-JTQLQIEISA-N -1 3 384.418 -1.341 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCCOCCO ZINC000820444113 607506839 /nfs/dbraw/zinc/50/68/39/607506839.db2.gz GMCOSHVUPSQJKM-JTQLQIEISA-N -1 3 384.418 -1.341 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCCOCCO ZINC000820444114 607507237 /nfs/dbraw/zinc/50/72/37/607507237.db2.gz GMCOSHVUPSQJKM-SNVBAGLBSA-N -1 3 384.418 -1.341 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCCOCCO ZINC000820444114 607507235 /nfs/dbraw/zinc/50/72/35/607507235.db2.gz GMCOSHVUPSQJKM-SNVBAGLBSA-N -1 3 384.418 -1.341 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)O[C@H]1CNC(=O)C1 ZINC000820444117 607322236 /nfs/dbraw/zinc/32/22/36/607322236.db2.gz GPADPODTTAIKDW-PSASIEDQSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)O[C@H]1CNC(=O)C1 ZINC000820444117 607322235 /nfs/dbraw/zinc/32/22/35/607322235.db2.gz GPADPODTTAIKDW-PSASIEDQSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)O[C@@H]1CNC(=O)C1 ZINC000820444118 607322403 /nfs/dbraw/zinc/32/24/03/607322403.db2.gz GPADPODTTAIKDW-SCZZXKLOSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)O[C@@H]1CNC(=O)C1 ZINC000820444118 607322402 /nfs/dbraw/zinc/32/24/02/607322402.db2.gz GPADPODTTAIKDW-SCZZXKLOSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)O[C@H]1CNC(=O)C1 ZINC000820444119 607322215 /nfs/dbraw/zinc/32/22/15/607322215.db2.gz GPADPODTTAIKDW-WCBMZHEXSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)O[C@H]1CNC(=O)C1 ZINC000820444119 607322214 /nfs/dbraw/zinc/32/22/14/607322214.db2.gz GPADPODTTAIKDW-WCBMZHEXSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)O[C@@H]1CNC(=O)C1 ZINC000820444120 607322227 /nfs/dbraw/zinc/32/22/27/607322227.db2.gz GPADPODTTAIKDW-WPRPVWTQSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)O[C@@H]1CNC(=O)C1 ZINC000820444120 607322226 /nfs/dbraw/zinc/32/22/26/607322226.db2.gz GPADPODTTAIKDW-WPRPVWTQSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@@H]1CC(=O)N(C)C1 ZINC000820444451 607019730 /nfs/dbraw/zinc/01/97/30/607019730.db2.gz JHYZETIQRKVATC-GXSJLCMTSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@@H]1CC(=O)N(C)C1 ZINC000820444451 607019728 /nfs/dbraw/zinc/01/97/28/607019728.db2.gz JHYZETIQRKVATC-GXSJLCMTSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@H]1CC(=O)N(C)C1 ZINC000820444452 607019888 /nfs/dbraw/zinc/01/98/88/607019888.db2.gz JHYZETIQRKVATC-KOLCDFICSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@H]1CC(=O)N(C)C1 ZINC000820444452 607019885 /nfs/dbraw/zinc/01/98/85/607019885.db2.gz JHYZETIQRKVATC-KOLCDFICSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@@H]1CC(=O)N(C)C1 ZINC000820444453 607019646 /nfs/dbraw/zinc/01/96/46/607019646.db2.gz JHYZETIQRKVATC-MWLCHTKSSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@@H]1CC(=O)N(C)C1 ZINC000820444453 607019645 /nfs/dbraw/zinc/01/96/45/607019645.db2.gz JHYZETIQRKVATC-MWLCHTKSSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@H]1CC(=O)N(C)C1 ZINC000820444454 607019641 /nfs/dbraw/zinc/01/96/41/607019641.db2.gz JHYZETIQRKVATC-ONGXEEELSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@H]1CC(=O)N(C)C1 ZINC000820444454 607019640 /nfs/dbraw/zinc/01/96/40/607019640.db2.gz JHYZETIQRKVATC-ONGXEEELSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC(C)(C)C(N)=O ZINC000820444545 945451518 /nfs/dbraw/zinc/45/15/18/945451518.db2.gz KKRWVGGCWVPVSZ-MRVPVSSYSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NC(C)(C)C(N)=O ZINC000820444545 945451511 /nfs/dbraw/zinc/45/15/11/945451511.db2.gz KKRWVGGCWVPVSZ-MRVPVSSYSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC(C)(C)C(N)=O ZINC000820444546 945451497 /nfs/dbraw/zinc/45/14/97/945451497.db2.gz KKRWVGGCWVPVSZ-QMMMGPOBSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NC(C)(C)C(N)=O ZINC000820444546 945451491 /nfs/dbraw/zinc/45/14/91/945451491.db2.gz KKRWVGGCWVPVSZ-QMMMGPOBSA-N -1 3 381.418 -1.086 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC1=NCC(=O)N1 ZINC000820444698 607025868 /nfs/dbraw/zinc/02/58/68/607025868.db2.gz LHDTYHQSDPQMQS-SSDOTTSWSA-N -1 3 378.374 -1.865 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NC1=NCC(=O)N1 ZINC000820444698 607025867 /nfs/dbraw/zinc/02/58/67/607025867.db2.gz LHDTYHQSDPQMQS-SSDOTTSWSA-N -1 3 378.374 -1.865 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC1=NCC(=O)N1 ZINC000820444700 607025844 /nfs/dbraw/zinc/02/58/44/607025844.db2.gz LHDTYHQSDPQMQS-ZETCQYMHSA-N -1 3 378.374 -1.865 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NC1=NCC(=O)N1 ZINC000820444700 607025842 /nfs/dbraw/zinc/02/58/42/607025842.db2.gz LHDTYHQSDPQMQS-ZETCQYMHSA-N -1 3 378.374 -1.865 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)OCC(=O)NC(N)=O ZINC000820445052 607116167 /nfs/dbraw/zinc/11/61/67/607116167.db2.gz MZAFNCQRETZSEJ-SSDOTTSWSA-N -1 3 397.373 -1.728 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)OCC(=O)NC(N)=O ZINC000820445052 607116165 /nfs/dbraw/zinc/11/61/65/607116165.db2.gz MZAFNCQRETZSEJ-SSDOTTSWSA-N -1 3 397.373 -1.728 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)OCC(=O)NC(N)=O ZINC000820445054 607116241 /nfs/dbraw/zinc/11/62/41/607116241.db2.gz MZAFNCQRETZSEJ-ZETCQYMHSA-N -1 3 397.373 -1.728 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)OCC(=O)NC(N)=O ZINC000820445054 607116240 /nfs/dbraw/zinc/11/62/40/607116240.db2.gz MZAFNCQRETZSEJ-ZETCQYMHSA-N -1 3 397.373 -1.728 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)OCc1nnnn1C ZINC000820445574 607116109 /nfs/dbraw/zinc/11/61/09/607116109.db2.gz QYRNACDYEQAUJJ-MRVPVSSYSA-N -1 3 393.389 -1.200 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)OCc1nnnn1C ZINC000820445574 607116107 /nfs/dbraw/zinc/11/61/07/607116107.db2.gz QYRNACDYEQAUJJ-MRVPVSSYSA-N -1 3 393.389 -1.200 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)OCc1nnnn1C ZINC000820445598 607116003 /nfs/dbraw/zinc/11/60/03/607116003.db2.gz QYRNACDYEQAUJJ-QMMMGPOBSA-N -1 3 393.389 -1.200 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)OCc1nnnn1C ZINC000820445598 607116001 /nfs/dbraw/zinc/11/60/01/607116001.db2.gz QYRNACDYEQAUJJ-QMMMGPOBSA-N -1 3 393.389 -1.200 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NN1CCOCC1 ZINC000820445803 607145289 /nfs/dbraw/zinc/14/52/89/607145289.db2.gz RDVQWSSFZGURTK-JTQLQIEISA-N -1 3 381.418 -1.103 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NN1CCOCC1 ZINC000820445803 607145288 /nfs/dbraw/zinc/14/52/88/607145288.db2.gz RDVQWSSFZGURTK-JTQLQIEISA-N -1 3 381.418 -1.103 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NN1CCOCC1 ZINC000820445819 607145404 /nfs/dbraw/zinc/14/54/04/607145404.db2.gz RDVQWSSFZGURTK-SNVBAGLBSA-N -1 3 381.418 -1.103 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NN1CCOCC1 ZINC000820445819 607145403 /nfs/dbraw/zinc/14/54/03/607145403.db2.gz RDVQWSSFZGURTK-SNVBAGLBSA-N -1 3 381.418 -1.103 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CCCNC(=O)C1 ZINC000820445981 607020100 /nfs/dbraw/zinc/02/01/00/607020100.db2.gz SEZKSKZGMSWVPH-JTQLQIEISA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CCCNC(=O)C1 ZINC000820445981 607020098 /nfs/dbraw/zinc/02/00/98/607020098.db2.gz SEZKSKZGMSWVPH-JTQLQIEISA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CCCNC(=O)C1 ZINC000820445983 607020126 /nfs/dbraw/zinc/02/01/26/607020126.db2.gz SEZKSKZGMSWVPH-SNVBAGLBSA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CCCNC(=O)C1 ZINC000820445983 607020124 /nfs/dbraw/zinc/02/01/24/607020124.db2.gz SEZKSKZGMSWVPH-SNVBAGLBSA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CCNC(=O)CC1 ZINC000820446343 945450583 /nfs/dbraw/zinc/45/05/83/945450583.db2.gz VDNZKAHZVYVPFS-JTQLQIEISA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CCNC(=O)CC1 ZINC000820446343 945450579 /nfs/dbraw/zinc/45/05/79/945450579.db2.gz VDNZKAHZVYVPFS-JTQLQIEISA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CCNC(=O)CC1 ZINC000820446344 945450817 /nfs/dbraw/zinc/45/08/17/945450817.db2.gz VDNZKAHZVYVPFS-SNVBAGLBSA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CCNC(=O)CC1 ZINC000820446344 945450812 /nfs/dbraw/zinc/45/08/12/945450812.db2.gz VDNZKAHZVYVPFS-SNVBAGLBSA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CCO[C@@H](CO)C1 ZINC000820446599 607233998 /nfs/dbraw/zinc/23/39/98/607233998.db2.gz WHTLFECBXYJBNS-CMPLNLGQSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CCO[C@@H](CO)C1 ZINC000820446599 607233997 /nfs/dbraw/zinc/23/39/97/607233997.db2.gz WHTLFECBXYJBNS-CMPLNLGQSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CCO[C@H](CO)C1 ZINC000820446600 607234022 /nfs/dbraw/zinc/23/40/22/607234022.db2.gz WHTLFECBXYJBNS-JQWIXIFHSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CCO[C@H](CO)C1 ZINC000820446600 607234021 /nfs/dbraw/zinc/23/40/21/607234021.db2.gz WHTLFECBXYJBNS-JQWIXIFHSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CCO[C@H](CO)C1 ZINC000820446602 607234178 /nfs/dbraw/zinc/23/41/78/607234178.db2.gz WHTLFECBXYJBNS-PWSUYJOCSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CCO[C@H](CO)C1 ZINC000820446602 607234177 /nfs/dbraw/zinc/23/41/77/607234177.db2.gz WHTLFECBXYJBNS-PWSUYJOCSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CCO[C@@H](CO)C1 ZINC000820446603 607233973 /nfs/dbraw/zinc/23/39/73/607233973.db2.gz WHTLFECBXYJBNS-ZYHUDNBSSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CCO[C@@H](CO)C1 ZINC000820446603 607233972 /nfs/dbraw/zinc/23/39/72/607233972.db2.gz WHTLFECBXYJBNS-ZYHUDNBSSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N=c1nc[nH]n1C ZINC000820446984 607159218 /nfs/dbraw/zinc/15/92/18/607159218.db2.gz XWXMTCULIQCBGC-MRVPVSSYSA-N -1 3 377.390 -1.277 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N=c1nc[nH]n1C ZINC000820446984 607159216 /nfs/dbraw/zinc/15/92/16/607159216.db2.gz XWXMTCULIQCBGC-MRVPVSSYSA-N -1 3 377.390 -1.277 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N=c1nc[nH]n1C ZINC000820446998 607159278 /nfs/dbraw/zinc/15/92/78/607159278.db2.gz XWXMTCULIQCBGC-QMMMGPOBSA-N -1 3 377.390 -1.277 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N=c1nc[nH]n1C ZINC000820446998 607159277 /nfs/dbraw/zinc/15/92/77/607159277.db2.gz XWXMTCULIQCBGC-QMMMGPOBSA-N -1 3 377.390 -1.277 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCc1nncn1C ZINC000820447101 606993631 /nfs/dbraw/zinc/99/36/31/606993631.db2.gz YEVCATAKZRTTBK-SECBINFHSA-N -1 3 391.417 -1.022 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCc1nncn1C ZINC000820447101 606993630 /nfs/dbraw/zinc/99/36/30/606993630.db2.gz YEVCATAKZRTTBK-SECBINFHSA-N -1 3 391.417 -1.022 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCc1nncn1C ZINC000820447105 606993537 /nfs/dbraw/zinc/99/35/37/606993537.db2.gz YEVCATAKZRTTBK-VIFPVBQESA-N -1 3 391.417 -1.022 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCc1nncn1C ZINC000820447105 606993536 /nfs/dbraw/zinc/99/35/36/606993536.db2.gz YEVCATAKZRTTBK-VIFPVBQESA-N -1 3 391.417 -1.022 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCCNC(N)=O ZINC000820447183 607035968 /nfs/dbraw/zinc/03/59/68/607035968.db2.gz YMNHCCCBBTXLOC-MRVPVSSYSA-N -1 3 382.406 -1.682 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCCNC(N)=O ZINC000820447183 607035967 /nfs/dbraw/zinc/03/59/67/607035967.db2.gz YMNHCCCBBTXLOC-MRVPVSSYSA-N -1 3 382.406 -1.682 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCCNC(N)=O ZINC000820447192 607035998 /nfs/dbraw/zinc/03/59/98/607035998.db2.gz YMNHCCCBBTXLOC-QMMMGPOBSA-N -1 3 382.406 -1.682 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCCNC(N)=O ZINC000820447192 607035996 /nfs/dbraw/zinc/03/59/96/607035996.db2.gz YMNHCCCBBTXLOC-QMMMGPOBSA-N -1 3 382.406 -1.682 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCCOCC(N)=O ZINC000820447210 607324056 /nfs/dbraw/zinc/32/40/56/607324056.db2.gz YORFAZPPLRVPOT-SECBINFHSA-N -1 3 397.417 -1.848 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCCOCC(N)=O ZINC000820447210 607324055 /nfs/dbraw/zinc/32/40/55/607324055.db2.gz YORFAZPPLRVPOT-SECBINFHSA-N -1 3 397.417 -1.848 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCCOCC(N)=O ZINC000820447246 607323901 /nfs/dbraw/zinc/32/39/01/607323901.db2.gz YORFAZPPLRVPOT-VIFPVBQESA-N -1 3 397.417 -1.848 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCCOCC(N)=O ZINC000820447246 607323900 /nfs/dbraw/zinc/32/39/00/607323900.db2.gz YORFAZPPLRVPOT-VIFPVBQESA-N -1 3 397.417 -1.848 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)O[C@@H]1CCNC1=O ZINC000820447249 607262655 /nfs/dbraw/zinc/26/26/55/607262655.db2.gz YQAOQSLXQYDLTM-GZMMTYOYSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)O[C@@H]1CCNC1=O ZINC000820447249 607262654 /nfs/dbraw/zinc/26/26/54/607262654.db2.gz YQAOQSLXQYDLTM-GZMMTYOYSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)O[C@H]1CCNC1=O ZINC000820447251 607262797 /nfs/dbraw/zinc/26/27/97/607262797.db2.gz YQAOQSLXQYDLTM-KCJUWKMLSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)O[C@H]1CCNC1=O ZINC000820447251 607262796 /nfs/dbraw/zinc/26/27/96/607262796.db2.gz YQAOQSLXQYDLTM-KCJUWKMLSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)O[C@H]1CCNC1=O ZINC000820447253 607262788 /nfs/dbraw/zinc/26/27/88/607262788.db2.gz YQAOQSLXQYDLTM-KWQFWETISA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)O[C@H]1CCNC1=O ZINC000820447253 607262787 /nfs/dbraw/zinc/26/27/87/607262787.db2.gz YQAOQSLXQYDLTM-KWQFWETISA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)O[C@@H]1CCNC1=O ZINC000820447255 607262889 /nfs/dbraw/zinc/26/28/89/607262889.db2.gz YQAOQSLXQYDLTM-LDYMZIIASA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)O[C@@H]1CCNC1=O ZINC000820447255 607262888 /nfs/dbraw/zinc/26/28/88/607262888.db2.gz YQAOQSLXQYDLTM-LDYMZIIASA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CCNC(=O)[C@H]1C ZINC000820447526 607020420 /nfs/dbraw/zinc/02/04/20/607020420.db2.gz ZNOOHNDCGJXEAI-NXEZZACHSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CCNC(=O)[C@H]1C ZINC000820447526 607020419 /nfs/dbraw/zinc/02/04/19/607020419.db2.gz ZNOOHNDCGJXEAI-NXEZZACHSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CCNC(=O)[C@@H]1C ZINC000820447528 607020502 /nfs/dbraw/zinc/02/05/02/607020502.db2.gz ZNOOHNDCGJXEAI-UWVGGRQHSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CCNC(=O)[C@@H]1C ZINC000820447528 607020500 /nfs/dbraw/zinc/02/05/00/607020500.db2.gz ZNOOHNDCGJXEAI-UWVGGRQHSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CCNC(=O)[C@H]1C ZINC000820447530 607020230 /nfs/dbraw/zinc/02/02/30/607020230.db2.gz ZNOOHNDCGJXEAI-VHSXEESVSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CCNC(=O)[C@H]1C ZINC000820447530 607020229 /nfs/dbraw/zinc/02/02/29/607020229.db2.gz ZNOOHNDCGJXEAI-VHSXEESVSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CCNC(=O)[C@@H]1C ZINC000820447532 607020252 /nfs/dbraw/zinc/02/02/52/607020252.db2.gz ZNOOHNDCGJXEAI-ZJUUUORDSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CCNC(=O)[C@@H]1C ZINC000820447532 607020251 /nfs/dbraw/zinc/02/02/51/607020251.db2.gz ZNOOHNDCGJXEAI-ZJUUUORDSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCC(=O)N(C)C ZINC000820449701 606983382 /nfs/dbraw/zinc/98/33/82/606983382.db2.gz AWAJXBNVIPHTMV-SECBINFHSA-N -1 3 381.418 -1.262 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCC(=O)N(C)C ZINC000820449701 606983381 /nfs/dbraw/zinc/98/33/81/606983381.db2.gz AWAJXBNVIPHTMV-SECBINFHSA-N -1 3 381.418 -1.262 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCC(=O)N(C)C ZINC000820449702 606983317 /nfs/dbraw/zinc/98/33/17/606983317.db2.gz AWAJXBNVIPHTMV-VIFPVBQESA-N -1 3 381.418 -1.262 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCC(=O)N(C)C ZINC000820449702 606983315 /nfs/dbraw/zinc/98/33/15/606983315.db2.gz AWAJXBNVIPHTMV-VIFPVBQESA-N -1 3 381.418 -1.262 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NN1CCOCC1 ZINC000820449759 607145540 /nfs/dbraw/zinc/14/55/40/607145540.db2.gz CBHQWSYABVRKFJ-JTQLQIEISA-N -1 3 381.418 -1.103 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NN1CCOCC1 ZINC000820449759 607145539 /nfs/dbraw/zinc/14/55/39/607145539.db2.gz CBHQWSYABVRKFJ-JTQLQIEISA-N -1 3 381.418 -1.103 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NN1CCOCC1 ZINC000820449760 607145054 /nfs/dbraw/zinc/14/50/54/607145054.db2.gz CBHQWSYABVRKFJ-SNVBAGLBSA-N -1 3 381.418 -1.103 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NN1CCOCC1 ZINC000820449760 607145053 /nfs/dbraw/zinc/14/50/53/607145053.db2.gz CBHQWSYABVRKFJ-SNVBAGLBSA-N -1 3 381.418 -1.103 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)O[C@H]1CNC(=O)C1 ZINC000820449887 607322329 /nfs/dbraw/zinc/32/23/29/607322329.db2.gz DLXINKNCZJGOGT-PSASIEDQSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)O[C@H]1CNC(=O)C1 ZINC000820449887 607322328 /nfs/dbraw/zinc/32/23/28/607322328.db2.gz DLXINKNCZJGOGT-PSASIEDQSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)O[C@@H]1CNC(=O)C1 ZINC000820449889 607322388 /nfs/dbraw/zinc/32/23/88/607322388.db2.gz DLXINKNCZJGOGT-SCZZXKLOSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)O[C@@H]1CNC(=O)C1 ZINC000820449889 607322387 /nfs/dbraw/zinc/32/23/87/607322387.db2.gz DLXINKNCZJGOGT-SCZZXKLOSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)O[C@H]1CNC(=O)C1 ZINC000820449894 607322344 /nfs/dbraw/zinc/32/23/44/607322344.db2.gz DLXINKNCZJGOGT-WCBMZHEXSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)O[C@H]1CNC(=O)C1 ZINC000820449894 607322343 /nfs/dbraw/zinc/32/23/43/607322343.db2.gz DLXINKNCZJGOGT-WCBMZHEXSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)O[C@@H]1CNC(=O)C1 ZINC000820449897 607322362 /nfs/dbraw/zinc/32/23/62/607322362.db2.gz DLXINKNCZJGOGT-WPRPVWTQSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)O[C@@H]1CNC(=O)C1 ZINC000820449897 607322361 /nfs/dbraw/zinc/32/23/61/607322361.db2.gz DLXINKNCZJGOGT-WPRPVWTQSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCCOCCO ZINC000820450046 607507015 /nfs/dbraw/zinc/50/70/15/607507015.db2.gz GMKWBYJZKHTESO-JTQLQIEISA-N -1 3 384.418 -1.341 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCCOCCO ZINC000820450046 607507013 /nfs/dbraw/zinc/50/70/13/607507013.db2.gz GMKWBYJZKHTESO-JTQLQIEISA-N -1 3 384.418 -1.341 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCCOCCO ZINC000820450048 607507032 /nfs/dbraw/zinc/50/70/32/607507032.db2.gz GMKWBYJZKHTESO-SNVBAGLBSA-N -1 3 384.418 -1.341 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCCOCCO ZINC000820450048 607507030 /nfs/dbraw/zinc/50/70/30/607507030.db2.gz GMKWBYJZKHTESO-SNVBAGLBSA-N -1 3 384.418 -1.341 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)OCc1nnnn1C ZINC000820450165 607118769 /nfs/dbraw/zinc/11/87/69/607118769.db2.gz HOJDZNMXIIEVED-MRVPVSSYSA-N -1 3 393.389 -1.200 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)OCc1nnnn1C ZINC000820450165 607118767 /nfs/dbraw/zinc/11/87/67/607118767.db2.gz HOJDZNMXIIEVED-MRVPVSSYSA-N -1 3 393.389 -1.200 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)OCc1nnnn1C ZINC000820450166 607120414 /nfs/dbraw/zinc/12/04/14/607120414.db2.gz HOJDZNMXIIEVED-QMMMGPOBSA-N -1 3 393.389 -1.200 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)OCc1nnnn1C ZINC000820450166 607120413 /nfs/dbraw/zinc/12/04/13/607120413.db2.gz HOJDZNMXIIEVED-QMMMGPOBSA-N -1 3 393.389 -1.200 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCCCC(N)=O ZINC000820450229 606995401 /nfs/dbraw/zinc/99/54/01/606995401.db2.gz ICGQWESYGVCUPL-SECBINFHSA-N -1 3 381.418 -1.085 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCCCC(N)=O ZINC000820450229 606995400 /nfs/dbraw/zinc/99/54/00/606995400.db2.gz ICGQWESYGVCUPL-SECBINFHSA-N -1 3 381.418 -1.085 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCCCC(N)=O ZINC000820450231 606995036 /nfs/dbraw/zinc/99/50/36/606995036.db2.gz ICGQWESYGVCUPL-VIFPVBQESA-N -1 3 381.418 -1.085 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCCCC(N)=O ZINC000820450231 606995034 /nfs/dbraw/zinc/99/50/34/606995034.db2.gz ICGQWESYGVCUPL-VIFPVBQESA-N -1 3 381.418 -1.085 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)OCC(=O)NC(N)=O ZINC000820450254 607120612 /nfs/dbraw/zinc/12/06/12/607120612.db2.gz IKBZRXRBKKDPRM-SSDOTTSWSA-N -1 3 397.373 -1.728 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)OCC(=O)NC(N)=O ZINC000820450254 607120610 /nfs/dbraw/zinc/12/06/10/607120610.db2.gz IKBZRXRBKKDPRM-SSDOTTSWSA-N -1 3 397.373 -1.728 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)OCC(=O)NC(N)=O ZINC000820450257 607120544 /nfs/dbraw/zinc/12/05/44/607120544.db2.gz IKBZRXRBKKDPRM-ZETCQYMHSA-N -1 3 397.373 -1.728 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)OCC(=O)NC(N)=O ZINC000820450257 607120542 /nfs/dbraw/zinc/12/05/42/607120542.db2.gz IKBZRXRBKKDPRM-ZETCQYMHSA-N -1 3 397.373 -1.728 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@@H]1CCN(C)C1=O ZINC000820450451 607041970 /nfs/dbraw/zinc/04/19/70/607041970.db2.gz KTRKJLSDPCZGDZ-BXKDBHETSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@@H]1CCN(C)C1=O ZINC000820450451 607041969 /nfs/dbraw/zinc/04/19/69/607041969.db2.gz KTRKJLSDPCZGDZ-BXKDBHETSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@H]1CCN(C)C1=O ZINC000820450453 607042083 /nfs/dbraw/zinc/04/20/83/607042083.db2.gz KTRKJLSDPCZGDZ-CABZTGNLSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@H]1CCN(C)C1=O ZINC000820450453 607042081 /nfs/dbraw/zinc/04/20/81/607042081.db2.gz KTRKJLSDPCZGDZ-CABZTGNLSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@@H]1CCN(C)C1=O ZINC000820450456 607041892 /nfs/dbraw/zinc/04/18/92/607041892.db2.gz KTRKJLSDPCZGDZ-JOYOIKCWSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@@H]1CCN(C)C1=O ZINC000820450456 607041891 /nfs/dbraw/zinc/04/18/91/607041891.db2.gz KTRKJLSDPCZGDZ-JOYOIKCWSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@H]1CCN(C)C1=O ZINC000820450458 607041940 /nfs/dbraw/zinc/04/19/40/607041940.db2.gz KTRKJLSDPCZGDZ-SKDRFNHKSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@H]1CCN(C)C1=O ZINC000820450458 607041939 /nfs/dbraw/zinc/04/19/39/607041939.db2.gz KTRKJLSDPCZGDZ-SKDRFNHKSA-N -1 3 393.429 -1.120 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCCOCC(N)=O ZINC000820450501 607324618 /nfs/dbraw/zinc/32/46/18/607324618.db2.gz LNURXWZSJWIYSH-SECBINFHSA-N -1 3 397.417 -1.848 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCCOCC(N)=O ZINC000820450501 607324617 /nfs/dbraw/zinc/32/46/17/607324617.db2.gz LNURXWZSJWIYSH-SECBINFHSA-N -1 3 397.417 -1.848 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCCOCC(N)=O ZINC000820450503 607324615 /nfs/dbraw/zinc/32/46/15/607324615.db2.gz LNURXWZSJWIYSH-VIFPVBQESA-N -1 3 397.417 -1.848 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCCOCC(N)=O ZINC000820450503 607324614 /nfs/dbraw/zinc/32/46/14/607324614.db2.gz LNURXWZSJWIYSH-VIFPVBQESA-N -1 3 397.417 -1.848 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N=c1nc[nH]n1C ZINC000820450808 607159923 /nfs/dbraw/zinc/15/99/23/607159923.db2.gz PGYDJNCRRBMERS-MRVPVSSYSA-N -1 3 377.390 -1.277 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N=c1nc[nH]n1C ZINC000820450808 607159922 /nfs/dbraw/zinc/15/99/22/607159922.db2.gz PGYDJNCRRBMERS-MRVPVSSYSA-N -1 3 377.390 -1.277 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N=c1nc[nH]n1C ZINC000820450809 607159938 /nfs/dbraw/zinc/15/99/38/607159938.db2.gz PGYDJNCRRBMERS-QMMMGPOBSA-N -1 3 377.390 -1.277 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N=c1nc[nH]n1C ZINC000820450809 607159937 /nfs/dbraw/zinc/15/99/37/607159937.db2.gz PGYDJNCRRBMERS-QMMMGPOBSA-N -1 3 377.390 -1.277 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCCn1cncn1 ZINC000820450916 607020387 /nfs/dbraw/zinc/02/03/87/607020387.db2.gz QHPMPAVONWFLMX-JTQLQIEISA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCCn1cncn1 ZINC000820450916 607020385 /nfs/dbraw/zinc/02/03/85/607020385.db2.gz QHPMPAVONWFLMX-JTQLQIEISA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCCn1cncn1 ZINC000820450918 607020155 /nfs/dbraw/zinc/02/01/55/607020155.db2.gz QHPMPAVONWFLMX-SNVBAGLBSA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCCn1cncn1 ZINC000820450918 607020153 /nfs/dbraw/zinc/02/01/53/607020153.db2.gz QHPMPAVONWFLMX-SNVBAGLBSA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@@H]1CCCNC1=O ZINC000820451211 607017256 /nfs/dbraw/zinc/01/72/56/607017256.db2.gz SQLAZGAKCQUTEM-BXKDBHETSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@@H]1CCCNC1=O ZINC000820451211 607017255 /nfs/dbraw/zinc/01/72/55/607017255.db2.gz SQLAZGAKCQUTEM-BXKDBHETSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@H]1CCCNC1=O ZINC000820451213 607016860 /nfs/dbraw/zinc/01/68/60/607016860.db2.gz SQLAZGAKCQUTEM-CABZTGNLSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@H]1CCCNC1=O ZINC000820451213 607016858 /nfs/dbraw/zinc/01/68/58/607016858.db2.gz SQLAZGAKCQUTEM-CABZTGNLSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@@H]1CCCNC1=O ZINC000820451215 607017094 /nfs/dbraw/zinc/01/70/94/607017094.db2.gz SQLAZGAKCQUTEM-JOYOIKCWSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@@H]1CCCNC1=O ZINC000820451215 607017093 /nfs/dbraw/zinc/01/70/93/607017093.db2.gz SQLAZGAKCQUTEM-JOYOIKCWSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@H]1CCCNC1=O ZINC000820451216 607017161 /nfs/dbraw/zinc/01/71/61/607017161.db2.gz SQLAZGAKCQUTEM-SKDRFNHKSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@H]1CCCNC1=O ZINC000820451216 607017159 /nfs/dbraw/zinc/01/71/59/607017159.db2.gz SQLAZGAKCQUTEM-SKDRFNHKSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCCn1ncnn1 ZINC000820451623 607357130 /nfs/dbraw/zinc/35/71/30/607357130.db2.gz WKOIYMGZKXULKQ-SECBINFHSA-N -1 3 392.405 -1.664 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCCn1ncnn1 ZINC000820451623 607357128 /nfs/dbraw/zinc/35/71/28/607357128.db2.gz WKOIYMGZKXULKQ-SECBINFHSA-N -1 3 392.405 -1.664 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCCn1ncnn1 ZINC000820451625 607357035 /nfs/dbraw/zinc/35/70/35/607357035.db2.gz WKOIYMGZKXULKQ-VIFPVBQESA-N -1 3 392.405 -1.664 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCCn1ncnn1 ZINC000820451625 607357033 /nfs/dbraw/zinc/35/70/33/607357033.db2.gz WKOIYMGZKXULKQ-VIFPVBQESA-N -1 3 392.405 -1.664 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCC(=O)NC1CC1 ZINC000820451686 606984107 /nfs/dbraw/zinc/98/41/07/606984107.db2.gz WSUCAKWXAVPHEU-SECBINFHSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCC(=O)NC1CC1 ZINC000820451686 606984106 /nfs/dbraw/zinc/98/41/06/606984106.db2.gz WSUCAKWXAVPHEU-SECBINFHSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCC(=O)NC1CC1 ZINC000820451687 606984113 /nfs/dbraw/zinc/98/41/13/606984113.db2.gz WSUCAKWXAVPHEU-VIFPVBQESA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCC(=O)NC1CC1 ZINC000820451687 606984112 /nfs/dbraw/zinc/98/41/12/606984112.db2.gz WSUCAKWXAVPHEU-VIFPVBQESA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCCNC(N)=O ZINC000820451956 607036490 /nfs/dbraw/zinc/03/64/90/607036490.db2.gz YTRSDDRMNJNOCQ-MRVPVSSYSA-N -1 3 382.406 -1.682 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCCNC(N)=O ZINC000820451956 607036488 /nfs/dbraw/zinc/03/64/88/607036488.db2.gz YTRSDDRMNJNOCQ-MRVPVSSYSA-N -1 3 382.406 -1.682 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCCNC(N)=O ZINC000820451957 607036521 /nfs/dbraw/zinc/03/65/21/607036521.db2.gz YTRSDDRMNJNOCQ-QMMMGPOBSA-N -1 3 382.406 -1.682 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCCNC(N)=O ZINC000820451957 607036520 /nfs/dbraw/zinc/03/65/20/607036520.db2.gz YTRSDDRMNJNOCQ-QMMMGPOBSA-N -1 3 382.406 -1.682 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)O[C@@H]1CCNC1=O ZINC000820451968 607262850 /nfs/dbraw/zinc/26/28/50/607262850.db2.gz YWGIGBQAMOWSLR-GZMMTYOYSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)O[C@@H]1CCNC1=O ZINC000820451968 607262849 /nfs/dbraw/zinc/26/28/49/607262849.db2.gz YWGIGBQAMOWSLR-GZMMTYOYSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)O[C@H]1CCNC1=O ZINC000820451969 607262600 /nfs/dbraw/zinc/26/26/00/607262600.db2.gz YWGIGBQAMOWSLR-KCJUWKMLSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)O[C@H]1CCNC1=O ZINC000820451969 607262599 /nfs/dbraw/zinc/26/25/99/607262599.db2.gz YWGIGBQAMOWSLR-KCJUWKMLSA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)O[C@H]1CCNC1=O ZINC000820451970 607262686 /nfs/dbraw/zinc/26/26/86/607262686.db2.gz YWGIGBQAMOWSLR-KWQFWETISA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)O[C@H]1CCNC1=O ZINC000820451970 607262685 /nfs/dbraw/zinc/26/26/85/607262685.db2.gz YWGIGBQAMOWSLR-KWQFWETISA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)O[C@@H]1CCNC1=O ZINC000820451971 607262591 /nfs/dbraw/zinc/26/25/91/607262591.db2.gz YWGIGBQAMOWSLR-LDYMZIIASA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)O[C@@H]1CCNC1=O ZINC000820451971 607262590 /nfs/dbraw/zinc/26/25/90/607262590.db2.gz YWGIGBQAMOWSLR-LDYMZIIASA-N -1 3 380.386 -1.035 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCc1nncn1C ZINC000820452092 606993496 /nfs/dbraw/zinc/99/34/96/606993496.db2.gz 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YYBGIPGSHZHFMF-WCQYABFASA-N -1 3 395.445 -1.567 20 0 GAADHM Cn1cc(-c2nn[n-]n2)cc1C(=O)N[C@@H]1CS(=O)(=O)C[C@@H]1N1CCOCC1 ZINC000822638183 606240807 /nfs/dbraw/zinc/24/08/07/606240807.db2.gz YYBGIPGSHZHFMF-YPMHNXCESA-N -1 3 395.445 -1.567 20 0 GAADHM Cn1cc(-c2nnn[n-]2)cc1C(=O)N[C@@H]1CS(=O)(=O)C[C@@H]1N1CCOCC1 ZINC000822638183 606240805 /nfs/dbraw/zinc/24/08/05/606240805.db2.gz YYBGIPGSHZHFMF-YPMHNXCESA-N -1 3 395.445 -1.567 20 0 GAADHM Cn1cc(-c2nn[n-]n2)cc1C(=O)NCCN1CCN(S(C)(=O)=O)CC1 ZINC000822641266 606282393 /nfs/dbraw/zinc/28/23/93/606282393.db2.gz GSMADYPMWMLGHG-UHFFFAOYSA-N -1 3 382.450 -1.488 20 0 GAADHM Cn1cc(-c2nnn[n-]2)cc1C(=O)NCCN1CCN(S(C)(=O)=O)CC1 ZINC000822641266 606282392 /nfs/dbraw/zinc/28/23/92/606282392.db2.gz GSMADYPMWMLGHG-UHFFFAOYSA-N -1 3 382.450 -1.488 20 0 GAADHM Cn1cc(-c2nn[n-]n2)cc1C(=O)OCCn1cnc2c1c(=O)n(C)c(=O)n2C ZINC000822659302 606385073 /nfs/dbraw/zinc/38/50/73/606385073.db2.gz JHSQRKZJCOYGMZ-UHFFFAOYSA-N -1 3 399.371 -1.191 20 0 GAADHM Cn1cc(-c2nnn[n-]2)cc1C(=O)OCCn1cnc2c1c(=O)n(C)c(=O)n2C ZINC000822659302 606385071 /nfs/dbraw/zinc/38/50/71/606385071.db2.gz JHSQRKZJCOYGMZ-UHFFFAOYSA-N -1 3 399.371 -1.191 20 0 GAADHM Cn1cc(-c2nn[n-]n2)cc1C(=O)OCC(=O)c1c(N)n(C)c(=O)n(C)c1=O ZINC000822659492 606390942 /nfs/dbraw/zinc/39/09/42/606390942.db2.gz NCFNRPDMLBGKGY-UHFFFAOYSA-N -1 3 388.344 -1.776 20 0 GAADHM Cn1cc(-c2nnn[n-]2)cc1C(=O)OCC(=O)c1c(N)n(C)c(=O)n(C)c1=O ZINC000822659492 606390940 /nfs/dbraw/zinc/39/09/40/606390940.db2.gz NCFNRPDMLBGKGY-UHFFFAOYSA-N -1 3 388.344 -1.776 20 0 GAADHM Cn1ncc2c1nnn(CN1CCN(c3ccc(-c4nn[n-]n4)cn3)CC1)c2=O ZINC000822708747 606633164 /nfs/dbraw/zinc/63/31/64/606633164.db2.gz BQZXEJSMNDDSPC-UHFFFAOYSA-N -1 3 394.403 -1.120 20 0 GAADHM Cn1ncc2c1nnn(CN1CCN(c3ccc(-c4nnn[n-]4)cn3)CC1)c2=O ZINC000822708747 606633163 /nfs/dbraw/zinc/63/31/63/606633163.db2.gz BQZXEJSMNDDSPC-UHFFFAOYSA-N -1 3 394.403 -1.120 20 0 GAADHM Cn1ncc2c1nnn(CN1CCN(c3ncccc3-c3nn[n-]n3)CC1)c2=O ZINC000822709242 606633076 /nfs/dbraw/zinc/63/30/76/606633076.db2.gz IIKLTRYTVLPFGE-UHFFFAOYSA-N -1 3 394.403 -1.120 20 0 GAADHM Cn1ncc2c1nnn(CN1CCN(c3ncccc3-c3nnn[n-]3)CC1)c2=O ZINC000822709242 606633075 /nfs/dbraw/zinc/63/30/75/606633075.db2.gz IIKLTRYTVLPFGE-UHFFFAOYSA-N -1 3 394.403 -1.120 20 0 GAADHM Cn1ncc2c1nnn(CN1CCN(c3cc(-c4nn[n-]n4)ccn3)CC1)c2=O ZINC000822709372 606633167 /nfs/dbraw/zinc/63/31/67/606633167.db2.gz KCORWBKYBBIHHE-UHFFFAOYSA-N -1 3 394.403 -1.120 20 0 GAADHM Cn1ncc2c1nnn(CN1CCN(c3cc(-c4nnn[n-]4)ccn3)CC1)c2=O ZINC000822709372 606633166 /nfs/dbraw/zinc/63/31/66/606633166.db2.gz KCORWBKYBBIHHE-UHFFFAOYSA-N -1 3 394.403 -1.120 20 0 GAADHM NC(=O)[C@@H](c1ccc(-c2nn[n-]n2)cc1)N1CCN(CCS(N)(=O)=O)CC1 ZINC000822850335 606090708 /nfs/dbraw/zinc/09/07/08/606090708.db2.gz FHTHDXJSVNQDTD-CYBMUJFWSA-N -1 3 394.461 -1.701 20 0 GAADHM NC(=O)[C@@H](c1ccc(-c2nnn[n-]2)cc1)N1CCN(CCS(N)(=O)=O)CC1 ZINC000822850335 606090704 /nfs/dbraw/zinc/09/07/04/606090704.db2.gz FHTHDXJSVNQDTD-CYBMUJFWSA-N -1 3 394.461 -1.701 20 0 GAADHM NC(=O)[C@H](c1ccc(-c2nn[n-]n2)cc1)N1CCN(CCS(N)(=O)=O)CC1 ZINC000822850336 606090967 /nfs/dbraw/zinc/09/09/67/606090967.db2.gz FHTHDXJSVNQDTD-ZDUSSCGKSA-N -1 3 394.461 -1.701 20 0 GAADHM NC(=O)[C@H](c1ccc(-c2nnn[n-]2)cc1)N1CCN(CCS(N)(=O)=O)CC1 ZINC000822850336 606090962 /nfs/dbraw/zinc/09/09/62/606090962.db2.gz FHTHDXJSVNQDTD-ZDUSSCGKSA-N -1 3 394.461 -1.701 20 0 GAADHM NC(=O)CS(=O)(=O)c1ccc(C(=O)n2ncc(-c3nnn[n-]3)c2N)cc1 ZINC000822868861 606642291 /nfs/dbraw/zinc/64/22/91/606642291.db2.gz JCXSEZAYJVDQHM-UHFFFAOYSA-N -1 3 376.358 -1.407 20 0 GAADHM NC(=O)CN(CC(N)=O)C(=O)CCCC(=O)Nc1ccccc1-c1nn[n-]n1 ZINC000822869076 607300731 /nfs/dbraw/zinc/30/07/31/607300731.db2.gz NUVJYWNBNUJIBL-UHFFFAOYSA-N -1 3 388.388 -1.225 20 0 GAADHM NC(=O)CN(CC(N)=O)C(=O)CCCC(=O)Nc1ccccc1-c1nnn[n-]1 ZINC000822869076 607300730 /nfs/dbraw/zinc/30/07/30/607300730.db2.gz NUVJYWNBNUJIBL-UHFFFAOYSA-N -1 3 388.388 -1.225 20 0 GAADHM NC(=O)Cn1cc(C(=O)O[C@@H]2CCN(c3ccc(-c4nn[n-]n4)cc3)C2=O)nn1 ZINC000822873695 946208323 /nfs/dbraw/zinc/20/83/23/946208323.db2.gz GPUZUGOICKJOLU-GFCCVEGCSA-N -1 3 397.355 -1.094 20 0 GAADHM NC(=O)Cn1cc(C(=O)O[C@@H]2CCN(c3ccc(-c4nnn[n-]4)cc3)C2=O)nn1 ZINC000822873695 946208313 /nfs/dbraw/zinc/20/83/13/946208313.db2.gz GPUZUGOICKJOLU-GFCCVEGCSA-N -1 3 397.355 -1.094 20 0 GAADHM NC(=O)Cn1cc(C(=O)O[C@H]2CCN(c3ccc(-c4nn[n-]n4)cc3)C2=O)nn1 ZINC000822873696 946207702 /nfs/dbraw/zinc/20/77/02/946207702.db2.gz GPUZUGOICKJOLU-LBPRGKRZSA-N -1 3 397.355 -1.094 20 0 GAADHM NC(=O)Cn1cc(C(=O)O[C@H]2CCN(c3ccc(-c4nnn[n-]4)cc3)C2=O)nn1 ZINC000822873696 946207694 /nfs/dbraw/zinc/20/76/94/946207694.db2.gz GPUZUGOICKJOLU-LBPRGKRZSA-N -1 3 397.355 -1.094 20 0 GAADHM NC(=O)Cn1cc(C(=O)N2CCN(Cc3ccc(-c4nn[n-]n4)cc3)CC2)nn1 ZINC000822873698 599135796 /nfs/dbraw/zinc/13/57/96/599135796.db2.gz GRDCLHUSZFUBKM-UHFFFAOYSA-N -1 3 396.415 -1.099 20 0 GAADHM NC(=O)NC(=O)CCNC(=O)c1ccc(-n2ncc(-c3nn[n-]n3)c2N)cc1 ZINC000822873769 606614734 /nfs/dbraw/zinc/61/47/34/606614734.db2.gz IKVXOZIASBLROT-UHFFFAOYSA-N -1 3 384.360 -1.051 20 0 GAADHM NC(=O)NC(=O)CCNC(=O)c1ccc(-n2ncc(-c3nnn[n-]3)c2N)cc1 ZINC000822873769 606614732 /nfs/dbraw/zinc/61/47/32/606614732.db2.gz IKVXOZIASBLROT-UHFFFAOYSA-N -1 3 384.360 -1.051 20 0 GAADHM NC(=O)N1CCN2C(=O)N(CC(=O)Nc3cccc(-c4nn[n-]n4)c3)C(=O)[C@H]2C1 ZINC000822874047 606361847 /nfs/dbraw/zinc/36/18/47/606361847.db2.gz RSHQGGTZNCXDKC-LLVKDONJSA-N -1 3 399.371 -1.168 20 0 GAADHM NC(=O)N1CCN2C(=O)N(CC(=O)Nc3cccc(-c4nnn[n-]4)c3)C(=O)[C@H]2C1 ZINC000822874047 606361844 /nfs/dbraw/zinc/36/18/44/606361844.db2.gz RSHQGGTZNCXDKC-LLVKDONJSA-N -1 3 399.371 -1.168 20 0 GAADHM NC(=O)N1CCN2C(=O)N(CC(=O)Nc3cccc(-c4nn[n-]n4)c3)C(=O)[C@@H]2C1 ZINC000822874048 606361840 /nfs/dbraw/zinc/36/18/40/606361840.db2.gz RSHQGGTZNCXDKC-NSHDSACASA-N -1 3 399.371 -1.168 20 0 GAADHM NC(=O)N1CCN2C(=O)N(CC(=O)Nc3cccc(-c4nnn[n-]4)c3)C(=O)[C@@H]2C1 ZINC000822874048 606361839 /nfs/dbraw/zinc/36/18/39/606361839.db2.gz RSHQGGTZNCXDKC-NSHDSACASA-N -1 3 399.371 -1.168 20 0 GAADHM NC(=O)Cn1cc(C(=O)N2CCN(c3ccccc3-c3nn[n-]n3)CC2)nn1 ZINC000822874257 599149436 /nfs/dbraw/zinc/14/94/36/599149436.db2.gz WMMRJEIOCBXRSL-UHFFFAOYSA-N -1 3 382.388 -1.094 20 0 GAADHM NC(=O)Cn1cc(C(=O)N2CCN(c3ccccc3-c3nnn[n-]3)CC2)nn1 ZINC000822874257 599149434 /nfs/dbraw/zinc/14/94/34/599149434.db2.gz WMMRJEIOCBXRSL-UHFFFAOYSA-N -1 3 382.388 -1.094 20 0 GAADHM NC(=O)N1CCN2C(=O)N(CC(=O)Nc3ccc(-c4nn[n-]n4)cc3)C(=O)[C@H]2C1 ZINC000822874386 606361687 /nfs/dbraw/zinc/36/16/87/606361687.db2.gz ZAKRIDVAWJXLNP-LLVKDONJSA-N -1 3 399.371 -1.168 20 0 GAADHM NC(=O)N1CCN2C(=O)N(CC(=O)Nc3ccc(-c4nnn[n-]4)cc3)C(=O)[C@H]2C1 ZINC000822874386 606361686 /nfs/dbraw/zinc/36/16/86/606361686.db2.gz ZAKRIDVAWJXLNP-LLVKDONJSA-N -1 3 399.371 -1.168 20 0 GAADHM NC(=O)N1CCN2C(=O)N(CC(=O)Nc3ccc(-c4nn[n-]n4)cc3)C(=O)[C@@H]2C1 ZINC000822874387 606361878 /nfs/dbraw/zinc/36/18/78/606361878.db2.gz ZAKRIDVAWJXLNP-NSHDSACASA-N -1 3 399.371 -1.168 20 0 GAADHM NC(=O)N1CCN2C(=O)N(CC(=O)Nc3ccc(-c4nnn[n-]4)cc3)C(=O)[C@@H]2C1 ZINC000822874387 606361876 /nfs/dbraw/zinc/36/18/76/606361876.db2.gz ZAKRIDVAWJXLNP-NSHDSACASA-N -1 3 399.371 -1.168 20 0 GAADHM NS(=O)(=O)[C@@H]1CCCN(C(=O)CNC(=O)c2ccc(-c3nn[n-]n3)cc2)C1 ZINC000822889671 599319154 /nfs/dbraw/zinc/31/91/54/599319154.db2.gz AOZLZLPXVLSGGM-GFCCVEGCSA-N -1 3 393.429 -1.124 20 0 GAADHM NS(=O)(=O)[C@@H]1CCCN(C(=O)CNC(=O)c2ccc(-c3nnn[n-]3)cc2)C1 ZINC000822889671 599319152 /nfs/dbraw/zinc/31/91/52/599319152.db2.gz AOZLZLPXVLSGGM-GFCCVEGCSA-N -1 3 393.429 -1.124 20 0 GAADHM NS(=O)(=O)[C@H]1CCCN(C(=O)CNC(=O)c2ccc(-c3nn[n-]n3)cc2)C1 ZINC000822889672 599319544 /nfs/dbraw/zinc/31/95/44/599319544.db2.gz AOZLZLPXVLSGGM-LBPRGKRZSA-N -1 3 393.429 -1.124 20 0 GAADHM NS(=O)(=O)[C@H]1CCCN(C(=O)CNC(=O)c2ccc(-c3nnn[n-]3)cc2)C1 ZINC000822889672 599319539 /nfs/dbraw/zinc/31/95/39/599319539.db2.gz AOZLZLPXVLSGGM-LBPRGKRZSA-N -1 3 393.429 -1.124 20 0 GAADHM NS(=O)(=O)CCN1CCN(C(=O)COc2ccccc2-c2nn[n-]n2)CC1 ZINC000822894625 946213874 /nfs/dbraw/zinc/21/38/74/946213874.db2.gz DNAZOCNZALFJPK-UHFFFAOYSA-N -1 3 395.445 -1.322 20 0 GAADHM NS(=O)(=O)CCN1CCN(C(=O)COc2ccccc2-c2nnn[n-]2)CC1 ZINC000822894625 946213867 /nfs/dbraw/zinc/21/38/67/946213867.db2.gz DNAZOCNZALFJPK-UHFFFAOYSA-N -1 3 395.445 -1.322 20 0 GAADHM NS(=O)(=O)CCN1CCN(C(=O)Cc2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000822895014 606287338 /nfs/dbraw/zinc/28/73/38/606287338.db2.gz KQSOCYGCRHPKQS-UHFFFAOYSA-N -1 3 379.446 -1.158 20 0 GAADHM NS(=O)(=O)CCN1CCN(C(=O)Cc2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000822895014 606287334 /nfs/dbraw/zinc/28/73/34/606287334.db2.gz KQSOCYGCRHPKQS-UHFFFAOYSA-N -1 3 379.446 -1.158 20 0 GAADHM NS(=O)(=O)CCN1CCN(CC(=O)Nc2cccc(-c3nn[n-]n3)c2)CC1 ZINC000822895159 606090113 /nfs/dbraw/zinc/09/01/13/606090113.db2.gz LYXRBKASMMEOCA-UHFFFAOYSA-N -1 3 394.461 -1.289 20 0 GAADHM NS(=O)(=O)CCN1CCN(CC(=O)Nc2cccc(-c3nnn[n-]3)c2)CC1 ZINC000822895159 606090111 /nfs/dbraw/zinc/09/01/11/606090111.db2.gz LYXRBKASMMEOCA-UHFFFAOYSA-N -1 3 394.461 -1.289 20 0 GAADHM NS(=O)(=O)N1CCN([C@H]2CCN(c3sccc3-c3nn[n-]n3)C2=O)CC1 ZINC000822895225 606316465 /nfs/dbraw/zinc/31/64/65/606316465.db2.gz OLCVKCUPBSGELB-JTQLQIEISA-N -1 3 398.474 -1.145 20 0 GAADHM NS(=O)(=O)N1CCN([C@H]2CCN(c3sccc3-c3nnn[n-]3)C2=O)CC1 ZINC000822895225 606316464 /nfs/dbraw/zinc/31/64/64/606316464.db2.gz OLCVKCUPBSGELB-JTQLQIEISA-N -1 3 398.474 -1.145 20 0 GAADHM NS(=O)(=O)N1CCN([C@@H]2CCN(c3sccc3-c3nn[n-]n3)C2=O)CC1 ZINC000822895226 606316599 /nfs/dbraw/zinc/31/65/99/606316599.db2.gz OLCVKCUPBSGELB-SNVBAGLBSA-N -1 3 398.474 -1.145 20 0 GAADHM NS(=O)(=O)N1CCN([C@@H]2CCN(c3sccc3-c3nnn[n-]3)C2=O)CC1 ZINC000822895226 606316597 /nfs/dbraw/zinc/31/65/97/606316597.db2.gz OLCVKCUPBSGELB-SNVBAGLBSA-N -1 3 398.474 -1.145 20 0 GAADHM NS(=O)(=O)CCN1CCN(C(=O)Cc2cccc(-c3nn[n-]n3)c2)CC1 ZINC000822895360 606598890 /nfs/dbraw/zinc/59/88/90/606598890.db2.gz PPMLYANTCZMUNR-UHFFFAOYSA-N -1 3 379.446 -1.158 20 0 GAADHM NS(=O)(=O)CCN1CCN(C(=O)Cc2cccc(-c3nnn[n-]3)c2)CC1 ZINC000822895360 606598888 /nfs/dbraw/zinc/59/88/88/606598888.db2.gz PPMLYANTCZMUNR-UHFFFAOYSA-N -1 3 379.446 -1.158 20 0 GAADHM NS(=O)(=O)CCN1CCN(C(=O)COc2cccc(-c3nn[n-]n3)c2)CC1 ZINC000822895559 606287329 /nfs/dbraw/zinc/28/73/29/606287329.db2.gz SVFNNVYXODMJSE-UHFFFAOYSA-N -1 3 395.445 -1.322 20 0 GAADHM NS(=O)(=O)CCN1CCN(C(=O)COc2cccc(-c3nnn[n-]3)c2)CC1 ZINC000822895559 606287327 /nfs/dbraw/zinc/28/73/27/606287327.db2.gz SVFNNVYXODMJSE-UHFFFAOYSA-N -1 3 395.445 -1.322 20 0 GAADHM NS(=O)(=O)CCN1CCN(C(=O)CNc2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000822895574 606194574 /nfs/dbraw/zinc/19/45/74/606194574.db2.gz UCCYBYDLXQODIY-UHFFFAOYSA-N -1 3 394.461 -1.289 20 0 GAADHM NS(=O)(=O)c1ccc(N2CCN3C(=O)C(=O)NC[C@@H]3C2)c(-c2nn[n-]n2)c1 ZINC000822895610 607174104 /nfs/dbraw/zinc/17/41/04/607174104.db2.gz VISBLZVWOFISQX-MRVPVSSYSA-N -1 3 392.401 -2.339 20 0 GAADHM NS(=O)(=O)c1ccc(N2CCN3C(=O)C(=O)NC[C@@H]3C2)c(-c2nnn[n-]2)c1 ZINC000822895610 607174103 /nfs/dbraw/zinc/17/41/03/607174103.db2.gz VISBLZVWOFISQX-MRVPVSSYSA-N -1 3 392.401 -2.339 20 0 GAADHM NS(=O)(=O)c1ccc(N2CCN3C(=O)C(=O)NC[C@H]3C2)c(-c2nn[n-]n2)c1 ZINC000822895611 607174168 /nfs/dbraw/zinc/17/41/68/607174168.db2.gz VISBLZVWOFISQX-QMMMGPOBSA-N -1 3 392.401 -2.339 20 0 GAADHM NS(=O)(=O)c1ccc(N2CCN3C(=O)C(=O)NC[C@H]3C2)c(-c2nnn[n-]2)c1 ZINC000822895611 607174167 /nfs/dbraw/zinc/17/41/67/607174167.db2.gz VISBLZVWOFISQX-QMMMGPOBSA-N -1 3 392.401 -2.339 20 0 GAADHM NS(=O)(=O)CCN1CCN(C(=O)COc2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000822895626 606287360 /nfs/dbraw/zinc/28/73/60/606287360.db2.gz VVQDZYDQCKGNAF-UHFFFAOYSA-N -1 3 395.445 -1.322 20 0 GAADHM NS(=O)(=O)N1CCN(C(=O)CNC(=O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000822895719 599353308 /nfs/dbraw/zinc/35/33/08/599353308.db2.gz WMXZJWLMWDCBTM-UHFFFAOYSA-N -1 3 394.417 -2.056 20 0 GAADHM NS(=O)(=O)N1CCN(C(=O)CNC(=O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000822895719 599353306 /nfs/dbraw/zinc/35/33/06/599353306.db2.gz WMXZJWLMWDCBTM-UHFFFAOYSA-N -1 3 394.417 -2.056 20 0 GAADHM NS(=O)(=O)CCN1CCN(CC(=O)Nc2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000822895749 946214286 /nfs/dbraw/zinc/21/42/86/946214286.db2.gz WYMYCNAXEBHUIM-UHFFFAOYSA-N -1 3 394.461 -1.289 20 0 GAADHM NS(=O)(=O)CCN1CCN(CC(=O)Nc2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000822895749 946214279 /nfs/dbraw/zinc/21/42/79/946214279.db2.gz WYMYCNAXEBHUIM-UHFFFAOYSA-N -1 3 394.461 -1.289 20 0 GAADHM NS(=O)(=O)c1cnn(CC(=O)NCCOc2ccc(-c3nn[n-]n3)cc2)c1 ZINC000822899694 599469486 /nfs/dbraw/zinc/46/94/86/599469486.db2.gz PCPMHGRJRLJGQM-UHFFFAOYSA-N -1 3 392.401 -1.094 20 0 GAADHM NS(=O)(=O)c1ccc(NC[C@H](O)CN2CCOCC2)c(-c2nn[n-]n2)c1 ZINC000822899717 607303180 /nfs/dbraw/zinc/30/31/80/607303180.db2.gz PTIOONSZFQIOMZ-JTQLQIEISA-N -1 3 383.434 -1.381 20 0 GAADHM NS(=O)(=O)c1ccc(NC[C@H](O)CN2CCOCC2)c(-c2nnn[n-]2)c1 ZINC000822899717 607303179 /nfs/dbraw/zinc/30/31/79/607303179.db2.gz PTIOONSZFQIOMZ-JTQLQIEISA-N -1 3 383.434 -1.381 20 0 GAADHM NS(=O)(=O)c1ccc(NC[C@@H](O)CN2CCOCC2)c(-c2nn[n-]n2)c1 ZINC000822899718 607303353 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C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NN1CCCNC1=O ZINC000824641343 946883463 /nfs/dbraw/zinc/88/34/63/946883463.db2.gz UOGNJVNVXHFNIQ-VIFPVBQESA-N -1 3 394.417 -1.020 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N(C)[C@@H](C)C(N)=O ZINC000824641565 608251768 /nfs/dbraw/zinc/25/17/68/608251768.db2.gz WYVQTVZZTJEGFT-BDAKNGLRSA-N -1 3 381.418 -1.134 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N(C)[C@@H](C)C(N)=O ZINC000824641565 608251767 /nfs/dbraw/zinc/25/17/67/608251767.db2.gz WYVQTVZZTJEGFT-BDAKNGLRSA-N -1 3 381.418 -1.134 20 0 GAADHM C[C@H](C(N)=O)N(C)C(=O)[C@H](C)NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000824641566 608251525 /nfs/dbraw/zinc/25/15/25/608251525.db2.gz WYVQTVZZTJEGFT-DTWKUNHWSA-N -1 3 381.418 -1.134 20 0 GAADHM C[C@H](C(N)=O)N(C)C(=O)[C@H](C)NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000824641566 608251524 /nfs/dbraw/zinc/25/15/24/608251524.db2.gz WYVQTVZZTJEGFT-DTWKUNHWSA-N -1 3 381.418 -1.134 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N(C)[C@@H](C)C(N)=O ZINC000824641567 608251414 /nfs/dbraw/zinc/25/14/14/608251414.db2.gz WYVQTVZZTJEGFT-IUCAKERBSA-N -1 3 381.418 -1.134 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N(C)[C@@H](C)C(N)=O ZINC000824641567 608251412 /nfs/dbraw/zinc/25/14/12/608251412.db2.gz WYVQTVZZTJEGFT-IUCAKERBSA-N -1 3 381.418 -1.134 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N(C)[C@H](C)C(N)=O ZINC000824641568 608251657 /nfs/dbraw/zinc/25/16/57/608251657.db2.gz WYVQTVZZTJEGFT-RKDXNWHRSA-N -1 3 381.418 -1.134 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N(C)[C@H](C)C(N)=O ZINC000824641568 608251655 /nfs/dbraw/zinc/25/16/55/608251655.db2.gz WYVQTVZZTJEGFT-RKDXNWHRSA-N -1 3 381.418 -1.134 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC[C@@]1(O)CCOC1 ZINC000824641789 607861984 /nfs/dbraw/zinc/86/19/84/607861984.db2.gz ZBCBRZDQMSZACN-BMIGLBTASA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NC[C@@]1(O)CCOC1 ZINC000824641789 607861983 /nfs/dbraw/zinc/86/19/83/607861983.db2.gz ZBCBRZDQMSZACN-BMIGLBTASA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC[C@@]1(O)CCOC1 ZINC000824641790 607861757 /nfs/dbraw/zinc/86/17/57/607861757.db2.gz ZBCBRZDQMSZACN-BONVTDFDSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NC[C@@]1(O)CCOC1 ZINC000824641790 607861756 /nfs/dbraw/zinc/86/17/56/607861756.db2.gz ZBCBRZDQMSZACN-BONVTDFDSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC[C@]1(O)CCOC1 ZINC000824641791 607861850 /nfs/dbraw/zinc/86/18/50/607861850.db2.gz ZBCBRZDQMSZACN-MEBBXXQBSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NC[C@]1(O)CCOC1 ZINC000824641791 607861849 /nfs/dbraw/zinc/86/18/49/607861849.db2.gz ZBCBRZDQMSZACN-MEBBXXQBSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC[C@]1(O)CCOC1 ZINC000824641792 607861763 /nfs/dbraw/zinc/86/17/63/607861763.db2.gz ZBCBRZDQMSZACN-ZUZCIYMTSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NC[C@]1(O)CCOC1 ZINC000824641792 607861762 /nfs/dbraw/zinc/86/17/62/607861762.db2.gz ZBCBRZDQMSZACN-ZUZCIYMTSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCc1ncn(C)n1 ZINC000824641799 608589737 /nfs/dbraw/zinc/58/97/37/608589737.db2.gz ZDDLRYBVKUHKIP-SECBINFHSA-N -1 3 391.417 -1.022 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCc1ncn(C)n1 ZINC000824641799 608589735 /nfs/dbraw/zinc/58/97/35/608589735.db2.gz ZDDLRYBVKUHKIP-SECBINFHSA-N -1 3 391.417 -1.022 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCc1ncn(C)n1 ZINC000824641800 608589679 /nfs/dbraw/zinc/58/96/79/608589679.db2.gz ZDDLRYBVKUHKIP-VIFPVBQESA-N -1 3 391.417 -1.022 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCc1ncn(C)n1 ZINC000824641800 608589678 /nfs/dbraw/zinc/58/96/78/608589678.db2.gz ZDDLRYBVKUHKIP-VIFPVBQESA-N -1 3 391.417 -1.022 20 0 GAADHM C[C@@H](NS(C)(=O)=O)C(=O)OCC(=O)NCc1cccc(-c2nn[n-]n2)c1 ZINC000824649877 607975667 /nfs/dbraw/zinc/97/56/67/607975667.db2.gz NWWOKMIXNYLBDY-SECBINFHSA-N -1 3 382.402 -1.036 20 0 GAADHM C[C@@H](NS(C)(=O)=O)C(=O)OCC(=O)NCc1cccc(-c2nnn[n-]2)c1 ZINC000824649877 607975666 /nfs/dbraw/zinc/97/56/66/607975666.db2.gz NWWOKMIXNYLBDY-SECBINFHSA-N -1 3 382.402 -1.036 20 0 GAADHM C[C@H](NS(C)(=O)=O)C(=O)OCC(=O)NCc1cccc(-c2nn[n-]n2)c1 ZINC000824649885 607975497 /nfs/dbraw/zinc/97/54/97/607975497.db2.gz NWWOKMIXNYLBDY-VIFPVBQESA-N -1 3 382.402 -1.036 20 0 GAADHM C[C@H](NS(C)(=O)=O)C(=O)OCC(=O)NCc1cccc(-c2nnn[n-]2)c1 ZINC000824649885 607975496 /nfs/dbraw/zinc/97/54/96/607975496.db2.gz NWWOKMIXNYLBDY-VIFPVBQESA-N -1 3 382.402 -1.036 20 0 GAADHM C[C@@H](NS(C)(=O)=O)C(=O)OCC(=O)NCc1ccc(-c2nn[n-]n2)cc1 ZINC000824650561 607975580 /nfs/dbraw/zinc/97/55/80/607975580.db2.gz RPBZMYMOEIFAJQ-SECBINFHSA-N -1 3 382.402 -1.036 20 0 GAADHM C[C@@H](NS(C)(=O)=O)C(=O)OCC(=O)NCc1ccc(-c2nnn[n-]2)cc1 ZINC000824650561 607975579 /nfs/dbraw/zinc/97/55/79/607975579.db2.gz RPBZMYMOEIFAJQ-SECBINFHSA-N -1 3 382.402 -1.036 20 0 GAADHM C[C@H](NS(C)(=O)=O)C(=O)OCC(=O)NCc1ccc(-c2nn[n-]n2)cc1 ZINC000824650562 607975488 /nfs/dbraw/zinc/97/54/88/607975488.db2.gz RPBZMYMOEIFAJQ-VIFPVBQESA-N -1 3 382.402 -1.036 20 0 GAADHM C[C@H](NS(C)(=O)=O)C(=O)OCC(=O)NCc1ccc(-c2nnn[n-]2)cc1 ZINC000824650562 607975487 /nfs/dbraw/zinc/97/54/87/607975487.db2.gz RPBZMYMOEIFAJQ-VIFPVBQESA-N -1 3 382.402 -1.036 20 0 GAADHM C[C@@H](O)C(=O)N1CCN(c2ccc(S(N)(=O)=O)cc2-c2nn[n-]n2)CC1 ZINC000824678788 608233276 /nfs/dbraw/zinc/23/32/76/608233276.db2.gz ONUGQCOWQZNNAX-SECBINFHSA-N -1 3 381.418 -1.457 20 0 GAADHM C[C@@H](O)C(=O)N1CCN(c2ccc(S(N)(=O)=O)cc2-c2nnn[n-]2)CC1 ZINC000824678788 608233274 /nfs/dbraw/zinc/23/32/74/608233274.db2.gz ONUGQCOWQZNNAX-SECBINFHSA-N -1 3 381.418 -1.457 20 0 GAADHM C[C@H](O)C(=O)N1CCN(c2ccc(S(N)(=O)=O)cc2-c2nn[n-]n2)CC1 ZINC000824678789 608233212 /nfs/dbraw/zinc/23/32/12/608233212.db2.gz ONUGQCOWQZNNAX-VIFPVBQESA-N -1 3 381.418 -1.457 20 0 GAADHM C[C@H](O)C(=O)N1CCN(c2ccc(S(N)(=O)=O)cc2-c2nnn[n-]2)CC1 ZINC000824678789 608233211 /nfs/dbraw/zinc/23/32/11/608233211.db2.gz ONUGQCOWQZNNAX-VIFPVBQESA-N -1 3 381.418 -1.457 20 0 GAADHM C[C@@H](O)C(=O)N1CCN(C(=O)C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)CC1 ZINC000824678800 608244710 /nfs/dbraw/zinc/24/47/10/608244710.db2.gz OTQHLYVNNPTEMM-SECBINFHSA-N -1 3 391.363 -1.004 20 0 GAADHM C[C@@H](O)C(=O)N1CCN(C(=O)C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)CC1 ZINC000824678800 608244708 /nfs/dbraw/zinc/24/47/08/608244708.db2.gz OTQHLYVNNPTEMM-SECBINFHSA-N -1 3 391.363 -1.004 20 0 GAADHM C[C@H](O)C(=O)N1CCN(C(=O)C(=O)Nc2ccc(F)cc2-c2nn[n-]n2)CC1 ZINC000824678801 608244849 /nfs/dbraw/zinc/24/48/49/608244849.db2.gz OTQHLYVNNPTEMM-VIFPVBQESA-N -1 3 391.363 -1.004 20 0 GAADHM C[C@H](O)C(=O)N1CCN(C(=O)C(=O)Nc2ccc(F)cc2-c2nnn[n-]2)CC1 ZINC000824678801 608244847 /nfs/dbraw/zinc/24/48/47/608244847.db2.gz OTQHLYVNNPTEMM-VIFPVBQESA-N -1 3 391.363 -1.004 20 0 GAADHM C[C@@H](O)C(=O)N1CCN(C(=O)C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)CC1 ZINC000824679439 608244954 /nfs/dbraw/zinc/24/49/54/608244954.db2.gz SCOFRACPXCGECA-SECBINFHSA-N -1 3 391.363 -1.004 20 0 GAADHM C[C@@H](O)C(=O)N1CCN(C(=O)C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)CC1 ZINC000824679439 608244953 /nfs/dbraw/zinc/24/49/53/608244953.db2.gz SCOFRACPXCGECA-SECBINFHSA-N -1 3 391.363 -1.004 20 0 GAADHM C[C@H](O)C(=O)N1CCN(C(=O)C(=O)Nc2ccc(F)c(-c3nn[n-]n3)c2)CC1 ZINC000824679441 608244630 /nfs/dbraw/zinc/24/46/30/608244630.db2.gz SCOFRACPXCGECA-VIFPVBQESA-N -1 3 391.363 -1.004 20 0 GAADHM C[C@H](O)C(=O)N1CCN(C(=O)C(=O)Nc2ccc(F)c(-c3nnn[n-]3)c2)CC1 ZINC000824679441 608244628 /nfs/dbraw/zinc/24/46/28/608244628.db2.gz SCOFRACPXCGECA-VIFPVBQESA-N -1 3 391.363 -1.004 20 0 GAADHM C[C@@H](O)C(=O)N1CCN(C(=O)CNC(=O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC000824679743 608255424 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390.360 -1.095 20 0 GAADHM CCS(=O)(=O)NCC(=O)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC000825662914 607965553 /nfs/dbraw/zinc/96/55/53/607965553.db2.gz DWGOMBSPFNBNMO-UHFFFAOYSA-N -1 3 380.434 -1.150 20 0 GAADHM CCS(=O)(=O)NCC(=O)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC000825662914 607965552 /nfs/dbraw/zinc/96/55/52/607965552.db2.gz DWGOMBSPFNBNMO-UHFFFAOYSA-N -1 3 380.434 -1.150 20 0 GAADHM CCS(=O)(=O)NCC(=O)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1 ZINC000825663810 607966469 /nfs/dbraw/zinc/96/64/69/607966469.db2.gz WSLKQIMEDWFKTG-UHFFFAOYSA-N -1 3 380.434 -1.150 20 0 GAADHM CCS(=O)(=O)NCC(=O)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1 ZINC000825663810 607966468 /nfs/dbraw/zinc/96/64/68/607966468.db2.gz WSLKQIMEDWFKTG-UHFFFAOYSA-N -1 3 380.434 -1.150 20 0 GAADHM CCS(=O)(=O)NCC(=O)N1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC000825663925 607977763 /nfs/dbraw/zinc/97/77/63/607977763.db2.gz ZYUPRGSCSXEDGZ-UHFFFAOYSA-N -1 3 380.434 -1.150 20 0 GAADHM CCS(=O)(=O)NCC(=O)N1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC000825663925 607977762 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385.384 -1.055 20 0 GAADHM CNC(=O)[C@H]1CN([C@H]2CC(=O)N(c3ccc(-c4nnn[n-]4)cc3)C2=O)CCO1 ZINC000826060971 609368650 /nfs/dbraw/zinc/36/86/50/609368650.db2.gz XMUYVUUSDSPCNG-QWHCGFSZSA-N -1 3 385.384 -1.055 20 0 GAADHM CNC(=O)[C@@H]1CN([C@H]2CC(=O)N(c3ccc(-c4nn[n-]n4)cc3)C2=O)CCO1 ZINC000826060972 609368559 /nfs/dbraw/zinc/36/85/59/609368559.db2.gz XMUYVUUSDSPCNG-STQMWFEESA-N -1 3 385.384 -1.055 20 0 GAADHM CNC(=O)[C@@H]1CN([C@H]2CC(=O)N(c3ccc(-c4nnn[n-]4)cc3)C2=O)CCO1 ZINC000826060972 609368558 /nfs/dbraw/zinc/36/85/58/609368558.db2.gz XMUYVUUSDSPCNG-STQMWFEESA-N -1 3 385.384 -1.055 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)Nc2cccc(-c3nn[n-]n3)c2)C1 ZINC000826082757 607558084 /nfs/dbraw/zinc/55/80/84/607558084.db2.gz AJLMPHDIEYXXOO-LLVKDONJSA-N -1 3 379.402 -1.045 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)Nc2cccc(-c3nnn[n-]3)c2)C1 ZINC000826082757 607558082 /nfs/dbraw/zinc/55/80/82/607558082.db2.gz AJLMPHDIEYXXOO-LLVKDONJSA-N -1 3 379.402 -1.045 20 0 GAADHM CNS(=O)(=O)[C@H]1CCN(C(=O)C(=O)Nc2cccc(-c3nn[n-]n3)c2)C1 ZINC000826082762 607558031 /nfs/dbraw/zinc/55/80/31/607558031.db2.gz AJLMPHDIEYXXOO-NSHDSACASA-N -1 3 379.402 -1.045 20 0 GAADHM CNS(=O)(=O)[C@H]1CCN(C(=O)C(=O)Nc2cccc(-c3nnn[n-]3)c2)C1 ZINC000826082762 607558029 /nfs/dbraw/zinc/55/80/29/607558029.db2.gz AJLMPHDIEYXXOO-NSHDSACASA-N -1 3 379.402 -1.045 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCN(C(=O)CNC(=O)c2ccc(-c3nn[n-]n3)cc2)C1 ZINC000826083377 607563341 /nfs/dbraw/zinc/56/33/41/607563341.db2.gz JXGROQIPFJYKTE-GFCCVEGCSA-N -1 3 393.429 -1.253 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCN(C(=O)CNC(=O)c2ccc(-c3nnn[n-]3)cc2)C1 ZINC000826083377 607563340 /nfs/dbraw/zinc/56/33/40/607563340.db2.gz JXGROQIPFJYKTE-GFCCVEGCSA-N -1 3 393.429 -1.253 20 0 GAADHM CNS(=O)(=O)[C@H]1CCN(C(=O)CNC(=O)c2ccc(-c3nn[n-]n3)cc2)C1 ZINC000826083378 607563338 /nfs/dbraw/zinc/56/33/38/607563338.db2.gz JXGROQIPFJYKTE-LBPRGKRZSA-N -1 3 393.429 -1.253 20 0 GAADHM CNS(=O)(=O)[C@H]1CCN(C(=O)CNC(=O)c2ccc(-c3nnn[n-]3)cc2)C1 ZINC000826083378 607563337 /nfs/dbraw/zinc/56/33/37/607563337.db2.gz JXGROQIPFJYKTE-LBPRGKRZSA-N -1 3 393.429 -1.253 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCN(c2ccc(S(N)(=O)=O)cc2-c2nn[n-]n2)C1 ZINC000826083623 607542611 /nfs/dbraw/zinc/54/26/11/607542611.db2.gz OVHKMUWPFLMHCF-SECBINFHSA-N -1 3 387.447 -1.358 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCN(c2ccc(S(N)(=O)=O)cc2-c2nnn[n-]2)C1 ZINC000826083623 607542610 /nfs/dbraw/zinc/54/26/10/607542610.db2.gz OVHKMUWPFLMHCF-SECBINFHSA-N -1 3 387.447 -1.358 20 0 GAADHM CNS(=O)(=O)[C@H]1CCN(c2ccc(S(N)(=O)=O)cc2-c2nn[n-]n2)C1 ZINC000826083624 607542462 /nfs/dbraw/zinc/54/24/62/607542462.db2.gz OVHKMUWPFLMHCF-VIFPVBQESA-N -1 3 387.447 -1.358 20 0 GAADHM CNS(=O)(=O)[C@H]1CCN(c2ccc(S(N)(=O)=O)cc2-c2nnn[n-]2)C1 ZINC000826083624 607542461 /nfs/dbraw/zinc/54/24/61/607542461.db2.gz OVHKMUWPFLMHCF-VIFPVBQESA-N -1 3 387.447 -1.358 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000826083823 607557883 /nfs/dbraw/zinc/55/78/83/607557883.db2.gz RSJMIUXSLZOPJV-LLVKDONJSA-N -1 3 379.402 -1.045 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)Nc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000826083823 607557880 /nfs/dbraw/zinc/55/78/80/607557880.db2.gz RSJMIUXSLZOPJV-LLVKDONJSA-N -1 3 379.402 -1.045 20 0 GAADHM CNS(=O)(=O)[C@H]1CCN(C(=O)C(=O)Nc2ccc(-c3nn[n-]n3)cc2)C1 ZINC000826083825 607558423 /nfs/dbraw/zinc/55/84/23/607558423.db2.gz RSJMIUXSLZOPJV-NSHDSACASA-N -1 3 379.402 -1.045 20 0 GAADHM CNS(=O)(=O)[C@H]1CCN(C(=O)C(=O)Nc2ccc(-c3nnn[n-]3)cc2)C1 ZINC000826083825 607558422 /nfs/dbraw/zinc/55/84/22/607558422.db2.gz RSJMIUXSLZOPJV-NSHDSACASA-N -1 3 379.402 -1.045 20 0 GAADHM CNS(=O)(=O)CCC(=O)OCC(=O)NCc1ccc(-c2nn[n-]n2)cc1 ZINC000826090237 608382601 /nfs/dbraw/zinc/38/26/01/608382601.db2.gz DPPLOYYUTXMVPB-UHFFFAOYSA-N -1 3 382.402 -1.035 20 0 GAADHM CNS(=O)(=O)CCC(=O)OCC(=O)NCc1ccc(-c2nnn[n-]2)cc1 ZINC000826090237 608382599 /nfs/dbraw/zinc/38/25/99/608382599.db2.gz DPPLOYYUTXMVPB-UHFFFAOYSA-N -1 3 382.402 -1.035 20 0 GAADHM CNS(=O)(=O)CCC(=O)OCC(=O)NCc1cccc(-c2nn[n-]n2)c1 ZINC000826091127 608382491 /nfs/dbraw/zinc/38/24/91/608382491.db2.gz VVILYPFIHNESEN-UHFFFAOYSA-N -1 3 382.402 -1.035 20 0 GAADHM CNS(=O)(=O)CCC(=O)OCC(=O)NCc1cccc(-c2nnn[n-]2)c1 ZINC000826091127 608382490 /nfs/dbraw/zinc/38/24/90/608382490.db2.gz VVILYPFIHNESEN-UHFFFAOYSA-N -1 3 382.402 -1.035 20 0 GAADHM COC(=O)CNC(=O)CNS(=O)(=O)Cc1cc(-c2nn[n-]n2)ccc1F ZINC000826138522 608327252 /nfs/dbraw/zinc/32/72/52/608327252.db2.gz XYRPNOFMBOYJHZ-UHFFFAOYSA-N -1 3 386.365 -1.286 20 0 GAADHM COC[C@@H](NC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(N)=O ZINC000826149227 608009338 /nfs/dbraw/zinc/00/93/38/608009338.db2.gz COGUVWBXUODQGX-GZMMTYOYSA-N -1 3 397.417 -1.850 20 0 GAADHM COC[C@@H](NC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(N)=O ZINC000826149227 608009337 /nfs/dbraw/zinc/00/93/37/608009337.db2.gz COGUVWBXUODQGX-GZMMTYOYSA-N -1 3 397.417 -1.850 20 0 GAADHM COC[C@H](NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(N)=O ZINC000826149228 608009301 /nfs/dbraw/zinc/00/93/01/608009301.db2.gz COGUVWBXUODQGX-KCJUWKMLSA-N -1 3 397.417 -1.850 20 0 GAADHM COC[C@H](NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(N)=O ZINC000826149228 608009300 /nfs/dbraw/zinc/00/93/00/608009300.db2.gz COGUVWBXUODQGX-KCJUWKMLSA-N -1 3 397.417 -1.850 20 0 GAADHM COC[C@H](NC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(N)=O ZINC000826149229 608009492 /nfs/dbraw/zinc/00/94/92/608009492.db2.gz COGUVWBXUODQGX-KWQFWETISA-N -1 3 397.417 -1.850 20 0 GAADHM COC[C@H](NC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(N)=O ZINC000826149229 608009491 /nfs/dbraw/zinc/00/94/91/608009491.db2.gz COGUVWBXUODQGX-KWQFWETISA-N -1 3 397.417 -1.850 20 0 GAADHM COC[C@@H](NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(N)=O ZINC000826149230 608009414 /nfs/dbraw/zinc/00/94/14/608009414.db2.gz COGUVWBXUODQGX-LDYMZIIASA-N -1 3 397.417 -1.850 20 0 GAADHM COC[C@@H](NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(N)=O ZINC000826149230 608009413 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CYHBFWUXSDVFIJ-KWQFWETISA-N -1 3 397.417 -1.850 20 0 GAADHM COC[C@H](NC(=O)[C@H](C)NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(N)=O ZINC000826149245 608009312 /nfs/dbraw/zinc/00/93/12/608009312.db2.gz CYHBFWUXSDVFIJ-KWQFWETISA-N -1 3 397.417 -1.850 20 0 GAADHM COC[C@@H](NC(=O)[C@@H](C)NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(N)=O ZINC000826149246 608009501 /nfs/dbraw/zinc/00/95/01/608009501.db2.gz CYHBFWUXSDVFIJ-LDYMZIIASA-N -1 3 397.417 -1.850 20 0 GAADHM COC[C@@H](NC(=O)[C@@H](C)NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(N)=O ZINC000826149246 608009500 /nfs/dbraw/zinc/00/95/00/608009500.db2.gz CYHBFWUXSDVFIJ-LDYMZIIASA-N -1 3 397.417 -1.850 20 0 GAADHM COC[C@H](O)CNC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000826152264 607510267 /nfs/dbraw/zinc/51/02/67/607510267.db2.gz UQPSITXKQDADQB-GXSJLCMTSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@H](O)CNC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000826152264 607510266 /nfs/dbraw/zinc/51/02/66/607510266.db2.gz UQPSITXKQDADQB-GXSJLCMTSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@@H](O)CNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000826152265 607510147 /nfs/dbraw/zinc/51/01/47/607510147.db2.gz UQPSITXKQDADQB-KOLCDFICSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@@H](O)CNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000826152265 607510145 /nfs/dbraw/zinc/51/01/45/607510145.db2.gz UQPSITXKQDADQB-KOLCDFICSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@H](O)CNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000826152266 607510019 /nfs/dbraw/zinc/51/00/19/607510019.db2.gz UQPSITXKQDADQB-MWLCHTKSSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@H](O)CNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000826152266 607510017 /nfs/dbraw/zinc/51/00/17/607510017.db2.gz UQPSITXKQDADQB-MWLCHTKSSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@@H](O)CNC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000826152267 607510429 /nfs/dbraw/zinc/51/04/29/607510429.db2.gz UQPSITXKQDADQB-ONGXEEELSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@@H](O)CNC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000826152267 607510428 /nfs/dbraw/zinc/51/04/28/607510428.db2.gz UQPSITXKQDADQB-ONGXEEELSA-N -1 3 384.418 -1.343 20 0 GAADHM COCCN1CCN(c2ccc(S(N)(=O)=O)cc2-c2nn[n-]n2)CC1=O ZINC000826159380 608555336 /nfs/dbraw/zinc/55/53/36/608555336.db2.gz CUGKBQOGGTUPJY-UHFFFAOYSA-N -1 3 381.418 -1.191 20 0 GAADHM COCCN1CCN(c2ccc(S(N)(=O)=O)cc2-c2nnn[n-]2)CC1=O ZINC000826159380 608555335 /nfs/dbraw/zinc/55/53/35/608555335.db2.gz CUGKBQOGGTUPJY-UHFFFAOYSA-N -1 3 381.418 -1.191 20 0 GAADHM COCCN1CCN(C(=O)CNC(=O)c2ccc(-c3nn[n-]n3)cc2)CC1=O ZINC000826159968 608553719 /nfs/dbraw/zinc/55/37/19/608553719.db2.gz ZPVAQTPZLXSDSC-UHFFFAOYSA-N -1 3 387.400 -1.086 20 0 GAADHM COCCN1CCN(C(=O)CNC(=O)c2ccc(-c3nnn[n-]3)cc2)CC1=O ZINC000826159968 608553718 /nfs/dbraw/zinc/55/37/18/608553718.db2.gz ZPVAQTPZLXSDSC-UHFFFAOYSA-N -1 3 387.400 -1.086 20 0 GAADHM COc1cc(-c2nn[n-]n2)ccc1OCC(=O)NCCN1CCNC(=O)C1 ZINC000826175037 609319818 /nfs/dbraw/zinc/31/98/18/609319818.db2.gz QZTXQIPRKHSUCH-UHFFFAOYSA-N -1 3 375.389 -1.198 20 0 GAADHM COc1cc(-c2nnn[n-]2)ccc1OCC(=O)NCCN1CCNC(=O)C1 ZINC000826175037 609319816 /nfs/dbraw/zinc/31/98/16/609319816.db2.gz QZTXQIPRKHSUCH-UHFFFAOYSA-N -1 3 375.389 -1.198 20 0 GAADHM COc1cc(-c2nn[n-]n2)ccc1OCC(=O)N1CCN(C(=O)CO)CC1 ZINC000826175099 608015539 /nfs/dbraw/zinc/01/55/39/608015539.db2.gz STEQPZMWOMMEKC-UHFFFAOYSA-N -1 3 376.373 -1.083 20 0 GAADHM COc1cc(-c2nnn[n-]2)ccc1OCC(=O)N1CCN(C(=O)CO)CC1 ZINC000826175099 608015538 /nfs/dbraw/zinc/01/55/38/608015538.db2.gz STEQPZMWOMMEKC-UHFFFAOYSA-N -1 3 376.373 -1.083 20 0 GAADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C(=O)N1CCN(C(=O)CO)CC1 ZINC000826184808 608493309 /nfs/dbraw/zinc/49/33/09/608493309.db2.gz LPMMNKTVXDNWFZ-UHFFFAOYSA-N -1 3 389.372 -1.523 20 0 GAADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C(=O)N1CCN(C(=O)CO)CC1 ZINC000826184808 608493307 /nfs/dbraw/zinc/49/33/07/608493307.db2.gz LPMMNKTVXDNWFZ-UHFFFAOYSA-N -1 3 389.372 -1.523 20 0 GAADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C(=O)NCC(=O)N1CCOCC1 ZINC000826185023 947565875 /nfs/dbraw/zinc/56/58/75/947565875.db2.gz VXEUKKLVFFPJAM-UHFFFAOYSA-N -1 3 389.372 -1.211 20 0 GAADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C(=O)NCC(=O)N1CCOCC1 ZINC000826185023 947565868 /nfs/dbraw/zinc/56/58/68/947565868.db2.gz VXEUKKLVFFPJAM-UHFFFAOYSA-N -1 3 389.372 -1.211 20 0 GAADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C(=O)NCCN1CCNC(=O)C1 ZINC000826185772 609368646 /nfs/dbraw/zinc/36/86/46/609368646.db2.gz TTYIDPPEGROMBA-UHFFFAOYSA-N -1 3 388.388 -1.638 20 0 GAADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C(=O)NCCN1CCNC(=O)C1 ZINC000826185772 609368645 /nfs/dbraw/zinc/36/86/45/609368645.db2.gz TTYIDPPEGROMBA-UHFFFAOYSA-N -1 3 388.388 -1.638 20 0 GAADHM COc1ccc(-c2nn[n-]n2)cc1NC(=O)C(=O)NCCC(=O)NC(N)=O ZINC000826185966 608362890 /nfs/dbraw/zinc/36/28/90/608362890.db2.gz YZPVXLREBGYAIX-UHFFFAOYSA-N -1 3 376.333 -1.485 20 0 GAADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C(=O)NCCC(=O)NC(N)=O ZINC000826185966 608362889 /nfs/dbraw/zinc/36/28/89/608362889.db2.gz YZPVXLREBGYAIX-UHFFFAOYSA-N -1 3 376.333 -1.485 20 0 GAADHM COc1ccc(CNC(=O)C(=O)NC[C@@H](C)S(N)(=O)=O)cc1-c1nn[n-]n1 ZINC000826196271 609414544 /nfs/dbraw/zinc/41/45/44/609414544.db2.gz WGXVJZOAWLHZFG-MRVPVSSYSA-N -1 3 397.417 -1.715 20 0 GAADHM COc1ccc(CNC(=O)C(=O)NC[C@@H](C)S(N)(=O)=O)cc1-c1nnn[n-]1 ZINC000826196271 609414542 /nfs/dbraw/zinc/41/45/42/609414542.db2.gz WGXVJZOAWLHZFG-MRVPVSSYSA-N -1 3 397.417 -1.715 20 0 GAADHM COc1ccc(CNC(=O)C(=O)NC[C@H](C)S(N)(=O)=O)cc1-c1nn[n-]n1 ZINC000826196272 609414567 /nfs/dbraw/zinc/41/45/67/609414567.db2.gz WGXVJZOAWLHZFG-QMMMGPOBSA-N -1 3 397.417 -1.715 20 0 GAADHM COc1ccc(CNC(=O)C(=O)NC[C@H](C)S(N)(=O)=O)cc1-c1nnn[n-]1 ZINC000826196272 609414566 /nfs/dbraw/zinc/41/45/66/609414566.db2.gz WGXVJZOAWLHZFG-QMMMGPOBSA-N -1 3 397.417 -1.715 20 0 GAADHM CS(=O)(=O)NCCNS(=O)(=O)Cc1cc(-c2nn[n-]n2)ccc1F ZINC000826223579 608327368 /nfs/dbraw/zinc/32/73/68/608327368.db2.gz RXMZIQHILZAJKM-UHFFFAOYSA-N -1 3 378.411 -1.026 20 0 GAADHM CS(=O)(=O)NCCNS(=O)(=O)Cc1cc(-c2nnn[n-]2)ccc1F ZINC000826223579 608327367 /nfs/dbraw/zinc/32/73/67/608327367.db2.gz RXMZIQHILZAJKM-UHFFFAOYSA-N -1 3 378.411 -1.026 20 0 GAADHM Cc1c(C(=O)n2ncc(-c3nnn[n-]3)c2N)cnc2c1c(=O)n(C)c(=O)n2C ZINC000826235128 607460469 /nfs/dbraw/zinc/46/04/69/607460469.db2.gz CEUJXZKKUPTUKV-UHFFFAOYSA-N -1 3 382.344 -1.412 20 0 GAADHM Cc1c(NC(=O)C(=O)NC[C@@H](O)CN2CCOCC2)cccc1-c1nn[n-]n1 ZINC000826240931 608813502 /nfs/dbraw/zinc/81/35/02/608813502.db2.gz MDYOCNRVIMQIJA-GFCCVEGCSA-N -1 3 389.416 -1.077 20 0 GAADHM Cc1c(NC(=O)C(=O)NC[C@@H](O)CN2CCOCC2)cccc1-c1nnn[n-]1 ZINC000826240931 608813501 /nfs/dbraw/zinc/81/35/01/608813501.db2.gz MDYOCNRVIMQIJA-GFCCVEGCSA-N -1 3 389.416 -1.077 20 0 GAADHM Cc1c(NC(=O)C(=O)NC[C@H](O)CN2CCOCC2)cccc1-c1nn[n-]n1 ZINC000826240932 608814124 /nfs/dbraw/zinc/81/41/24/608814124.db2.gz MDYOCNRVIMQIJA-LBPRGKRZSA-N -1 3 389.416 -1.077 20 0 GAADHM Cc1c(NC(=O)C(=O)NC[C@H](O)CN2CCOCC2)cccc1-c1nnn[n-]1 ZINC000826240932 608814122 /nfs/dbraw/zinc/81/41/22/608814122.db2.gz MDYOCNRVIMQIJA-LBPRGKRZSA-N -1 3 389.416 -1.077 20 0 GAADHM Cc1cc(C(=O)N(CC(N)=O)CC(N)=O)nn1-c1cccc(-c2nn[n-]n2)c1 ZINC000826257764 609221495 /nfs/dbraw/zinc/22/14/95/609221495.db2.gz OLXDUAYJJQOOIG-UHFFFAOYSA-N -1 3 383.372 -1.226 20 0 GAADHM Cc1cc(C(=O)N(CC(N)=O)CC(N)=O)nn1-c1cccc(-c2nnn[n-]2)c1 ZINC000826257764 609221493 /nfs/dbraw/zinc/22/14/93/609221493.db2.gz OLXDUAYJJQOOIG-UHFFFAOYSA-N -1 3 383.372 -1.226 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)C(=O)NC[C@@H](O)CN1CCOCC1 ZINC000826276864 608813835 /nfs/dbraw/zinc/81/38/35/608813835.db2.gz AKFKXQRCQDTKEY-CYBMUJFWSA-N -1 3 389.416 -1.077 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)C(=O)NC[C@@H](O)CN1CCOCC1 ZINC000826276864 608813831 /nfs/dbraw/zinc/81/38/31/608813831.db2.gz AKFKXQRCQDTKEY-CYBMUJFWSA-N -1 3 389.416 -1.077 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)C(=O)NC[C@H](O)CN1CCOCC1 ZINC000826276865 608813699 /nfs/dbraw/zinc/81/36/99/608813699.db2.gz AKFKXQRCQDTKEY-ZDUSSCGKSA-N -1 3 389.416 -1.077 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)cc1NC(=O)C(=O)NC[C@H](O)CN1CCOCC1 ZINC000826276865 608813695 /nfs/dbraw/zinc/81/36/95/608813695.db2.gz AKFKXQRCQDTKEY-ZDUSSCGKSA-N -1 3 389.416 -1.077 20 0 GAADHM Cc1cccc(NC(=O)C(=O)NC[C@@H](O)CN2CCOCC2)c1-c1nn[n-]n1 ZINC000826299155 608814074 /nfs/dbraw/zinc/81/40/74/608814074.db2.gz UEZQOJOOKJHBNB-GFCCVEGCSA-N -1 3 389.416 -1.077 20 0 GAADHM Cc1cccc(NC(=O)C(=O)NC[C@@H](O)CN2CCOCC2)c1-c1nnn[n-]1 ZINC000826299155 608814071 /nfs/dbraw/zinc/81/40/71/608814071.db2.gz UEZQOJOOKJHBNB-GFCCVEGCSA-N -1 3 389.416 -1.077 20 0 GAADHM Cc1cccc(NC(=O)C(=O)NC[C@H](O)CN2CCOCC2)c1-c1nn[n-]n1 ZINC000826299156 608814207 /nfs/dbraw/zinc/81/42/07/608814207.db2.gz UEZQOJOOKJHBNB-LBPRGKRZSA-N -1 3 389.416 -1.077 20 0 GAADHM Cc1cccc(NC(=O)C(=O)NC[C@H](O)CN2CCOCC2)c1-c1nnn[n-]1 ZINC000826299156 608814206 /nfs/dbraw/zinc/81/42/06/608814206.db2.gz UEZQOJOOKJHBNB-LBPRGKRZSA-N -1 3 389.416 -1.077 20 0 GAADHM Cc1cccc(S(=O)(=O)N2CCN(S(N)(=O)=O)CC2)c1-c1nn[n-]n1 ZINC000826301918 607615455 /nfs/dbraw/zinc/61/54/55/607615455.db2.gz UTDJDJNKLCYZQB-UHFFFAOYSA-N -1 3 387.447 -1.315 20 0 GAADHM Cc1cccc(S(=O)(=O)N2CCN(S(N)(=O)=O)CC2)c1-c1nnn[n-]1 ZINC000826301918 607615454 /nfs/dbraw/zinc/61/54/54/607615454.db2.gz UTDJDJNKLCYZQB-UHFFFAOYSA-N -1 3 387.447 -1.315 20 0 GAADHM Cc1cccc(S(=O)(=O)N2CCN3C(=O)C(=O)NC[C@H]3C2)c1-c1nn[n-]n1 ZINC000826302007 607674006 /nfs/dbraw/zinc/67/40/06/607674006.db2.gz XREFDZKHLJKGHT-JTQLQIEISA-N -1 3 391.413 -1.494 20 0 GAADHM Cc1cccc(S(=O)(=O)N2CCN3C(=O)C(=O)NC[C@H]3C2)c1-c1nnn[n-]1 ZINC000826302007 607674004 /nfs/dbraw/zinc/67/40/04/607674004.db2.gz XREFDZKHLJKGHT-JTQLQIEISA-N -1 3 391.413 -1.494 20 0 GAADHM Cc1cccc(S(=O)(=O)N2CCN3C(=O)C(=O)NC[C@@H]3C2)c1-c1nn[n-]n1 ZINC000826302008 607674261 /nfs/dbraw/zinc/67/42/61/607674261.db2.gz XREFDZKHLJKGHT-SNVBAGLBSA-N -1 3 391.413 -1.494 20 0 GAADHM Cc1cccc(S(=O)(=O)N2CCN3C(=O)C(=O)NC[C@@H]3C2)c1-c1nnn[n-]1 ZINC000826302008 607674259 /nfs/dbraw/zinc/67/42/59/607674259.db2.gz XREFDZKHLJKGHT-SNVBAGLBSA-N -1 3 391.413 -1.494 20 0 GAADHM Cc1ccnc(N2CCN([C@@H]3CS(=O)(=O)C[C@@H]3O)CC2)c1-c1nn[n-]n1 ZINC000826310929 947900611 /nfs/dbraw/zinc/90/06/11/947900611.db2.gz NWPDBSYJKYQUPE-NEPJUHHUSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1ccnc(N2CCN([C@@H]3CS(=O)(=O)C[C@@H]3O)CC2)c1-c1nnn[n-]1 ZINC000826310929 947900607 /nfs/dbraw/zinc/90/06/07/947900607.db2.gz NWPDBSYJKYQUPE-NEPJUHHUSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1ccnc(N2CCN([C@H]3CS(=O)(=O)C[C@H]3O)CC2)c1-c1nn[n-]n1 ZINC000826310930 947900665 /nfs/dbraw/zinc/90/06/65/947900665.db2.gz NWPDBSYJKYQUPE-NWDGAFQWSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1ccnc(N2CCN([C@H]3CS(=O)(=O)C[C@H]3O)CC2)c1-c1nnn[n-]1 ZINC000826310930 947900661 /nfs/dbraw/zinc/90/06/61/947900661.db2.gz NWPDBSYJKYQUPE-NWDGAFQWSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1ccnc(N2CCN([C@H]3CS(=O)(=O)C[C@@H]3O)CC2)c1-c1nn[n-]n1 ZINC000826310931 947899789 /nfs/dbraw/zinc/89/97/89/947899789.db2.gz NWPDBSYJKYQUPE-RYUDHWBXSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1ccnc(N2CCN([C@H]3CS(=O)(=O)C[C@@H]3O)CC2)c1-c1nnn[n-]1 ZINC000826310931 947899783 /nfs/dbraw/zinc/89/97/83/947899783.db2.gz NWPDBSYJKYQUPE-RYUDHWBXSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1ccnc(N2CCN([C@@H]3CS(=O)(=O)C[C@H]3O)CC2)c1-c1nn[n-]n1 ZINC000826310932 947899614 /nfs/dbraw/zinc/89/96/14/947899614.db2.gz NWPDBSYJKYQUPE-VXGBXAGGSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1ccnc(N2CCN([C@@H]3CS(=O)(=O)C[C@H]3O)CC2)c1-c1nnn[n-]1 ZINC000826310932 947899609 /nfs/dbraw/zinc/89/96/09/947899609.db2.gz NWPDBSYJKYQUPE-VXGBXAGGSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1nc(NC(=O)Cn2ncn(C)c2=O)n(-c2ccc(-c3nn[n-]n3)cc2)n1 ZINC000826327166 947954369 /nfs/dbraw/zinc/95/43/69/947954369.db2.gz VRKCNNXZZVMSLC-UHFFFAOYSA-N -1 3 381.360 -1.288 20 0 GAADHM Cn1c2ncn(CCOC(=O)c3ccc(-c4nn[n-]n4)[nH]3)c2c(=O)n(C)c1=O ZINC000826354431 607776743 /nfs/dbraw/zinc/77/67/43/607776743.db2.gz CRHDJIVCCSIKGJ-UHFFFAOYSA-N -1 3 385.344 -1.201 20 0 GAADHM Cn1c2ncn(CCOC(=O)c3c[nH]c(-c4nn[n-]n4)c3)c2c(=O)n(C)c1=O ZINC000826354664 948107261 /nfs/dbraw/zinc/10/72/61/948107261.db2.gz PESGJBLXDHVYEI-UHFFFAOYSA-N -1 3 385.344 -1.201 20 0 GAADHM Cn1c2ncn(CCOC(=O)c3c[nH]c(-c4nnn[n-]4)c3)c2c(=O)n(C)c1=O ZINC000826354664 948107254 /nfs/dbraw/zinc/10/72/54/948107254.db2.gz PESGJBLXDHVYEI-UHFFFAOYSA-N -1 3 385.344 -1.201 20 0 GAADHM Cn1c2[nH]c(COC(=O)c3ccc(-c4nn[n-]n4)cn3)nc2c(=O)n(C)c1=O ZINC000826354716 608147026 /nfs/dbraw/zinc/14/70/26/608147026.db2.gz RRZOQAIQNNJZNU-UHFFFAOYSA-N -1 3 383.328 -1.108 20 0 GAADHM Cn1c2[nH]c(COC(=O)c3ccc(-c4nnn[n-]4)cn3)nc2c(=O)n(C)c1=O ZINC000826354716 608147025 /nfs/dbraw/zinc/14/70/25/608147025.db2.gz RRZOQAIQNNJZNU-UHFFFAOYSA-N -1 3 383.328 -1.108 20 0 GAADHM Cn1cc(-c2nn[n-]n2)cc1C(=O)OCc1nc2c([nH]1)n(C)c(=O)n(C)c2=O ZINC000826358555 608147175 /nfs/dbraw/zinc/14/71/75/608147175.db2.gz YFKSPRICRSIPGF-UHFFFAOYSA-N -1 3 385.344 -1.164 20 0 GAADHM Cn1cc(-c2nnn[n-]2)cc1C(=O)OCc1nc2c([nH]1)n(C)c(=O)n(C)c2=O ZINC000826358555 608147174 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NC(=O)N[C@H](CO)C(=O)N[C@H]1CCCN(c2ccc(-c3nnn[n-]3)cc2)C1=O ZINC000826392105 609265724 /nfs/dbraw/zinc/26/57/24/609265724.db2.gz NODMXJJQBIVBTE-NWDGAFQWSA-N -1 3 388.388 -1.493 20 0 GAADHM NC(=O)N[C@@H](CO)C(=O)N[C@H]1CCCN(c2ccc(-c3nn[n-]n3)cc2)C1=O ZINC000826392106 609265885 /nfs/dbraw/zinc/26/58/85/609265885.db2.gz NODMXJJQBIVBTE-RYUDHWBXSA-N -1 3 388.388 -1.493 20 0 GAADHM NC(=O)N[C@@H](CO)C(=O)N[C@H]1CCCN(c2ccc(-c3nnn[n-]3)cc2)C1=O ZINC000826392106 609265883 /nfs/dbraw/zinc/26/58/83/609265883.db2.gz NODMXJJQBIVBTE-RYUDHWBXSA-N -1 3 388.388 -1.493 20 0 GAADHM NC(=O)N[C@H](CO)C(=O)N[C@@H]1CCCN(c2ccc(-c3nn[n-]n3)cc2)C1=O ZINC000826392107 609265445 /nfs/dbraw/zinc/26/54/45/609265445.db2.gz NODMXJJQBIVBTE-VXGBXAGGSA-N -1 3 388.388 -1.493 20 0 GAADHM NC(=O)N[C@H](CO)C(=O)N[C@@H]1CCCN(c2ccc(-c3nnn[n-]3)cc2)C1=O ZINC000826392107 609265444 /nfs/dbraw/zinc/26/54/44/609265444.db2.gz NODMXJJQBIVBTE-VXGBXAGGSA-N -1 3 388.388 -1.493 20 0 GAADHM NC(=O)c1cccc(NC(=O)C(=O)NCCNc2ccc(-c3nn[n-]n3)cn2)n1 ZINC000826393701 609620738 /nfs/dbraw/zinc/62/07/38/609620738.db2.gz FQTCVCQMECPVHE-UHFFFAOYSA-N -1 3 396.371 -1.078 20 0 GAADHM NC(=O)c1cccc(NC(=O)C(=O)NCCNc2ccc(-c3nnn[n-]3)cn2)n1 ZINC000826393701 609620737 /nfs/dbraw/zinc/62/07/37/609620737.db2.gz FQTCVCQMECPVHE-UHFFFAOYSA-N -1 3 396.371 -1.078 20 0 GAADHM NC(=O)c1cn(C2CN(S(=O)(=O)c3ccccc3-c3nn[n-]n3)C2)nn1 ZINC000826393710 609497820 /nfs/dbraw/zinc/49/78/20/609497820.db2.gz GAWUWOIICNSQDP-UHFFFAOYSA-N -1 3 375.374 -1.197 20 0 GAADHM NC(=O)c1cn(C2CN(S(=O)(=O)c3ccccc3-c3nnn[n-]3)C2)nn1 ZINC000826393710 609497818 /nfs/dbraw/zinc/49/78/18/609497818.db2.gz GAWUWOIICNSQDP-UHFFFAOYSA-N -1 3 375.374 -1.197 20 0 GAADHM NC(=O)c1cn(C2CN(S(=O)(=O)c3ccc(-c4nn[n-]n4)cc3)C2)nn1 ZINC000826393948 609498075 /nfs/dbraw/zinc/49/80/75/609498075.db2.gz QNMHNGHIQRKYLD-UHFFFAOYSA-N -1 3 375.374 -1.197 20 0 GAADHM NC(=O)c1cn(C2CN(S(=O)(=O)c3ccc(-c4nnn[n-]4)cc3)C2)nn1 ZINC000826393948 609498073 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379.402 -1.514 20 0 GAADHM NS(=O)(=O)[C@H]1CCN(C(=O)CNC(=O)c2ccc(-c3nnn[n-]3)cc2)C1 ZINC000826394007 607928876 /nfs/dbraw/zinc/92/88/76/607928876.db2.gz SPQDZAPPMPSSCJ-NSHDSACASA-N -1 3 379.402 -1.514 20 0 GAADHM NC(=O)c1cn(C2CN(S(=O)(=O)c3cccc(-c4nn[n-]n4)c3)C2)nn1 ZINC000826394040 609498206 /nfs/dbraw/zinc/49/82/06/609498206.db2.gz UOWMMAQQXUHCMB-UHFFFAOYSA-N -1 3 375.374 -1.197 20 0 GAADHM NC(=O)c1cn(C2CN(S(=O)(=O)c3cccc(-c4nnn[n-]4)c3)C2)nn1 ZINC000826394040 609498204 /nfs/dbraw/zinc/49/82/04/609498204.db2.gz UOWMMAQQXUHCMB-UHFFFAOYSA-N -1 3 375.374 -1.197 20 0 GAADHM NC(=O)c1cn(C2CN(S(=O)(=O)c3ccc(F)cc3-c3nnn[n-]3)C2)nn1 ZINC000826394092 609497725 /nfs/dbraw/zinc/49/77/25/609497725.db2.gz WMWSPMGUGUSMTR-UHFFFAOYSA-N -1 3 393.364 -1.058 20 0 GAADHM NC(=O)c1cn(C2CN(S(=O)(=O)c3ccc(F)c(-c4nnn[n-]4)c3)C2)nn1 ZINC000826394100 609498377 /nfs/dbraw/zinc/49/83/77/609498377.db2.gz WVQCVQLTSJQJHW-UHFFFAOYSA-N -1 3 393.364 -1.058 20 0 GAADHM 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ZINC001144901079 1075068590 /nfs/dbraw/zinc/06/85/90/1075068590.db2.gz YMUYDGIDGCADQN-UKKRHICBSA-N -1 3 390.389 -2.327 20 0 GAADHM CC(C)(C)OC([O-])=NC(=O)[C@@H]1CCCN1C(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO ZINC001144901079 1075068587 /nfs/dbraw/zinc/06/85/87/1075068587.db2.gz YMUYDGIDGCADQN-UKKRHICBSA-N -1 3 390.389 -2.327 20 0 GAADHM CC(C)(C)OC(=O)[N-]C(=O)[C@@H]1CCCN1C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO ZINC001144901080 1075068544 /nfs/dbraw/zinc/06/85/44/1075068544.db2.gz YMUYDGIDGCADQN-XWLWVQCSSA-N -1 3 390.389 -2.327 20 0 GAADHM CC(C)(C)OC([O-])=NC(=O)[C@@H]1CCCN1C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO ZINC001144901080 1075068540 /nfs/dbraw/zinc/06/85/40/1075068540.db2.gz YMUYDGIDGCADQN-XWLWVQCSSA-N -1 3 390.389 -2.327 20 0 GAADHM CC(C)(C)OC(=O)[N-]C(=O)[C@@H]1CCCN1C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO ZINC001144901081 1075068579 /nfs/dbraw/zinc/06/85/79/1075068579.db2.gz YMUYDGIDGCADQN-ZRUFSTJUSA-N -1 3 390.389 -2.327 20 0 GAADHM CC(C)(C)OC([O-])=NC(=O)[C@@H]1CCCN1C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO ZINC001144901081 1075068577 /nfs/dbraw/zinc/06/85/77/1075068577.db2.gz YMUYDGIDGCADQN-ZRUFSTJUSA-N -1 3 390.389 -2.327 20 0 GAADHM CN(C)C(=O)COCc1nnc2n1CCN(C(=O)c1cc(=O)[n-]c(=O)[nH]1)C2 ZINC001147693719 1075083987 /nfs/dbraw/zinc/08/39/87/1075083987.db2.gz XGXPPPALENXRIE-UHFFFAOYSA-N -1 3 377.361 -1.260 20 0 GAADHM Cc1cn([C@H]2C[C@H](NC(=O)c3cc(=O)[n-]c(=O)[nH]3)[C@@H](CO)O2)c(=O)[nH]c1=O ZINC001147701640 1075084002 /nfs/dbraw/zinc/08/40/02/1075084002.db2.gz LVRKBTKLMHCODR-JVUFJMBOSA-N -1 3 379.329 -1.463 20 0 GAADHM C[C@H](NC(=O)Cn1cnnn1)C(=O)N1CCN(C(=O)c2ccc([O-])cc2)CC1 ZINC001149871548 1073899316 /nfs/dbraw/zinc/89/93/16/1073899316.db2.gz HEYHRESZQLWOAG-LBPRGKRZSA-N -1 3 387.400 -1.132 20 0 GAADHM C[C@@H]1O[C@@H](OCCNC(=O)c2cccc3c2[N-]C(=O)C3=O)[C@@H](O)[C@H](O)[C@@H]1O ZINC001152460412 1073907665 /nfs/dbraw/zinc/90/76/65/1073907665.db2.gz POJGEMAQOXOQPX-TUNJVAHVSA-N -1 3 380.353 -1.605 20 0 GAADHM COC(=O)c1c[n-]c(C(=O)OC)c1NC(=O)c1ncn2c1nnn(C)c2=O ZINC001152747478 1073908904 /nfs/dbraw/zinc/90/89/04/1073908904.db2.gz UXSXDYRHRAQRIJ-UHFFFAOYSA-N -1 3 375.301 -1.023 20 0 GAADHM CNS(=O)(=O)c1ccc(O)c([N-]C(=O)c2ncn3c2nnn(C)c3=O)c1 ZINC001152753722 1073909434 /nfs/dbraw/zinc/90/94/34/1073909434.db2.gz DVABUWROGTXSCR-UHFFFAOYSA-N -1 3 379.358 -1.311 20 0 GAADHM O=C(Cn1cc(Br)c(=O)[n-]c1=O)N1CCC(=O)NCC12COC2 ZINC001153357597 1073912242 /nfs/dbraw/zinc/91/22/42/1073912242.db2.gz VAILCWMXRUFOLE-UHFFFAOYSA-N -1 3 387.190 -1.171 20 0 GAADHM C[C@@H]1O[C@@H](OCCNC(=O)c2cnc3cccnc3c2[O-])[C@@H](O)[C@H](O)[C@@H]1O ZINC001153863808 1073912762 /nfs/dbraw/zinc/91/27/62/1073912762.db2.gz UYRXCJSZUCXRTI-AJBDSUIQSA-N -1 3 379.369 -1.503 20 0 GAADHM CNC(=O)CN(CC(=O)NC)C(=O)c1nn(-c2ccc(F)cc2)c([O-])cc1=O ZINC001154130074 1073913920 /nfs/dbraw/zinc/91/39/20/1073913920.db2.gz MNCHLLKIYQRULA-UHFFFAOYSA-N -1 3 391.359 -1.192 20 0 GAADHM CNC(=O)CN(CC(=O)NC)C(=O)c1nn(-c2ccc(F)cc2)c(=O)cc1[O-] ZINC001154130074 1073913907 /nfs/dbraw/zinc/91/39/07/1073913907.db2.gz MNCHLLKIYQRULA-UHFFFAOYSA-N -1 3 391.359 -1.192 20 0 GAADHM O=C(CN1CCNC(=O)C1)NCC[N-]S(=O)(=O)c1ccc(F)cc1F ZINC001155189258 1073917300 /nfs/dbraw/zinc/91/73/00/1073917300.db2.gz DGRWYJBEHTXUAG-UHFFFAOYSA-N -1 3 376.385 -1.209 20 0 GAADHM COC(=O)c1cnc(-n2[n-]c(=O)nc2CN)c(S(=O)(=O)N2CCOCC2)c1 ZINC001157940762 1073929268 /nfs/dbraw/zinc/92/92/68/1073929268.db2.gz GOZVPONYSJFYJX-UHFFFAOYSA-N -1 3 398.401 -1.366 20 0 GAADHM N[C@@H](Cc1nn[n-]n1)C(=O)N1C[C@@H](NC(=O)CC2CC2)[C@H]2OCCC[C@H]2C1 ZINC001158716184 1073935910 /nfs/dbraw/zinc/93/59/10/1073935910.db2.gz VJXBVLZALKHLGZ-JFILPPLUSA-N -1 3 377.449 -1.008 20 0 GAADHM N[C@@H](Cc1nnn[n-]1)C(=O)N1C[C@@H](NC(=O)CC2CC2)[C@H]2OCCC[C@H]2C1 ZINC001158716184 1073935906 /nfs/dbraw/zinc/93/59/06/1073935906.db2.gz VJXBVLZALKHLGZ-JFILPPLUSA-N -1 3 377.449 -1.008 20 0 GAADHM CN(C)C(=O)COCc1noc2c1CN(C(=O)[C@@H](N)Cc1nn[n-]n1)CC2 ZINC001158747572 1073936683 /nfs/dbraw/zinc/93/66/83/1073936683.db2.gz OSCBBPFNTALPNN-JTQLQIEISA-N -1 3 378.393 -1.753 20 0 GAADHM CN(C)C(=O)COCc1noc2c1CN(C(=O)[C@@H](N)Cc1nnn[n-]1)CC2 ZINC001158747572 1073936677 /nfs/dbraw/zinc/93/66/77/1073936677.db2.gz OSCBBPFNTALPNN-JTQLQIEISA-N -1 3 378.393 -1.753 20 0 GAADHM N[C@@H](Cc1nn[n-]n1)C(=O)N1C[C@@H]2COC[C@H](C(=O)N3CCC(F)CC3)[C@@H]2C1 ZINC001158925017 1073939333 /nfs/dbraw/zinc/93/93/33/1073939333.db2.gz DWJKQDTXVPRTBG-ZZVYKPCYSA-N -1 3 395.439 -1.249 20 0 GAADHM N[C@@H](Cc1nnn[n-]1)C(=O)N1C[C@@H]2COC[C@H](C(=O)N3CCC(F)CC3)[C@@H]2C1 ZINC001158925017 1073939328 /nfs/dbraw/zinc/93/93/28/1073939328.db2.gz DWJKQDTXVPRTBG-ZZVYKPCYSA-N -1 3 395.439 -1.249 20 0 GAADHM COCCNC(=O)[C@@H]1Cn2nccc2CN(C(=O)[C@@H](N)Cc2nn[n-]n2)C1 ZINC001158991722 1073943021 /nfs/dbraw/zinc/94/30/21/1073943021.db2.gz PNEXDEAEGDSUCC-JQWIXIFHSA-N -1 3 377.409 -2.313 20 0 GAADHM COCCNC(=O)[C@@H]1Cn2nccc2CN(C(=O)[C@@H](N)Cc2nnn[n-]2)C1 ZINC001158991722 1073943011 /nfs/dbraw/zinc/94/30/11/1073943011.db2.gz PNEXDEAEGDSUCC-JQWIXIFHSA-N -1 3 377.409 -2.313 20 0 GAADHM COCCNC(=O)[C@H]1Cn2nccc2CN(C(=O)[C@@H](N)Cc2nn[n-]n2)C1 ZINC001158991728 1073942810 /nfs/dbraw/zinc/94/28/10/1073942810.db2.gz PNEXDEAEGDSUCC-PWSUYJOCSA-N -1 3 377.409 -2.313 20 0 GAADHM COCCNC(=O)[C@H]1Cn2nccc2CN(C(=O)[C@@H](N)Cc2nnn[n-]2)C1 ZINC001158991728 1073942802 /nfs/dbraw/zinc/94/28/02/1073942802.db2.gz PNEXDEAEGDSUCC-PWSUYJOCSA-N -1 3 377.409 -2.313 20 0 GAADHM COC(=O)[C@@]1(C)C[C@H](N2CCOCC2)CCN1C(=O)[C@@H](N)Cc1nn[n-]n1 ZINC001159076607 1073944350 /nfs/dbraw/zinc/94/43/50/1073944350.db2.gz KDISNIDMJJIIJR-BFQNTYOBSA-N -1 3 381.437 -1.676 20 0 GAADHM COC(=O)[C@@]1(C)C[C@H](N2CCOCC2)CCN1C(=O)[C@@H](N)Cc1nnn[n-]1 ZINC001159076607 1073944345 /nfs/dbraw/zinc/94/43/45/1073944345.db2.gz KDISNIDMJJIIJR-BFQNTYOBSA-N -1 3 381.437 -1.676 20 0 GAADHM COC(=O)[C@]1(C)C[C@@H](N2CCOCC2)CCN1C(=O)[C@@H](N)Cc1nn[n-]n1 ZINC001159076608 1073944232 /nfs/dbraw/zinc/94/42/32/1073944232.db2.gz KDISNIDMJJIIJR-MKBNYLNASA-N -1 3 381.437 -1.676 20 0 GAADHM COC(=O)[C@]1(C)C[C@@H](N2CCOCC2)CCN1C(=O)[C@@H](N)Cc1nnn[n-]1 ZINC001159076608 1073944227 /nfs/dbraw/zinc/94/42/27/1073944227.db2.gz KDISNIDMJJIIJR-MKBNYLNASA-N -1 3 381.437 -1.676 20 0 GAADHM COC(=O)[C@@]1(C)C[C@@H](N2CCOCC2)CCN1C(=O)[C@@H](N)Cc1nn[n-]n1 ZINC001159076609 1073944274 /nfs/dbraw/zinc/94/42/74/1073944274.db2.gz KDISNIDMJJIIJR-MQIPJXDCSA-N -1 3 381.437 -1.676 20 0 GAADHM COC(=O)[C@@]1(C)C[C@@H](N2CCOCC2)CCN1C(=O)[C@@H](N)Cc1nnn[n-]1 ZINC001159076609 1073944268 /nfs/dbraw/zinc/94/42/68/1073944268.db2.gz KDISNIDMJJIIJR-MQIPJXDCSA-N -1 3 381.437 -1.676 20 0 GAADHM COC(=O)[C@]1(C)C[C@H](N2CCOCC2)CCN1C(=O)[C@@H](N)Cc1nn[n-]n1 ZINC001159076610 1073944422 /nfs/dbraw/zinc/94/44/22/1073944422.db2.gz KDISNIDMJJIIJR-WQGACYEGSA-N -1 3 381.437 -1.676 20 0 GAADHM COC(=O)[C@]1(C)C[C@H](N2CCOCC2)CCN1C(=O)[C@@H](N)Cc1nnn[n-]1 ZINC001159076610 1073944417 /nfs/dbraw/zinc/94/44/17/1073944417.db2.gz KDISNIDMJJIIJR-WQGACYEGSA-N -1 3 381.437 -1.676 20 0 GAADHM N[C@@H](Cc1nn[n-]n1)C(=O)N1CCO[C@H]2[C@H](OCC(=O)N3CCCC3)CC[C@@H]21 ZINC001159090696 1073945056 /nfs/dbraw/zinc/94/50/56/1073945056.db2.gz HJZQKXKRYAGIMO-BCUIYNNISA-N -1 3 393.448 -1.533 20 0 GAADHM N[C@@H](Cc1nnn[n-]1)C(=O)N1CCO[C@H]2[C@H](OCC(=O)N3CCCC3)CC[C@@H]21 ZINC001159090696 1073945049 /nfs/dbraw/zinc/94/50/49/1073945049.db2.gz HJZQKXKRYAGIMO-BCUIYNNISA-N -1 3 393.448 -1.533 20 0 GAADHM CNC(=O)CN1CCOC[C@]2(CCCN(C(=O)[C@@H](N)Cc3nn[n-]n3)C2)C1 ZINC001159122810 1073945840 /nfs/dbraw/zinc/94/58/40/1073945840.db2.gz AKMFWYWNUMBEKV-BLLLJJGKSA-N -1 3 380.453 -2.244 20 0 GAADHM CNC(=O)CN1CCOC[C@]2(CCCN(C(=O)[C@@H](N)Cc3nnn[n-]3)C2)C1 ZINC001159122810 1073945834 /nfs/dbraw/zinc/94/58/34/1073945834.db2.gz AKMFWYWNUMBEKV-BLLLJJGKSA-N -1 3 380.453 -2.244 20 0 GAADHM CNC(=O)CN1CCOC[C@@]2(CCCN(C(=O)[C@@H](N)Cc3nn[n-]n3)C2)C1 ZINC001159122811 1073945794 /nfs/dbraw/zinc/94/57/94/1073945794.db2.gz AKMFWYWNUMBEKV-LRDDRELGSA-N -1 3 380.453 -2.244 20 0 GAADHM CNC(=O)CN1CCOC[C@@]2(CCCN(C(=O)[C@@H](N)Cc3nnn[n-]3)C2)C1 ZINC001159122811 1073945791 /nfs/dbraw/zinc/94/57/91/1073945791.db2.gz AKMFWYWNUMBEKV-LRDDRELGSA-N -1 3 380.453 -2.244 20 0 GAADHM CN(C)C(=O)COC[C@H]1CC[C@@H]2[C@@H](CCN2C(=O)[C@@H](N)Cc2nn[n-]n2)O1 ZINC001159136123 1073947324 /nfs/dbraw/zinc/94/73/24/1073947324.db2.gz MRDZPDHGNXRNCV-YVECIDJPSA-N -1 3 381.437 -1.677 20 0 GAADHM CN(C)C(=O)COC[C@H]1CC[C@@H]2[C@@H](CCN2C(=O)[C@@H](N)Cc2nnn[n-]2)O1 ZINC001159136123 1073947319 /nfs/dbraw/zinc/94/73/19/1073947319.db2.gz MRDZPDHGNXRNCV-YVECIDJPSA-N -1 3 381.437 -1.677 20 0 GAADHM Cn1cccc1C(=O)N[C@H]1CN(C(=O)[C@@H](N)Cc2nn[n-]n2)[C@@H]2CCCO[C@@H]21 ZINC001159266010 1073949364 /nfs/dbraw/zinc/94/93/64/1073949364.db2.gz ANXTZUMMNYFMKS-UUIJZJDISA-N -1 3 388.432 -1.404 20 0 GAADHM Cn1cccc1C(=O)N[C@H]1CN(C(=O)[C@@H](N)Cc2nnn[n-]2)[C@@H]2CCCO[C@@H]21 ZINC001159266010 1073949358 /nfs/dbraw/zinc/94/93/58/1073949358.db2.gz ANXTZUMMNYFMKS-UUIJZJDISA-N -1 3 388.432 -1.404 20 0 GAADHM Cc1nc(N2CCOCC2)[n-]c(=O)c1CCC(=O)N1CC2(C1)NC(=O)NC2=O ZINC001159370502 1073950235 /nfs/dbraw/zinc/95/02/35/1073950235.db2.gz NKEIWVNTDIKPSO-UHFFFAOYSA-N -1 3 390.400 -1.320 20 0 GAADHM CN(C)C(=O)NC[C@H]1CCC[C@]2(CCN(C(=O)[C@@H](N)Cc3nn[n-]n3)C2)O1 ZINC001159449079 1073950581 /nfs/dbraw/zinc/95/05/81/1073950581.db2.gz AJEAIJNGNYTRFQ-BFQNTYOBSA-N -1 3 380.453 -1.119 20 0 GAADHM CN(C)C(=O)NC[C@H]1CCC[C@]2(CCN(C(=O)[C@@H](N)Cc3nnn[n-]3)C2)O1 ZINC001159449079 1073950576 /nfs/dbraw/zinc/95/05/76/1073950576.db2.gz AJEAIJNGNYTRFQ-BFQNTYOBSA-N -1 3 380.453 -1.119 20 0 GAADHM Cc1nc(N(C)C)nc2c1COC[C@@]21CCN(C(=O)[C@@H](N)Cc2nn[n-]n2)C1 ZINC001159463791 1073951556 /nfs/dbraw/zinc/95/15/56/1073951556.db2.gz WFERTYYFXHTMSC-SJCJKPOMSA-N -1 3 387.448 -1.066 20 0 GAADHM Cc1nc(N(C)C)nc2c1COC[C@@]21CCN(C(=O)[C@@H](N)Cc2nnn[n-]2)C1 ZINC001159463791 1073951554 /nfs/dbraw/zinc/95/15/54/1073951554.db2.gz WFERTYYFXHTMSC-SJCJKPOMSA-N -1 3 387.448 -1.066 20 0 GAADHM Cc1nc(N(C)C)nc2c1COC[C@]21CCN(C(=O)[C@@H](N)Cc2nn[n-]n2)C1 ZINC001159463803 1073951378 /nfs/dbraw/zinc/95/13/78/1073951378.db2.gz WFERTYYFXHTMSC-YVEFUNNKSA-N -1 3 387.448 -1.066 20 0 GAADHM Cc1nc(N(C)C)nc2c1COC[C@]21CCN(C(=O)[C@@H](N)Cc2nnn[n-]2)C1 ZINC001159463803 1073951371 /nfs/dbraw/zinc/95/13/71/1073951371.db2.gz WFERTYYFXHTMSC-YVEFUNNKSA-N -1 3 387.448 -1.066 20 0 GAADHM CN(C)C(=O)CN1CC[C@@]2(CCCN(C(=O)[C@@H](N)Cc3nn[n-]n3)C2)C1=O ZINC001159491598 1073951262 /nfs/dbraw/zinc/95/12/62/1073951262.db2.gz FDGXJKBPPJZSJX-MEDUHNTESA-N -1 3 378.437 -2.001 20 0 GAADHM CN(C)C(=O)CN1CC[C@@]2(CCCN(C(=O)[C@@H](N)Cc3nnn[n-]3)C2)C1=O ZINC001159491598 1073951258 /nfs/dbraw/zinc/95/12/58/1073951258.db2.gz FDGXJKBPPJZSJX-MEDUHNTESA-N -1 3 378.437 -2.001 20 0 GAADHM CN(C)C(=O)CN1CC[C@]2(CCCN(C(=O)[C@@H](N)Cc3nn[n-]n3)C2)C1=O ZINC001159491600 1073951458 /nfs/dbraw/zinc/95/14/58/1073951458.db2.gz FDGXJKBPPJZSJX-ZBEGNZNMSA-N -1 3 378.437 -2.001 20 0 GAADHM CN(C)C(=O)CN1CC[C@]2(CCCN(C(=O)[C@@H](N)Cc3nnn[n-]3)C2)C1=O ZINC001159491600 1073951453 /nfs/dbraw/zinc/95/14/53/1073951453.db2.gz FDGXJKBPPJZSJX-ZBEGNZNMSA-N -1 3 378.437 -2.001 20 0 GAADHM N[C@@H](Cc1nn[n-]n1)C(=O)N1C[C@@H]2COC[C@]2(C(=O)NCCc2ccccc2)C1 ZINC001159611321 1073955220 /nfs/dbraw/zinc/95/52/20/1073955220.db2.gz YNIZJWOEWRGEGX-ZRGWGRIASA-N -1 3 399.455 -1.097 20 0 GAADHM N[C@@H](Cc1nnn[n-]1)C(=O)N1C[C@@H]2COC[C@]2(C(=O)NCCc2ccccc2)C1 ZINC001159611321 1073955217 /nfs/dbraw/zinc/95/52/17/1073955217.db2.gz YNIZJWOEWRGEGX-ZRGWGRIASA-N -1 3 399.455 -1.097 20 0 GAADHM N[C@@H](Cc1nn[n-]n1)C(=O)N1CCCn2c(=O)cc(Cn3ccnc3)nc2C1 ZINC001159635391 1073955884 /nfs/dbraw/zinc/95/58/84/1073955884.db2.gz MTSZSQOHAHDYLC-LBPRGKRZSA-N -1 3 384.404 -1.697 20 0 GAADHM N[C@@H](Cc1nnn[n-]1)C(=O)N1CCCn2c(=O)cc(Cn3ccnc3)nc2C1 ZINC001159635391 1073955879 /nfs/dbraw/zinc/95/58/79/1073955879.db2.gz MTSZSQOHAHDYLC-LBPRGKRZSA-N -1 3 384.404 -1.697 20 0 GAADHM N[C@@H](Cc1nn[n-]n1)C(=O)N1CCC2(CC1)CN(c1cncnc1)C(=O)CO2 ZINC001159654429 1073956856 /nfs/dbraw/zinc/95/68/56/1073956856.db2.gz MLIIPHXECUSDBS-LBPRGKRZSA-N -1 3 387.404 -1.716 20 0 GAADHM N[C@@H](Cc1nnn[n-]1)C(=O)N1CCC2(CC1)CN(c1cncnc1)C(=O)CO2 ZINC001159654429 1073956853 /nfs/dbraw/zinc/95/68/53/1073956853.db2.gz MLIIPHXECUSDBS-LBPRGKRZSA-N -1 3 387.404 -1.716 20 0 GAADHM Cn1cccc1C(=O)NCc1cn2c(n1)CN(C(=O)[C@@H](N)Cc1nn[n-]n1)CC2 ZINC001159663264 1073956962 /nfs/dbraw/zinc/95/69/62/1073956962.db2.gz HABMXCHWEQZAKH-LBPRGKRZSA-N -1 3 398.431 -1.423 20 0 GAADHM Cn1cccc1C(=O)NCc1cn2c(n1)CN(C(=O)[C@@H](N)Cc1nnn[n-]1)CC2 ZINC001159663264 1073956958 /nfs/dbraw/zinc/95/69/58/1073956958.db2.gz HABMXCHWEQZAKH-LBPRGKRZSA-N -1 3 398.431 -1.423 20 0 GAADHM N[C@@H](Cc1nn[n-]n1)C(=O)N1C[C@@H]2COC[C@]2(COCC(=O)N2CCCC2)C1 ZINC001159738119 1073957575 /nfs/dbraw/zinc/95/75/75/1073957575.db2.gz PXYPFOXOTDGNNM-IGCXYCKISA-N -1 3 393.448 -1.817 20 0 GAADHM N[C@@H](Cc1nnn[n-]1)C(=O)N1C[C@@H]2COC[C@]2(COCC(=O)N2CCCC2)C1 ZINC001159738119 1073957572 /nfs/dbraw/zinc/95/75/72/1073957572.db2.gz PXYPFOXOTDGNNM-IGCXYCKISA-N -1 3 393.448 -1.817 20 0 GAADHM N[C@@H](Cc1nn[n-]n1)C(=O)N1C[C@H]2OCC(=O)N(c3cccc(F)c3)[C@@H]2C1 ZINC001159746362 1073957625 /nfs/dbraw/zinc/95/76/25/1073957625.db2.gz MYDXVYJCSLSMJW-YNEHKIRRSA-N -1 3 375.364 -1.149 20 0 GAADHM N[C@@H](Cc1nnn[n-]1)C(=O)N1C[C@H]2OCC(=O)N(c3cccc(F)c3)[C@@H]2C1 ZINC001159746362 1073957622 /nfs/dbraw/zinc/95/76/22/1073957622.db2.gz MYDXVYJCSLSMJW-YNEHKIRRSA-N -1 3 375.364 -1.149 20 0 GAADHM N[C@@H](Cc1nn[n-]n1)C(=O)N1C[C@@H]2COC[C@@H](CC(=O)NCC3CC3)[C@@H]2C1 ZINC001159766005 1073957931 /nfs/dbraw/zinc/95/79/31/1073957931.db2.gz SJADOIPFENZFGY-MQYQWHSLSA-N -1 3 377.449 -1.293 20 0 GAADHM N[C@@H](Cc1nnn[n-]1)C(=O)N1C[C@@H]2COC[C@@H](CC(=O)NCC3CC3)[C@@H]2C1 ZINC001159766005 1073957928 /nfs/dbraw/zinc/95/79/28/1073957928.db2.gz SJADOIPFENZFGY-MQYQWHSLSA-N -1 3 377.449 -1.293 20 0 GAADHM N[C@@H](Cc1nn[n-]n1)C(=O)N1C[C@@H]2COC[C@@H](CC(=O)N3CCOCC3)[C@@H]2C1 ZINC001159767796 1073958065 /nfs/dbraw/zinc/95/80/65/1073958065.db2.gz MIJOGRVPXOLJLB-MQYQWHSLSA-N -1 3 393.448 -1.961 20 0 GAADHM N[C@@H](Cc1nnn[n-]1)C(=O)N1C[C@@H]2COC[C@@H](CC(=O)N3CCOCC3)[C@@H]2C1 ZINC001159767796 1073958057 /nfs/dbraw/zinc/95/80/57/1073958057.db2.gz MIJOGRVPXOLJLB-MQYQWHSLSA-N -1 3 393.448 -1.961 20 0 GAADHM Cn1ccc(CN2CCOCC23CCN(C(=O)[C@@H](N)Cc2nn[n-]n2)CC3)n1 ZINC001159962195 1073959916 /nfs/dbraw/zinc/95/99/16/1073959916.db2.gz OOTVMTARNSLJGQ-AWEZNQCLSA-N -1 3 389.464 -1.303 20 0 GAADHM Cn1ccc(CN2CCOCC23CCN(C(=O)[C@@H](N)Cc2nnn[n-]2)CC3)n1 ZINC001159962195 1073959910 /nfs/dbraw/zinc/95/99/10/1073959910.db2.gz OOTVMTARNSLJGQ-AWEZNQCLSA-N -1 3 389.464 -1.303 20 0 GAADHM N[C@@H](Cc1nn[n-]n1)C(=O)N1CC[C@]2(C[C@@H](OCC(=O)N3CCCC3)CO2)C1 ZINC001159980042 1073959888 /nfs/dbraw/zinc/95/98/88/1073959888.db2.gz IEHAUYHTXBJWRA-IGCXYCKISA-N -1 3 393.448 -1.532 20 0 GAADHM N[C@@H](Cc1nnn[n-]1)C(=O)N1CC[C@]2(C[C@@H](OCC(=O)N3CCCC3)CO2)C1 ZINC001159980042 1073959882 /nfs/dbraw/zinc/95/98/82/1073959882.db2.gz IEHAUYHTXBJWRA-IGCXYCKISA-N -1 3 393.448 -1.532 20 0 GAADHM Cc1noc(C)c1CN1CCO[C@H]2CN(C(=O)[C@@H](N)Cc3nn[n-]n3)C[C@H]21 ZINC001159987602 1073959959 /nfs/dbraw/zinc/95/99/59/1073959959.db2.gz NOYRGKLMCMOCOV-MJBXVCDLSA-N -1 3 376.421 -1.214 20 0 GAADHM Cc1noc(C)c1CN1CCO[C@H]2CN(C(=O)[C@@H](N)Cc3nnn[n-]3)C[C@H]21 ZINC001159987602 1073959955 /nfs/dbraw/zinc/95/99/55/1073959955.db2.gz NOYRGKLMCMOCOV-MJBXVCDLSA-N -1 3 376.421 -1.214 20 0 GAADHM N[C@@H](Cc1nn[n-]n1)C(=O)N1C[C@H](NC(=O)c2cscn2)[C@@H]2OCCC[C@@H]21 ZINC001160017063 1073960505 /nfs/dbraw/zinc/96/05/05/1073960505.db2.gz PMIGEXIMUBXEDX-PZEZNAACSA-N -1 3 392.445 -1.286 20 0 GAADHM N[C@@H](Cc1nnn[n-]1)C(=O)N1C[C@H](NC(=O)c2cscn2)[C@@H]2OCCC[C@@H]21 ZINC001160017063 1073960500 /nfs/dbraw/zinc/96/05/00/1073960500.db2.gz PMIGEXIMUBXEDX-PZEZNAACSA-N -1 3 392.445 -1.286 20 0 GAADHM N[C@@H](Cc1nn[n-]n1)C(=O)N1CCC2(C[C@@H](C(=O)N3CCOCC3)CO2)CC1 ZINC001160104346 1073965727 /nfs/dbraw/zinc/96/57/27/1073965727.db2.gz PNPYPHSSVVTXPI-OLZOCXBDSA-N -1 3 393.448 -1.674 20 0 GAADHM N[C@@H](Cc1nnn[n-]1)C(=O)N1CCC2(C[C@@H](C(=O)N3CCOCC3)CO2)CC1 ZINC001160104346 1073965722 /nfs/dbraw/zinc/96/57/22/1073965722.db2.gz PNPYPHSSVVTXPI-OLZOCXBDSA-N -1 3 393.448 -1.674 20 0 GAADHM N[C@@H](Cc1nn[n-]n1)C(=O)N1CCC2(C[C@H](C(=O)N3CCOCC3)CO2)CC1 ZINC001160104347 1073965592 /nfs/dbraw/zinc/96/55/92/1073965592.db2.gz PNPYPHSSVVTXPI-STQMWFEESA-N -1 3 393.448 -1.674 20 0 GAADHM N[C@@H](Cc1nnn[n-]1)C(=O)N1CCC2(C[C@H](C(=O)N3CCOCC3)CO2)CC1 ZINC001160104347 1073965587 /nfs/dbraw/zinc/96/55/87/1073965587.db2.gz PNPYPHSSVVTXPI-STQMWFEESA-N -1 3 393.448 -1.674 20 0 GAADHM CC(=O)N1[C@H](Cn2cccn2)C[C@@H]2CN(C(=O)[C@@H](N)Cc3nn[n-]n3)CC[C@@H]21 ZINC001160173996 1073965828 /nfs/dbraw/zinc/96/58/28/1073965828.db2.gz OFJHBSCFEAXXBU-QPSCCSFWSA-N -1 3 387.448 -1.196 20 0 GAADHM CC(=O)N1[C@H](Cn2cccn2)C[C@@H]2CN(C(=O)[C@@H](N)Cc3nnn[n-]3)CC[C@@H]21 ZINC001160173996 1073965819 /nfs/dbraw/zinc/96/58/19/1073965819.db2.gz OFJHBSCFEAXXBU-QPSCCSFWSA-N -1 3 387.448 -1.196 20 0 GAADHM Cn1ccnc1C(=O)N[C@H]1CN(C(=O)[C@@H](N)Cc2nn[n-]n2)[C@@H]2CCCO[C@@H]21 ZINC001160211836 1073966415 /nfs/dbraw/zinc/96/64/15/1073966415.db2.gz KEFSABSHSSDNFG-MEWQQHAOSA-N -1 3 389.420 -2.009 20 0 GAADHM Cn1ccnc1C(=O)N[C@H]1CN(C(=O)[C@@H](N)Cc2nnn[n-]2)[C@@H]2CCCO[C@@H]21 ZINC001160211836 1073966407 /nfs/dbraw/zinc/96/64/07/1073966407.db2.gz KEFSABSHSSDNFG-MEWQQHAOSA-N -1 3 389.420 -2.009 20 0 GAADHM CN(C)C(=O)Cn1c(=O)ccc2c1CCN(C(=O)[C@@H](N)Cc1nn[n-]n1)CC2 ZINC001160266814 1073967699 /nfs/dbraw/zinc/96/76/99/1073967699.db2.gz NKRXXMGRIYAOIL-LBPRGKRZSA-N -1 3 388.432 -2.053 20 0 GAADHM CN(C)C(=O)Cn1c(=O)ccc2c1CCN(C(=O)[C@@H](N)Cc1nnn[n-]1)CC2 ZINC001160266814 1073967694 /nfs/dbraw/zinc/96/76/94/1073967694.db2.gz NKRXXMGRIYAOIL-LBPRGKRZSA-N -1 3 388.432 -2.053 20 0 GAADHM COCCO[C@H]1CCN(C(=O)[C@@H](N)Cc2nn[n-]n2)[C@H]1Cc1cnn(C)c1 ZINC001160327014 1073967630 /nfs/dbraw/zinc/96/76/30/1073967630.db2.gz WLMLULHXMCRWQY-IHRRRGAJSA-N -1 3 378.437 -1.322 20 0 GAADHM COCCO[C@H]1CCN(C(=O)[C@@H](N)Cc2nnn[n-]2)[C@H]1Cc1cnn(C)c1 ZINC001160327014 1073967617 /nfs/dbraw/zinc/96/76/17/1073967617.db2.gz WLMLULHXMCRWQY-IHRRRGAJSA-N -1 3 378.437 -1.322 20 0 GAADHM N[C@@H](Cc1nn[n-]n1)C(=O)N1CC[C@H]2OC[C@@H](C(=O)N3CCCCO3)C[C@H]2C1 ZINC001160380674 1073969937 /nfs/dbraw/zinc/96/99/37/1073969937.db2.gz IBCQFRUMVKILNP-XDQVBPFNSA-N -1 3 393.448 -1.123 20 0 GAADHM N[C@@H](Cc1nnn[n-]1)C(=O)N1CC[C@H]2OC[C@@H](C(=O)N3CCCCO3)C[C@H]2C1 ZINC001160380674 1073969929 /nfs/dbraw/zinc/96/99/29/1073969929.db2.gz IBCQFRUMVKILNP-XDQVBPFNSA-N -1 3 393.448 -1.123 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CN(C(=O)[C@@H](N)Cc3nn[n-]n3)[C@@H]3CCCO[C@@H]32)cn1 ZINC001160401583 1073971098 /nfs/dbraw/zinc/97/10/98/1073971098.db2.gz UCGGQLDKSMVRFC-CIQGVGRVSA-N -1 3 389.420 -2.009 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CN(C(=O)[C@@H](N)Cc3nnn[n-]3)[C@@H]3CCCO[C@@H]32)cn1 ZINC001160401583 1073971093 /nfs/dbraw/zinc/97/10/93/1073971093.db2.gz UCGGQLDKSMVRFC-CIQGVGRVSA-N -1 3 389.420 -2.009 20 0 GAADHM CNC(=O)c1ccc2c(c1)C1(CCN(C(=O)[C@@H](N)Cc3nn[n-]n3)CC1)C(=O)N2 ZINC001160407679 1073971868 /nfs/dbraw/zinc/97/18/68/1073971868.db2.gz AXJFWWWCQSFHCH-LBPRGKRZSA-N -1 3 398.427 -1.058 20 0 GAADHM CNC(=O)c1ccc2c(c1)C1(CCN(C(=O)[C@@H](N)Cc3nnn[n-]3)CC1)C(=O)N2 ZINC001160407679 1073971856 /nfs/dbraw/zinc/97/18/56/1073971856.db2.gz AXJFWWWCQSFHCH-LBPRGKRZSA-N -1 3 398.427 -1.058 20 0 GAADHM CC(C)C(=O)N1CCO[C@@]2(C1)COCCN(C(=O)[C@@H](N)Cc1nn[n-]n1)C2 ZINC001160419166 1073971723 /nfs/dbraw/zinc/97/17/23/1073971723.db2.gz PRYMGRONVQBSMZ-BLLLJJGKSA-N -1 3 381.437 -1.818 20 0 GAADHM CC(C)C(=O)N1CCO[C@@]2(C1)COCCN(C(=O)[C@@H](N)Cc1nnn[n-]1)C2 ZINC001160419166 1073971716 /nfs/dbraw/zinc/97/17/16/1073971716.db2.gz PRYMGRONVQBSMZ-BLLLJJGKSA-N -1 3 381.437 -1.818 20 0 GAADHM 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N[C@@H](Cc1nnn[n-]1)C(=O)NCc1cccc(S(=O)(=O)N2CCOCC2)c1 ZINC001220433688 1074049011 /nfs/dbraw/zinc/04/90/11/1074049011.db2.gz FNVAPCWZXAMENM-ZDUSSCGKSA-N -1 3 395.445 -1.593 20 0 GAADHM C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CN)C(=O)Nc1[n-]c(=O)nc2nc[nH]c21 ZINC001220471293 1074049225 /nfs/dbraw/zinc/04/92/25/1074049225.db2.gz HRZXUOPQVUXMCC-YUMQZZPRSA-N -1 3 376.377 -1.549 20 0 GAADHM NCC(=O)N1CCC[C@H]1C(=O)NCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)[O-] ZINC001220550748 1074050952 /nfs/dbraw/zinc/05/09/52/1074050952.db2.gz HSYAEYHTOYVPNR-RYUDHWBXSA-N -1 3 380.405 -2.022 20 0 GAADHM NCC(=O)N1CCC[C@H]1C(=O)NCCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)[O-] ZINC001220550748 1074050945 /nfs/dbraw/zinc/05/09/45/1074050945.db2.gz HSYAEYHTOYVPNR-RYUDHWBXSA-N -1 3 380.405 -2.022 20 0 GAADHM Cn1cncc1C[C@H](N)C(=O)NCCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)[O-] ZINC001220550769 1074050765 /nfs/dbraw/zinc/05/07/65/1074050765.db2.gz ILAVJBZQQVRJJH-STQMWFEESA-N -1 3 377.405 -1.669 20 0 GAADHM N[C@H]1CCCCN(CC(=O)NCCC(=O)N[C@@H](Cc2c[nH]cn2)C(=O)[O-])C1=O ZINC001220551388 1074050872 /nfs/dbraw/zinc/05/08/72/1074050872.db2.gz UMXLTWUEJWZOAM-STQMWFEESA-N -1 3 394.432 -1.632 20 0 GAADHM N[C@@H](Cc1nn[n-]n1)C(=O)NC1CCN(S(=O)(=O)c2ccccn2)CC1 ZINC001220620382 1074052013 /nfs/dbraw/zinc/05/20/13/1074052013.db2.gz SXURBDQTQKDQDS-NSHDSACASA-N -1 3 380.434 -1.566 20 0 GAADHM N[C@@H](Cc1nnn[n-]1)C(=O)NC1CCN(S(=O)(=O)c2ccccn2)CC1 ZINC001220620382 1074052002 /nfs/dbraw/zinc/05/20/02/1074052002.db2.gz SXURBDQTQKDQDS-NSHDSACASA-N -1 3 380.434 -1.566 20 0 GAADHM CC(N)=CC(=O)OCCCCOC(=O)C=C(C)NC(=O)[C@@H](N)Cc1nn[n-]n1 ZINC001220761014 1074053530 /nfs/dbraw/zinc/05/35/30/1074053530.db2.gz XOOOZOFLSUEAEO-MPONKROXSA-N -1 3 395.420 -1.181 20 0 GAADHM CC(N)=CC(=O)OCCCCOC(=O)C=C(C)NC(=O)[C@@H](N)Cc1nnn[n-]1 ZINC001220761014 1074053520 /nfs/dbraw/zinc/05/35/20/1074053520.db2.gz XOOOZOFLSUEAEO-MPONKROXSA-N -1 3 395.420 -1.181 20 0 GAADHM Cc1cn([C@H]2C[C@H](NC(=O)[C@@H](N)Cc3nn[n-]n3)[C@@H](CO)O2)c(=O)[nH]c1=O ZINC001220967040 1074055968 /nfs/dbraw/zinc/05/59/68/1074055968.db2.gz PHCDYTKRWCMVTH-WYOJIJJFSA-N -1 3 380.365 -2.895 20 0 GAADHM Cc1cn([C@H]2C[C@H](NC(=O)[C@@H](N)Cc3nnn[n-]3)[C@@H](CO)O2)c(=O)[nH]c1=O ZINC001220967040 1074055963 /nfs/dbraw/zinc/05/59/63/1074055963.db2.gz PHCDYTKRWCMVTH-WYOJIJJFSA-N -1 3 380.365 -2.895 20 0 GAADHM N[C@@H](Cc1nn[n-]n1)C(=O)NC1(Cc2cccnc2)CCS(=O)(=O)CC1 ZINC001221028122 1074056891 /nfs/dbraw/zinc/05/68/91/1074056891.db2.gz GUHMLGSINVGQGF-LBPRGKRZSA-N -1 3 379.446 -1.229 20 0 GAADHM [O-]C(=C(O)c1nc(-c2cccc(N3CCOCC3)c2)no1)[C@H](O)[C@@H](O)CO ZINC001247610883 1074099428 /nfs/dbraw/zinc/09/94/28/1074099428.db2.gz LCWCSIVTRPPNFS-BFHYXJOUSA-N -1 3 379.369 -1.169 20 0 GAADHM [O-]C(=C(O)c1nc(-c2cccc(N3CCOCC3)c2)no1)[C@@H](O)[C@H](O)CO ZINC001247610898 1074099448 /nfs/dbraw/zinc/09/94/48/1074099448.db2.gz LCWCSIVTRPPNFS-HZSPNIEDSA-N -1 3 379.369 -1.169 20 0 GAADHM [O-]C(=C(O)c1nc(-c2cccc(N3CCOCC3)c2)no1)[C@@H](O)[C@@H](O)CO ZINC001247610900 1074099357 /nfs/dbraw/zinc/09/93/57/1074099357.db2.gz LCWCSIVTRPPNFS-MELADBBJSA-N -1 3 379.369 -1.169 20 0 GAADHM [O-]C(=C(O)c1nc(-c2cccc(N3CCOCC3)c2)no1)[C@H](O)[C@H](O)CO ZINC001247610901 1074099544 /nfs/dbraw/zinc/09/95/44/1074099544.db2.gz LCWCSIVTRPPNFS-MGPQQGTHSA-N -1 3 379.369 -1.169 20 0 GAADHM [O-]C(=C(O)c1nc(-c2ccc(CN3CCOCC3)cc2)no1)[C@@H](O)[C@H](O)CO ZINC001247611724 1074099791 /nfs/dbraw/zinc/09/97/91/1074099791.db2.gz NHEUDIRTAIGENG-QLFBSQMISA-N -1 3 393.396 -1.174 20 0 GAADHM [O-]C(=C(O)c1nc(-c2ccc(CN3CCOCC3)cc2)no1)[C@H](O)[C@H](O)CO ZINC001247611743 1074099898 /nfs/dbraw/zinc/09/98/98/1074099898.db2.gz NHEUDIRTAIGENG-RBSFLKMASA-N -1 3 393.396 -1.174 20 0 GAADHM [O-]C(=C(O)c1nc(-c2ccc(CN3CCOCC3)cc2)no1)[C@H](O)[C@@H](O)CO ZINC001247611748 1074099944 /nfs/dbraw/zinc/09/99/44/1074099944.db2.gz NHEUDIRTAIGENG-RRFJBIMHSA-N -1 3 393.396 -1.174 20 0 GAADHM [O-]C(=C(O)c1nc(-c2ccc(CN3CCOCC3)cc2)no1)[C@@H](O)[C@@H](O)CO ZINC001247611750 1074099799 /nfs/dbraw/zinc/09/97/99/1074099799.db2.gz NHEUDIRTAIGENG-SOUVJXGZSA-N -1 3 393.396 -1.174 20 0 GAADHM [O-]C(=C(O)c1nc(-c2ccccc2N2CCOCC2)no1)[C@H](O)[C@@H](O)CO ZINC001247617481 1074099969 /nfs/dbraw/zinc/09/99/69/1074099969.db2.gz ZSEUZRWYEVJLRH-BFHYXJOUSA-N -1 3 379.369 -1.169 20 0 GAADHM [O-]C(=C(O)c1nc(-c2ccccc2N2CCOCC2)no1)[C@@H](O)[C@H](O)CO ZINC001247617482 1074099839 /nfs/dbraw/zinc/09/98/39/1074099839.db2.gz ZSEUZRWYEVJLRH-HZSPNIEDSA-N -1 3 379.369 -1.169 20 0 GAADHM [O-]C(=C(O)c1nc(-c2ccccc2N2CCOCC2)no1)[C@@H](O)[C@@H](O)CO ZINC001247617484 1074099810 /nfs/dbraw/zinc/09/98/10/1074099810.db2.gz ZSEUZRWYEVJLRH-MELADBBJSA-N -1 3 379.369 -1.169 20 0 GAADHM [O-]C(=C(O)c1nc(-c2ccccc2N2CCOCC2)no1)[C@H](O)[C@H](O)CO ZINC001247617485 1074100573 /nfs/dbraw/zinc/10/05/73/1074100573.db2.gz ZSEUZRWYEVJLRH-MGPQQGTHSA-N -1 3 379.369 -1.169 20 0 GAADHM NC(=O)CNC(=O)CNC(=O)C[N-]S(=O)(=O)c1cc(Cl)ccc1Cl 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ZINC001571140262 952624684 /nfs/dbraw/zinc/62/46/84/952624684.db2.gz PINUKQMDURXWNM-JTQLQIEISA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)C1CS(=O)(=O)C1 ZINC001571140262 952624680 /nfs/dbraw/zinc/62/46/80/952624680.db2.gz PINUKQMDURXWNM-JTQLQIEISA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)[C@]2(F)CCOC2)C[C@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001571140408 952625378 /nfs/dbraw/zinc/62/53/78/952625378.db2.gz QOYHBSLVXKHFEQ-HFAKWTLXSA-N -1 3 379.352 -1.375 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)[C@]2(F)CCOC2)C[C@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001571140408 952625377 /nfs/dbraw/zinc/62/53/77/952625377.db2.gz QOYHBSLVXKHFEQ-HFAKWTLXSA-N -1 3 379.352 -1.375 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)[C@@]2(F)CCOC2)C[C@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001571140409 952625358 /nfs/dbraw/zinc/62/53/58/952625358.db2.gz QOYHBSLVXKHFEQ-UEKVPHQBSA-N -1 3 379.352 -1.375 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)[C@@]2(F)CCOC2)C[C@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001571140409 952625357 /nfs/dbraw/zinc/62/53/57/952625357.db2.gz QOYHBSLVXKHFEQ-UEKVPHQBSA-N -1 3 379.352 -1.375 20 0 GAADHM O=C(N[C@H]1C[C@H](NC(=O)C2CS(=O)(=O)C2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001571140458 952625364 /nfs/dbraw/zinc/62/53/64/952625364.db2.gz RDHWVWKLRAPZOR-KYZUINATSA-N -1 3 379.402 -1.384 20 0 GAADHM O=C(N[C@H]1C[C@H](NC(=O)C2CS(=O)(=O)C2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001571140458 952625363 /nfs/dbraw/zinc/62/53/63/952625363.db2.gz RDHWVWKLRAPZOR-KYZUINATSA-N -1 3 379.402 -1.384 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)C1CS(=O)(=O)C1 ZINC001571141185 952631975 /nfs/dbraw/zinc/63/19/75/952631975.db2.gz VPTPMMSYTUUDKC-JTQLQIEISA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)C1CS(=O)(=O)C1 ZINC001571141185 952631972 /nfs/dbraw/zinc/63/19/72/952631972.db2.gz VPTPMMSYTUUDKC-JTQLQIEISA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)C1CS(=O)(=O)C1 ZINC001571141187 952632066 /nfs/dbraw/zinc/63/20/66/952632066.db2.gz VPTPMMSYTUUDKC-SNVBAGLBSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)C1CS(=O)(=O)C1 ZINC001571141187 952632063 /nfs/dbraw/zinc/63/20/63/952632063.db2.gz VPTPMMSYTUUDKC-SNVBAGLBSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)C2CS(=O)(=O)C2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001571141260 952633111 /nfs/dbraw/zinc/63/31/11/952633111.db2.gz WZMBHJCWMWJNTB-SECBINFHSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)C2CS(=O)(=O)C2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001571141260 952633108 /nfs/dbraw/zinc/63/31/08/952633108.db2.gz WZMBHJCWMWJNTB-SECBINFHSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)C2CS(=O)(=O)C2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001571141262 952632611 /nfs/dbraw/zinc/63/26/11/952632611.db2.gz WZMBHJCWMWJNTB-VIFPVBQESA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)C2CS(=O)(=O)C2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001571141262 952632610 /nfs/dbraw/zinc/63/26/10/952632610.db2.gz WZMBHJCWMWJNTB-VIFPVBQESA-N -1 3 379.402 -1.430 20 0 GAADHM COc1cc(-c2nn[n-]n2)ccc1C(=O)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001571141268 952632964 /nfs/dbraw/zinc/63/29/64/952632964.db2.gz XARZMIASZNZYLY-JTQLQIEISA-N -1 3 379.402 -1.150 20 0 GAADHM COc1cc(-c2nnn[n-]2)ccc1C(=O)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001571141268 952632960 /nfs/dbraw/zinc/63/29/60/952632960.db2.gz XARZMIASZNZYLY-JTQLQIEISA-N -1 3 379.402 -1.150 20 0 GAADHM COc1cc(-c2nn[n-]n2)ccc1C(=O)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001571141272 952632482 /nfs/dbraw/zinc/63/24/82/952632482.db2.gz XARZMIASZNZYLY-SNVBAGLBSA-N -1 3 379.402 -1.150 20 0 GAADHM COc1cc(-c2nnn[n-]2)ccc1C(=O)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001571141272 952632481 /nfs/dbraw/zinc/63/24/81/952632481.db2.gz XARZMIASZNZYLY-SNVBAGLBSA-N -1 3 379.402 -1.150 20 0 GAADHM COC(=O)[C@@]1(CNC(=O)c2cnccc2-c2nn[n-]n2)C[C@@H]1S(C)(=O)=O ZINC001571152075 952680891 /nfs/dbraw/zinc/68/08/91/952680891.db2.gz CQTXWMDJCGZUPU-IINYFYTJSA-N -1 3 380.386 -1.032 20 0 GAADHM COC(=O)[C@@]1(CNC(=O)c2cnccc2-c2nnn[n-]2)C[C@@H]1S(C)(=O)=O ZINC001571152075 952680889 /nfs/dbraw/zinc/68/08/89/952680889.db2.gz CQTXWMDJCGZUPU-IINYFYTJSA-N -1 3 380.386 -1.032 20 0 GAADHM CNC(=O)CN1CCC(NS(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001571166583 952763028 /nfs/dbraw/zinc/76/30/28/952763028.db2.gz NHNRNFFIAQVOMO-UHFFFAOYSA-N -1 3 380.434 -1.250 20 0 GAADHM CNC(=O)CN1CCC(NS(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001571166583 952763025 /nfs/dbraw/zinc/76/30/25/952763025.db2.gz NHNRNFFIAQVOMO-UHFFFAOYSA-N -1 3 380.434 -1.250 20 0 GAADHM O=C(Cn1cc(-c2nn[n-]n2)cn1)N1CCN([C@@H]2CCS(=O)(=O)C2)CC1 ZINC001571167010 952768759 /nfs/dbraw/zinc/76/87/59/952768759.db2.gz SHNSDEZVRQBSNS-GFCCVEGCSA-N -1 3 380.434 -1.606 20 0 GAADHM O=C(Cn1cc(-c2nnn[n-]2)cn1)N1CCN([C@@H]2CCS(=O)(=O)C2)CC1 ZINC001571167010 952768753 /nfs/dbraw/zinc/76/87/53/952768753.db2.gz SHNSDEZVRQBSNS-GFCCVEGCSA-N -1 3 380.434 -1.606 20 0 GAADHM O=C(Cn1cc(-c2nn[n-]n2)cn1)N1CCN([C@H]2CCS(=O)(=O)C2)CC1 ZINC001571167011 952768853 /nfs/dbraw/zinc/76/88/53/952768853.db2.gz SHNSDEZVRQBSNS-LBPRGKRZSA-N -1 3 380.434 -1.606 20 0 GAADHM O=C(Cn1cc(-c2nnn[n-]2)cn1)N1CCN([C@H]2CCS(=O)(=O)C2)CC1 ZINC001571167011 952768849 /nfs/dbraw/zinc/76/88/49/952768849.db2.gz SHNSDEZVRQBSNS-LBPRGKRZSA-N -1 3 380.434 -1.606 20 0 GAADHM O=C(N[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(=O)cn3)C[C@H]21)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001571172215 952803731 /nfs/dbraw/zinc/80/37/31/952803731.db2.gz PLNBMSONYUEOAJ-WOFXILAISA-N -1 3 381.356 -1.222 20 0 GAADHM O=C(N[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(=O)cn3)C[C@H]21)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001571172215 952803726 /nfs/dbraw/zinc/80/37/26/952803726.db2.gz PLNBMSONYUEOAJ-WOFXILAISA-N -1 3 381.356 -1.222 20 0 GAADHM C[C@@H](C(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)S(C)(=O)=O ZINC001571182744 952868937 /nfs/dbraw/zinc/86/89/37/952868937.db2.gz DDHJLBJGXOUHQQ-DTWKUNHWSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)S(C)(=O)=O ZINC001571182744 952868933 /nfs/dbraw/zinc/86/89/33/952868933.db2.gz DDHJLBJGXOUHQQ-DTWKUNHWSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)S(C)(=O)=O ZINC001571182745 952868916 /nfs/dbraw/zinc/86/89/16/952868916.db2.gz DDHJLBJGXOUHQQ-RKDXNWHRSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)S(C)(=O)=O ZINC001571182745 952868914 /nfs/dbraw/zinc/86/89/14/952868914.db2.gz DDHJLBJGXOUHQQ-RKDXNWHRSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H]1[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCN1C(=O)CS(C)(=O)=O ZINC001571182774 952869038 /nfs/dbraw/zinc/86/90/38/952869038.db2.gz FLKAPAVFIBGGPO-BDAKNGLRSA-N -1 3 381.418 -1.041 20 0 GAADHM O=C(CNc1ccc(-c2nn[n-]n2)cn1)NCC1(O)CCS(=O)(=O)CC1 ZINC001571183000 952871626 /nfs/dbraw/zinc/87/16/26/952871626.db2.gz LTNQPKMMBOXAKK-UHFFFAOYSA-N -1 3 381.418 -1.271 20 0 GAADHM O=C(CNc1ccc(-c2nnn[n-]2)cn1)NCC1(O)CCS(=O)(=O)CC1 ZINC001571183000 952871621 /nfs/dbraw/zinc/87/16/21/952871621.db2.gz LTNQPKMMBOXAKK-UHFFFAOYSA-N -1 3 381.418 -1.271 20 0 GAADHM CO[C@]1(CNC(=O)CNc2ccc(-c3nn[n-]n3)cn2)CCS(=O)(=O)C1 ZINC001571183140 952873854 /nfs/dbraw/zinc/87/38/54/952873854.db2.gz PXUHZWHPMNJTLY-AWEZNQCLSA-N -1 3 381.418 -1.007 20 0 GAADHM CO[C@]1(CNC(=O)CNc2ccc(-c3nnn[n-]3)cn2)CCS(=O)(=O)C1 ZINC001571183140 952873849 /nfs/dbraw/zinc/87/38/49/952873849.db2.gz PXUHZWHPMNJTLY-AWEZNQCLSA-N -1 3 381.418 -1.007 20 0 GAADHM CO[C@@]1(CNC(=O)CNc2ccc(-c3nn[n-]n3)cn2)CCS(=O)(=O)C1 ZINC001571183141 952874298 /nfs/dbraw/zinc/87/42/98/952874298.db2.gz PXUHZWHPMNJTLY-CQSZACIVSA-N -1 3 381.418 -1.007 20 0 GAADHM CO[C@@]1(CNC(=O)CNc2ccc(-c3nnn[n-]3)cn2)CCS(=O)(=O)C1 ZINC001571183141 952874297 /nfs/dbraw/zinc/87/42/97/952874297.db2.gz PXUHZWHPMNJTLY-CQSZACIVSA-N -1 3 381.418 -1.007 20 0 GAADHM Cn1ccc(=O)c(C(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]2O)c1 ZINC001571194421 952963473 /nfs/dbraw/zinc/96/34/73/952963473.db2.gz LZPBLXDABUAPDK-TZMCWYRMSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(=O)c(C(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]2O)c1 ZINC001571194421 952963469 /nfs/dbraw/zinc/96/34/69/952963469.db2.gz LZPBLXDABUAPDK-TZMCWYRMSA-N -1 3 382.384 -1.060 20 0 GAADHM O=C(Cn1cncn1)N1C[C@@H]2[C@@H](CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H]2C1 ZINC001571194591 952965743 /nfs/dbraw/zinc/96/57/43/952965743.db2.gz PPXKYKPTYUFUNP-RTCCRHLQSA-N -1 3 382.388 -1.079 20 0 GAADHM O=C(Cn1cncn1)N1C[C@@H]2[C@@H](CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H]2C1 ZINC001571194591 952965735 /nfs/dbraw/zinc/96/57/35/952965735.db2.gz PPXKYKPTYUFUNP-RTCCRHLQSA-N -1 3 382.388 -1.079 20 0 GAADHM CN(Cc1nnc2n1CCNC2=O)[C@@H](C(N)=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001571194972 952971231 /nfs/dbraw/zinc/97/12/31/952971231.db2.gz WBULDYHBWHEFFQ-GFCCVEGCSA-N -1 3 382.388 -1.140 20 0 GAADHM CN(Cc1nnc2n1CCNC2=O)[C@@H](C(N)=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001571194972 952971227 /nfs/dbraw/zinc/97/12/27/952971227.db2.gz WBULDYHBWHEFFQ-GFCCVEGCSA-N -1 3 382.388 -1.140 20 0 GAADHM CN(Cc1nnc2n1CCNC2=O)[C@H](C(N)=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001571194973 952970766 /nfs/dbraw/zinc/97/07/66/952970766.db2.gz WBULDYHBWHEFFQ-LBPRGKRZSA-N -1 3 382.388 -1.140 20 0 GAADHM CN(Cc1nnc2n1CCNC2=O)[C@H](C(N)=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001571194973 952970759 /nfs/dbraw/zinc/97/07/59/952970759.db2.gz WBULDYHBWHEFFQ-LBPRGKRZSA-N -1 3 382.388 -1.140 20 0 GAADHM O=C1NC[C@H](O)CC12CN(S(=O)(=O)c1ccc(F)cc1-c1nnn[n-]1)C2 ZINC001571195044 952972200 /nfs/dbraw/zinc/97/22/00/952972200.db2.gz WULBSYDIPPUPNF-SECBINFHSA-N -1 3 382.377 -1.123 20 0 GAADHM O=C1NC[C@@H](O)CC12CN(S(=O)(=O)c1ccc(F)cc1-c1nnn[n-]1)C2 ZINC001571195045 952972455 /nfs/dbraw/zinc/97/24/55/952972455.db2.gz WULBSYDIPPUPNF-VIFPVBQESA-N -1 3 382.377 -1.123 20 0 GAADHM C[C@@H](O)[C@H](O)CN1CCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001571210608 953072736 /nfs/dbraw/zinc/07/27/36/953072736.db2.gz UKGVXSWPCZGGBB-BXUZGUMPSA-N -1 3 382.446 -1.085 20 0 GAADHM C[C@@H](O)[C@H](O)CN1CCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001571210608 953072733 /nfs/dbraw/zinc/07/27/33/953072733.db2.gz UKGVXSWPCZGGBB-BXUZGUMPSA-N -1 3 382.446 -1.085 20 0 GAADHM C[C@H](O)[C@@H](O)CN1CCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001571210609 953073190 /nfs/dbraw/zinc/07/31/90/953073190.db2.gz UKGVXSWPCZGGBB-FZMZJTMJSA-N -1 3 382.446 -1.085 20 0 GAADHM C[C@H](O)[C@@H](O)CN1CCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001571210609 953073185 /nfs/dbraw/zinc/07/31/85/953073185.db2.gz UKGVXSWPCZGGBB-FZMZJTMJSA-N -1 3 382.446 -1.085 20 0 GAADHM C[C@@H](O)[C@@H](O)CN1CCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001571210610 953072707 /nfs/dbraw/zinc/07/27/07/953072707.db2.gz UKGVXSWPCZGGBB-RISCZKNCSA-N -1 3 382.446 -1.085 20 0 GAADHM C[C@@H](O)[C@@H](O)CN1CCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001571210610 953072705 /nfs/dbraw/zinc/07/27/05/953072705.db2.gz UKGVXSWPCZGGBB-RISCZKNCSA-N -1 3 382.446 -1.085 20 0 GAADHM C[C@H](O)[C@H](O)CN1CCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001571210611 953073118 /nfs/dbraw/zinc/07/31/18/953073118.db2.gz UKGVXSWPCZGGBB-SMDDNHRTSA-N -1 3 382.446 -1.085 20 0 GAADHM C[C@H](O)[C@H](O)CN1CCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001571210611 953073116 /nfs/dbraw/zinc/07/31/16/953073116.db2.gz UKGVXSWPCZGGBB-SMDDNHRTSA-N -1 3 382.446 -1.085 20 0 GAADHM Cc1[nH]c(-c2nn[n-]n2)cc1C(=O)NCCN1CCN(S(C)(=O)=O)CC1 ZINC001571210757 953074533 /nfs/dbraw/zinc/07/45/33/953074533.db2.gz WIAOQNRDVUBQMP-UHFFFAOYSA-N -1 3 382.450 -1.190 20 0 GAADHM Cc1[nH]c(-c2nnn[n-]2)cc1C(=O)NCCN1CCN(S(C)(=O)=O)CC1 ZINC001571210757 953074529 /nfs/dbraw/zinc/07/45/29/953074529.db2.gz WIAOQNRDVUBQMP-UHFFFAOYSA-N -1 3 382.450 -1.190 20 0 GAADHM Cc1ncncc1C(=O)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1O ZINC001571216637 953102553 /nfs/dbraw/zinc/10/25/53/953102553.db2.gz AKVBGYLIGVRSHF-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ncncc1C(=O)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1O ZINC001571216637 953102551 /nfs/dbraw/zinc/10/25/51/953102551.db2.gz AKVBGYLIGVRSHF-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM COC(=O)CCNC(=O)CCNS(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001571216671 953103783 /nfs/dbraw/zinc/10/37/83/953103783.db2.gz BEYVIDHUGVBHTM-UHFFFAOYSA-N -1 3 383.390 -1.391 20 0 GAADHM COC(=O)CCNC(=O)CCNS(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001571216671 953103780 /nfs/dbraw/zinc/10/37/80/953103780.db2.gz BEYVIDHUGVBHTM-UHFFFAOYSA-N -1 3 383.390 -1.391 20 0 GAADHM O=C(N[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C[C@H]1O)c1c[nH]c(=O)cn1 ZINC001571216689 953103321 /nfs/dbraw/zinc/10/33/21/953103321.db2.gz BRERVMMCAAVYOJ-CMPLNLGQSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C[C@H]1O)c1c[nH]c(=O)cn1 ZINC001571216689 953103315 /nfs/dbraw/zinc/10/33/15/953103315.db2.gz BRERVMMCAAVYOJ-CMPLNLGQSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O)c1c[nH]c(=O)cn1 ZINC001571216690 953103709 /nfs/dbraw/zinc/10/37/09/953103709.db2.gz BRERVMMCAAVYOJ-JQWIXIFHSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O)c1c[nH]c(=O)cn1 ZINC001571216690 953103707 /nfs/dbraw/zinc/10/37/07/953103707.db2.gz BRERVMMCAAVYOJ-JQWIXIFHSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O)c1c[nH]c(=O)cn1 ZINC001571216691 953103748 /nfs/dbraw/zinc/10/37/48/953103748.db2.gz BRERVMMCAAVYOJ-PWSUYJOCSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O)c1c[nH]c(=O)cn1 ZINC001571216691 953103747 /nfs/dbraw/zinc/10/37/47/953103747.db2.gz BRERVMMCAAVYOJ-PWSUYJOCSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C[C@H]1O)c1c[nH]c(=O)cn1 ZINC001571216692 953103845 /nfs/dbraw/zinc/10/38/45/953103845.db2.gz BRERVMMCAAVYOJ-ZYHUDNBSSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C[C@H]1O)c1c[nH]c(=O)cn1 ZINC001571216692 953103840 /nfs/dbraw/zinc/10/38/40/953103840.db2.gz BRERVMMCAAVYOJ-ZYHUDNBSSA-N -1 3 383.372 -1.285 20 0 GAADHM Cn1nnc(C(=O)N2CC[C@H]3CN(C(=O)c4cc(-c5nn[n-]n5)c[nH]4)C[C@H]32)n1 ZINC001571216709 953103633 /nfs/dbraw/zinc/10/36/33/953103633.db2.gz CMRCJYKKSVJXDP-GZMMTYOYSA-N -1 3 383.376 -1.295 20 0 GAADHM Cn1nnc(C(=O)N2CC[C@H]3CN(C(=O)c4cc(-c5nnn[n-]5)c[nH]4)C[C@H]32)n1 ZINC001571216709 953103631 /nfs/dbraw/zinc/10/36/31/953103631.db2.gz CMRCJYKKSVJXDP-GZMMTYOYSA-N -1 3 383.376 -1.295 20 0 GAADHM O=C(Cn1cnnn1)N1C[C@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]21 ZINC001571216710 953103670 /nfs/dbraw/zinc/10/36/70/953103670.db2.gz CMWSJIYEBYJUCR-BXKDBHETSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1cnnn1)N1C[C@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]21 ZINC001571216710 953103669 /nfs/dbraw/zinc/10/36/69/953103669.db2.gz CMWSJIYEBYJUCR-BXKDBHETSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(CNc1ccc(-c2nn[n-]n2)cn1)NCCc1nnc2n1CCNC2=O ZINC001571217027 953105603 /nfs/dbraw/zinc/10/56/03/953105603.db2.gz FBYPNSWJQKONCA-UHFFFAOYSA-N -1 3 383.376 -1.633 20 0 GAADHM O=C(CNc1ccc(-c2nnn[n-]2)cn1)NCCc1nnc2n1CCNC2=O ZINC001571217027 953105601 /nfs/dbraw/zinc/10/56/01/953105601.db2.gz FBYPNSWJQKONCA-UHFFFAOYSA-N -1 3 383.376 -1.633 20 0 GAADHM Cn1nc(C(=O)N2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2)ccc1=O ZINC001571217034 953105507 /nfs/dbraw/zinc/10/55/07/953105507.db2.gz FCXKRFRDSZEZJB-UHFFFAOYSA-N -1 3 383.372 -1.113 20 0 GAADHM Cn1nc(C(=O)N2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2)ccc1=O ZINC001571217034 953105503 /nfs/dbraw/zinc/10/55/03/953105503.db2.gz FCXKRFRDSZEZJB-UHFFFAOYSA-N -1 3 383.372 -1.113 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001571217036 953105563 /nfs/dbraw/zinc/10/55/63/953105563.db2.gz FJQIMVISIVIXAB-YWVKMMECSA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001571217036 953105560 /nfs/dbraw/zinc/10/55/60/953105560.db2.gz FJQIMVISIVIXAB-YWVKMMECSA-N -1 3 383.376 -1.106 20 0 GAADHM NC(=O)CN1CCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2F)CC1=O ZINC001571217276 953106412 /nfs/dbraw/zinc/10/64/12/953106412.db2.gz DJJHNIFOGNAATP-UHFFFAOYSA-N -1 3 383.365 -1.676 20 0 GAADHM NC(=O)CN1CCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2F)CC1=O ZINC001571217276 953106411 /nfs/dbraw/zinc/10/64/11/953106411.db2.gz DJJHNIFOGNAATP-UHFFFAOYSA-N -1 3 383.365 -1.676 20 0 GAADHM Cn1nc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)ccc1=O ZINC001571217340 953107574 /nfs/dbraw/zinc/10/75/74/953107574.db2.gz IKRGJAMVEYJVFJ-SECBINFHSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)ccc1=O ZINC001571217340 953107572 /nfs/dbraw/zinc/10/75/72/953107572.db2.gz IKRGJAMVEYJVFJ-SECBINFHSA-N -1 3 383.372 -1.067 20 0 GAADHM CO[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@H]1NC(=O)c1c[nH]c(=O)cn1 ZINC001571217374 953108110 /nfs/dbraw/zinc/10/81/10/953108110.db2.gz JMFAZILULRBMLX-VXGBXAGGSA-N -1 3 383.372 -1.021 20 0 GAADHM CO[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@H]1NC(=O)c1c[nH]c(=O)cn1 ZINC001571217374 953108107 /nfs/dbraw/zinc/10/81/07/953108107.db2.gz JMFAZILULRBMLX-VXGBXAGGSA-N -1 3 383.372 -1.021 20 0 GAADHM CN1CCn2c(CNC(=O)CNc3ccc(-c4nn[n-]n4)cn3)nnc2C1=O ZINC001571217387 953108247 /nfs/dbraw/zinc/10/82/47/953108247.db2.gz KKYFJRFGGJVYNT-UHFFFAOYSA-N -1 3 383.376 -1.333 20 0 GAADHM CN1CCn2c(CNC(=O)CNc3ccc(-c4nnn[n-]4)cn3)nnc2C1=O ZINC001571217387 953108243 /nfs/dbraw/zinc/10/82/43/953108243.db2.gz KKYFJRFGGJVYNT-UHFFFAOYSA-N -1 3 383.376 -1.333 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cccnn2)C[C@@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001571217490 953108212 /nfs/dbraw/zinc/10/82/12/953108212.db2.gz MGRMDDPYYSDFIC-GWCFXTLKSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cccnn2)C[C@@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001571217490 953108209 /nfs/dbraw/zinc/10/82/09/953108209.db2.gz MGRMDDPYYSDFIC-GWCFXTLKSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cccnn2)C[C@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001571217491 953107865 /nfs/dbraw/zinc/10/78/65/953107865.db2.gz MGRMDDPYYSDFIC-GXFFZTMASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cccnn2)C[C@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001571217491 953107860 /nfs/dbraw/zinc/10/78/60/953107860.db2.gz MGRMDDPYYSDFIC-GXFFZTMASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cccnn2)C[C@@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001571217493 953108585 /nfs/dbraw/zinc/10/85/85/953108585.db2.gz MGRMDDPYYSDFIC-MFKMUULPSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cccnn2)C[C@@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001571217493 953108584 /nfs/dbraw/zinc/10/85/84/953108584.db2.gz MGRMDDPYYSDFIC-MFKMUULPSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cccnn2)C[C@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001571217495 953108605 /nfs/dbraw/zinc/10/86/05/953108605.db2.gz MGRMDDPYYSDFIC-ZWNOBZJWSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cccnn2)C[C@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001571217495 953108602 /nfs/dbraw/zinc/10/86/02/953108602.db2.gz MGRMDDPYYSDFIC-ZWNOBZJWSA-N -1 3 383.372 -1.010 20 0 GAADHM Cc1cnc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)cn1 ZINC001571217517 953109355 /nfs/dbraw/zinc/10/93/55/953109355.db2.gz MWYXJRINVULTDM-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cnc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)cn1 ZINC001571217517 953109352 /nfs/dbraw/zinc/10/93/52/953109352.db2.gz MWYXJRINVULTDM-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cn1nnc(C(=O)NC[C@@H]2[C@H]3CN(C(=O)c4ccc(-c5nn[n-]n5)[nH]4)C[C@H]32)n1 ZINC001571217582 953109042 /nfs/dbraw/zinc/10/90/42/953109042.db2.gz NZWRCMZHCJOQOF-PSVAKVPMSA-N -1 3 383.376 -1.534 20 0 GAADHM Cn1nnc(C(=O)NC[C@@H]2[C@H]3CN(C(=O)c4ccc(-c5nnn[n-]5)[nH]4)C[C@H]32)n1 ZINC001571217582 953109039 /nfs/dbraw/zinc/10/90/39/953109039.db2.gz NZWRCMZHCJOQOF-PSVAKVPMSA-N -1 3 383.376 -1.534 20 0 GAADHM NC(=O)c1ncn(CC(=O)N2CCN(c3ncccc3-c3nn[n-]n3)CC2)n1 ZINC001571217589 953109470 /nfs/dbraw/zinc/10/94/70/953109470.db2.gz ODSAAWHJBOJASJ-UHFFFAOYSA-N -1 3 383.376 -1.699 20 0 GAADHM NC(=O)c1ncn(CC(=O)N2CCN(c3ncccc3-c3nnn[n-]3)CC2)n1 ZINC001571217589 953109465 /nfs/dbraw/zinc/10/94/65/953109465.db2.gz ODSAAWHJBOJASJ-UHFFFAOYSA-N -1 3 383.376 -1.699 20 0 GAADHM Cc1nnccc1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001571217624 953110116 /nfs/dbraw/zinc/11/01/16/953110116.db2.gz PKCLTTQCROEQPH-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1nnccc1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001571217624 953110114 /nfs/dbraw/zinc/11/01/14/953110114.db2.gz PKCLTTQCROEQPH-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cnc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)cn1 ZINC001571217625 953109951 /nfs/dbraw/zinc/10/99/51/953109951.db2.gz PKTGNLUGFFURJP-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cnc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)cn1 ZINC001571217625 953109947 /nfs/dbraw/zinc/10/99/47/953109947.db2.gz PKTGNLUGFFURJP-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)n1 ZINC001571217838 953111093 /nfs/dbraw/zinc/11/10/93/953111093.db2.gz PWBDTLQEBMWWLY-NEPJUHHUSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)n1 ZINC001571217838 953111090 /nfs/dbraw/zinc/11/10/90/953111090.db2.gz PWBDTLQEBMWWLY-NEPJUHHUSA-N -1 3 383.372 -1.091 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001571217856 953110968 /nfs/dbraw/zinc/11/09/68/953110968.db2.gz QOHAUCBYOTXEMG-ONOSFVFSSA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001571217856 953110966 /nfs/dbraw/zinc/11/09/66/953110966.db2.gz QOHAUCBYOTXEMG-ONOSFVFSSA-N -1 3 383.376 -1.106 20 0 GAADHM Cc1nccc(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)n1 ZINC001571217857 953110784 /nfs/dbraw/zinc/11/07/84/953110784.db2.gz QPSMPFOFIZHBSG-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM 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953227048 /nfs/dbraw/zinc/22/70/48/953227048.db2.gz ZDRYXGXLJWWERT-GMTLJSCSSA-N -1 3 384.400 -1.011 20 0 GAADHM NC(=O)[C@@H]1C[C@@H]1C(=O)N1C[C@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]21 ZINC001571238305 953227046 /nfs/dbraw/zinc/22/70/46/953227046.db2.gz ZDRYXGXLJWWERT-GMTLJSCSSA-N -1 3 384.400 -1.011 20 0 GAADHM CO[C@@H]1CN(c2cnc(-c3nnn[n-]3)cn2)C[C@H]1NC(=O)Cc1cncn1C ZINC001571238445 953228886 /nfs/dbraw/zinc/22/88/86/953228886.db2.gz CNNPJMFRQXSMMA-CHWSQXEVSA-N -1 3 384.404 -1.047 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@H](NC(=O)Cn3cncn3)[C@H](O)C2)n1 ZINC001571238527 953229981 /nfs/dbraw/zinc/22/99/81/953229981.db2.gz GBMPTRPBQPHZNI-CHWSQXEVSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@H](NC(=O)Cn3cncn3)[C@H](O)C2)n1 ZINC001571238527 953229978 /nfs/dbraw/zinc/22/99/78/953229978.db2.gz GBMPTRPBQPHZNI-CHWSQXEVSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@H](NC(=O)Cn3cncn3)[C@@H](O)C2)n1 ZINC001571238528 953230018 /nfs/dbraw/zinc/23/00/18/953230018.db2.gz GBMPTRPBQPHZNI-OLZOCXBDSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@H](NC(=O)Cn3cncn3)[C@@H](O)C2)n1 ZINC001571238528 953230009 /nfs/dbraw/zinc/23/00/09/953230009.db2.gz GBMPTRPBQPHZNI-OLZOCXBDSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@H](NC(=O)Cn3cncn3)[C@H](O)C2)n1 ZINC001571238529 953230172 /nfs/dbraw/zinc/23/01/72/953230172.db2.gz GBMPTRPBQPHZNI-QWHCGFSZSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@H](NC(=O)Cn3cncn3)[C@H](O)C2)n1 ZINC001571238529 953230168 /nfs/dbraw/zinc/23/01/68/953230168.db2.gz GBMPTRPBQPHZNI-QWHCGFSZSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@H](NC(=O)Cn3cncn3)[C@@H](O)C2)n1 ZINC001571238530 953230191 /nfs/dbraw/zinc/23/01/91/953230191.db2.gz GBMPTRPBQPHZNI-STQMWFEESA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@H](NC(=O)Cn3cncn3)[C@@H](O)C2)n1 ZINC001571238530 953230187 /nfs/dbraw/zinc/23/01/87/953230187.db2.gz 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Cn1cncc1CC(=O)N[C@@H]1CCN(c2cnc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001571238582 953230964 /nfs/dbraw/zinc/23/09/64/953230964.db2.gz HJWKMFAXDSTOLZ-YPMHNXCESA-N -1 3 384.404 -1.311 20 0 GAADHM O=C(Cc1cnc[nH]1)N1CCC(O)(CNc2ccnc(-c3nn[n-]n3)n2)CC1 ZINC001571238852 953233110 /nfs/dbraw/zinc/23/31/10/953233110.db2.gz NNDNQJYPRNESST-UHFFFAOYSA-N -1 3 384.404 -1.190 20 0 GAADHM Cc1nn(CC(=O)N[C@@H]2CCN(c3ncccc3-c3nn[n-]n3)C2)c(=O)n1C ZINC001571238981 953234866 /nfs/dbraw/zinc/23/48/66/953234866.db2.gz OVEDXOZFAMMAGL-LLVKDONJSA-N -1 3 384.404 -1.140 20 0 GAADHM Cc1nn(CC(=O)N[C@@H]2CCN(c3ncccc3-c3nnn[n-]3)C2)c(=O)n1C ZINC001571238981 953234863 /nfs/dbraw/zinc/23/48/63/953234863.db2.gz OVEDXOZFAMMAGL-LLVKDONJSA-N -1 3 384.404 -1.140 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(c3ncccc3-c3nn[n-]n3)C[C@@H]2O)c1N ZINC001571239138 953236318 /nfs/dbraw/zinc/23/63/18/953236318.db2.gz RAMQLBVSKPVVNW-NEPJUHHUSA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(c3ncccc3-c3nnn[n-]3)C[C@@H]2O)c1N ZINC001571239138 953236316 /nfs/dbraw/zinc/23/63/16/953236316.db2.gz RAMQLBVSKPVVNW-NEPJUHHUSA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(c3ncccc3-c3nn[n-]n3)C[C@H]2O)c1N ZINC001571239139 953236227 /nfs/dbraw/zinc/23/62/27/953236227.db2.gz RAMQLBVSKPVVNW-NWDGAFQWSA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(c3ncccc3-c3nnn[n-]3)C[C@H]2O)c1N ZINC001571239139 953236224 /nfs/dbraw/zinc/23/62/24/953236224.db2.gz RAMQLBVSKPVVNW-NWDGAFQWSA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(c3ncccc3-c3nn[n-]n3)C[C@@H]2O)c1N ZINC001571239140 953236648 /nfs/dbraw/zinc/23/66/48/953236648.db2.gz RAMQLBVSKPVVNW-RYUDHWBXSA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(c3ncccc3-c3nnn[n-]3)C[C@@H]2O)c1N ZINC001571239140 953236644 /nfs/dbraw/zinc/23/66/44/953236644.db2.gz RAMQLBVSKPVVNW-RYUDHWBXSA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(c3ncccc3-c3nn[n-]n3)C[C@H]2O)c1N ZINC001571239141 953236554 /nfs/dbraw/zinc/23/65/54/953236554.db2.gz 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Cc1nc(N2CC[C@H](NC(=O)Cn3cncn3)[C@H](O)C2)ccc1-c1nn[n-]n1 ZINC001571239528 953240456 /nfs/dbraw/zinc/24/04/56/953240456.db2.gz WHCRWYCUSJMXCS-QWHCGFSZSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)Cn3cncn3)[C@H](O)C2)ccc1-c1nnn[n-]1 ZINC001571239528 953240452 /nfs/dbraw/zinc/24/04/52/953240452.db2.gz WHCRWYCUSJMXCS-QWHCGFSZSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)Cn3cncn3)[C@@H](O)C2)ccc1-c1nn[n-]n1 ZINC001571239529 953240088 /nfs/dbraw/zinc/24/00/88/953240088.db2.gz WHCRWYCUSJMXCS-STQMWFEESA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)Cn3cncn3)[C@@H](O)C2)ccc1-c1nnn[n-]1 ZINC001571239529 953240087 /nfs/dbraw/zinc/24/00/87/953240087.db2.gz WHCRWYCUSJMXCS-STQMWFEESA-N -1 3 384.404 -1.082 20 0 GAADHM CN(c1ncccc1-c1nn[n-]n1)[C@@H]1CCN(C(=O)Cn2ncn(C)c2=O)C1 ZINC001571239535 953240129 /nfs/dbraw/zinc/24/01/29/953240129.db2.gz WMMGIAMMIXMKDG-LLVKDONJSA-N -1 3 384.404 -1.106 20 0 GAADHM CN(c1ncccc1-c1nnn[n-]1)[C@@H]1CCN(C(=O)Cn2ncn(C)c2=O)C1 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XUTAIHMKMPBQIF-AAEUAGOBSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1cncn1CC(=O)N[C@H]1CCN(c2cnc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001571239785 953243139 /nfs/dbraw/zinc/24/31/39/953243139.db2.gz XUTAIHMKMPBQIF-AAEUAGOBSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1cncn1CC(=O)N[C@@H]1CCN(c2cnc(-c3nn[n-]n3)cn2)C[C@H]1O ZINC001571239786 953242600 /nfs/dbraw/zinc/24/26/00/953242600.db2.gz XUTAIHMKMPBQIF-DGCLKSJQSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1cncn1CC(=O)N[C@@H]1CCN(c2cnc(-c3nnn[n-]3)cn2)C[C@H]1O ZINC001571239786 953242597 /nfs/dbraw/zinc/24/25/97/953242597.db2.gz XUTAIHMKMPBQIF-DGCLKSJQSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1cncn1CC(=O)N[C@H]1CCN(c2cnc(-c3nn[n-]n3)cn2)C[C@H]1O ZINC001571239787 953243163 /nfs/dbraw/zinc/24/31/63/953243163.db2.gz XUTAIHMKMPBQIF-WCQYABFASA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1cncn1CC(=O)N[C@H]1CCN(c2cnc(-c3nnn[n-]3)cn2)C[C@H]1O ZINC001571239787 953243162 /nfs/dbraw/zinc/24/31/62/953243162.db2.gz XUTAIHMKMPBQIF-WCQYABFASA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1cncn1CC(=O)N[C@@H]1CCN(c2cnc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001571239788 953243167 /nfs/dbraw/zinc/24/31/67/953243167.db2.gz XUTAIHMKMPBQIF-YPMHNXCESA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1cncn1CC(=O)N[C@@H]1CCN(c2cnc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001571239788 953243166 /nfs/dbraw/zinc/24/31/66/953243166.db2.gz XUTAIHMKMPBQIF-YPMHNXCESA-N -1 3 384.404 -1.082 20 0 GAADHM O=C1NC[C@H](O)CC12CN(S(=O)(=O)Cc1csc(-c3nnn[n-]3)c1)C2 ZINC001571241624 953248115 /nfs/dbraw/zinc/24/81/15/953248115.db2.gz GQTUZCOPRTWBSO-SECBINFHSA-N -1 3 384.443 -1.059 20 0 GAADHM O=C1NC[C@@H](O)CC12CN(S(=O)(=O)Cc1csc(-c3nnn[n-]3)c1)C2 ZINC001571241625 953247962 /nfs/dbraw/zinc/24/79/62/953247962.db2.gz GQTUZCOPRTWBSO-VIFPVBQESA-N -1 3 384.443 -1.059 20 0 GAADHM CN(C(=O)CN1CCNC(=O)C1)C1CN(Cc2ccccc2-c2nn[n-]n2)C1 ZINC001571242857 953260999 /nfs/dbraw/zinc/26/09/99/953260999.db2.gz POSXPGIAEADREC-UHFFFAOYSA-N -1 3 384.444 -1.059 20 0 GAADHM CN(C(=O)CN1CCNC(=O)C1)C1CN(Cc2ccccc2-c2nnn[n-]2)C1 ZINC001571242857 953260997 /nfs/dbraw/zinc/26/09/97/953260997.db2.gz POSXPGIAEADREC-UHFFFAOYSA-N -1 3 384.444 -1.059 20 0 GAADHM O=C(N[C@@H]1CN(Cc2nnnn2C2CC2)C[C@@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001571253877 953335306 /nfs/dbraw/zinc/33/53/06/953335306.db2.gz ALEDIHPNURZSAQ-NEPJUHHUSA-N -1 3 385.392 -1.509 20 0 GAADHM O=C(N[C@@H]1CN(Cc2nnnn2C2CC2)C[C@@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001571253877 953335303 /nfs/dbraw/zinc/33/53/03/953335303.db2.gz ALEDIHPNURZSAQ-NEPJUHHUSA-N -1 3 385.392 -1.509 20 0 GAADHM O=C(N[C@@H]1CN(Cc2nnnn2C2CC2)C[C@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001571253878 953334589 /nfs/dbraw/zinc/33/45/89/953334589.db2.gz ALEDIHPNURZSAQ-VXGBXAGGSA-N -1 3 385.392 -1.509 20 0 GAADHM O=C(N[C@@H]1CN(Cc2nnnn2C2CC2)C[C@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001571253878 953334587 /nfs/dbraw/zinc/33/45/87/953334587.db2.gz ALEDIHPNURZSAQ-VXGBXAGGSA-N -1 3 385.392 -1.509 20 0 GAADHM NC(=O)[C@H](CO)NC(=O)COc1cccc(Br)c1-c1nn[n-]n1 ZINC001571254244 953337358 /nfs/dbraw/zinc/33/73/58/953337358.db2.gz ATENXEDFEGGXSG-ZETCQYMHSA-N -1 3 385.178 -1.030 20 0 GAADHM NC(=O)[C@H](CO)NC(=O)COc1cccc(Br)c1-c1nnn[n-]1 ZINC001571254244 953337354 /nfs/dbraw/zinc/33/73/54/953337354.db2.gz ATENXEDFEGGXSG-ZETCQYMHSA-N -1 3 385.178 -1.030 20 0 GAADHM O=C(Cn1ncnn1)N1CCCO[C@H](CNc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001571254327 953338386 /nfs/dbraw/zinc/33/83/86/953338386.db2.gz FZEOQZFLNMYTHD-GFCCVEGCSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1ncnn1)N1CCCO[C@H](CNc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001571254327 953338379 /nfs/dbraw/zinc/33/83/79/953338379.db2.gz FZEOQZFLNMYTHD-GFCCVEGCSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1ncnn1)N1CCCO[C@@H](CNc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001571254329 953338258 /nfs/dbraw/zinc/33/82/58/953338258.db2.gz FZEOQZFLNMYTHD-LBPRGKRZSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1ncnn1)N1CCCO[C@@H](CNc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001571254329 953338256 /nfs/dbraw/zinc/33/82/56/953338256.db2.gz FZEOQZFLNMYTHD-LBPRGKRZSA-N -1 3 385.392 -1.022 20 0 GAADHM Cc1c(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)cnn1C ZINC001571254641 953340553 /nfs/dbraw/zinc/34/05/53/953340553.db2.gz BGKIOWRELOBKRK-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1c(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)cnn1C ZINC001571254641 953340548 /nfs/dbraw/zinc/34/05/48/953340548.db2.gz BGKIOWRELOBKRK-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM C[C@@H]1[C@H](NC(=O)Cn2ncnn2)CCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001571254691 953341110 /nfs/dbraw/zinc/34/11/10/953341110.db2.gz BSZNFQPQCZSGOO-NXEZZACHSA-N -1 3 385.392 -1.009 20 0 GAADHM C[C@@H]1[C@H](NC(=O)Cn2ncnn2)CCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001571254691 953341107 /nfs/dbraw/zinc/34/11/07/953341107.db2.gz BSZNFQPQCZSGOO-NXEZZACHSA-N -1 3 385.392 -1.009 20 0 GAADHM C[C@H]1[C@@H](NC(=O)Cn2ncnn2)CCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001571254694 953340652 /nfs/dbraw/zinc/34/06/52/953340652.db2.gz BSZNFQPQCZSGOO-UWVGGRQHSA-N -1 3 385.392 -1.009 20 0 GAADHM C[C@H]1[C@@H](NC(=O)Cn2ncnn2)CCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001571254694 953340650 /nfs/dbraw/zinc/34/06/50/953340650.db2.gz BSZNFQPQCZSGOO-UWVGGRQHSA-N -1 3 385.392 -1.009 20 0 GAADHM C[C@H]1[C@H](NC(=O)Cn2ncnn2)CCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001571254697 953341278 /nfs/dbraw/zinc/34/12/78/953341278.db2.gz BSZNFQPQCZSGOO-VHSXEESVSA-N -1 3 385.392 -1.009 20 0 GAADHM C[C@H]1[C@H](NC(=O)Cn2ncnn2)CCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001571254697 953341276 /nfs/dbraw/zinc/34/12/76/953341276.db2.gz BSZNFQPQCZSGOO-VHSXEESVSA-N -1 3 385.392 -1.009 20 0 GAADHM C[C@@H]1[C@@H](NC(=O)Cn2ncnn2)CCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001571254700 953340501 /nfs/dbraw/zinc/34/05/01/953340501.db2.gz BSZNFQPQCZSGOO-ZJUUUORDSA-N -1 3 385.392 -1.009 20 0 GAADHM C[C@@H]1[C@@H](NC(=O)Cn2ncnn2)CCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001571254700 953340496 /nfs/dbraw/zinc/34/04/96/953340496.db2.gz BSZNFQPQCZSGOO-ZJUUUORDSA-N -1 3 385.392 -1.009 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1CC[C@H]2CN(C(=O)[C@@H]3CNC(=O)N3)C[C@H]21 ZINC001571254708 953341875 /nfs/dbraw/zinc/34/18/75/953341875.db2.gz BWFYWZZPRUALNR-KPXOXKRLSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1CC[C@H]2CN(C(=O)[C@@H]3CNC(=O)N3)C[C@H]21 ZINC001571254708 953341870 /nfs/dbraw/zinc/34/18/70/953341870.db2.gz BWFYWZZPRUALNR-KPXOXKRLSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1CC[C@H]2CN(C(=O)[C@H]3CNC(=O)N3)C[C@H]21 ZINC001571254710 953342315 /nfs/dbraw/zinc/34/23/15/953342315.db2.gz BWFYWZZPRUALNR-XXILOJSOSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1CC[C@H]2CN(C(=O)[C@H]3CNC(=O)N3)C[C@H]21 ZINC001571254710 953342312 /nfs/dbraw/zinc/34/23/12/953342312.db2.gz BWFYWZZPRUALNR-XXILOJSOSA-N -1 3 385.388 -1.451 20 0 GAADHM CN(C[C@H]1CCCN1C(=O)Cn1cnnn1)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001571254728 953342250 /nfs/dbraw/zinc/34/22/50/953342250.db2.gz CDLHMMTWGJHKQV-LLVKDONJSA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C[C@H]1CCCN1C(=O)Cn1cnnn1)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001571254728 953342245 /nfs/dbraw/zinc/34/22/45/953342245.db2.gz CDLHMMTWGJHKQV-LLVKDONJSA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C[C@@H]1CCCN1C(=O)Cn1cnnn1)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001571254731 953341669 /nfs/dbraw/zinc/34/16/69/953341669.db2.gz CDLHMMTWGJHKQV-NSHDSACASA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C[C@@H]1CCCN1C(=O)Cn1cnnn1)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001571254731 953341667 /nfs/dbraw/zinc/34/16/67/953341667.db2.gz CDLHMMTWGJHKQV-NSHDSACASA-N -1 3 385.392 -1.056 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001571254838 953343452 /nfs/dbraw/zinc/34/34/52/953343452.db2.gz KQYPIUFGMVCNBD-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001571254838 953343449 /nfs/dbraw/zinc/34/34/49/953343449.db2.gz KQYPIUFGMVCNBD-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001571254839 953343034 /nfs/dbraw/zinc/34/30/34/953343034.db2.gz KQYPIUFGMVCNBD-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001571254839 953343031 /nfs/dbraw/zinc/34/30/31/953343031.db2.gz KQYPIUFGMVCNBD-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM Cc1cn(C)nc1C(=O)N1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001571254941 953343984 /nfs/dbraw/zinc/34/39/84/953343984.db2.gz CZJFATUNAVDWKW-NEPJUHHUSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cn(C)nc1C(=O)N1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001571254941 953343981 /nfs/dbraw/zinc/34/39/81/953343981.db2.gz CZJFATUNAVDWKW-NEPJUHHUSA-N -1 3 385.388 -1.148 20 0 GAADHM Cn1cncc1CC(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001571255003 953343942 /nfs/dbraw/zinc/34/39/42/953343942.db2.gz DPPGWZXKOJUKOG-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1cncc1CC(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001571255003 953343939 /nfs/dbraw/zinc/34/39/39/953343939.db2.gz DPPGWZXKOJUKOG-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM O=C(CCn1cccn1)N1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001571255035 953343993 /nfs/dbraw/zinc/34/39/93/953343993.db2.gz FYMKCLUIEVLVNT-OLZOCXBDSA-N -1 3 385.388 -1.217 20 0 GAADHM O=C(CCn1cccn1)N1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001571255035 953343991 /nfs/dbraw/zinc/34/39/91/953343991.db2.gz FYMKCLUIEVLVNT-OLZOCXBDSA-N -1 3 385.388 -1.217 20 0 GAADHM CC1(C)CN(C(=O)Cn2cnnn2)C[C@H]1NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001571255043 953345321 /nfs/dbraw/zinc/34/53/21/953345321.db2.gz GDMQAVSGPZXSKA-LLVKDONJSA-N -1 3 385.392 -1.152 20 0 GAADHM CC1(C)CN(C(=O)Cn2cnnn2)C[C@H]1NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001571255043 953345316 /nfs/dbraw/zinc/34/53/16/953345316.db2.gz GDMQAVSGPZXSKA-LLVKDONJSA-N -1 3 385.392 -1.152 20 0 GAADHM CC1(C)CN(C(=O)Cn2cnnn2)C[C@@H]1NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001571255044 953344827 /nfs/dbraw/zinc/34/48/27/953344827.db2.gz GDMQAVSGPZXSKA-NSHDSACASA-N -1 3 385.392 -1.152 20 0 GAADHM CC1(C)CN(C(=O)Cn2cnnn2)C[C@@H]1NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001571255044 953344826 /nfs/dbraw/zinc/34/48/26/953344826.db2.gz GDMQAVSGPZXSKA-NSHDSACASA-N -1 3 385.392 -1.152 20 0 GAADHM O=C(Cn1ncnn1)N1CCCC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001571255174 953345783 /nfs/dbraw/zinc/34/57/83/953345783.db2.gz MANNQKYWWSXBED-JTQLQIEISA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCCC[C@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001571255174 953345780 /nfs/dbraw/zinc/34/57/80/953345780.db2.gz MANNQKYWWSXBED-JTQLQIEISA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCCC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001571255175 953345772 /nfs/dbraw/zinc/34/57/72/953345772.db2.gz MANNQKYWWSXBED-SNVBAGLBSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCCC[C@@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001571255175 953345770 /nfs/dbraw/zinc/34/57/70/953345770.db2.gz MANNQKYWWSXBED-SNVBAGLBSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001571255188 953345911 /nfs/dbraw/zinc/34/59/11/953345911.db2.gz MKBWIDWPRQQBKG-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001571255188 953345909 /nfs/dbraw/zinc/34/59/09/953345909.db2.gz MKBWIDWPRQQBKG-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001571255189 953345763 /nfs/dbraw/zinc/34/57/63/953345763.db2.gz MKBWIDWPRQQBKG-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001571255189 953345762 /nfs/dbraw/zinc/34/57/62/953345762.db2.gz MKBWIDWPRQQBKG-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM Cn1nnc(C(=O)N2CCC[C@](CO)(Nc3ncccc3-c3nn[n-]n3)C2)n1 ZINC001571255211 953346704 /nfs/dbraw/zinc/34/67/04/953346704.db2.gz MTQCGIWSLDRNPB-HNNXBMFYSA-N -1 3 385.392 -1.136 20 0 GAADHM Cn1nnc(C(=O)N2CCC[C@](CO)(Nc3ncccc3-c3nnn[n-]3)C2)n1 ZINC001571255211 953346700 /nfs/dbraw/zinc/34/67/00/953346700.db2.gz MTQCGIWSLDRNPB-HNNXBMFYSA-N -1 3 385.392 -1.136 20 0 GAADHM Cn1nnc(C(=O)N2CCC[C@@](CO)(Nc3ncccc3-c3nn[n-]n3)C2)n1 ZINC001571255212 953347146 /nfs/dbraw/zinc/34/71/46/953347146.db2.gz MTQCGIWSLDRNPB-OAHLLOKOSA-N -1 3 385.392 -1.136 20 0 GAADHM Cn1nnc(C(=O)N2CCC[C@@](CO)(Nc3ncccc3-c3nnn[n-]3)C2)n1 ZINC001571255212 953347144 /nfs/dbraw/zinc/34/71/44/953347144.db2.gz MTQCGIWSLDRNPB-OAHLLOKOSA-N -1 3 385.392 -1.136 20 0 GAADHM Cn1nnnc1CN1CC2(C1)CN(C(=O)c1ccc(-c3nn[n-]n3)[nH]1)CCO2 ZINC001571255234 953347260 /nfs/dbraw/zinc/34/72/60/953347260.db2.gz NEBPRGPWCHNVHJ-UHFFFAOYSA-N -1 3 385.392 -1.555 20 0 GAADHM Cn1nnnc1CN1CC2(C1)CN(C(=O)c1ccc(-c3nnn[n-]3)[nH]1)CCO2 ZINC001571255234 953347256 /nfs/dbraw/zinc/34/72/56/953347256.db2.gz NEBPRGPWCHNVHJ-UHFFFAOYSA-N -1 3 385.392 -1.555 20 0 GAADHM CO[C@@H]1CN(c2cncc(-c3nn[n-]n3)n2)C[C@H]1NC(=O)Cc1nnc(C)[nH]1 ZINC001571255251 953347284 /nfs/dbraw/zinc/34/72/84/953347284.db2.gz NJYMSDAVMKLXPE-GHMZBOCLSA-N -1 3 385.392 -1.354 20 0 GAADHM CO[C@@H]1CN(c2cncc(-c3nnn[n-]3)n2)C[C@H]1NC(=O)Cc1nnc(C)[nH]1 ZINC001571255251 953347280 /nfs/dbraw/zinc/34/72/80/953347280.db2.gz NJYMSDAVMKLXPE-GHMZBOCLSA-N -1 3 385.392 -1.354 20 0 GAADHM Cc1nn(C)cc1C(=O)N1C[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001571255275 953346573 /nfs/dbraw/zinc/34/65/73/953346573.db2.gz HAZOXBQOBWNIKP-OLZOCXBDSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1nn(C)cc1C(=O)N1C[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001571255275 953346569 /nfs/dbraw/zinc/34/65/69/953346569.db2.gz HAZOXBQOBWNIKP-OLZOCXBDSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)c3c[nH]c(=O)n3C)[C@@H](O)C2)n1 ZINC001571255340 953348222 /nfs/dbraw/zinc/34/82/22/953348222.db2.gz IICXMLUDGMIBQM-PWSUYJOCSA-N -1 3 385.388 -1.011 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)c3c[nH]c(=O)n3C)[C@@H](O)C2)n1 ZINC001571255340 953348219 /nfs/dbraw/zinc/34/82/19/953348219.db2.gz IICXMLUDGMIBQM-PWSUYJOCSA-N -1 3 385.388 -1.011 20 0 GAADHM O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1C[C@H]2CCN(C(=O)[C@H]3CNC(=O)N3)C[C@H]21 ZINC001571255363 953348550 /nfs/dbraw/zinc/34/85/50/953348550.db2.gz ISEIRTJCHVDNPK-GGZOMVNGSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1C[C@H]2CCN(C(=O)[C@H]3CNC(=O)N3)C[C@H]21 ZINC001571255363 953348547 /nfs/dbraw/zinc/34/85/47/953348547.db2.gz ISEIRTJCHVDNPK-GGZOMVNGSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1C[C@H]2CCN(C(=O)[C@@H]3CNC(=O)N3)C[C@H]21 ZINC001571255365 953348539 /nfs/dbraw/zinc/34/85/39/953348539.db2.gz ISEIRTJCHVDNPK-JFUSQASVSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1C[C@H]2CCN(C(=O)[C@@H]3CNC(=O)N3)C[C@H]21 ZINC001571255365 953348534 /nfs/dbraw/zinc/34/85/34/953348534.db2.gz ISEIRTJCHVDNPK-JFUSQASVSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(N[C@@H]1CN(Cc2nnnn2C2CC2)C[C@H]1O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001571255451 953350038 /nfs/dbraw/zinc/35/00/38/953350038.db2.gz QDMVKBZQRMGLJF-VXGBXAGGSA-N -1 3 385.392 -1.509 20 0 GAADHM O=C(N[C@@H]1CN(Cc2nnnn2C2CC2)C[C@H]1O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001571255451 953350035 /nfs/dbraw/zinc/35/00/35/953350035.db2.gz QDMVKBZQRMGLJF-VXGBXAGGSA-N -1 3 385.392 -1.509 20 0 GAADHM O=C(NC[C@H]1CCCN1c1ncccc1-c1nn[n-]n1)[C@@H]1CC(=O)NC(=O)N1 ZINC001571255604 953352704 /nfs/dbraw/zinc/35/27/04/953352704.db2.gz KDIGYNRVBCNLPS-KOLCDFICSA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(NC[C@H]1CCCN1c1ncccc1-c1nnn[n-]1)[C@@H]1CC(=O)NC(=O)N1 ZINC001571255604 953352697 /nfs/dbraw/zinc/35/26/97/953352697.db2.gz KDIGYNRVBCNLPS-KOLCDFICSA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(NC[C@@H]1CCCN1c1ncccc1-c1nn[n-]n1)[C@@H]1CC(=O)NC(=O)N1 ZINC001571255605 953352890 /nfs/dbraw/zinc/35/28/90/953352890.db2.gz KDIGYNRVBCNLPS-ONGXEEELSA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(NC[C@@H]1CCCN1c1ncccc1-c1nnn[n-]1)[C@@H]1CC(=O)NC(=O)N1 ZINC001571255605 953352886 /nfs/dbraw/zinc/35/28/86/953352886.db2.gz KDIGYNRVBCNLPS-ONGXEEELSA-N -1 3 385.388 -1.055 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n(C)c1=O ZINC001571255607 953352022 /nfs/dbraw/zinc/35/20/22/953352022.db2.gz KEMPUAWELCQODX-SECBINFHSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n(C)c1=O ZINC001571255607 953352017 /nfs/dbraw/zinc/35/20/17/953352017.db2.gz KEMPUAWELCQODX-SECBINFHSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n(C)c1=O ZINC001571255609 953352360 /nfs/dbraw/zinc/35/23/60/953352360.db2.gz KEMPUAWELCQODX-VIFPVBQESA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n(C)c1=O ZINC001571255609 953352355 /nfs/dbraw/zinc/35/23/55/953352355.db2.gz KEMPUAWELCQODX-VIFPVBQESA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n(C)c1=O ZINC001571255614 953352723 /nfs/dbraw/zinc/35/27/23/953352723.db2.gz KKOAPTGOECQESQ-SECBINFHSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n(C)c1=O ZINC001571255614 953352716 /nfs/dbraw/zinc/35/27/16/953352716.db2.gz KKOAPTGOECQESQ-SECBINFHSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n(C)c1=O ZINC001571255617 953352617 /nfs/dbraw/zinc/35/26/17/953352617.db2.gz KKOAPTGOECQESQ-VIFPVBQESA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n(C)c1=O ZINC001571255617 953352610 /nfs/dbraw/zinc/35/26/10/953352610.db2.gz KKOAPTGOECQESQ-VIFPVBQESA-N -1 3 385.388 -1.124 20 0 GAADHM CN(C(=O)[C@@H]1CC(=O)NC(=O)N1)[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001571255623 953352070 /nfs/dbraw/zinc/35/20/70/953352070.db2.gz KOZQPUZQJKWTGK-KOLCDFICSA-N -1 3 385.388 -1.103 20 0 GAADHM CN(C(=O)[C@@H]1CC(=O)NC(=O)N1)[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001571255623 953352066 /nfs/dbraw/zinc/35/20/66/953352066.db2.gz KOZQPUZQJKWTGK-KOLCDFICSA-N -1 3 385.388 -1.103 20 0 GAADHM CN(C(=O)[C@@H]1CC(=O)NC(=O)N1)[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001571255625 953351698 /nfs/dbraw/zinc/35/16/98/953351698.db2.gz KOZQPUZQJKWTGK-ONGXEEELSA-N -1 3 385.388 -1.103 20 0 GAADHM CN(C(=O)[C@@H]1CC(=O)NC(=O)N1)[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001571255625 953351693 /nfs/dbraw/zinc/35/16/93/953351693.db2.gz KOZQPUZQJKWTGK-ONGXEEELSA-N -1 3 385.388 -1.103 20 0 GAADHM CO[C@@H]1CN(c2ccc(-c3nnn[n-]3)nn2)C[C@H]1NC(=O)Cc1nnc(C)[nH]1 ZINC001571255652 953352404 /nfs/dbraw/zinc/35/24/04/953352404.db2.gz RJNPXPWLPGDZES-GHMZBOCLSA-N -1 3 385.392 -1.354 20 0 GAADHM O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1CC[C@H]2CN(C(=O)[C@@H]3CNC(=O)N3)C[C@H]21 ZINC001571255678 953351933 /nfs/dbraw/zinc/35/19/33/953351933.db2.gz LGYQYWKYIXAITP-KPXOXKRLSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1CC[C@H]2CN(C(=O)[C@@H]3CNC(=O)N3)C[C@H]21 ZINC001571255678 953351928 /nfs/dbraw/zinc/35/19/28/953351928.db2.gz LGYQYWKYIXAITP-KPXOXKRLSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1CC[C@H]2CN(C(=O)[C@H]3CNC(=O)N3)C[C@H]21 ZINC001571255680 953351611 /nfs/dbraw/zinc/35/16/11/953351611.db2.gz LGYQYWKYIXAITP-XXILOJSOSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1CC[C@H]2CN(C(=O)[C@H]3CNC(=O)N3)C[C@H]21 ZINC001571255680 953351604 /nfs/dbraw/zinc/35/16/04/953351604.db2.gz LGYQYWKYIXAITP-XXILOJSOSA-N -1 3 385.388 -1.451 20 0 GAADHM Cn1cc(CC(=O)N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)cn1 ZINC001571255691 953353252 /nfs/dbraw/zinc/35/32/52/953353252.db2.gz LJJLSSRNEDGLKK-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1cc(CC(=O)N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)cn1 ZINC001571255691 953353242 /nfs/dbraw/zinc/35/32/42/953353242.db2.gz LJJLSSRNEDGLKK-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cc1ncn(C)c1C(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O ZINC001571255753 953353580 /nfs/dbraw/zinc/35/35/80/953353580.db2.gz MOOWHBIQORFKFU-NEPJUHHUSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1ncn(C)c1C(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O ZINC001571255753 953353575 /nfs/dbraw/zinc/35/35/75/953353575.db2.gz MOOWHBIQORFKFU-NEPJUHHUSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cn1cnnn1)N1CCCO[C@H](CNc2ncccc2-c2nn[n-]n2)C1 ZINC001571255934 953360588 /nfs/dbraw/zinc/36/05/88/953360588.db2.gz WSXRRQVHWXZGNP-LLVKDONJSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1cnnn1)N1CCCO[C@H](CNc2ncccc2-c2nnn[n-]2)C1 ZINC001571255934 953360579 /nfs/dbraw/zinc/36/05/79/953360579.db2.gz WSXRRQVHWXZGNP-LLVKDONJSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1cnnn1)N1CCCO[C@@H](CNc2ncccc2-c2nn[n-]n2)C1 ZINC001571255936 953359929 /nfs/dbraw/zinc/35/99/29/953359929.db2.gz WSXRRQVHWXZGNP-NSHDSACASA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1cnnn1)N1CCCO[C@@H](CNc2ncccc2-c2nnn[n-]2)C1 ZINC001571255936 953359923 /nfs/dbraw/zinc/35/99/23/953359923.db2.gz WSXRRQVHWXZGNP-NSHDSACASA-N -1 3 385.392 -1.022 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n(C)c1=O ZINC001571255970 953360563 /nfs/dbraw/zinc/36/05/63/953360563.db2.gz NJVXIIDFLSJISF-SNVBAGLBSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n(C)c1=O ZINC001571255970 953360555 /nfs/dbraw/zinc/36/05/55/953360555.db2.gz NJVXIIDFLSJISF-SNVBAGLBSA-N -1 3 385.388 -1.124 20 0 GAADHM Cc1ccnn1CC(=O)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001571255993 953359438 /nfs/dbraw/zinc/35/94/38/953359438.db2.gz NTASJEUDMULGKZ-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccnn1CC(=O)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001571255993 953359433 /nfs/dbraw/zinc/35/94/33/953359433.db2.gz NTASJEUDMULGKZ-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccnn1CC(=O)N1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001571255994 953359301 /nfs/dbraw/zinc/35/93/01/953359301.db2.gz NTASJEUDMULGKZ-OLZOCXBDSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccnn1CC(=O)N1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001571255994 953359293 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945915235 /nfs/dbraw/zinc/91/52/35/945915235.db2.gz CKQLEKXQXTXXII-XXILOJSOSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1O)[C@H]1CCC(=O)NC1 ZINC001571285389 945915227 /nfs/dbraw/zinc/91/52/27/945915227.db2.gz CKQLEKXQXTXXII-XXILOJSOSA-N -1 3 388.388 -1.978 20 0 GAADHM CN1C(=O)CC[C@H]1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001571285405 945915295 /nfs/dbraw/zinc/91/52/95/945915295.db2.gz CRJICCWOZRQBJZ-GRYCIOLGSA-N -1 3 388.388 -1.883 20 0 GAADHM CN1C(=O)CC[C@H]1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001571285405 945915286 /nfs/dbraw/zinc/91/52/86/945915286.db2.gz CRJICCWOZRQBJZ-GRYCIOLGSA-N -1 3 388.388 -1.883 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CN(c3ncc(-c4nn[n-]n4)cc3F)C[C@@H]2O)c1N ZINC001571285410 945914814 /nfs/dbraw/zinc/91/48/14/945914814.db2.gz CWKCMZVETPAAEI-MNOVXSKESA-N -1 3 388.367 -1.304 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CN(c3ncc(-c4nnn[n-]4)cc3F)C[C@@H]2O)c1N ZINC001571285410 945914804 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GAADHM Cn1cnc(C(=O)N[C@H]2CCN(c3ncc(-c4nnn[n-]4)cc3F)C[C@@H]2O)n1 ZINC001571285606 945923385 /nfs/dbraw/zinc/92/33/85/945923385.db2.gz JUEDNYXMYMUJNE-QWRGUYRKSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]2O)n1 ZINC001571285607 945922665 /nfs/dbraw/zinc/92/26/65/945922665.db2.gz JUEDNYXMYMUJNE-WDEREUQCSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]2O)n1 ZINC001571285607 945922663 /nfs/dbraw/zinc/92/26/63/945922663.db2.gz JUEDNYXMYMUJNE-WDEREUQCSA-N -1 3 388.367 -1.101 20 0 GAADHM CO[C@@H]1CN(C(=O)[C@H]2CCC(=O)N2)C[C@H]1NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001571285610 945923440 /nfs/dbraw/zinc/92/34/40/945923440.db2.gz JWVHUYGJSXARPJ-YUSALJHKSA-N -1 3 388.388 -1.571 20 0 GAADHM CO[C@@H]1CN(C(=O)[C@H]2CCC(=O)N2)C[C@H]1NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001571285610 945923426 /nfs/dbraw/zinc/92/34/26/945923426.db2.gz JWVHUYGJSXARPJ-YUSALJHKSA-N -1 3 388.388 -1.571 20 0 GAADHM 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Cn1cc(C(=O)N[C@H]2CCN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]2O)nn1 ZINC001571285724 945926072 /nfs/dbraw/zinc/92/60/72/945926072.db2.gz MKZIIKIRQYJCSQ-CMPLNLGQSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(c3ncc(-c4nn[n-]n4)cc3F)C[C@@H]2O)nn1 ZINC001571285725 945926254 /nfs/dbraw/zinc/92/62/54/945926254.db2.gz MKZIIKIRQYJCSQ-JQWIXIFHSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(c3ncc(-c4nnn[n-]4)cc3F)C[C@@H]2O)nn1 ZINC001571285725 945926247 /nfs/dbraw/zinc/92/62/47/945926247.db2.gz MKZIIKIRQYJCSQ-JQWIXIFHSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(c3ncc(-c4nn[n-]n4)cc3F)C[C@@H]2O)nn1 ZINC001571285726 945924778 /nfs/dbraw/zinc/92/47/78/945924778.db2.gz MKZIIKIRQYJCSQ-PWSUYJOCSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(c3ncc(-c4nnn[n-]4)cc3F)C[C@@H]2O)nn1 ZINC001571285726 945924773 /nfs/dbraw/zinc/92/47/73/945924773.db2.gz MKZIIKIRQYJCSQ-PWSUYJOCSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]2O)nn1 ZINC001571285727 945925356 /nfs/dbraw/zinc/92/53/56/945925356.db2.gz MKZIIKIRQYJCSQ-ZYHUDNBSSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]2O)nn1 ZINC001571285727 945925352 /nfs/dbraw/zinc/92/53/52/945925352.db2.gz MKZIIKIRQYJCSQ-ZYHUDNBSSA-N -1 3 388.367 -1.101 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O)[C@H]1CCC(=O)NC1 ZINC001571285754 945925633 /nfs/dbraw/zinc/92/56/33/945925633.db2.gz MXOIYVOHFNMBNC-AXTRIDKLSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O)[C@H]1CCC(=O)NC1 ZINC001571285754 945925624 /nfs/dbraw/zinc/92/56/24/945925624.db2.gz MXOIYVOHFNMBNC-AXTRIDKLSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O)[C@@H]1CCC(=O)NC1 ZINC001571285755 945924866 /nfs/dbraw/zinc/92/48/66/945924866.db2.gz MXOIYVOHFNMBNC-FXAINCCUSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O)[C@@H]1CCC(=O)NC1 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LONSUYPTZCRRKO-NXEZZACHSA-N -1 3 392.445 -1.080 20 0 GAADHM O=C(CN1CCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)CC1)NC1CC1 ZINC001571310835 946479204 /nfs/dbraw/zinc/47/92/04/946479204.db2.gz NXTVAFSVJKGVAV-UHFFFAOYSA-N -1 3 392.445 -1.153 20 0 GAADHM O=C(CN1CCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)CC1)NC1CC1 ZINC001571310835 946479189 /nfs/dbraw/zinc/47/91/89/946479189.db2.gz NXTVAFSVJKGVAV-UHFFFAOYSA-N -1 3 392.445 -1.153 20 0 GAADHM CN1C[C@H](C(=O)N[C@@H]2CN(Cc3ccc(-c4nn[n-]n4)s3)C[C@H]2O)NC1=O ZINC001571311049 946483188 /nfs/dbraw/zinc/48/31/88/946483188.db2.gz QQCTVARRFFZGEH-GMTAPVOTSA-N -1 3 392.445 -1.387 20 0 GAADHM CN1C[C@H](C(=O)N[C@@H]2CN(Cc3ccc(-c4nnn[n-]4)s3)C[C@H]2O)NC1=O ZINC001571311049 946483183 /nfs/dbraw/zinc/48/31/83/946483183.db2.gz QQCTVARRFFZGEH-GMTAPVOTSA-N -1 3 392.445 -1.387 20 0 GAADHM CN1C[C@@H](C(=O)N[C@@H]2CN(Cc3ccc(-c4nn[n-]n4)s3)C[C@H]2O)NC1=O ZINC001571311050 946482981 /nfs/dbraw/zinc/48/29/81/946482981.db2.gz QQCTVARRFFZGEH-OUAUKWLOSA-N -1 3 392.445 -1.387 20 0 GAADHM CN1C[C@@H](C(=O)N[C@@H]2CN(Cc3ccc(-c4nnn[n-]4)s3)C[C@H]2O)NC1=O ZINC001571311050 946482973 /nfs/dbraw/zinc/48/29/73/946482973.db2.gz QQCTVARRFFZGEH-OUAUKWLOSA-N -1 3 392.445 -1.387 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)C[C@@H]3CCNC3=O)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001571311164 946482888 /nfs/dbraw/zinc/48/28/88/946482888.db2.gz SGBNBNYNFNHURC-AEJSXWLSSA-N -1 3 392.445 -1.176 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)C[C@H]3CCNC3=O)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001571311167 946483330 /nfs/dbraw/zinc/48/33/30/946483330.db2.gz SGBNBNYNFNHURC-BBBLOLIVSA-N -1 3 392.445 -1.176 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@H](NC(=O)[C@H]3CCS(=O)(=O)N3)C2)n1 ZINC001571311250 946485359 /nfs/dbraw/zinc/48/53/59/946485359.db2.gz UOYJPIJNJDSIRS-CMPLNLGQSA-N -1 3 392.445 -1.043 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@H](NC(=O)[C@H]3CCS(=O)(=O)N3)C2)n1 ZINC001571311250 946485354 /nfs/dbraw/zinc/48/53/54/946485354.db2.gz UOYJPIJNJDSIRS-CMPLNLGQSA-N -1 3 392.445 -1.043 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@H](NC(=O)[C@@H]3CCS(=O)(=O)N3)C2)n1 ZINC001571311252 946485643 /nfs/dbraw/zinc/48/56/43/946485643.db2.gz UOYJPIJNJDSIRS-JQWIXIFHSA-N -1 3 392.445 -1.043 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@H](NC(=O)[C@@H]3CCS(=O)(=O)N3)C2)n1 ZINC001571311252 946485636 /nfs/dbraw/zinc/48/56/36/946485636.db2.gz UOYJPIJNJDSIRS-JQWIXIFHSA-N -1 3 392.445 -1.043 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@H](NC(=O)[C@@H]3CCS(=O)(=O)N3)C2)n1 ZINC001571311254 946484859 /nfs/dbraw/zinc/48/48/59/946484859.db2.gz UOYJPIJNJDSIRS-PWSUYJOCSA-N -1 3 392.445 -1.043 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@H](NC(=O)[C@@H]3CCS(=O)(=O)N3)C2)n1 ZINC001571311254 946484851 /nfs/dbraw/zinc/48/48/51/946484851.db2.gz UOYJPIJNJDSIRS-PWSUYJOCSA-N -1 3 392.445 -1.043 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@H](NC(=O)[C@H]3CCS(=O)(=O)N3)C2)n1 ZINC001571311256 946485096 /nfs/dbraw/zinc/48/50/96/946485096.db2.gz UOYJPIJNJDSIRS-ZYHUDNBSSA-N -1 3 392.445 -1.043 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@H](NC(=O)[C@H]3CCS(=O)(=O)N3)C2)n1 ZINC001571311256 946485093 /nfs/dbraw/zinc/48/50/93/946485093.db2.gz UOYJPIJNJDSIRS-ZYHUDNBSSA-N -1 3 392.445 -1.043 20 0 GAADHM O=C(N[C@@H]1CN(Cc2cccc(-c3nn[n-]n3)c2)C[C@H]1O)C1CS(=O)(=O)C1 ZINC001571311468 946487737 /nfs/dbraw/zinc/48/77/37/946487737.db2.gz YFWJDCUFZJAVIS-ZIAGYGMSSA-N -1 3 392.441 -1.427 20 0 GAADHM O=C(N[C@@H]1CN(Cc2cccc(-c3nnn[n-]3)c2)C[C@H]1O)C1CS(=O)(=O)C1 ZINC001571311468 946487732 /nfs/dbraw/zinc/48/77/32/946487732.db2.gz YFWJDCUFZJAVIS-ZIAGYGMSSA-N -1 3 392.441 -1.427 20 0 GAADHM O=C(N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2Cl)C[C@@H]1O)[C@H]1CCC(=O)N1 ZINC001571317334 946605910 /nfs/dbraw/zinc/60/59/10/946605910.db2.gz DEYGIWBINRURAA-MXWKQRLJSA-N -1 3 392.807 -1.141 20 0 GAADHM O=C(N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2Cl)C[C@@H]1O)[C@H]1CCC(=O)N1 ZINC001571317334 946605904 /nfs/dbraw/zinc/60/59/04/946605904.db2.gz DEYGIWBINRURAA-MXWKQRLJSA-N -1 3 392.807 -1.141 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC(CCO)(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573387816 947912886 /nfs/dbraw/zinc/91/28/86/947912886.db2.gz DPUZYVYPQYIBLF-UHFFFAOYSA-N -1 3 390.404 -1.634 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC(CCO)(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573387816 947912880 /nfs/dbraw/zinc/91/28/80/947912880.db2.gz DPUZYVYPQYIBLF-UHFFFAOYSA-N -1 3 390.404 -1.634 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@H](O)CN(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001573387845 947913228 /nfs/dbraw/zinc/91/32/28/947913228.db2.gz FCTXGCFMDLEQSJ-CYBMUJFWSA-N -1 3 376.421 -1.005 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@H](O)CN(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001573387845 947913220 /nfs/dbraw/zinc/91/32/20/947913220.db2.gz FCTXGCFMDLEQSJ-CYBMUJFWSA-N -1 3 376.421 -1.005 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@@H](O)CN(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001573387850 947912356 /nfs/dbraw/zinc/91/23/56/947912356.db2.gz FCTXGCFMDLEQSJ-ZDUSSCGKSA-N -1 3 376.421 -1.005 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@@H](O)CN(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001573387850 947912350 /nfs/dbraw/zinc/91/23/50/947912350.db2.gz FCTXGCFMDLEQSJ-ZDUSSCGKSA-N -1 3 376.421 -1.005 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC(O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573388307 947918175 /nfs/dbraw/zinc/91/81/75/947918175.db2.gz KTPSHNTZCHLIJW-UHFFFAOYSA-N -1 3 376.377 -2.024 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC(O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573388307 947918173 /nfs/dbraw/zinc/91/81/73/947918173.db2.gz KTPSHNTZCHLIJW-UHFFFAOYSA-N -1 3 376.377 -2.024 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC(O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573388388 947919466 /nfs/dbraw/zinc/91/94/66/947919466.db2.gz LXOKNMANZKFTKO-UHFFFAOYSA-N -1 3 376.377 -2.024 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC(O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573388388 947919462 /nfs/dbraw/zinc/91/94/62/947919462.db2.gz LXOKNMANZKFTKO-UHFFFAOYSA-N -1 3 376.377 -2.024 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC(CCO)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573388608 947921225 /nfs/dbraw/zinc/92/12/25/947921225.db2.gz MNTNWLUAURCGCX-UHFFFAOYSA-N -1 3 390.404 -1.634 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC(CCO)(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573388608 947921216 /nfs/dbraw/zinc/92/12/16/947921216.db2.gz MNTNWLUAURCGCX-UHFFFAOYSA-N -1 3 390.404 -1.634 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC(O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573388634 947920249 /nfs/dbraw/zinc/92/02/49/947920249.db2.gz NEZOEJIJOIWREU-UHFFFAOYSA-N -1 3 376.377 -2.024 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC(O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573388634 947920245 /nfs/dbraw/zinc/92/02/45/947920245.db2.gz NEZOEJIJOIWREU-UHFFFAOYSA-N -1 3 376.377 -2.024 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@@H](O)CN(C)c1ncccc1-c1nn[n-]n1 ZINC001573388666 947920811 /nfs/dbraw/zinc/92/08/11/947920811.db2.gz NMVODTHADHWEPV-GFCCVEGCSA-N -1 3 376.421 -1.005 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@@H](O)CN(C)c1ncccc1-c1nnn[n-]1 ZINC001573388666 947920804 /nfs/dbraw/zinc/92/08/04/947920804.db2.gz NMVODTHADHWEPV-GFCCVEGCSA-N -1 3 376.421 -1.005 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@H](O)CN(C)c1ncccc1-c1nn[n-]n1 ZINC001573388667 947920398 /nfs/dbraw/zinc/92/03/98/947920398.db2.gz NMVODTHADHWEPV-LBPRGKRZSA-N -1 3 376.421 -1.005 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@H](O)CN(C)c1ncccc1-c1nnn[n-]1 ZINC001573388667 947920394 /nfs/dbraw/zinc/92/03/94/947920394.db2.gz NMVODTHADHWEPV-LBPRGKRZSA-N -1 3 376.421 -1.005 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)CCOCCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573389096 947922606 /nfs/dbraw/zinc/92/26/06/947922606.db2.gz PWIJRABKWSKATR-UHFFFAOYSA-N -1 3 392.420 -1.122 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)CCOCCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573389096 947922602 /nfs/dbraw/zinc/92/26/02/947922602.db2.gz PWIJRABKWSKATR-UHFFFAOYSA-N -1 3 392.420 -1.122 20 0 GAADHM CC(=O)N(C)CC(=O)N(CCO)CCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001573389110 947924610 /nfs/dbraw/zinc/92/46/10/947924610.db2.gz QEYUIJPCYMPNEG-UHFFFAOYSA-N -1 3 378.393 -1.776 20 0 GAADHM CC(=O)N(C)CC(=O)N(CCO)CCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001573389110 947924606 /nfs/dbraw/zinc/92/46/06/947924606.db2.gz QEYUIJPCYMPNEG-UHFFFAOYSA-N -1 3 378.393 -1.776 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@@H](O)CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001573389509 947924478 /nfs/dbraw/zinc/92/44/78/947924478.db2.gz RWKKXQBQIMEZHB-GFCCVEGCSA-N -1 3 392.420 -1.436 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@@H](O)CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001573389509 947924474 /nfs/dbraw/zinc/92/44/74/947924474.db2.gz RWKKXQBQIMEZHB-GFCCVEGCSA-N -1 3 392.420 -1.436 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@H](O)CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001573389512 947923924 /nfs/dbraw/zinc/92/39/24/947923924.db2.gz RWKKXQBQIMEZHB-LBPRGKRZSA-N -1 3 392.420 -1.436 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@H](O)CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001573389512 947923917 /nfs/dbraw/zinc/92/39/17/947923917.db2.gz RWKKXQBQIMEZHB-LBPRGKRZSA-N -1 3 392.420 -1.436 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@@H](O)CN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573389549 947926681 /nfs/dbraw/zinc/92/66/81/947926681.db2.gz SLFJKXAUJQJXCW-LLVKDONJSA-N -1 3 392.420 -1.436 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@@H](O)CN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573389549 947926678 /nfs/dbraw/zinc/92/66/78/947926678.db2.gz SLFJKXAUJQJXCW-LLVKDONJSA-N -1 3 392.420 -1.436 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@H](O)CN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573389551 947926641 /nfs/dbraw/zinc/92/66/41/947926641.db2.gz SLFJKXAUJQJXCW-NSHDSACASA-N -1 3 392.420 -1.436 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@H](O)CN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573389551 947926640 /nfs/dbraw/zinc/92/66/40/947926640.db2.gz SLFJKXAUJQJXCW-NSHDSACASA-N -1 3 392.420 -1.436 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001573389950 947926213 /nfs/dbraw/zinc/92/62/13/947926213.db2.gz VOTURJULTZZQQQ-LLVKDONJSA-N -1 3 378.393 -1.778 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001573389950 947926205 /nfs/dbraw/zinc/92/62/05/947926205.db2.gz VOTURJULTZZQQQ-LLVKDONJSA-N -1 3 378.393 -1.778 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001573389952 947925836 /nfs/dbraw/zinc/92/58/36/947925836.db2.gz VOTURJULTZZQQQ-NSHDSACASA-N -1 3 378.393 -1.778 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001573389952 947925830 /nfs/dbraw/zinc/92/58/30/947925830.db2.gz VOTURJULTZZQQQ-NSHDSACASA-N -1 3 378.393 -1.778 20 0 GAADHM CC(=O)N(C)CC(=O)N(CCO)CCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573390015 947928824 /nfs/dbraw/zinc/92/88/24/947928824.db2.gz VVPQRMKKJKDRMU-UHFFFAOYSA-N -1 3 378.393 -1.776 20 0 GAADHM CC(=O)N(C)CC(=O)N(CCO)CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573390015 947928820 /nfs/dbraw/zinc/92/88/20/947928820.db2.gz VVPQRMKKJKDRMU-UHFFFAOYSA-N -1 3 378.393 -1.776 20 0 GAADHM CC(=O)N(C)CC(=O)N(CCO)CCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001573390093 947927693 /nfs/dbraw/zinc/92/76/93/947927693.db2.gz WGVXIYKFAWTCCK-UHFFFAOYSA-N -1 3 378.393 -1.776 20 0 GAADHM CC(=O)N(C)CC(=O)N(CCO)CCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001573390093 947927684 /nfs/dbraw/zinc/92/76/84/947927684.db2.gz WGVXIYKFAWTCCK-UHFFFAOYSA-N -1 3 378.393 -1.776 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@H](O)CN(C)c1ccc(-c2nn[n-]n2)nc1 ZINC001573390200 947927424 /nfs/dbraw/zinc/92/74/24/947927424.db2.gz XEDOYQLFOWGHAA-CYBMUJFWSA-N -1 3 376.421 -1.005 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@H](O)CN(C)c1ccc(-c2nnn[n-]2)nc1 ZINC001573390200 947927416 /nfs/dbraw/zinc/92/74/16/947927416.db2.gz XEDOYQLFOWGHAA-CYBMUJFWSA-N -1 3 376.421 -1.005 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@@H](O)CN(C)c1ccc(-c2nn[n-]n2)nc1 ZINC001573390203 947928456 /nfs/dbraw/zinc/92/84/56/947928456.db2.gz XEDOYQLFOWGHAA-ZDUSSCGKSA-N -1 3 376.421 -1.005 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)C[C@@H](O)CN(C)c1ccc(-c2nnn[n-]2)nc1 ZINC001573390203 947928449 /nfs/dbraw/zinc/92/84/49/947928449.db2.gz XEDOYQLFOWGHAA-ZDUSSCGKSA-N -1 3 376.421 -1.005 20 0 GAADHM CC(=O)N(C)CC(=O)N1CCOC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573390706 947931447 /nfs/dbraw/zinc/93/14/47/947931447.db2.gz AQHDBVCVSLMGJP-LLVKDONJSA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)N1CCOC[C@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573390706 947931443 /nfs/dbraw/zinc/93/14/43/947931443.db2.gz AQHDBVCVSLMGJP-LLVKDONJSA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)N1CCOC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573390707 947931255 /nfs/dbraw/zinc/93/12/55/947931255.db2.gz AQHDBVCVSLMGJP-NSHDSACASA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)N1CCOC[C@@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573390707 947931250 /nfs/dbraw/zinc/93/12/50/947931250.db2.gz AQHDBVCVSLMGJP-NSHDSACASA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)N1CCO[C@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573390748 947932148 /nfs/dbraw/zinc/93/21/48/947932148.db2.gz BXTIFDZZWAAQEL-LLVKDONJSA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)N1CCO[C@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573390748 947932147 /nfs/dbraw/zinc/93/21/47/947932147.db2.gz BXTIFDZZWAAQEL-LLVKDONJSA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)N1CCO[C@@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573390749 947931493 /nfs/dbraw/zinc/93/14/93/947931493.db2.gz BXTIFDZZWAAQEL-NSHDSACASA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)N1CCO[C@@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573390749 947931487 /nfs/dbraw/zinc/93/14/87/947931487.db2.gz BXTIFDZZWAAQEL-NSHDSACASA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)N1CCOC[C@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001573391955 947937812 /nfs/dbraw/zinc/93/78/12/947937812.db2.gz MREXLRAGGWOFJE-GFCCVEGCSA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)N1CCOC[C@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001573391955 947937804 /nfs/dbraw/zinc/93/78/04/947937804.db2.gz MREXLRAGGWOFJE-GFCCVEGCSA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)N1CCOC[C@@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001573391956 947937458 /nfs/dbraw/zinc/93/74/58/947937458.db2.gz MREXLRAGGWOFJE-LBPRGKRZSA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)N1CCOC[C@@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001573391956 947937456 /nfs/dbraw/zinc/93/74/56/947937456.db2.gz MREXLRAGGWOFJE-LBPRGKRZSA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)N1CCO[C@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573391974 947940115 /nfs/dbraw/zinc/94/01/15/947940115.db2.gz NMVPBAWKSLXGFR-GFCCVEGCSA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)N1CCO[C@H](CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573391974 947940110 /nfs/dbraw/zinc/94/01/10/947940110.db2.gz NMVPBAWKSLXGFR-GFCCVEGCSA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)N1CCO[C@@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573391975 947940415 /nfs/dbraw/zinc/94/04/15/947940415.db2.gz NMVPBAWKSLXGFR-LBPRGKRZSA-N -1 3 390.404 -1.370 20 0 GAADHM 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CC(=O)N(C)CC(=O)N1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001573393423 947956964 /nfs/dbraw/zinc/95/69/64/947956964.db2.gz MGWFPQBNXVDBRJ-GWCFXTLKSA-N -1 3 390.404 -1.635 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1 ZINC001573393424 947956721 /nfs/dbraw/zinc/95/67/21/947956721.db2.gz MGWFPQBNXVDBRJ-GXFFZTMASA-N -1 3 390.404 -1.635 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H](O)C1 ZINC001573393424 947956715 /nfs/dbraw/zinc/95/67/15/947956715.db2.gz MGWFPQBNXVDBRJ-GXFFZTMASA-N -1 3 390.404 -1.635 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001573393425 947957377 /nfs/dbraw/zinc/95/73/77/947957377.db2.gz MGWFPQBNXVDBRJ-MFKMUULPSA-N -1 3 390.404 -1.635 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001573393425 947957369 /nfs/dbraw/zinc/95/73/69/947957369.db2.gz MGWFPQBNXVDBRJ-MFKMUULPSA-N -1 3 390.404 -1.635 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1 ZINC001573393426 947956886 /nfs/dbraw/zinc/95/68/86/947956886.db2.gz MGWFPQBNXVDBRJ-ZWNOBZJWSA-N -1 3 390.404 -1.635 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H](O)C1 ZINC001573393426 947956881 /nfs/dbraw/zinc/95/68/81/947956881.db2.gz MGWFPQBNXVDBRJ-ZWNOBZJWSA-N -1 3 390.404 -1.635 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001573395173 947967526 /nfs/dbraw/zinc/96/75/26/947967526.db2.gz XJGQKZLGRIIGRF-AAEUAGOBSA-N -1 3 390.404 -1.635 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001573395173 947967521 /nfs/dbraw/zinc/96/75/21/947967521.db2.gz XJGQKZLGRIIGRF-AAEUAGOBSA-N -1 3 390.404 -1.635 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@H](O)C1 ZINC001573395177 947968079 /nfs/dbraw/zinc/96/80/79/947968079.db2.gz XJGQKZLGRIIGRF-DGCLKSJQSA-N -1 3 390.404 -1.635 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@H](O)C1 ZINC001573395177 947968070 /nfs/dbraw/zinc/96/80/70/947968070.db2.gz XJGQKZLGRIIGRF-DGCLKSJQSA-N -1 3 390.404 -1.635 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@H](O)C1 ZINC001573395216 947967734 /nfs/dbraw/zinc/96/77/34/947967734.db2.gz XJGQKZLGRIIGRF-WCQYABFASA-N -1 3 390.404 -1.635 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@H](O)C1 ZINC001573395216 947967724 /nfs/dbraw/zinc/96/77/24/947967724.db2.gz XJGQKZLGRIIGRF-WCQYABFASA-N -1 3 390.404 -1.635 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001573395219 947969003 /nfs/dbraw/zinc/96/90/03/947969003.db2.gz XJGQKZLGRIIGRF-YPMHNXCESA-N -1 3 390.404 -1.635 20 0 GAADHM CC(=O)N(C)CC(=O)N1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001573395219 947968994 /nfs/dbraw/zinc/96/89/94/947968994.db2.gz XJGQKZLGRIIGRF-YPMHNXCESA-N -1 3 390.404 -1.635 20 0 GAADHM 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CC(=O)N(C)CC(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCO1 ZINC001573405430 948041687 /nfs/dbraw/zinc/04/16/87/948041687.db2.gz QFNMPAIIRDEUON-LBPRGKRZSA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCO1 ZINC001573405430 948041683 /nfs/dbraw/zinc/04/16/83/948041683.db2.gz QFNMPAIIRDEUON-LBPRGKRZSA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)NC[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1 ZINC001573405516 948044690 /nfs/dbraw/zinc/04/46/90/948044690.db2.gz SHROZKPMWQYOCM-GFCCVEGCSA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)NC[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1 ZINC001573405516 948044683 /nfs/dbraw/zinc/04/46/83/948044683.db2.gz SHROZKPMWQYOCM-GFCCVEGCSA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)NC[C@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1 ZINC001573405518 948043692 /nfs/dbraw/zinc/04/36/92/948043692.db2.gz SHROZKPMWQYOCM-LBPRGKRZSA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)NC[C@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1 ZINC001573405518 948043684 /nfs/dbraw/zinc/04/36/84/948043684.db2.gz SHROZKPMWQYOCM-LBPRGKRZSA-N -1 3 390.404 -1.370 20 0 GAADHM CC(=O)N(C)CC(=O)NCCN1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001573405855 948049643 /nfs/dbraw/zinc/04/96/43/948049643.db2.gz XTHRXCJJHSAPBX-UHFFFAOYSA-N -1 3 387.448 -1.022 20 0 GAADHM CC(=O)N(C)CC(=O)NCCN1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001573405855 948049637 /nfs/dbraw/zinc/04/96/37/948049637.db2.gz XTHRXCJJHSAPBX-UHFFFAOYSA-N -1 3 387.448 -1.022 20 0 GAADHM CC(=O)N(C)CC(=O)NCCN1CCN(c2ccc(-c3nnn[n-]3)nn2)CC1 ZINC001573405898 948049332 /nfs/dbraw/zinc/04/93/32/948049332.db2.gz YDZWZZFTFFZFGG-UHFFFAOYSA-N -1 3 388.436 -1.627 20 0 GAADHM CC(=O)N(C)CC(=O)N[C@@H]1CN(c2snc(C)c2-c2nnn[n-]2)C[C@H]1O ZINC001573406364 948051523 /nfs/dbraw/zinc/05/15/23/948051523.db2.gz BNRYWBLGEIUVSV-NXEZZACHSA-N -1 3 380.434 -1.224 20 0 GAADHM CC(=O)N(C)CC(=O)N[C@@H]1CN(c2snc(C)c2-c2nnn[n-]2)C[C@@H]1O ZINC001573406365 948051688 /nfs/dbraw/zinc/05/16/88/948051688.db2.gz BNRYWBLGEIUVSV-ZJUUUORDSA-N -1 3 380.434 -1.224 20 0 GAADHM CC(=O)N(C)CC(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001573406386 948051421 /nfs/dbraw/zinc/05/14/21/948051421.db2.gz CXIWHNNRMFNAKN-NEPJUHHUSA-N -1 3 378.368 -1.455 20 0 GAADHM CC(=O)N(C)CC(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001573406386 948051415 /nfs/dbraw/zinc/05/14/15/948051415.db2.gz CXIWHNNRMFNAKN-NEPJUHHUSA-N -1 3 378.368 -1.455 20 0 GAADHM CC(=O)N(C)CC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O ZINC001573406436 948053212 /nfs/dbraw/zinc/05/32/12/948053212.db2.gz IJNMVSIKQUVZFI-NEPJUHHUSA-N -1 3 376.377 -2.025 20 0 GAADHM CC(=O)N(C)CC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O ZINC001573406436 948053201 /nfs/dbraw/zinc/05/32/01/948053201.db2.gz IJNMVSIKQUVZFI-NEPJUHHUSA-N -1 3 376.377 -2.025 20 0 GAADHM CC(=O)N(C)CC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O ZINC001573406437 948052722 /nfs/dbraw/zinc/05/27/22/948052722.db2.gz IJNMVSIKQUVZFI-VXGBXAGGSA-N -1 3 376.377 -2.025 20 0 GAADHM CC(=O)N(C)CC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O ZINC001573406437 948052712 /nfs/dbraw/zinc/05/27/12/948052712.db2.gz IJNMVSIKQUVZFI-VXGBXAGGSA-N -1 3 376.377 -2.025 20 0 GAADHM CC(=O)N(C)CC(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O ZINC001573406580 948055638 /nfs/dbraw/zinc/05/56/38/948055638.db2.gz MAEAQCVDVOOXGE-NEPJUHHUSA-N -1 3 376.377 -2.025 20 0 GAADHM CC(=O)N(C)CC(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O ZINC001573406580 948055632 /nfs/dbraw/zinc/05/56/32/948055632.db2.gz MAEAQCVDVOOXGE-NEPJUHHUSA-N -1 3 376.377 -2.025 20 0 GAADHM CC(=O)N(C)CC(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O ZINC001573406581 948055562 /nfs/dbraw/zinc/05/55/62/948055562.db2.gz MAEAQCVDVOOXGE-VXGBXAGGSA-N -1 3 376.377 -2.025 20 0 GAADHM CC(=O)N(C)CC(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O ZINC001573406581 948055555 /nfs/dbraw/zinc/05/55/55/948055555.db2.gz MAEAQCVDVOOXGE-VXGBXAGGSA-N -1 3 376.377 -2.025 20 0 GAADHM CC(=O)N(C)CC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O ZINC001573406808 948057070 /nfs/dbraw/zinc/05/70/70/948057070.db2.gz VCWQTVWKDOXSJA-NEPJUHHUSA-N -1 3 376.377 -2.025 20 0 GAADHM CC(=O)N(C)CC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O ZINC001573406808 948057063 /nfs/dbraw/zinc/05/70/63/948057063.db2.gz VCWQTVWKDOXSJA-NEPJUHHUSA-N -1 3 376.377 -2.025 20 0 GAADHM CC(=O)N(C)CC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1O ZINC001573406809 948058149 /nfs/dbraw/zinc/05/81/49/948058149.db2.gz VCWQTVWKDOXSJA-VXGBXAGGSA-N -1 3 376.377 -2.025 20 0 GAADHM CC(=O)N(C)CC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1O ZINC001573406809 948058141 /nfs/dbraw/zinc/05/81/41/948058141.db2.gz VCWQTVWKDOXSJA-VXGBXAGGSA-N -1 3 376.377 -2.025 20 0 GAADHM CC(=O)N(C)CCCC(=O)N[C@@H](CO)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573408110 948062040 /nfs/dbraw/zinc/06/20/40/948062040.db2.gz BHBHJNBBXVCEDQ-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)N[C@@H](CO)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573408110 948062030 /nfs/dbraw/zinc/06/20/30/948062030.db2.gz BHBHJNBBXVCEDQ-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)N[C@H](CO)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573408115 948062246 /nfs/dbraw/zinc/06/22/46/948062246.db2.gz BHBHJNBBXVCEDQ-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)N[C@H](CO)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573408115 948062239 /nfs/dbraw/zinc/06/22/39/948062239.db2.gz BHBHJNBBXVCEDQ-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001573408168 948063726 /nfs/dbraw/zinc/06/37/26/948063726.db2.gz COKPDPICFTYBMJ-GFCCVEGCSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001573408168 948063717 /nfs/dbraw/zinc/06/37/17/948063717.db2.gz COKPDPICFTYBMJ-GFCCVEGCSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)N[C@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001573408170 948061725 /nfs/dbraw/zinc/06/17/25/948061725.db2.gz COKPDPICFTYBMJ-LBPRGKRZSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)N[C@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001573408170 948061723 /nfs/dbraw/zinc/06/17/23/948061723.db2.gz COKPDPICFTYBMJ-LBPRGKRZSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001573408196 948064569 /nfs/dbraw/zinc/06/45/69/948064569.db2.gz DEXFXJUIYSTDPZ-GFCCVEGCSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001573408196 948064559 /nfs/dbraw/zinc/06/45/59/948064559.db2.gz DEXFXJUIYSTDPZ-GFCCVEGCSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001573408198 948065324 /nfs/dbraw/zinc/06/53/24/948065324.db2.gz DEXFXJUIYSTDPZ-LBPRGKRZSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001573408198 948065314 /nfs/dbraw/zinc/06/53/14/948065314.db2.gz DEXFXJUIYSTDPZ-LBPRGKRZSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001573408402 948065564 /nfs/dbraw/zinc/06/55/64/948065564.db2.gz GAOUOJQEFIBUSO-GFCCVEGCSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001573408402 948065556 /nfs/dbraw/zinc/06/55/56/948065556.db2.gz GAOUOJQEFIBUSO-GFCCVEGCSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)NC[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001573408403 948064691 /nfs/dbraw/zinc/06/46/91/948064691.db2.gz GAOUOJQEFIBUSO-LBPRGKRZSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)NC[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001573408403 948064684 /nfs/dbraw/zinc/06/46/84/948064684.db2.gz GAOUOJQEFIBUSO-LBPRGKRZSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)NC[C@@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573408712 948070564 /nfs/dbraw/zinc/07/05/64/948070564.db2.gz MLSQKVLBVDQUHS-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)NC[C@@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573408712 948070553 /nfs/dbraw/zinc/07/05/53/948070553.db2.gz MLSQKVLBVDQUHS-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)NC[C@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573408713 948070331 /nfs/dbraw/zinc/07/03/31/948070331.db2.gz MLSQKVLBVDQUHS-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)NC[C@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573408713 948070323 /nfs/dbraw/zinc/07/03/23/948070323.db2.gz MLSQKVLBVDQUHS-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)NC[C@@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001573409968 948077352 /nfs/dbraw/zinc/07/73/52/948077352.db2.gz YUIVBYRYOIPOSP-GFCCVEGCSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)NC[C@@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001573409968 948077343 /nfs/dbraw/zinc/07/73/43/948077343.db2.gz YUIVBYRYOIPOSP-GFCCVEGCSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)NC[C@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001573409971 948076663 /nfs/dbraw/zinc/07/66/63/948076663.db2.gz YUIVBYRYOIPOSP-LBPRGKRZSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N(C)CCCC(=O)NC[C@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001573409971 948076653 /nfs/dbraw/zinc/07/66/53/948076653.db2.gz YUIVBYRYOIPOSP-LBPRGKRZSA-N -1 3 392.420 -1.340 20 0 GAADHM CC(=O)N1CC(C(=O)N(CCO)CCNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573413236 948080537 /nfs/dbraw/zinc/08/05/37/948080537.db2.gz AFOXIYCFDPPFCV-UHFFFAOYSA-N -1 3 390.404 -1.776 20 0 GAADHM CC(=O)N1CC(C(=O)N(CCO)CCNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573413236 948080530 /nfs/dbraw/zinc/08/05/30/948080530.db2.gz AFOXIYCFDPPFCV-UHFFFAOYSA-N -1 3 390.404 -1.776 20 0 GAADHM CC(=O)N1CC(C(=O)N(CCO)CCNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573413243 948080064 /nfs/dbraw/zinc/08/00/64/948080064.db2.gz AHTHZSZHOHJUKO-UHFFFAOYSA-N -1 3 390.404 -1.776 20 0 GAADHM CC(=O)N1CC(C(=O)N(CCO)CCNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573413243 948080054 /nfs/dbraw/zinc/08/00/54/948080054.db2.gz AHTHZSZHOHJUKO-UHFFFAOYSA-N -1 3 390.404 -1.776 20 0 GAADHM CC(=O)N1CC(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)C1 ZINC001573413323 948078923 /nfs/dbraw/zinc/07/89/23/948078923.db2.gz BPPGZHCFHKNOBY-UHFFFAOYSA-N -1 3 388.388 -2.024 20 0 GAADHM CC(=O)N1CC(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)C1 ZINC001573413323 948078912 /nfs/dbraw/zinc/07/89/12/948078912.db2.gz BPPGZHCFHKNOBY-UHFFFAOYSA-N -1 3 388.388 -2.024 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@@H](O)CN(C)c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001573413599 948081927 /nfs/dbraw/zinc/08/19/27/948081927.db2.gz BSEYCUAUNLLNGB-AWEZNQCLSA-N -1 3 388.432 -1.005 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@@H](O)CN(C)c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001573413599 948081918 /nfs/dbraw/zinc/08/19/18/948081918.db2.gz BSEYCUAUNLLNGB-AWEZNQCLSA-N -1 3 388.432 -1.005 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@H](O)CN(C)c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001573413601 948082667 /nfs/dbraw/zinc/08/26/67/948082667.db2.gz BSEYCUAUNLLNGB-CQSZACIVSA-N -1 3 388.432 -1.005 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@H](O)CN(C)c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001573413601 948082656 /nfs/dbraw/zinc/08/26/56/948082656.db2.gz BSEYCUAUNLLNGB-CQSZACIVSA-N -1 3 388.432 -1.005 20 0 GAADHM CC(=O)N1CC(C(=O)N(CCO)CCNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573414547 948094184 /nfs/dbraw/zinc/09/41/84/948094184.db2.gz OBTCBHWFNQVPNM-UHFFFAOYSA-N -1 3 390.404 -1.776 20 0 GAADHM CC(=O)N1CC(C(=O)N(CCO)CCNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573414547 948094176 /nfs/dbraw/zinc/09/41/76/948094176.db2.gz OBTCBHWFNQVPNM-UHFFFAOYSA-N -1 3 390.404 -1.776 20 0 GAADHM CC(=O)N1CC(C(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)C1 ZINC001573414548 948095810 /nfs/dbraw/zinc/09/58/10/948095810.db2.gz OCQVHSUNEQLBAQ-UHFFFAOYSA-N -1 3 388.388 -2.024 20 0 GAADHM CC(=O)N1CC(C(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)C1 ZINC001573414548 948095805 /nfs/dbraw/zinc/09/58/05/948095805.db2.gz OCQVHSUNEQLBAQ-UHFFFAOYSA-N -1 3 388.388 -2.024 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@H](O)CN(C)c2ncccc2-c2nn[n-]n2)C1 ZINC001573414679 948097544 /nfs/dbraw/zinc/09/75/44/948097544.db2.gz NJSHKRWTEVBFGZ-CYBMUJFWSA-N -1 3 388.432 -1.005 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@H](O)CN(C)c2ncccc2-c2nnn[n-]2)C1 ZINC001573414679 948097536 /nfs/dbraw/zinc/09/75/36/948097536.db2.gz NJSHKRWTEVBFGZ-CYBMUJFWSA-N -1 3 388.432 -1.005 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@@H](O)CN(C)c2ncccc2-c2nn[n-]n2)C1 ZINC001573414680 948096965 /nfs/dbraw/zinc/09/69/65/948096965.db2.gz NJSHKRWTEVBFGZ-ZDUSSCGKSA-N -1 3 388.432 -1.005 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@@H](O)CN(C)c2ncccc2-c2nnn[n-]2)C1 ZINC001573414680 948096957 /nfs/dbraw/zinc/09/69/57/948096957.db2.gz NJSHKRWTEVBFGZ-ZDUSSCGKSA-N -1 3 388.432 -1.005 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573415266 948105412 /nfs/dbraw/zinc/10/54/12/948105412.db2.gz QMZBECCNCVYOPC-GFCCVEGCSA-N -1 3 390.404 -1.778 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573415266 948105407 /nfs/dbraw/zinc/10/54/07/948105407.db2.gz QMZBECCNCVYOPC-GFCCVEGCSA-N -1 3 390.404 -1.778 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573415267 948105202 /nfs/dbraw/zinc/10/52/02/948105202.db2.gz QMZBECCNCVYOPC-LBPRGKRZSA-N -1 3 390.404 -1.778 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573415267 948105198 /nfs/dbraw/zinc/10/51/98/948105198.db2.gz QMZBECCNCVYOPC-LBPRGKRZSA-N -1 3 390.404 -1.778 20 0 GAADHM CC(=O)N1CC(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)C1 ZINC001573415354 948107115 /nfs/dbraw/zinc/10/71/15/948107115.db2.gz YDYMAZVJQFWOLH-UHFFFAOYSA-N -1 3 388.388 -2.024 20 0 GAADHM CC(=O)N1CC(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)C1 ZINC001573415354 948107110 /nfs/dbraw/zinc/10/71/10/948107110.db2.gz YDYMAZVJQFWOLH-UHFFFAOYSA-N -1 3 388.388 -2.024 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@H](O)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573415439 948109497 /nfs/dbraw/zinc/10/94/97/948109497.db2.gz RZKHCTPEQNPFRF-LLVKDONJSA-N -1 3 390.404 -1.778 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@H](O)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573415439 948109495 /nfs/dbraw/zinc/10/94/95/948109495.db2.gz RZKHCTPEQNPFRF-LLVKDONJSA-N -1 3 390.404 -1.778 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@@H](O)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573415440 948109225 /nfs/dbraw/zinc/10/92/25/948109225.db2.gz RZKHCTPEQNPFRF-NSHDSACASA-N -1 3 390.404 -1.778 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@@H](O)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573415440 948109218 /nfs/dbraw/zinc/10/92/18/948109218.db2.gz RZKHCTPEQNPFRF-NSHDSACASA-N -1 3 390.404 -1.778 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@H](O)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573415482 948108498 /nfs/dbraw/zinc/10/84/98/948108498.db2.gz UVSMXBSERRVTAL-GFCCVEGCSA-N -1 3 390.404 -1.778 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@H](O)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573415482 948108493 /nfs/dbraw/zinc/10/84/93/948108493.db2.gz UVSMXBSERRVTAL-GFCCVEGCSA-N -1 3 390.404 -1.778 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@@H](O)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573415483 948109284 /nfs/dbraw/zinc/10/92/84/948109284.db2.gz UVSMXBSERRVTAL-LBPRGKRZSA-N -1 3 390.404 -1.778 20 0 GAADHM CC(=O)N1CC(C(=O)N(C)C[C@@H](O)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573415483 948109276 /nfs/dbraw/zinc/10/92/76/948109276.db2.gz UVSMXBSERRVTAL-LBPRGKRZSA-N -1 3 390.404 -1.778 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@H]2CCN(c3ncccc3-c3nn[n-]n3)C[C@@H]2O)C1 ZINC001573417743 948111984 /nfs/dbraw/zinc/11/19/84/948111984.db2.gz ARPHTEIGZPNFRH-KBPBESRZSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@H]2CCN(c3ncccc3-c3nnn[n-]3)C[C@@H]2O)C1 ZINC001573417743 948111982 /nfs/dbraw/zinc/11/19/82/948111982.db2.gz ARPHTEIGZPNFRH-KBPBESRZSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@@H]2CCN(c3ncccc3-c3nn[n-]n3)C[C@@H]2O)C1 ZINC001573417744 948111964 /nfs/dbraw/zinc/11/19/64/948111964.db2.gz ARPHTEIGZPNFRH-KGLIPLIRSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@@H]2CCN(c3ncccc3-c3nnn[n-]3)C[C@@H]2O)C1 ZINC001573417744 948111961 /nfs/dbraw/zinc/11/19/61/948111961.db2.gz ARPHTEIGZPNFRH-KGLIPLIRSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@H]2CCN(c3ncccc3-c3nn[n-]n3)C[C@H]2O)C1 ZINC001573417745 948112054 /nfs/dbraw/zinc/11/20/54/948112054.db2.gz ARPHTEIGZPNFRH-UONOGXRCSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@H]2CCN(c3ncccc3-c3nnn[n-]3)C[C@H]2O)C1 ZINC001573417745 948112049 /nfs/dbraw/zinc/11/20/49/948112049.db2.gz ARPHTEIGZPNFRH-UONOGXRCSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@@H]2CCN(c3ncccc3-c3nn[n-]n3)C[C@H]2O)C1 ZINC001573417746 948114570 /nfs/dbraw/zinc/11/45/70/948114570.db2.gz ARPHTEIGZPNFRH-ZIAGYGMSSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@@H]2CCN(c3ncccc3-c3nnn[n-]3)C[C@H]2O)C1 ZINC001573417746 948114563 /nfs/dbraw/zinc/11/45/63/948114563.db2.gz ARPHTEIGZPNFRH-ZIAGYGMSSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573418135 948113986 /nfs/dbraw/zinc/11/39/86/948113986.db2.gz CUUZQKQEMIDWPM-IMRBUKKESA-N -1 3 384.400 -1.140 20 0 GAADHM CC(=O)N1CC(C(=O)N2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573418135 948113982 /nfs/dbraw/zinc/11/39/82/948113982.db2.gz CUUZQKQEMIDWPM-IMRBUKKESA-N -1 3 384.400 -1.140 20 0 GAADHM CC(=O)N1CC(C(=O)N2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573418162 948115576 /nfs/dbraw/zinc/11/55/76/948115576.db2.gz DRAZBEFZGLZIFD-IMRBUKKESA-N -1 3 384.400 -1.140 20 0 GAADHM CC(=O)N1CC(C(=O)N2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573418162 948115574 /nfs/dbraw/zinc/11/55/74/948115574.db2.gz DRAZBEFZGLZIFD-IMRBUKKESA-N -1 3 384.400 -1.140 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@H](CO)NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573419350 948122858 /nfs/dbraw/zinc/12/28/58/948122858.db2.gz LEPWTJVYVNBRIW-LLVKDONJSA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@H](CO)NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573419350 948122851 /nfs/dbraw/zinc/12/28/51/948122851.db2.gz LEPWTJVYVNBRIW-LLVKDONJSA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@@H](CO)NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573419351 948123179 /nfs/dbraw/zinc/12/31/79/948123179.db2.gz LEPWTJVYVNBRIW-NSHDSACASA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@@H](CO)NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573419351 948123172 /nfs/dbraw/zinc/12/31/72/948123172.db2.gz LEPWTJVYVNBRIW-NSHDSACASA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)N2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573419385 948123270 /nfs/dbraw/zinc/12/32/70/948123270.db2.gz LXSRXXJSOPETHE-YABSGUDNSA-N -1 3 384.400 -1.140 20 0 GAADHM CC(=O)N1CC(C(=O)N2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573419385 948123261 /nfs/dbraw/zinc/12/32/61/948123261.db2.gz LXSRXXJSOPETHE-YABSGUDNSA-N -1 3 384.400 -1.140 20 0 GAADHM CC(=O)N1CC(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)C1 ZINC001573419637 948124829 /nfs/dbraw/zinc/12/48/29/948124829.db2.gz OCEKFHJUIVMHAA-CHWSQXEVSA-N -1 3 388.388 -2.025 20 0 GAADHM CC(=O)N1CC(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)C1 ZINC001573419637 948124824 /nfs/dbraw/zinc/12/48/24/948124824.db2.gz OCEKFHJUIVMHAA-CHWSQXEVSA-N -1 3 388.388 -2.025 20 0 GAADHM CC(=O)N1CC(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)C1 ZINC001573419638 948124641 /nfs/dbraw/zinc/12/46/41/948124641.db2.gz OCEKFHJUIVMHAA-OLZOCXBDSA-N -1 3 388.388 -2.025 20 0 GAADHM CC(=O)N1CC(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)C1 ZINC001573419638 948124636 /nfs/dbraw/zinc/12/46/36/948124636.db2.gz OCEKFHJUIVMHAA-OLZOCXBDSA-N -1 3 388.388 -2.025 20 0 GAADHM CC(=O)N1CC(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)C1 ZINC001573419723 948127251 /nfs/dbraw/zinc/12/72/51/948127251.db2.gz QFWLVXXHQFBYPK-CHWSQXEVSA-N -1 3 388.388 -2.025 20 0 GAADHM CC(=O)N1CC(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)C1 ZINC001573419723 948127244 /nfs/dbraw/zinc/12/72/44/948127244.db2.gz QFWLVXXHQFBYPK-CHWSQXEVSA-N -1 3 388.388 -2.025 20 0 GAADHM CC(=O)N1CC(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)C1 ZINC001573419724 948126218 /nfs/dbraw/zinc/12/62/18/948126218.db2.gz QFWLVXXHQFBYPK-OLZOCXBDSA-N -1 3 388.388 -2.025 20 0 GAADHM CC(=O)N1CC(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)C1 ZINC001573419724 948126212 /nfs/dbraw/zinc/12/62/12/948126212.db2.gz QFWLVXXHQFBYPK-OLZOCXBDSA-N -1 3 388.388 -2.025 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@H](CO)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573419777 948128996 /nfs/dbraw/zinc/12/89/96/948128996.db2.gz SAMRQZMQUKIEMD-JTQLQIEISA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@H](CO)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573419777 948128990 /nfs/dbraw/zinc/12/89/90/948128990.db2.gz SAMRQZMQUKIEMD-JTQLQIEISA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@@H](CO)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573419778 948128877 /nfs/dbraw/zinc/12/88/77/948128877.db2.gz SAMRQZMQUKIEMD-SNVBAGLBSA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@@H](CO)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573419778 948128870 /nfs/dbraw/zinc/12/88/70/948128870.db2.gz SAMRQZMQUKIEMD-SNVBAGLBSA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@H](CO)NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573419811 948128339 /nfs/dbraw/zinc/12/83/39/948128339.db2.gz SVVHKJOZVIQBSR-LLVKDONJSA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@H](CO)NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573419811 948128336 /nfs/dbraw/zinc/12/83/36/948128336.db2.gz SVVHKJOZVIQBSR-LLVKDONJSA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@@H](CO)NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573419812 948128975 /nfs/dbraw/zinc/12/89/75/948128975.db2.gz SVVHKJOZVIQBSR-NSHDSACASA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@@H](CO)NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573419812 948128966 /nfs/dbraw/zinc/12/89/66/948128966.db2.gz SVVHKJOZVIQBSR-NSHDSACASA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@H]2CCN(c3ccc(-c4nn[n-]n4)cn3)C[C@@H]2O)C1 ZINC001573419859 948130670 /nfs/dbraw/zinc/13/06/70/948130670.db2.gz ULPNHIWKQUUZSQ-KBPBESRZSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@H]2CCN(c3ccc(-c4nnn[n-]4)cn3)C[C@@H]2O)C1 ZINC001573419859 948130664 /nfs/dbraw/zinc/13/06/64/948130664.db2.gz ULPNHIWKQUUZSQ-KBPBESRZSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@@H]2CCN(c3ccc(-c4nn[n-]n4)cn3)C[C@@H]2O)C1 ZINC001573419860 948130323 /nfs/dbraw/zinc/13/03/23/948130323.db2.gz ULPNHIWKQUUZSQ-KGLIPLIRSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@@H]2CCN(c3ccc(-c4nnn[n-]4)cn3)C[C@@H]2O)C1 ZINC001573419860 948130319 /nfs/dbraw/zinc/13/03/19/948130319.db2.gz ULPNHIWKQUUZSQ-KGLIPLIRSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@H]2CCN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]2O)C1 ZINC001573419861 948130756 /nfs/dbraw/zinc/13/07/56/948130756.db2.gz ULPNHIWKQUUZSQ-UONOGXRCSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@H]2CCN(c3ccc(-c4nnn[n-]4)cn3)C[C@H]2O)C1 ZINC001573419861 948130753 /nfs/dbraw/zinc/13/07/53/948130753.db2.gz ULPNHIWKQUUZSQ-UONOGXRCSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@@H]2CCN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]2O)C1 ZINC001573419862 948131579 /nfs/dbraw/zinc/13/15/79/948131579.db2.gz ULPNHIWKQUUZSQ-ZIAGYGMSSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@@H]2CCN(c3ccc(-c4nnn[n-]4)cn3)C[C@H]2O)C1 ZINC001573419862 948131571 /nfs/dbraw/zinc/13/15/71/948131571.db2.gz ULPNHIWKQUUZSQ-ZIAGYGMSSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@@H](CO)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573420179 948134932 /nfs/dbraw/zinc/13/49/32/948134932.db2.gz YQMMZNYTIITRSU-JTQLQIEISA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@@H](CO)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573420179 948134928 /nfs/dbraw/zinc/13/49/28/948134928.db2.gz YQMMZNYTIITRSU-JTQLQIEISA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@H](CO)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573420180 948134403 /nfs/dbraw/zinc/13/44/03/948134403.db2.gz YQMMZNYTIITRSU-SNVBAGLBSA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@H](CO)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573420180 948134396 /nfs/dbraw/zinc/13/43/96/948134396.db2.gz YQMMZNYTIITRSU-SNVBAGLBSA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@H]2CCN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]2O)C1 ZINC001573420219 948134880 /nfs/dbraw/zinc/13/48/80/948134880.db2.gz ZJZZSNOSBLZQFL-DZGCQCFKSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@H]2CCN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]2O)C1 ZINC001573420219 948134876 /nfs/dbraw/zinc/13/48/76/948134876.db2.gz ZJZZSNOSBLZQFL-DZGCQCFKSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@@H]2CCN(c3ccc(-c4nn[n-]n4)nc3)C[C@@H]2O)C1 ZINC001573420221 948134326 /nfs/dbraw/zinc/13/43/26/948134326.db2.gz ZJZZSNOSBLZQFL-HIFRSBDPSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@@H]2CCN(c3ccc(-c4nnn[n-]4)nc3)C[C@@H]2O)C1 ZINC001573420221 948134319 /nfs/dbraw/zinc/13/43/19/948134319.db2.gz ZJZZSNOSBLZQFL-HIFRSBDPSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@@H]2CCN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]2O)C1 ZINC001573420223 948134659 /nfs/dbraw/zinc/13/46/59/948134659.db2.gz ZJZZSNOSBLZQFL-UKRRQHHQSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@@H]2CCN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]2O)C1 ZINC001573420223 948134656 /nfs/dbraw/zinc/13/46/56/948134656.db2.gz ZJZZSNOSBLZQFL-UKRRQHHQSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@H]2CCN(c3ccc(-c4nn[n-]n4)nc3)C[C@@H]2O)C1 ZINC001573420225 948134818 /nfs/dbraw/zinc/13/48/18/948134818.db2.gz ZJZZSNOSBLZQFL-ZFWWWQNUSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@H]2CCN(c3ccc(-c4nnn[n-]4)nc3)C[C@@H]2O)C1 ZINC001573420225 948134816 /nfs/dbraw/zinc/13/48/16/948134816.db2.gz ZJZZSNOSBLZQFL-ZFWWWQNUSA-N -1 3 386.416 -1.204 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@@H](O)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573421064 948135987 /nfs/dbraw/zinc/13/59/87/948135987.db2.gz BWRZLVQHXLFMDJ-LLVKDONJSA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@@H](O)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573421064 948135976 /nfs/dbraw/zinc/13/59/76/948135976.db2.gz BWRZLVQHXLFMDJ-LLVKDONJSA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@H](O)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573421066 948136185 /nfs/dbraw/zinc/13/61/85/948136185.db2.gz BWRZLVQHXLFMDJ-NSHDSACASA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@H](O)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573421066 948136180 /nfs/dbraw/zinc/13/61/80/948136180.db2.gz BWRZLVQHXLFMDJ-NSHDSACASA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@@]2(O)CCN(c3ccc(-c4nn[n-]n4)cn3)C2)C1 ZINC001573421100 948136673 /nfs/dbraw/zinc/13/66/73/948136673.db2.gz CGVDHXFJURZZPB-KRWDZBQOSA-N -1 3 386.416 -1.203 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@@]2(O)CCN(c3ccc(-c4nnn[n-]4)cn3)C2)C1 ZINC001573421100 948136669 /nfs/dbraw/zinc/13/66/69/948136669.db2.gz CGVDHXFJURZZPB-KRWDZBQOSA-N -1 3 386.416 -1.203 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@]2(O)CCN(c3ccc(-c4nn[n-]n4)cn3)C2)C1 ZINC001573421102 948136086 /nfs/dbraw/zinc/13/60/86/948136086.db2.gz CGVDHXFJURZZPB-QGZVFWFLSA-N -1 3 386.416 -1.203 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@]2(O)CCN(c3ccc(-c4nnn[n-]4)cn3)C2)C1 ZINC001573421102 948136081 /nfs/dbraw/zinc/13/60/81/948136081.db2.gz CGVDHXFJURZZPB-QGZVFWFLSA-N -1 3 386.416 -1.203 20 0 GAADHM CC(=O)N1CC(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)C1 ZINC001573421104 948136508 /nfs/dbraw/zinc/13/65/08/948136508.db2.gz CKYCKWKUEYOQRC-UHFFFAOYSA-N -1 3 388.388 -2.024 20 0 GAADHM CC(=O)N1CC(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)C1 ZINC001573421104 948136502 /nfs/dbraw/zinc/13/65/02/948136502.db2.gz CKYCKWKUEYOQRC-UHFFFAOYSA-N -1 3 388.388 -2.024 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@@H](O)CN(C)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573421412 948137588 /nfs/dbraw/zinc/13/75/88/948137588.db2.gz DLFRXVVIDYKVNU-LLVKDONJSA-N -1 3 390.404 -1.778 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@@H](O)CN(C)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573421412 948137580 /nfs/dbraw/zinc/13/75/80/948137580.db2.gz DLFRXVVIDYKVNU-LLVKDONJSA-N -1 3 390.404 -1.778 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@H](O)CN(C)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573421413 948137658 /nfs/dbraw/zinc/13/76/58/948137658.db2.gz DLFRXVVIDYKVNU-NSHDSACASA-N -1 3 390.404 -1.778 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@H](O)CN(C)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573421413 948137651 /nfs/dbraw/zinc/13/76/51/948137651.db2.gz DLFRXVVIDYKVNU-NSHDSACASA-N -1 3 390.404 -1.778 20 0 GAADHM CC(=O)N1CC(C(=O)NCC2(O)CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)C1 ZINC001573421654 948140179 /nfs/dbraw/zinc/14/01/79/948140179.db2.gz HPWMJWIXYATJGM-UHFFFAOYSA-N -1 3 388.388 -2.024 20 0 GAADHM CC(=O)N1CC(C(=O)NCC2(O)CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)C1 ZINC001573421654 948140172 /nfs/dbraw/zinc/14/01/72/948140172.db2.gz HPWMJWIXYATJGM-UHFFFAOYSA-N -1 3 388.388 -2.024 20 0 GAADHM CC(=O)N1CC(C(=O)NCCN(CCO)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573421694 948139220 /nfs/dbraw/zinc/13/92/20/948139220.db2.gz HVAXOIREAOTVGL-UHFFFAOYSA-N -1 3 390.404 -1.776 20 0 GAADHM CC(=O)N1CC(C(=O)NCCN(CCO)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573421694 948139209 /nfs/dbraw/zinc/13/92/09/948139209.db2.gz HVAXOIREAOTVGL-UHFFFAOYSA-N -1 3 390.404 -1.776 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@@]2(O)CCN(c3ccc(-c4nn[n-]n4)nc3)C2)C1 ZINC001573422214 948140634 /nfs/dbraw/zinc/14/06/34/948140634.db2.gz IRDNBASZTMWTHO-KRWDZBQOSA-N -1 3 386.416 -1.203 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@@]2(O)CCN(c3ccc(-c4nnn[n-]4)nc3)C2)C1 ZINC001573422214 948140630 /nfs/dbraw/zinc/14/06/30/948140630.db2.gz IRDNBASZTMWTHO-KRWDZBQOSA-N -1 3 386.416 -1.203 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@]2(O)CCN(c3ccc(-c4nn[n-]n4)nc3)C2)C1 ZINC001573422215 948140479 /nfs/dbraw/zinc/14/04/79/948140479.db2.gz IRDNBASZTMWTHO-QGZVFWFLSA-N -1 3 386.416 -1.203 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@]2(O)CCN(c3ccc(-c4nnn[n-]4)nc3)C2)C1 ZINC001573422215 948140471 /nfs/dbraw/zinc/14/04/71/948140471.db2.gz IRDNBASZTMWTHO-QGZVFWFLSA-N -1 3 386.416 -1.203 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@@]2(O)CCN(c3ncccc3-c3nn[n-]n3)C2)C1 ZINC001573423016 948142554 /nfs/dbraw/zinc/14/25/54/948142554.db2.gz LWLDJLZLMXZBNG-KRWDZBQOSA-N -1 3 386.416 -1.203 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@@]2(O)CCN(c3ncccc3-c3nnn[n-]3)C2)C1 ZINC001573423016 948142548 /nfs/dbraw/zinc/14/25/48/948142548.db2.gz LWLDJLZLMXZBNG-KRWDZBQOSA-N -1 3 386.416 -1.203 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@]2(O)CCN(c3ncccc3-c3nn[n-]n3)C2)C1 ZINC001573423020 948142459 /nfs/dbraw/zinc/14/24/59/948142459.db2.gz LWLDJLZLMXZBNG-QGZVFWFLSA-N -1 3 386.416 -1.203 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@]2(O)CCN(c3ncccc3-c3nnn[n-]3)C2)C1 ZINC001573423020 948142452 /nfs/dbraw/zinc/14/24/52/948142452.db2.gz LWLDJLZLMXZBNG-QGZVFWFLSA-N -1 3 386.416 -1.203 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573423142 948144332 /nfs/dbraw/zinc/14/43/32/948144332.db2.gz NYZVFSZVWXBQOJ-LLVKDONJSA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573423142 948144325 /nfs/dbraw/zinc/14/43/25/948144325.db2.gz NYZVFSZVWXBQOJ-LLVKDONJSA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573423146 948144443 /nfs/dbraw/zinc/14/44/43/948144443.db2.gz NYZVFSZVWXBQOJ-NSHDSACASA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573423146 948144438 /nfs/dbraw/zinc/14/44/38/948144438.db2.gz NYZVFSZVWXBQOJ-NSHDSACASA-N -1 3 376.377 -2.120 20 0 GAADHM CC(=O)N1CC(C(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)C1 ZINC001573423171 948143190 /nfs/dbraw/zinc/14/31/90/948143190.db2.gz OBBJDSRPGSDDED-UHFFFAOYSA-N -1 3 388.388 -2.024 20 0 GAADHM CC(=O)N1CC(C(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)C1 ZINC001573423171 948143185 /nfs/dbraw/zinc/14/31/85/948143185.db2.gz OBBJDSRPGSDDED-UHFFFAOYSA-N -1 3 388.388 -2.024 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@H](O)CNc2snc(C)c2-c2nnn[n-]2)C1 ZINC001573423229 948143282 /nfs/dbraw/zinc/14/32/82/948143282.db2.gz OQMQYBZZSPDKFW-JTQLQIEISA-N -1 3 380.434 -1.001 20 0 GAADHM CC(=O)N1CC(C(=O)NC[C@@H](O)CNc2snc(C)c2-c2nnn[n-]2)C1 ZINC001573423237 948144271 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CC(=O)N[C@H](C)C(=O)N1CC[C@](O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573472650 946067547 /nfs/dbraw/zinc/06/75/47/946067547.db2.gz WYEGHWIKMCSOFK-ABKXIKBNSA-N -1 3 390.404 -1.587 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CC[C@](O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573472651 946067270 /nfs/dbraw/zinc/06/72/70/946067270.db2.gz WYEGHWIKMCSOFK-FVMDXXJSSA-N -1 3 390.404 -1.587 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CC[C@](O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573472651 946067257 /nfs/dbraw/zinc/06/72/57/946067257.db2.gz WYEGHWIKMCSOFK-FVMDXXJSSA-N -1 3 390.404 -1.587 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CC[C@@](O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573472652 946068538 /nfs/dbraw/zinc/06/85/38/946068538.db2.gz WYEGHWIKMCSOFK-JDNHERCYSA-N -1 3 390.404 -1.587 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CC[C@@](O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573472652 946068528 /nfs/dbraw/zinc/06/85/28/946068528.db2.gz WYEGHWIKMCSOFK-JDNHERCYSA-N -1 3 390.404 -1.587 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CC[C@@](O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573472653 946066107 /nfs/dbraw/zinc/06/61/07/946066107.db2.gz WYEGHWIKMCSOFK-XXFAHNHDSA-N -1 3 390.404 -1.587 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CC[C@@](O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573472653 946066097 /nfs/dbraw/zinc/06/60/97/946066097.db2.gz WYEGHWIKMCSOFK-XXFAHNHDSA-N -1 3 390.404 -1.587 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCO[C@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573473453 946080778 /nfs/dbraw/zinc/08/07/78/946080778.db2.gz CJKQRXIOBKDUHG-GXSJLCMTSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCO[C@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573473453 946080770 /nfs/dbraw/zinc/08/07/70/946080770.db2.gz CJKQRXIOBKDUHG-GXSJLCMTSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CCO[C@@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573473454 946079320 /nfs/dbraw/zinc/07/93/20/946079320.db2.gz CJKQRXIOBKDUHG-KOLCDFICSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CCO[C@@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573473454 946079308 /nfs/dbraw/zinc/07/93/08/946079308.db2.gz CJKQRXIOBKDUHG-KOLCDFICSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CCO[C@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573473455 946080097 /nfs/dbraw/zinc/08/00/97/946080097.db2.gz CJKQRXIOBKDUHG-MWLCHTKSSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CCO[C@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573473455 946080084 /nfs/dbraw/zinc/08/00/84/946080084.db2.gz CJKQRXIOBKDUHG-MWLCHTKSSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCO[C@@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573473456 946080590 /nfs/dbraw/zinc/08/05/90/946080590.db2.gz CJKQRXIOBKDUHG-ONGXEEELSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCO[C@@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573473456 946080579 /nfs/dbraw/zinc/08/05/79/946080579.db2.gz CJKQRXIOBKDUHG-ONGXEEELSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCOC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573474156 946088725 /nfs/dbraw/zinc/08/87/25/946088725.db2.gz ISWCVBTXRYNLQH-GXSJLCMTSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCOC[C@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573474156 946088709 /nfs/dbraw/zinc/08/87/09/946088709.db2.gz ISWCVBTXRYNLQH-GXSJLCMTSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CCOC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573474160 946089912 /nfs/dbraw/zinc/08/99/12/946089912.db2.gz ISWCVBTXRYNLQH-KOLCDFICSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CCOC[C@@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573474160 946089902 /nfs/dbraw/zinc/08/99/02/946089902.db2.gz ISWCVBTXRYNLQH-KOLCDFICSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CCOC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573474161 946087562 /nfs/dbraw/zinc/08/75/62/946087562.db2.gz ISWCVBTXRYNLQH-MWLCHTKSSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CCOC[C@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573474161 946087552 /nfs/dbraw/zinc/08/75/52/946087552.db2.gz ISWCVBTXRYNLQH-MWLCHTKSSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCOC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573474163 946089945 /nfs/dbraw/zinc/08/99/45/946089945.db2.gz ISWCVBTXRYNLQH-ONGXEEELSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCOC[C@@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573474163 946089934 /nfs/dbraw/zinc/08/99/34/946089934.db2.gz ISWCVBTXRYNLQH-ONGXEEELSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CCOC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001573474311 946089744 /nfs/dbraw/zinc/08/97/44/946089744.db2.gz KKGPCJNPVHEUML-BXKDBHETSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CCOC[C@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001573474311 946089734 /nfs/dbraw/zinc/08/97/34/946089734.db2.gz KKGPCJNPVHEUML-BXKDBHETSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCOC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001573474312 946089679 /nfs/dbraw/zinc/08/96/79/946089679.db2.gz KKGPCJNPVHEUML-CABZTGNLSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCOC[C@@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001573474312 946089668 /nfs/dbraw/zinc/08/96/68/946089668.db2.gz KKGPCJNPVHEUML-CABZTGNLSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCOC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001573474313 946088050 /nfs/dbraw/zinc/08/80/50/946088050.db2.gz KKGPCJNPVHEUML-JOYOIKCWSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCOC[C@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001573474313 946088036 /nfs/dbraw/zinc/08/80/36/946088036.db2.gz KKGPCJNPVHEUML-JOYOIKCWSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CCOC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001573474317 946087927 /nfs/dbraw/zinc/08/79/27/946087927.db2.gz KKGPCJNPVHEUML-SKDRFNHKSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CCOC[C@@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001573474317 946087921 /nfs/dbraw/zinc/08/79/21/946087921.db2.gz KKGPCJNPVHEUML-SKDRFNHKSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CCOC[C@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001573474322 946088168 /nfs/dbraw/zinc/08/81/68/946088168.db2.gz KOWIZGFEASVBRR-BXKDBHETSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CCOC[C@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001573474322 946088148 /nfs/dbraw/zinc/08/81/48/946088148.db2.gz KOWIZGFEASVBRR-BXKDBHETSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCOC[C@@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001573474324 946087976 /nfs/dbraw/zinc/08/79/76/946087976.db2.gz KOWIZGFEASVBRR-CABZTGNLSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCOC[C@@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001573474324 946087953 /nfs/dbraw/zinc/08/79/53/946087953.db2.gz KOWIZGFEASVBRR-CABZTGNLSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCOC[C@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001573474326 946088124 /nfs/dbraw/zinc/08/81/24/946088124.db2.gz KOWIZGFEASVBRR-JOYOIKCWSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCOC[C@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001573474326 946088112 /nfs/dbraw/zinc/08/81/12/946088112.db2.gz KOWIZGFEASVBRR-JOYOIKCWSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CCOC[C@@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001573474328 946089197 /nfs/dbraw/zinc/08/91/97/946089197.db2.gz KOWIZGFEASVBRR-SKDRFNHKSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CCOC[C@@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001573474328 946089188 /nfs/dbraw/zinc/08/91/88/946089188.db2.gz KOWIZGFEASVBRR-SKDRFNHKSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CCO[C@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573474589 946092440 /nfs/dbraw/zinc/09/24/40/946092440.db2.gz LIDJGXHWZBRSSC-BXKDBHETSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N1CCO[C@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573474589 946092424 /nfs/dbraw/zinc/09/24/24/946092424.db2.gz LIDJGXHWZBRSSC-BXKDBHETSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCO[C@@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573474590 946092654 /nfs/dbraw/zinc/09/26/54/946092654.db2.gz LIDJGXHWZBRSSC-CABZTGNLSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCO[C@@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573474590 946092642 /nfs/dbraw/zinc/09/26/42/946092642.db2.gz LIDJGXHWZBRSSC-CABZTGNLSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCO[C@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573474591 946092408 /nfs/dbraw/zinc/09/24/08/946092408.db2.gz LIDJGXHWZBRSSC-JOYOIKCWSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N1CCO[C@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573474591 946092392 /nfs/dbraw/zinc/09/23/92/946092392.db2.gz LIDJGXHWZBRSSC-JOYOIKCWSA-N -1 3 390.404 -1.323 20 0 GAADHM 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CC(=O)N[C@H](C)C(=O)N1CCO[C@@H](CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573475615 946101839 /nfs/dbraw/zinc/10/18/39/946101839.db2.gz WCVYTHLXKRUZBP-SKDRFNHKSA-N -1 3 390.404 -1.323 20 0 GAADHM CC(=O)N[C@H](C)C(=O)NC1(CCO)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573475672 946102548 /nfs/dbraw/zinc/10/25/48/946102548.db2.gz ABYGWABGRQHMCD-SECBINFHSA-N -1 3 390.404 -1.587 20 0 GAADHM CC(=O)N[C@H](C)C(=O)NC1(CCO)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573475672 946102543 /nfs/dbraw/zinc/10/25/43/946102543.db2.gz ABYGWABGRQHMCD-SECBINFHSA-N -1 3 390.404 -1.587 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)NC1(CCO)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573475679 946104140 /nfs/dbraw/zinc/10/41/40/946104140.db2.gz ABYGWABGRQHMCD-VIFPVBQESA-N -1 3 390.404 -1.587 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)NC1(CCO)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573475679 946104136 /nfs/dbraw/zinc/10/41/36/946104136.db2.gz ABYGWABGRQHMCD-VIFPVBQESA-N -1 3 390.404 -1.587 20 0 GAADHM 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CC(=O)NCC(=O)N[C@]1(CO)CCCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573511639 946488689 /nfs/dbraw/zinc/48/86/89/946488689.db2.gz BZTFAXAWRAZTIP-MRXNPFEDSA-N -1 3 390.404 -1.586 20 0 GAADHM CC(=O)NCC(=O)NC1(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCOCC1 ZINC001573512433 946499051 /nfs/dbraw/zinc/49/90/51/946499051.db2.gz FTCUXGPAKROQMN-UHFFFAOYSA-N -1 3 390.404 -1.274 20 0 GAADHM CC(=O)NCC(=O)NC1(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCOCC1 ZINC001573512433 946499046 /nfs/dbraw/zinc/49/90/46/946499046.db2.gz FTCUXGPAKROQMN-UHFFFAOYSA-N -1 3 390.404 -1.274 20 0 GAADHM CC(=O)NCC(=O)NC1(CCO)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573513017 946507237 /nfs/dbraw/zinc/50/72/37/946507237.db2.gz KBWCALKXDLVYSG-UHFFFAOYSA-N -1 3 376.377 -1.976 20 0 GAADHM CC(=O)NCC(=O)NC1(CCO)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573513017 946507234 /nfs/dbraw/zinc/50/72/34/946507234.db2.gz KBWCALKXDLVYSG-UHFFFAOYSA-N -1 3 376.377 -1.976 20 0 GAADHM CC(=O)NCC(=O)NC1(CO)CCN(c2ncc(-c3nn[n-]n3)cc2F)CC1 ZINC001573513653 946513032 /nfs/dbraw/zinc/51/30/32/946513032.db2.gz OWHYZGWHQBDECN-UHFFFAOYSA-N -1 3 392.395 -1.016 20 0 GAADHM CC(=O)NCC(=O)NC1(CO)CCN(c2ncc(-c3nnn[n-]3)cc2F)CC1 ZINC001573513653 946513018 /nfs/dbraw/zinc/51/30/18/946513018.db2.gz OWHYZGWHQBDECN-UHFFFAOYSA-N -1 3 392.395 -1.016 20 0 GAADHM CC(=O)NCC(=O)N[C@@]1(CO)CCCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573514150 946519615 /nfs/dbraw/zinc/51/96/15/946519615.db2.gz SYOONGJTLLYPQB-INIZCTEOSA-N -1 3 390.404 -1.586 20 0 GAADHM CC(=O)NCC(=O)N[C@@]1(CO)CCCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573514150 946519609 /nfs/dbraw/zinc/51/96/09/946519609.db2.gz SYOONGJTLLYPQB-INIZCTEOSA-N -1 3 390.404 -1.586 20 0 GAADHM CC(=O)NCC(=O)N[C@]1(CO)CCCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573514151 946521727 /nfs/dbraw/zinc/52/17/27/946521727.db2.gz SYOONGJTLLYPQB-MRXNPFEDSA-N -1 3 390.404 -1.586 20 0 GAADHM CC(=O)NCC(=O)N[C@]1(CO)CCCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573514151 946521722 /nfs/dbraw/zinc/52/17/22/946521722.db2.gz SYOONGJTLLYPQB-MRXNPFEDSA-N -1 3 390.404 -1.586 20 0 GAADHM CC(=O)NCC(=O)NC1(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCOCC1 ZINC001573514187 946519907 /nfs/dbraw/zinc/51/99/07/946519907.db2.gz UTNKNZFDVRTPKO-UHFFFAOYSA-N -1 3 390.404 -1.274 20 0 GAADHM CC(=O)NCC(=O)NC1(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCOCC1 ZINC001573514187 946519899 /nfs/dbraw/zinc/51/98/99/946519899.db2.gz UTNKNZFDVRTPKO-UHFFFAOYSA-N -1 3 390.404 -1.274 20 0 GAADHM CC(=O)NCC(=O)NC1(CCO)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573514316 946526379 /nfs/dbraw/zinc/52/63/79/946526379.db2.gz XBZLQQCOLJZBLG-UHFFFAOYSA-N -1 3 376.377 -1.976 20 0 GAADHM CC(=O)NCC(=O)NC1(CCO)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573514316 946526372 /nfs/dbraw/zinc/52/63/72/946526372.db2.gz XBZLQQCOLJZBLG-UHFFFAOYSA-N -1 3 376.377 -1.976 20 0 GAADHM CC(=O)NCC(=O)NC1(CO)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001573514335 946525886 /nfs/dbraw/zinc/52/58/86/946525886.db2.gz XLYUQFVZWRRWKM-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CC(=O)NCC(=O)NC1(CO)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001573514335 946525876 /nfs/dbraw/zinc/52/58/76/946525876.db2.gz XLYUQFVZWRRWKM-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CC(=O)NCC(=O)N[C@@]1(CO)CCCN(c2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001573514371 946526394 /nfs/dbraw/zinc/52/63/94/946526394.db2.gz XZOCEQIZGNSFCY-INIZCTEOSA-N -1 3 392.395 -1.016 20 0 GAADHM CC(=O)NCC(=O)N[C@@]1(CO)CCCN(c2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001573514371 946526390 /nfs/dbraw/zinc/52/63/90/946526390.db2.gz XZOCEQIZGNSFCY-INIZCTEOSA-N -1 3 392.395 -1.016 20 0 GAADHM CC(=O)NCC(=O)N[C@]1(CO)CCCN(c2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001573514372 946525655 /nfs/dbraw/zinc/52/56/55/946525655.db2.gz XZOCEQIZGNSFCY-MRXNPFEDSA-N -1 3 392.395 -1.016 20 0 GAADHM CC(=O)NCC(=O)N[C@]1(CO)CCCN(c2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001573514372 946525639 /nfs/dbraw/zinc/52/56/39/946525639.db2.gz XZOCEQIZGNSFCY-MRXNPFEDSA-N -1 3 392.395 -1.016 20 0 GAADHM CC(=O)NCC(=O)NC1(CCO)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573514400 946527874 /nfs/dbraw/zinc/52/78/74/946527874.db2.gz YNDFDMVOZDUSPS-UHFFFAOYSA-N -1 3 376.377 -1.976 20 0 GAADHM CC(=O)NCC(=O)NC1(CCO)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573514400 946527867 /nfs/dbraw/zinc/52/78/67/946527867.db2.gz YNDFDMVOZDUSPS-UHFFFAOYSA-N -1 3 376.377 -1.976 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H]1C[C@@H](Nc2ncccc2-c2nn[n-]n2)C1 ZINC001573514581 946530572 /nfs/dbraw/zinc/53/05/72/946530572.db2.gz AOKDYOALOTVVSI-PHIMTYICSA-N -1 3 387.404 -1.427 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H]1C[C@@H](Nc2ncccc2-c2nnn[n-]2)C1 ZINC001573514581 946530566 /nfs/dbraw/zinc/53/05/66/946530566.db2.gz AOKDYOALOTVVSI-PHIMTYICSA-N -1 3 387.404 -1.427 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001573514624 946532745 /nfs/dbraw/zinc/53/27/45/946532745.db2.gz BQIIEZSHYYDIQV-VIFPVBQESA-N -1 3 375.393 -1.569 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001573514624 946532733 /nfs/dbraw/zinc/53/27/33/946532733.db2.gz BQIIEZSHYYDIQV-VIFPVBQESA-N -1 3 375.393 -1.569 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)CCN(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001573514649 946532017 /nfs/dbraw/zinc/53/20/17/946532017.db2.gz BYPQLRLKYCRSOR-UHFFFAOYSA-N -1 3 389.420 -1.591 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)CCN(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001573514649 946532009 /nfs/dbraw/zinc/53/20/09/946532009.db2.gz BYPQLRLKYCRSOR-UHFFFAOYSA-N -1 3 389.420 -1.591 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)[C@@H](C)CNc1ncccc1-c1nn[n-]n1 ZINC001573514666 946532091 /nfs/dbraw/zinc/53/20/91/946532091.db2.gz CFHMGPNTJVNCOA-JTQLQIEISA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)[C@@H](C)CNc1ncccc1-c1nnn[n-]1 ZINC001573514666 946532086 /nfs/dbraw/zinc/53/20/86/946532086.db2.gz CFHMGPNTJVNCOA-JTQLQIEISA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)[C@H](C)CNc1ncccc1-c1nn[n-]n1 ZINC001573514667 946532344 /nfs/dbraw/zinc/53/23/44/946532344.db2.gz CFHMGPNTJVNCOA-SNVBAGLBSA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)[C@H](C)CNc1ncccc1-c1nnn[n-]1 ZINC001573514667 946532338 /nfs/dbraw/zinc/53/23/38/946532338.db2.gz CFHMGPNTJVNCOA-SNVBAGLBSA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001573514776 946533304 /nfs/dbraw/zinc/53/33/04/946533304.db2.gz CVHPVJZDQHJPQP-NEPJUHHUSA-N -1 3 378.368 -1.407 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001573514776 946533299 /nfs/dbraw/zinc/53/32/99/946533299.db2.gz CVHPVJZDQHJPQP-NEPJUHHUSA-N -1 3 378.368 -1.407 20 0 GAADHM CC(=O)NCC(=O)N[C@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001573514777 946533388 /nfs/dbraw/zinc/53/33/88/946533388.db2.gz CVHPVJZDQHJPQP-NWDGAFQWSA-N -1 3 378.368 -1.407 20 0 GAADHM CC(=O)NCC(=O)N[C@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001573514777 946533379 /nfs/dbraw/zinc/53/33/79/946533379.db2.gz CVHPVJZDQHJPQP-NWDGAFQWSA-N -1 3 378.368 -1.407 20 0 GAADHM CC(=O)NCC(=O)N[C@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001573514778 946532201 /nfs/dbraw/zinc/53/22/01/946532201.db2.gz CVHPVJZDQHJPQP-RYUDHWBXSA-N -1 3 378.368 -1.407 20 0 GAADHM CC(=O)NCC(=O)N[C@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001573514778 946532196 /nfs/dbraw/zinc/53/21/96/946532196.db2.gz CVHPVJZDQHJPQP-RYUDHWBXSA-N -1 3 378.368 -1.407 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001573514779 946532268 /nfs/dbraw/zinc/53/22/68/946532268.db2.gz CVHPVJZDQHJPQP-VXGBXAGGSA-N -1 3 378.368 -1.407 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001573514779 946532264 /nfs/dbraw/zinc/53/22/64/946532264.db2.gz CVHPVJZDQHJPQP-VXGBXAGGSA-N -1 3 378.368 -1.407 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCC1(Nc2ncccc2-c2nn[n-]n2)CC1 ZINC001573514780 946532324 /nfs/dbraw/zinc/53/23/24/946532324.db2.gz CWZOFIPTAHWOLO-UHFFFAOYSA-N -1 3 387.404 -1.425 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCC1(Nc2ncccc2-c2nnn[n-]2)CC1 ZINC001573514780 946532317 /nfs/dbraw/zinc/53/23/17/946532317.db2.gz CWZOFIPTAHWOLO-UHFFFAOYSA-N -1 3 387.404 -1.425 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCC1(Nc2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001573514784 946532302 /nfs/dbraw/zinc/53/23/02/946532302.db2.gz DBBZRGHGQTXYLQ-UHFFFAOYSA-N -1 3 387.404 -1.425 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCC1(Nc2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001573514784 946532298 /nfs/dbraw/zinc/53/22/98/946532298.db2.gz DBBZRGHGQTXYLQ-UHFFFAOYSA-N -1 3 387.404 -1.425 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001573514785 946532058 /nfs/dbraw/zinc/53/20/58/946532058.db2.gz DDJMXZRHJZLJMD-LLVKDONJSA-N -1 3 387.404 -1.791 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001573514785 946532056 /nfs/dbraw/zinc/53/20/56/946532056.db2.gz DDJMXZRHJZLJMD-LLVKDONJSA-N -1 3 387.404 -1.791 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001573514786 946533335 /nfs/dbraw/zinc/53/33/35/946533335.db2.gz DDJMXZRHJZLJMD-NSHDSACASA-N -1 3 387.404 -1.791 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001573514786 946533329 /nfs/dbraw/zinc/53/33/29/946533329.db2.gz DDJMXZRHJZLJMD-NSHDSACASA-N -1 3 387.404 -1.791 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)CNc1ncccc1-c1nn[n-]n1 ZINC001573514845 946535105 /nfs/dbraw/zinc/53/51/05/946535105.db2.gz FCJZWMFEHNOWHA-JTQLQIEISA-N -1 3 389.420 -1.322 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)CNc1ncccc1-c1nnn[n-]1 ZINC001573514845 946535092 /nfs/dbraw/zinc/53/50/92/946535092.db2.gz FCJZWMFEHNOWHA-JTQLQIEISA-N -1 3 389.420 -1.322 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)CNc1ncccc1-c1nn[n-]n1 ZINC001573514846 946535724 /nfs/dbraw/zinc/53/57/24/946535724.db2.gz FCJZWMFEHNOWHA-SNVBAGLBSA-N -1 3 389.420 -1.322 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)CNc1ncccc1-c1nnn[n-]1 ZINC001573514846 946535716 /nfs/dbraw/zinc/53/57/16/946535716.db2.gz FCJZWMFEHNOWHA-SNVBAGLBSA-N -1 3 389.420 -1.322 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)CN(C)c1ccc(-c2nn[n-]n2)nc1 ZINC001573514968 946534663 /nfs/dbraw/zinc/53/46/63/946534663.db2.gz FPBRERWKWSBFOE-JTQLQIEISA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)CN(C)c1ccc(-c2nnn[n-]2)nc1 ZINC001573514968 946534659 /nfs/dbraw/zinc/53/46/59/946534659.db2.gz FPBRERWKWSBFOE-JTQLQIEISA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)CN(C)c1ccc(-c2nn[n-]n2)nc1 ZINC001573514969 946535231 /nfs/dbraw/zinc/53/52/31/946535231.db2.gz FPBRERWKWSBFOE-SNVBAGLBSA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)CN(C)c1ccc(-c2nnn[n-]2)nc1 ZINC001573514969 946535220 /nfs/dbraw/zinc/53/52/20/946535220.db2.gz FPBRERWKWSBFOE-SNVBAGLBSA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CCc2c(sc(N)c2-c2nn[n-]n2)C1 ZINC001573514973 946536114 /nfs/dbraw/zinc/53/61/14/946536114.db2.gz FXRTYBHPPRZUER-UHFFFAOYSA-N -1 3 378.418 -1.353 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CCc2c(sc(N)c2-c2nnn[n-]2)C1 ZINC001573514973 946536103 /nfs/dbraw/zinc/53/61/03/946536103.db2.gz FXRTYBHPPRZUER-UHFFFAOYSA-N -1 3 378.418 -1.353 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCN(C)c1ccc(-c2nn[n-]n2)nc1 ZINC001573514977 946538142 /nfs/dbraw/zinc/53/81/42/946538142.db2.gz GAPPTUBELWNCJX-UHFFFAOYSA-N -1 3 375.393 -1.934 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCN(C)c1ccc(-c2nnn[n-]2)nc1 ZINC001573514977 946538132 /nfs/dbraw/zinc/53/81/32/946538132.db2.gz GAPPTUBELWNCJX-UHFFFAOYSA-N -1 3 375.393 -1.934 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CC[C@@H](Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001573514991 946536932 /nfs/dbraw/zinc/53/69/32/946536932.db2.gz GHLNJEPMBFJWFE-GFCCVEGCSA-N -1 3 387.404 -1.473 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CC[C@@H](Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001573514991 946536922 /nfs/dbraw/zinc/53/69/22/946536922.db2.gz GHLNJEPMBFJWFE-GFCCVEGCSA-N -1 3 387.404 -1.473 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CC[C@H](Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001573514993 946537805 /nfs/dbraw/zinc/53/78/05/946537805.db2.gz GHLNJEPMBFJWFE-LBPRGKRZSA-N -1 3 387.404 -1.473 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CC[C@H](Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001573514993 946537793 /nfs/dbraw/zinc/53/77/93/946537793.db2.gz GHLNJEPMBFJWFE-LBPRGKRZSA-N -1 3 387.404 -1.473 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)[C@@H](C)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001573515049 946536817 /nfs/dbraw/zinc/53/68/17/946536817.db2.gz HBRVNLYPLHVEJF-JTQLQIEISA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)[C@@H](C)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001573515049 946536810 /nfs/dbraw/zinc/53/68/10/946536810.db2.gz HBRVNLYPLHVEJF-JTQLQIEISA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)[C@H](C)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001573515051 946537196 /nfs/dbraw/zinc/53/71/96/946537196.db2.gz HBRVNLYPLHVEJF-SNVBAGLBSA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)[C@H](C)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001573515051 946537186 /nfs/dbraw/zinc/53/71/86/946537186.db2.gz HBRVNLYPLHVEJF-SNVBAGLBSA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCC[C@H](C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001573515119 946537389 /nfs/dbraw/zinc/53/73/89/946537389.db2.gz IAWQMKQJAZWWIB-JTQLQIEISA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCC[C@H](C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001573515119 946537376 /nfs/dbraw/zinc/53/73/76/946537376.db2.gz IAWQMKQJAZWWIB-JTQLQIEISA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCC[C@H](C)Nc1ncccc1-c1nn[n-]n1 ZINC001573515146 946540777 /nfs/dbraw/zinc/54/07/77/946540777.db2.gz IKJHSGYJAIOOMR-JTQLQIEISA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCC[C@H](C)Nc1ncccc1-c1nnn[n-]1 ZINC001573515146 946540764 /nfs/dbraw/zinc/54/07/64/946540764.db2.gz IKJHSGYJAIOOMR-JTQLQIEISA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCC[C@@H](C)Nc1ncccc1-c1nn[n-]n1 ZINC001573515147 946539868 /nfs/dbraw/zinc/53/98/68/946539868.db2.gz IKJHSGYJAIOOMR-SNVBAGLBSA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCC[C@@H](C)Nc1ncccc1-c1nnn[n-]1 ZINC001573515147 946539858 /nfs/dbraw/zinc/53/98/58/946539858.db2.gz IKJHSGYJAIOOMR-SNVBAGLBSA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)CCNc1ccc(-c2nn[n-]n2)cn1 ZINC001573515156 946540387 /nfs/dbraw/zinc/54/03/87/946540387.db2.gz INCKJZSNVOEUIA-UHFFFAOYSA-N -1 3 375.393 -1.616 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)CCNc1ccc(-c2nnn[n-]2)cn1 ZINC001573515156 946540381 /nfs/dbraw/zinc/54/03/81/946540381.db2.gz INCKJZSNVOEUIA-UHFFFAOYSA-N -1 3 375.393 -1.616 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)CN(C)c1ncccc1-c1nn[n-]n1 ZINC001573515195 946539725 /nfs/dbraw/zinc/53/97/25/946539725.db2.gz IXHAVWHZXXVGCG-JTQLQIEISA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)CN(C)c1ncccc1-c1nnn[n-]1 ZINC001573515195 946539713 /nfs/dbraw/zinc/53/97/13/946539713.db2.gz IXHAVWHZXXVGCG-JTQLQIEISA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)CN(C)c1ncccc1-c1nn[n-]n1 ZINC001573515197 946540303 /nfs/dbraw/zinc/54/03/03/946540303.db2.gz IXHAVWHZXXVGCG-SNVBAGLBSA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)CN(C)c1ncccc1-c1nnn[n-]1 ZINC001573515197 946540287 /nfs/dbraw/zinc/54/02/87/946540287.db2.gz IXHAVWHZXXVGCG-SNVBAGLBSA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)[C@@H](C)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001573515206 946540463 /nfs/dbraw/zinc/54/04/63/946540463.db2.gz IYZRHKXYDJVBOR-NXEZZACHSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)[C@@H](C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001573515206 946540456 /nfs/dbraw/zinc/54/04/56/946540456.db2.gz IYZRHKXYDJVBOR-NXEZZACHSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)[C@H](C)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001573515208 946541000 /nfs/dbraw/zinc/54/10/00/946541000.db2.gz IYZRHKXYDJVBOR-UWVGGRQHSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)[C@H](C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001573515208 946540989 /nfs/dbraw/zinc/54/09/89/946540989.db2.gz IYZRHKXYDJVBOR-UWVGGRQHSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)[C@H](C)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001573515210 946540251 /nfs/dbraw/zinc/54/02/51/946540251.db2.gz IYZRHKXYDJVBOR-VHSXEESVSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)[C@H](C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001573515210 946540243 /nfs/dbraw/zinc/54/02/43/946540243.db2.gz IYZRHKXYDJVBOR-VHSXEESVSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)[C@@H](C)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001573515212 946539551 /nfs/dbraw/zinc/53/95/51/946539551.db2.gz IYZRHKXYDJVBOR-ZJUUUORDSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)[C@@H](C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001573515212 946539542 /nfs/dbraw/zinc/53/95/42/946539542.db2.gz IYZRHKXYDJVBOR-ZJUUUORDSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001573515218 946541602 /nfs/dbraw/zinc/54/16/02/946541602.db2.gz JBKQHDPRTBWNQH-HAQNSBGRSA-N -1 3 387.404 -1.427 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H]1C[C@H](Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001573515218 946541598 /nfs/dbraw/zinc/54/15/98/946541598.db2.gz JBKQHDPRTBWNQH-HAQNSBGRSA-N -1 3 387.404 -1.427 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H]1C[C@@H](Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001573515220 946539832 /nfs/dbraw/zinc/53/98/32/946539832.db2.gz JBKQHDPRTBWNQH-TXEJJXNPSA-N -1 3 387.404 -1.427 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H]1C[C@@H](Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001573515220 946539819 /nfs/dbraw/zinc/53/98/19/946539819.db2.gz JBKQHDPRTBWNQH-TXEJJXNPSA-N -1 3 387.404 -1.427 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CC[C@@H](Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001573515223 946539937 /nfs/dbraw/zinc/53/99/37/946539937.db2.gz JEDZMPZWXTUSDZ-GFCCVEGCSA-N -1 3 387.404 -1.473 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CC[C@@H](Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001573515223 946539931 /nfs/dbraw/zinc/53/99/31/946539931.db2.gz JEDZMPZWXTUSDZ-GFCCVEGCSA-N -1 3 387.404 -1.473 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CC[C@H](Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001573515224 946541529 /nfs/dbraw/zinc/54/15/29/946541529.db2.gz JEDZMPZWXTUSDZ-LBPRGKRZSA-N -1 3 387.404 -1.473 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CC[C@H](Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001573515224 946541522 /nfs/dbraw/zinc/54/15/22/946541522.db2.gz JEDZMPZWXTUSDZ-LBPRGKRZSA-N -1 3 387.404 -1.473 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)Nc1ccc(-c2nn[n-]n2)c(C)n1 ZINC001573515226 946540167 /nfs/dbraw/zinc/54/01/67/946540167.db2.gz JHCUTDQJRMXDLW-SECBINFHSA-N -1 3 389.420 -1.261 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)Nc1ccc(-c2nnn[n-]2)c(C)n1 ZINC001573515226 946540158 /nfs/dbraw/zinc/54/01/58/946540158.db2.gz JHCUTDQJRMXDLW-SECBINFHSA-N -1 3 389.420 -1.261 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)Nc1ccc(-c2nn[n-]n2)c(C)n1 ZINC001573515231 946541305 /nfs/dbraw/zinc/54/13/05/946541305.db2.gz JHCUTDQJRMXDLW-VIFPVBQESA-N -1 3 389.420 -1.261 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)Nc1ccc(-c2nnn[n-]2)c(C)n1 ZINC001573515231 946541297 /nfs/dbraw/zinc/54/12/97/946541297.db2.gz JHCUTDQJRMXDLW-VIFPVBQESA-N -1 3 389.420 -1.261 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCN(C)c1nc(C)ccc1-c1nn[n-]n1 ZINC001573515241 946540442 /nfs/dbraw/zinc/54/04/42/946540442.db2.gz JMXHWCOLWOSXTG-UHFFFAOYSA-N -1 3 389.420 -1.625 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCN(C)c1nc(C)ccc1-c1nnn[n-]1 ZINC001573515241 946540433 /nfs/dbraw/zinc/54/04/33/946540433.db2.gz JMXHWCOLWOSXTG-UHFFFAOYSA-N -1 3 389.420 -1.625 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCN(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001573515251 946541189 /nfs/dbraw/zinc/54/11/89/946541189.db2.gz JQXIQJISJICMMP-UHFFFAOYSA-N -1 3 375.393 -1.934 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCN(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001573515251 946541178 /nfs/dbraw/zinc/54/11/78/946541178.db2.gz JQXIQJISJICMMP-UHFFFAOYSA-N -1 3 375.393 -1.934 20 0 GAADHM CC(=O)NCC(=O)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O ZINC001573515286 946540021 /nfs/dbraw/zinc/54/00/21/946540021.db2.gz KAFRXMAKRCNHRP-CMPLNLGQSA-N -1 3 376.377 -1.978 20 0 GAADHM CC(=O)NCC(=O)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O ZINC001573515286 946540013 /nfs/dbraw/zinc/54/00/13/946540013.db2.gz KAFRXMAKRCNHRP-CMPLNLGQSA-N -1 3 376.377 -1.978 20 0 GAADHM CC(=O)NCC(=O)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O ZINC001573515287 946540742 /nfs/dbraw/zinc/54/07/42/946540742.db2.gz KAFRXMAKRCNHRP-JQWIXIFHSA-N -1 3 376.377 -1.978 20 0 GAADHM CC(=O)NCC(=O)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O ZINC001573515287 946540731 /nfs/dbraw/zinc/54/07/31/946540731.db2.gz KAFRXMAKRCNHRP-JQWIXIFHSA-N -1 3 376.377 -1.978 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O ZINC001573515288 946540815 /nfs/dbraw/zinc/54/08/15/946540815.db2.gz KAFRXMAKRCNHRP-PWSUYJOCSA-N -1 3 376.377 -1.978 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O ZINC001573515288 946540801 /nfs/dbraw/zinc/54/08/01/946540801.db2.gz KAFRXMAKRCNHRP-PWSUYJOCSA-N -1 3 376.377 -1.978 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O ZINC001573515290 946540863 /nfs/dbraw/zinc/54/08/63/946540863.db2.gz KAFRXMAKRCNHRP-ZYHUDNBSSA-N -1 3 376.377 -1.978 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O ZINC001573515290 946540844 /nfs/dbraw/zinc/54/08/44/946540844.db2.gz KAFRXMAKRCNHRP-ZYHUDNBSSA-N -1 3 376.377 -1.978 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCN(C)c1ccc(-c2nn[n-]n2)c(C)n1 ZINC001573515307 946542862 /nfs/dbraw/zinc/54/28/62/946542862.db2.gz KJNMZAOHCLXZKQ-UHFFFAOYSA-N -1 3 389.420 -1.625 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCN(C)c1ccc(-c2nnn[n-]2)c(C)n1 ZINC001573515307 946542859 /nfs/dbraw/zinc/54/28/59/946542859.db2.gz KJNMZAOHCLXZKQ-UHFFFAOYSA-N -1 3 389.420 -1.625 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)N(C)c1ncccc1-c1nn[n-]n1 ZINC001573515325 946544035 /nfs/dbraw/zinc/54/40/35/946544035.db2.gz KXKUBVGJXJRSKQ-JTQLQIEISA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)N(C)c1ncccc1-c1nnn[n-]1 ZINC001573515325 946544022 /nfs/dbraw/zinc/54/40/22/946544022.db2.gz KXKUBVGJXJRSKQ-JTQLQIEISA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)N(C)c1ncccc1-c1nn[n-]n1 ZINC001573515327 946542323 /nfs/dbraw/zinc/54/23/23/946542323.db2.gz KXKUBVGJXJRSKQ-SNVBAGLBSA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)N(C)c1ncccc1-c1nnn[n-]1 ZINC001573515327 946542313 /nfs/dbraw/zinc/54/23/13/946542313.db2.gz KXKUBVGJXJRSKQ-SNVBAGLBSA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)[C@@H](C)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001573515346 946542670 /nfs/dbraw/zinc/54/26/70/946542670.db2.gz LDFUJADHOYOTLX-JTQLQIEISA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)[C@@H](C)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001573515346 946542663 /nfs/dbraw/zinc/54/26/63/946542663.db2.gz LDFUJADHOYOTLX-JTQLQIEISA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)[C@H](C)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001573515348 946543210 /nfs/dbraw/zinc/54/32/10/946543210.db2.gz LDFUJADHOYOTLX-SNVBAGLBSA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)[C@H](C)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001573515348 946543206 /nfs/dbraw/zinc/54/32/06/946543206.db2.gz LDFUJADHOYOTLX-SNVBAGLBSA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001573515350 946544281 /nfs/dbraw/zinc/54/42/81/946544281.db2.gz LDZYNAUJPZQFLO-SECBINFHSA-N -1 3 375.393 -1.569 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001573515350 946544276 /nfs/dbraw/zinc/54/42/76/946544276.db2.gz LDZYNAUJPZQFLO-SECBINFHSA-N -1 3 375.393 -1.569 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)CCNc1ccc(-c2nn[n-]n2)cn1 ZINC001573515400 946542692 /nfs/dbraw/zinc/54/26/92/946542692.db2.gz LYMLXAUNAUIQEL-JTQLQIEISA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)CCNc1ccc(-c2nnn[n-]2)cn1 ZINC001573515400 946542687 /nfs/dbraw/zinc/54/26/87/946542687.db2.gz LYMLXAUNAUIQEL-JTQLQIEISA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)CCNc1ccc(-c2nn[n-]n2)cn1 ZINC001573515401 946542882 /nfs/dbraw/zinc/54/28/82/946542882.db2.gz LYMLXAUNAUIQEL-SNVBAGLBSA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)CCNc1ccc(-c2nnn[n-]2)cn1 ZINC001573515401 946542872 /nfs/dbraw/zinc/54/28/72/946542872.db2.gz LYMLXAUNAUIQEL-SNVBAGLBSA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)N[C@H]1COC2(CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)C1 ZINC001573515443 946546316 /nfs/dbraw/zinc/54/63/16/946546316.db2.gz MLXFVBRFBYBLBZ-LLVKDONJSA-N -1 3 388.388 -1.569 20 0 GAADHM CC(=O)NCC(=O)N[C@H]1COC2(CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)C1 ZINC001573515443 946546313 /nfs/dbraw/zinc/54/63/13/946546313.db2.gz MLXFVBRFBYBLBZ-LLVKDONJSA-N -1 3 388.388 -1.569 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1COC2(CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)C1 ZINC001573515445 946546618 /nfs/dbraw/zinc/54/66/18/946546618.db2.gz MLXFVBRFBYBLBZ-NSHDSACASA-N -1 3 388.388 -1.569 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1COC2(CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)C1 ZINC001573515445 946546606 /nfs/dbraw/zinc/54/66/06/946546606.db2.gz MLXFVBRFBYBLBZ-NSHDSACASA-N -1 3 388.388 -1.569 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)CNc1nc(C)ccc1-c1nn[n-]n1 ZINC001573515497 946546351 /nfs/dbraw/zinc/54/63/51/946546351.db2.gz NEYQXGOABFLNCO-JTQLQIEISA-N -1 3 389.420 -1.261 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)CNc1nc(C)ccc1-c1nnn[n-]1 ZINC001573515497 946546348 /nfs/dbraw/zinc/54/63/48/946546348.db2.gz NEYQXGOABFLNCO-JTQLQIEISA-N -1 3 389.420 -1.261 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)CNc1nc(C)ccc1-c1nn[n-]n1 ZINC001573515499 946546337 /nfs/dbraw/zinc/54/63/37/946546337.db2.gz NEYQXGOABFLNCO-SNVBAGLBSA-N -1 3 389.420 -1.261 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)CNc1nc(C)ccc1-c1nnn[n-]1 ZINC001573515499 946546335 /nfs/dbraw/zinc/54/63/35/946546335.db2.gz NEYQXGOABFLNCO-SNVBAGLBSA-N -1 3 389.420 -1.261 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CC[C@@H](Nc2ncccc2-c2nn[n-]n2)C1 ZINC001573515630 946545567 /nfs/dbraw/zinc/54/55/67/946545567.db2.gz OBBNTNSWZANFRF-LLVKDONJSA-N -1 3 387.404 -1.473 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CC[C@@H](Nc2ncccc2-c2nnn[n-]2)C1 ZINC001573515630 946545557 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946547718 /nfs/dbraw/zinc/54/77/18/946547718.db2.gz OJFYBLBPGRNFIO-VIFPVBQESA-N -1 3 375.393 -1.569 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001573515651 946547789 /nfs/dbraw/zinc/54/77/89/946547789.db2.gz OPJBGSUYRUNVMD-UHFFFAOYSA-N -1 3 387.404 -1.837 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001573515651 946547782 /nfs/dbraw/zinc/54/77/82/946547782.db2.gz OPJBGSUYRUNVMD-UHFFFAOYSA-N -1 3 387.404 -1.837 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CCN(c2snc(C)c2-c2nnn[n-]2)C[C@H]1O ZINC001573515654 946547683 /nfs/dbraw/zinc/54/76/83/946547683.db2.gz ORHKNQDKPKWNGE-NXEZZACHSA-N -1 3 380.434 -1.176 20 0 GAADHM CC(=O)NCC(=O)N[C@H]1CCN(c2snc(C)c2-c2nnn[n-]2)C[C@@H]1O ZINC001573515655 946549409 /nfs/dbraw/zinc/54/94/09/946549409.db2.gz ORHKNQDKPKWNGE-UWVGGRQHSA-N -1 3 380.434 -1.176 20 0 GAADHM CC(=O)NCC(=O)N[C@H]1CCN(c2snc(C)c2-c2nnn[n-]2)C[C@H]1O ZINC001573515656 946548314 /nfs/dbraw/zinc/54/83/14/946548314.db2.gz ORHKNQDKPKWNGE-VHSXEESVSA-N -1 3 380.434 -1.176 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CCN(c2snc(C)c2-c2nnn[n-]2)C[C@@H]1O ZINC001573515657 946547849 /nfs/dbraw/zinc/54/78/49/946547849.db2.gz ORHKNQDKPKWNGE-ZJUUUORDSA-N -1 3 380.434 -1.176 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC1CN(Cc2ccc(-c3nn[n-]n3)cc2)C1 ZINC001573515658 946549016 /nfs/dbraw/zinc/54/90/16/946549016.db2.gz OSAIABYNWPPNLW-UHFFFAOYSA-N -1 3 386.416 -1.581 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC1CN(Cc2ccc(-c3nnn[n-]3)cc2)C1 ZINC001573515658 946549009 /nfs/dbraw/zinc/54/90/09/946549009.db2.gz OSAIABYNWPPNLW-UHFFFAOYSA-N -1 3 386.416 -1.581 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)C[C@H](C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001573515659 946549313 /nfs/dbraw/zinc/54/93/13/946549313.db2.gz OTUGWSBUARXIGD-JTQLQIEISA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)C[C@H](C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001573515659 946549305 /nfs/dbraw/zinc/54/93/05/946549305.db2.gz OTUGWSBUARXIGD-JTQLQIEISA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)C[C@@H](C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001573515660 946549117 /nfs/dbraw/zinc/54/91/17/946549117.db2.gz OTUGWSBUARXIGD-SNVBAGLBSA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)C[C@@H](C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001573515660 946549111 /nfs/dbraw/zinc/54/91/11/946549111.db2.gz OTUGWSBUARXIGD-SNVBAGLBSA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001573515676 946547583 /nfs/dbraw/zinc/54/75/83/946547583.db2.gz OYQXSWUUNSPKQB-UHFFFAOYSA-N -1 3 387.404 -1.837 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001573515676 946547577 /nfs/dbraw/zinc/54/75/77/946547577.db2.gz OYQXSWUUNSPKQB-UHFFFAOYSA-N -1 3 387.404 -1.837 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC1CN(Cc2ccccc2-c2nn[n-]n2)C1 ZINC001573515691 946547767 /nfs/dbraw/zinc/54/77/67/946547767.db2.gz PBLKIVXVQPBVMW-UHFFFAOYSA-N -1 3 386.416 -1.581 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC1CN(Cc2ccccc2-c2nnn[n-]2)C1 ZINC001573515691 946547760 /nfs/dbraw/zinc/54/77/60/946547760.db2.gz PBLKIVXVQPBVMW-UHFFFAOYSA-N -1 3 386.416 -1.581 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)CCNc1ccc(-c2nn[n-]n2)nc1 ZINC001573515696 946548515 /nfs/dbraw/zinc/54/85/15/946548515.db2.gz PFKNFGGDGKEBFP-JTQLQIEISA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)CCNc1ccc(-c2nnn[n-]2)nc1 ZINC001573515696 946548505 /nfs/dbraw/zinc/54/85/05/946548505.db2.gz PFKNFGGDGKEBFP-JTQLQIEISA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)CCNc1ccc(-c2nn[n-]n2)nc1 ZINC001573515697 946548950 /nfs/dbraw/zinc/54/89/50/946548950.db2.gz PFKNFGGDGKEBFP-SNVBAGLBSA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)CCNc1ccc(-c2nnn[n-]2)nc1 ZINC001573515697 946548947 /nfs/dbraw/zinc/54/89/47/946548947.db2.gz PFKNFGGDGKEBFP-SNVBAGLBSA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)[C@@H](C)Nc1ncccc1-c1nn[n-]n1 ZINC001573515717 946550865 /nfs/dbraw/zinc/55/08/65/946550865.db2.gz PUTFMOGYOZDAHL-NXEZZACHSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)[C@@H](C)Nc1ncccc1-c1nnn[n-]1 ZINC001573515717 946550857 /nfs/dbraw/zinc/55/08/57/946550857.db2.gz PUTFMOGYOZDAHL-NXEZZACHSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)[C@H](C)Nc1ncccc1-c1nn[n-]n1 ZINC001573515718 946550248 /nfs/dbraw/zinc/55/02/48/946550248.db2.gz PUTFMOGYOZDAHL-UWVGGRQHSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)[C@H](C)Nc1ncccc1-c1nnn[n-]1 ZINC001573515718 946550243 /nfs/dbraw/zinc/55/02/43/946550243.db2.gz PUTFMOGYOZDAHL-UWVGGRQHSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)[C@@H](C)Nc1ncccc1-c1nn[n-]n1 ZINC001573515719 946552226 /nfs/dbraw/zinc/55/22/26/946552226.db2.gz PUTFMOGYOZDAHL-VHSXEESVSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)[C@@H](C)Nc1ncccc1-c1nnn[n-]1 ZINC001573515719 946552213 /nfs/dbraw/zinc/55/22/13/946552213.db2.gz PUTFMOGYOZDAHL-VHSXEESVSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)[C@H](C)Nc1ncccc1-c1nn[n-]n1 ZINC001573515720 946551386 /nfs/dbraw/zinc/55/13/86/946551386.db2.gz PUTFMOGYOZDAHL-ZJUUUORDSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)[C@H](C)Nc1ncccc1-c1nnn[n-]1 ZINC001573515720 946551375 /nfs/dbraw/zinc/55/13/75/946551375.db2.gz PUTFMOGYOZDAHL-ZJUUUORDSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001573515727 946551706 /nfs/dbraw/zinc/55/17/06/946551706.db2.gz PXTSVJXPLWYUML-HAQNSBGRSA-N -1 3 387.404 -1.427 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H]1C[C@H](Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001573515727 946551697 /nfs/dbraw/zinc/55/16/97/946551697.db2.gz PXTSVJXPLWYUML-HAQNSBGRSA-N -1 3 387.404 -1.427 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H]1C[C@@H](Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001573515728 946550589 /nfs/dbraw/zinc/55/05/89/946550589.db2.gz PXTSVJXPLWYUML-TXEJJXNPSA-N -1 3 387.404 -1.427 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H]1C[C@@H](Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001573515728 946550580 /nfs/dbraw/zinc/55/05/80/946550580.db2.gz PXTSVJXPLWYUML-TXEJJXNPSA-N -1 3 387.404 -1.427 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCCN(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001573515732 946550663 /nfs/dbraw/zinc/55/06/63/946550663.db2.gz QAZOGIGENKTPRC-UHFFFAOYSA-N -1 3 389.420 -1.544 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCCN(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001573515732 946550653 /nfs/dbraw/zinc/55/06/53/946550653.db2.gz QAZOGIGENKTPRC-UHFFFAOYSA-N -1 3 389.420 -1.544 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001573515735 946552170 /nfs/dbraw/zinc/55/21/70/946552170.db2.gz QCQQBTBHMDXMMS-UHFFFAOYSA-N -1 3 387.404 -1.837 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001573515735 946552159 /nfs/dbraw/zinc/55/21/59/946552159.db2.gz QCQQBTBHMDXMMS-UHFFFAOYSA-N -1 3 387.404 -1.837 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)C[C@H](C)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001573515775 946550977 /nfs/dbraw/zinc/55/09/77/946550977.db2.gz RAQYESWALYYNQW-JTQLQIEISA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)C[C@H](C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001573515775 946550966 /nfs/dbraw/zinc/55/09/66/946550966.db2.gz RAQYESWALYYNQW-JTQLQIEISA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)C[C@@H](C)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001573515776 946550359 /nfs/dbraw/zinc/55/03/59/946550359.db2.gz RAQYESWALYYNQW-SNVBAGLBSA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)C[C@@H](C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001573515776 946550351 /nfs/dbraw/zinc/55/03/51/946550351.db2.gz RAQYESWALYYNQW-SNVBAGLBSA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)Nc1ncccc1-c1nn[n-]n1 ZINC001573515777 946551600 /nfs/dbraw/zinc/55/16/00/946551600.db2.gz RDCQHSRMNHBPLF-SECBINFHSA-N -1 3 375.393 -1.569 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)Nc1ncccc1-c1nnn[n-]1 ZINC001573515777 946551596 /nfs/dbraw/zinc/55/15/96/946551596.db2.gz RDCQHSRMNHBPLF-SECBINFHSA-N -1 3 375.393 -1.569 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)Nc1ncccc1-c1nn[n-]n1 ZINC001573515778 946551974 /nfs/dbraw/zinc/55/19/74/946551974.db2.gz RDCQHSRMNHBPLF-VIFPVBQESA-N -1 3 375.393 -1.569 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)Nc1ncccc1-c1nnn[n-]1 ZINC001573515778 946551967 /nfs/dbraw/zinc/55/19/67/946551967.db2.gz RDCQHSRMNHBPLF-VIFPVBQESA-N -1 3 375.393 -1.569 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)[C@@H](C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001573515786 946551537 /nfs/dbraw/zinc/55/15/37/946551537.db2.gz RJLQQPNNLRGJDJ-NXEZZACHSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)[C@@H](C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001573515786 946551530 /nfs/dbraw/zinc/55/15/30/946551530.db2.gz RJLQQPNNLRGJDJ-NXEZZACHSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)[C@H](C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001573515787 946551489 /nfs/dbraw/zinc/55/14/89/946551489.db2.gz RJLQQPNNLRGJDJ-UWVGGRQHSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)[C@H](C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001573515787 946551482 /nfs/dbraw/zinc/55/14/82/946551482.db2.gz RJLQQPNNLRGJDJ-UWVGGRQHSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)[C@H](C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001573515788 946551144 /nfs/dbraw/zinc/55/11/44/946551144.db2.gz RJLQQPNNLRGJDJ-VHSXEESVSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)[C@H](C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001573515788 946551140 /nfs/dbraw/zinc/55/11/40/946551140.db2.gz RJLQQPNNLRGJDJ-VHSXEESVSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)[C@@H](C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001573515789 946552073 /nfs/dbraw/zinc/55/20/73/946552073.db2.gz RJLQQPNNLRGJDJ-ZJUUUORDSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)[C@@H](C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001573515789 946552060 /nfs/dbraw/zinc/55/20/60/946552060.db2.gz RJLQQPNNLRGJDJ-ZJUUUORDSA-N -1 3 389.420 -1.181 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001573515913 946553898 /nfs/dbraw/zinc/55/38/98/946553898.db2.gz SECWEHSBMXXSLC-SECBINFHSA-N -1 3 375.393 -1.569 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001573515913 946553892 /nfs/dbraw/zinc/55/38/92/946553892.db2.gz SECWEHSBMXXSLC-SECBINFHSA-N -1 3 375.393 -1.569 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001573515914 946554382 /nfs/dbraw/zinc/55/43/82/946554382.db2.gz SECWEHSBMXXSLC-VIFPVBQESA-N -1 3 375.393 -1.569 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001573515914 946554375 /nfs/dbraw/zinc/55/43/75/946554375.db2.gz SECWEHSBMXXSLC-VIFPVBQESA-N -1 3 375.393 -1.569 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)CNc1ccc(-c2nn[n-]n2)c(C)n1 ZINC001573515937 946553796 /nfs/dbraw/zinc/55/37/96/946553796.db2.gz SPFCNLFSPFJHQQ-SECBINFHSA-N -1 3 389.420 -1.261 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)CNc1ccc(-c2nnn[n-]2)c(C)n1 ZINC001573515937 946553786 /nfs/dbraw/zinc/55/37/86/946553786.db2.gz SPFCNLFSPFJHQQ-SECBINFHSA-N -1 3 389.420 -1.261 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)CN(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001573515940 946553500 /nfs/dbraw/zinc/55/35/00/946553500.db2.gz SXKKFMXWOPJWDG-JTQLQIEISA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)CN(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001573515940 946553488 /nfs/dbraw/zinc/55/34/88/946553488.db2.gz SXKKFMXWOPJWDG-JTQLQIEISA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)CN(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001573515941 946553411 /nfs/dbraw/zinc/55/34/11/946553411.db2.gz SXKKFMXWOPJWDG-SNVBAGLBSA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)CN(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001573515941 946553403 /nfs/dbraw/zinc/55/34/03/946553403.db2.gz SXKKFMXWOPJWDG-SNVBAGLBSA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001573515961 946554361 /nfs/dbraw/zinc/55/43/61/946554361.db2.gz UEBIYWZEHZRESQ-JTQLQIEISA-N -1 3 389.420 -1.322 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001573515961 946554348 /nfs/dbraw/zinc/55/43/48/946554348.db2.gz UEBIYWZEHZRESQ-JTQLQIEISA-N -1 3 389.420 -1.322 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001573515963 946553850 /nfs/dbraw/zinc/55/38/50/946553850.db2.gz UEBIYWZEHZRESQ-SNVBAGLBSA-N -1 3 389.420 -1.322 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001573515963 946553840 /nfs/dbraw/zinc/55/38/40/946553840.db2.gz UEBIYWZEHZRESQ-SNVBAGLBSA-N -1 3 389.420 -1.322 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)C[C@H](C)Nc1ncccc1-c1nn[n-]n1 ZINC001573516109 946557285 /nfs/dbraw/zinc/55/72/85/946557285.db2.gz USWTWQNUDUUYJF-JTQLQIEISA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)C[C@H](C)Nc1ncccc1-c1nnn[n-]1 ZINC001573516109 946557279 /nfs/dbraw/zinc/55/72/79/946557279.db2.gz USWTWQNUDUUYJF-JTQLQIEISA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)C[C@@H](C)Nc1ncccc1-c1nn[n-]n1 ZINC001573516112 946557670 /nfs/dbraw/zinc/55/76/70/946557670.db2.gz USWTWQNUDUUYJF-SNVBAGLBSA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)C[C@@H](C)Nc1ncccc1-c1nnn[n-]1 ZINC001573516112 946557668 /nfs/dbraw/zinc/55/76/68/946557668.db2.gz USWTWQNUDUUYJF-SNVBAGLBSA-N -1 3 389.420 -1.227 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)N(C)c1ccc(-c2nn[n-]n2)nc1 ZINC001573516116 946557072 /nfs/dbraw/zinc/55/70/72/946557072.db2.gz UUSDHPANTXAPOT-JTQLQIEISA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)N(C)c1ccc(-c2nnn[n-]2)nc1 ZINC001573516116 946557066 /nfs/dbraw/zinc/55/70/66/946557066.db2.gz UUSDHPANTXAPOT-JTQLQIEISA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)N(C)c1ccc(-c2nn[n-]n2)nc1 ZINC001573516119 946555576 /nfs/dbraw/zinc/55/55/76/946555576.db2.gz UUSDHPANTXAPOT-SNVBAGLBSA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)N(C)c1ccc(-c2nnn[n-]2)nc1 ZINC001573516119 946555569 /nfs/dbraw/zinc/55/55/69/946555569.db2.gz UUSDHPANTXAPOT-SNVBAGLBSA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)N[C@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1O ZINC001573516121 946557259 /nfs/dbraw/zinc/55/72/59/946557259.db2.gz UXXCBXGQJGZDGB-CMPLNLGQSA-N -1 3 376.377 -1.978 20 0 GAADHM CC(=O)NCC(=O)N[C@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1O ZINC001573516121 946557252 /nfs/dbraw/zinc/55/72/52/946557252.db2.gz UXXCBXGQJGZDGB-CMPLNLGQSA-N -1 3 376.377 -1.978 20 0 GAADHM CC(=O)NCC(=O)N[C@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O ZINC001573516123 946556218 /nfs/dbraw/zinc/55/62/18/946556218.db2.gz UXXCBXGQJGZDGB-JQWIXIFHSA-N -1 3 376.377 -1.978 20 0 GAADHM CC(=O)NCC(=O)N[C@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O ZINC001573516123 946556215 /nfs/dbraw/zinc/55/62/15/946556215.db2.gz UXXCBXGQJGZDGB-JQWIXIFHSA-N -1 3 376.377 -1.978 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O ZINC001573516124 946557345 /nfs/dbraw/zinc/55/73/45/946557345.db2.gz UXXCBXGQJGZDGB-PWSUYJOCSA-N -1 3 376.377 -1.978 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O ZINC001573516124 946557337 /nfs/dbraw/zinc/55/73/37/946557337.db2.gz UXXCBXGQJGZDGB-PWSUYJOCSA-N -1 3 376.377 -1.978 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1O ZINC001573516125 946556670 /nfs/dbraw/zinc/55/66/70/946556670.db2.gz UXXCBXGQJGZDGB-ZYHUDNBSSA-N -1 3 376.377 -1.978 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1O ZINC001573516125 946556664 /nfs/dbraw/zinc/55/66/64/946556664.db2.gz UXXCBXGQJGZDGB-ZYHUDNBSSA-N -1 3 376.377 -1.978 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCN(C)c1cccc(F)c1-c1nn[n-]n1 ZINC001573516140 946556976 /nfs/dbraw/zinc/55/69/76/946556976.db2.gz VDXBIMKPTFWLCP-UHFFFAOYSA-N -1 3 392.395 -1.190 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCN(C)c1cccc(F)c1-c1nnn[n-]1 ZINC001573516140 946556972 /nfs/dbraw/zinc/55/69/72/946556972.db2.gz VDXBIMKPTFWLCP-UHFFFAOYSA-N -1 3 392.395 -1.190 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001573516143 946555892 /nfs/dbraw/zinc/55/58/92/946555892.db2.gz VGOYSWVRWIGDAW-GFCCVEGCSA-N -1 3 387.404 -1.791 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001573516143 946555885 /nfs/dbraw/zinc/55/58/85/946555885.db2.gz VGOYSWVRWIGDAW-GFCCVEGCSA-N -1 3 387.404 -1.791 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001573516145 946556611 /nfs/dbraw/zinc/55/66/11/946556611.db2.gz VGOYSWVRWIGDAW-LBPRGKRZSA-N -1 3 387.404 -1.791 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001573516145 946556604 /nfs/dbraw/zinc/55/66/04/946556604.db2.gz VGOYSWVRWIGDAW-LBPRGKRZSA-N -1 3 387.404 -1.791 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCC1(Nc2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001573516146 946557151 /nfs/dbraw/zinc/55/71/51/946557151.db2.gz VJXLDSODXVWHQU-UHFFFAOYSA-N -1 3 387.404 -1.425 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCC1(Nc2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001573516146 946557144 /nfs/dbraw/zinc/55/71/44/946557144.db2.gz VJXLDSODXVWHQU-UHFFFAOYSA-N -1 3 387.404 -1.425 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001573516171 946556870 /nfs/dbraw/zinc/55/68/70/946556870.db2.gz VQXUDRJLQPXNDT-JTQLQIEISA-N -1 3 389.420 -1.322 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001573516171 946556861 /nfs/dbraw/zinc/55/68/61/946556861.db2.gz VQXUDRJLQPXNDT-JTQLQIEISA-N -1 3 389.420 -1.322 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001573516172 946557511 /nfs/dbraw/zinc/55/75/11/946557511.db2.gz VQXUDRJLQPXNDT-SNVBAGLBSA-N -1 3 389.420 -1.322 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001573516172 946557503 /nfs/dbraw/zinc/55/75/03/946557503.db2.gz VQXUDRJLQPXNDT-SNVBAGLBSA-N -1 3 389.420 -1.322 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1COC2(CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)C1 ZINC001573516176 946557777 /nfs/dbraw/zinc/55/77/77/946557777.db2.gz VTIYUQORQPFLNO-JTQLQIEISA-N -1 3 388.388 -1.569 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1COC2(CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)C1 ZINC001573516176 946557772 /nfs/dbraw/zinc/55/77/72/946557772.db2.gz VTIYUQORQPFLNO-JTQLQIEISA-N -1 3 388.388 -1.569 20 0 GAADHM CC(=O)NCC(=O)N[C@H]1COC2(CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)C1 ZINC001573516179 946557829 /nfs/dbraw/zinc/55/78/29/946557829.db2.gz VTIYUQORQPFLNO-SNVBAGLBSA-N -1 3 388.388 -1.569 20 0 GAADHM CC(=O)NCC(=O)N[C@H]1COC2(CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)C1 ZINC001573516179 946557821 /nfs/dbraw/zinc/55/78/21/946557821.db2.gz VTIYUQORQPFLNO-SNVBAGLBSA-N -1 3 388.388 -1.569 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)CCN(C)c1ncccc1-c1nn[n-]n1 ZINC001573516379 946562403 /nfs/dbraw/zinc/56/24/03/946562403.db2.gz YMCZNRPMFYJWMJ-UHFFFAOYSA-N -1 3 389.420 -1.591 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)CCN(C)c1ncccc1-c1nnn[n-]1 ZINC001573516379 946562392 /nfs/dbraw/zinc/56/23/92/946562392.db2.gz YMCZNRPMFYJWMJ-UHFFFAOYSA-N -1 3 389.420 -1.591 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001573516394 946561889 /nfs/dbraw/zinc/56/18/89/946561889.db2.gz YOZWTBSHRMHZPT-SECBINFHSA-N -1 3 375.393 -1.569 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001573516394 946561882 /nfs/dbraw/zinc/56/18/82/946561882.db2.gz YOZWTBSHRMHZPT-SECBINFHSA-N -1 3 375.393 -1.569 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001573516395 946563080 /nfs/dbraw/zinc/56/30/80/946563080.db2.gz YOZWTBSHRMHZPT-VIFPVBQESA-N -1 3 375.393 -1.569 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001573516395 946563073 /nfs/dbraw/zinc/56/30/73/946563073.db2.gz YOZWTBSHRMHZPT-VIFPVBQESA-N -1 3 375.393 -1.569 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001573516408 946562914 /nfs/dbraw/zinc/56/29/14/946562914.db2.gz YWNGGTNQOXKTAU-LLVKDONJSA-N -1 3 387.404 -1.791 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001573516408 946562907 /nfs/dbraw/zinc/56/29/07/946562907.db2.gz YWNGGTNQOXKTAU-LLVKDONJSA-N -1 3 387.404 -1.791 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001573516409 946562093 /nfs/dbraw/zinc/56/20/93/946562093.db2.gz YWNGGTNQOXKTAU-NSHDSACASA-N -1 3 387.404 -1.791 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001573516409 946562084 /nfs/dbraw/zinc/56/20/84/946562084.db2.gz YWNGGTNQOXKTAU-NSHDSACASA-N -1 3 387.404 -1.791 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)CCNc1nc(C)ccc1-c1nn[n-]n1 ZINC001573516411 946562574 /nfs/dbraw/zinc/56/25/74/946562574.db2.gz YYYPEMVDTXUKNW-UHFFFAOYSA-N -1 3 389.420 -1.307 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)CCNc1nc(C)ccc1-c1nnn[n-]1 ZINC001573516411 946562565 /nfs/dbraw/zinc/56/25/65/946562565.db2.gz YYYPEMVDTXUKNW-UHFFFAOYSA-N -1 3 389.420 -1.307 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)CCNc1ncccc1-c1nn[n-]n1 ZINC001573516417 946561645 /nfs/dbraw/zinc/56/16/45/946561645.db2.gz ZBQKXBBAGXSSDM-UHFFFAOYSA-N -1 3 375.393 -1.616 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)CCNc1ncccc1-c1nnn[n-]1 ZINC001573516417 946561635 /nfs/dbraw/zinc/56/16/35/946561635.db2.gz ZBQKXBBAGXSSDM-UHFFFAOYSA-N -1 3 375.393 -1.616 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)Nc1nc(C)ccc1-c1nn[n-]n1 ZINC001573516439 946562180 /nfs/dbraw/zinc/56/21/80/946562180.db2.gz ZRDQSOXNCUGFNB-JTQLQIEISA-N -1 3 389.420 -1.261 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)Nc1nc(C)ccc1-c1nnn[n-]1 ZINC001573516439 946562173 /nfs/dbraw/zinc/56/21/73/946562173.db2.gz ZRDQSOXNCUGFNB-JTQLQIEISA-N -1 3 389.420 -1.261 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)Nc1nc(C)ccc1-c1nn[n-]n1 ZINC001573516440 946561372 /nfs/dbraw/zinc/56/13/72/946561372.db2.gz ZRDQSOXNCUGFNB-SNVBAGLBSA-N -1 3 389.420 -1.261 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)Nc1nc(C)ccc1-c1nnn[n-]1 ZINC001573516440 946561366 /nfs/dbraw/zinc/56/13/66/946561366.db2.gz ZRDQSOXNCUGFNB-SNVBAGLBSA-N -1 3 389.420 -1.261 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)CCNc1ccc(-c2nn[n-]n2)c(C)n1 ZINC001573516450 946561199 /nfs/dbraw/zinc/56/11/99/946561199.db2.gz ZSNYCRPGNXXYNX-UHFFFAOYSA-N -1 3 389.420 -1.307 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)CCNc1ccc(-c2nnn[n-]2)c(C)n1 ZINC001573516450 946561189 /nfs/dbraw/zinc/56/11/89/946561189.db2.gz ZSNYCRPGNXXYNX-UHFFFAOYSA-N -1 3 389.420 -1.307 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC1CN(Cc2ccc(-c3nnn[n-]3)s2)C1 ZINC001573516452 946561617 /nfs/dbraw/zinc/56/16/17/946561617.db2.gz ZUCRUBRLFDSREV-UHFFFAOYSA-N -1 3 392.445 -1.519 20 0 GAADHM CC(=O)NCC(=O)NC[C@@]1(C)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1 ZINC001573516945 946562539 /nfs/dbraw/zinc/56/25/39/946562539.db2.gz AKEPAFNTZRFRQH-INIZCTEOSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@@]1(C)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1 ZINC001573516945 946562530 /nfs/dbraw/zinc/56/25/30/946562530.db2.gz AKEPAFNTZRFRQH-INIZCTEOSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@]1(C)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1 ZINC001573516946 946562985 /nfs/dbraw/zinc/56/29/85/946562985.db2.gz AKEPAFNTZRFRQH-MRXNPFEDSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@]1(C)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1 ZINC001573516946 946562976 /nfs/dbraw/zinc/56/29/76/946562976.db2.gz AKEPAFNTZRFRQH-MRXNPFEDSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@@]1(C)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCO1 ZINC001573516947 946561441 /nfs/dbraw/zinc/56/14/41/946561441.db2.gz AKNDKJBZJCYJEA-INIZCTEOSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@@]1(C)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCO1 ZINC001573516947 946561433 /nfs/dbraw/zinc/56/14/33/946561433.db2.gz AKNDKJBZJCYJEA-INIZCTEOSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@]1(C)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCO1 ZINC001573516948 946562028 /nfs/dbraw/zinc/56/20/28/946562028.db2.gz AKNDKJBZJCYJEA-MRXNPFEDSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@]1(C)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCO1 ZINC001573516948 946562015 /nfs/dbraw/zinc/56/20/15/946562015.db2.gz AKNDKJBZJCYJEA-MRXNPFEDSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NCC1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001573517000 946564489 /nfs/dbraw/zinc/56/44/89/946564489.db2.gz CBWFIJNTRFTLHJ-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CC(=O)NCC(=O)NCC1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001573517000 946564478 /nfs/dbraw/zinc/56/44/78/946564478.db2.gz CBWFIJNTRFTLHJ-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CC(=O)NCC(=O)NCC1(O)CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C1 ZINC001573517010 946565431 /nfs/dbraw/zinc/56/54/31/946565431.db2.gz CMILGSZUVLAXJL-UHFFFAOYSA-N -1 3 377.380 -1.195 20 0 GAADHM CC(=O)NCC(=O)NCC1(O)CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C1 ZINC001573517010 946565426 /nfs/dbraw/zinc/56/54/26/946565426.db2.gz CMILGSZUVLAXJL-UHFFFAOYSA-N -1 3 377.380 -1.195 20 0 GAADHM CC(=O)NCC(=O)NC[C@@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573517309 946569847 /nfs/dbraw/zinc/56/98/47/946569847.db2.gz GUGSFVMYNGIPKO-HNNXBMFYSA-N -1 3 376.377 -1.976 20 0 GAADHM CC(=O)NCC(=O)NC[C@@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573517309 946569833 /nfs/dbraw/zinc/56/98/33/946569833.db2.gz GUGSFVMYNGIPKO-HNNXBMFYSA-N -1 3 376.377 -1.976 20 0 GAADHM CC(=O)NCC(=O)NC[C@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573517310 946568354 /nfs/dbraw/zinc/56/83/54/946568354.db2.gz GUGSFVMYNGIPKO-OAHLLOKOSA-N -1 3 376.377 -1.976 20 0 GAADHM CC(=O)NCC(=O)NC[C@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573517310 946568344 /nfs/dbraw/zinc/56/83/44/946568344.db2.gz GUGSFVMYNGIPKO-OAHLLOKOSA-N -1 3 376.377 -1.976 20 0 GAADHM CC(=O)NCC(=O)NCC1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001573517322 946570194 /nfs/dbraw/zinc/57/01/94/946570194.db2.gz HBMQILRSJNAGLM-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CC(=O)NCC(=O)NCC1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001573517322 946570189 /nfs/dbraw/zinc/57/01/89/946570189.db2.gz HBMQILRSJNAGLM-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CC(=O)NCC(=O)NCC1(O)CN(Cc2ccc(-c3nn[n-]n3)cc2F)C1 ZINC001573517466 946574450 /nfs/dbraw/zinc/57/44/50/946574450.db2.gz KURFMKOMMUTPIU-UHFFFAOYSA-N -1 3 377.380 -1.195 20 0 GAADHM CC(=O)NCC(=O)NCC1(O)CN(Cc2ccc(-c3nnn[n-]3)cc2F)C1 ZINC001573517466 946574439 /nfs/dbraw/zinc/57/44/39/946574439.db2.gz KURFMKOMMUTPIU-UHFFFAOYSA-N -1 3 377.380 -1.195 20 0 GAADHM CC(=O)NCC(=O)NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573517495 946573886 /nfs/dbraw/zinc/57/38/86/946573886.db2.gz LIUPWOYSXBVNQD-HNNXBMFYSA-N -1 3 376.377 -1.976 20 0 GAADHM CC(=O)NCC(=O)NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573517495 946573875 /nfs/dbraw/zinc/57/38/75/946573875.db2.gz LIUPWOYSXBVNQD-HNNXBMFYSA-N -1 3 376.377 -1.976 20 0 GAADHM CC(=O)NCC(=O)NC[C@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573517496 946574180 /nfs/dbraw/zinc/57/41/80/946574180.db2.gz LIUPWOYSXBVNQD-OAHLLOKOSA-N -1 3 376.377 -1.976 20 0 GAADHM CC(=O)NCC(=O)NC[C@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573517496 946574177 /nfs/dbraw/zinc/57/41/77/946574177.db2.gz LIUPWOYSXBVNQD-OAHLLOKOSA-N -1 3 376.377 -1.976 20 0 GAADHM CC(=O)NCC(=O)NCC1(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCOCC1 ZINC001573517506 946573825 /nfs/dbraw/zinc/57/38/25/946573825.db2.gz LRJVVDHSPCZMKA-UHFFFAOYSA-N -1 3 390.404 -1.274 20 0 GAADHM CC(=O)NCC(=O)NCC1(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCOCC1 ZINC001573517506 946573818 /nfs/dbraw/zinc/57/38/18/946573818.db2.gz LRJVVDHSPCZMKA-UHFFFAOYSA-N -1 3 390.404 -1.274 20 0 GAADHM CC(=O)NCC(=O)NCC1(O)CN(Cc2cc(F)ccc2-c2nn[n-]n2)C1 ZINC001573517585 946578048 /nfs/dbraw/zinc/57/80/48/946578048.db2.gz NTZDIGQCVBGTRS-UHFFFAOYSA-N -1 3 377.380 -1.195 20 0 GAADHM CC(=O)NCC(=O)NCC1(O)CN(Cc2cc(F)ccc2-c2nnn[n-]2)C1 ZINC001573517585 946578040 /nfs/dbraw/zinc/57/80/40/946578040.db2.gz NTZDIGQCVBGTRS-UHFFFAOYSA-N -1 3 377.380 -1.195 20 0 GAADHM CC(=O)NCC(=O)NC[C@@]1(C)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCO1 ZINC001573517694 946579273 /nfs/dbraw/zinc/57/92/73/946579273.db2.gz PTBYFFYJWNKLOX-INIZCTEOSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@@]1(C)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCO1 ZINC001573517694 946579264 /nfs/dbraw/zinc/57/92/64/946579264.db2.gz PTBYFFYJWNKLOX-INIZCTEOSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@]1(C)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCO1 ZINC001573517696 946579490 /nfs/dbraw/zinc/57/94/90/946579490.db2.gz PTBYFFYJWNKLOX-MRXNPFEDSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@]1(C)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCO1 ZINC001573517696 946579487 /nfs/dbraw/zinc/57/94/87/946579487.db2.gz PTBYFFYJWNKLOX-MRXNPFEDSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573518306 946588324 /nfs/dbraw/zinc/58/83/24/946588324.db2.gz YNJYISDVBBTUOP-HNNXBMFYSA-N -1 3 376.377 -1.976 20 0 GAADHM CC(=O)NCC(=O)NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573518306 946588313 /nfs/dbraw/zinc/58/83/13/946588313.db2.gz YNJYISDVBBTUOP-HNNXBMFYSA-N -1 3 376.377 -1.976 20 0 GAADHM CC(=O)NCC(=O)NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573518307 946587783 /nfs/dbraw/zinc/58/77/83/946587783.db2.gz YNJYISDVBBTUOP-OAHLLOKOSA-N -1 3 376.377 -1.976 20 0 GAADHM CC(=O)NCC(=O)NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001573518307 946587773 /nfs/dbraw/zinc/58/77/73/946587773.db2.gz YNJYISDVBBTUOP-OAHLLOKOSA-N -1 3 376.377 -1.976 20 0 GAADHM CC(=O)NCC(=O)NC[C@@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001573518325 946590533 /nfs/dbraw/zinc/59/05/33/946590533.db2.gz YXHFOYNBLZYOEZ-HNNXBMFYSA-N -1 3 378.368 -1.406 20 0 GAADHM CC(=O)NCC(=O)NC[C@@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001573518325 946590523 /nfs/dbraw/zinc/59/05/23/946590523.db2.gz YXHFOYNBLZYOEZ-HNNXBMFYSA-N -1 3 378.368 -1.406 20 0 GAADHM CC(=O)NCC(=O)NC[C@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001573518326 946590897 /nfs/dbraw/zinc/59/08/97/946590897.db2.gz YXHFOYNBLZYOEZ-OAHLLOKOSA-N -1 3 378.368 -1.406 20 0 GAADHM CC(=O)NCC(=O)NC[C@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001573518326 946590893 /nfs/dbraw/zinc/59/08/93/946590893.db2.gz YXHFOYNBLZYOEZ-OAHLLOKOSA-N -1 3 378.368 -1.406 20 0 GAADHM CC(=O)NCC(=O)NCC1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001573518344 946589228 /nfs/dbraw/zinc/58/92/28/946589228.db2.gz ZRDRKPQRBRWJQW-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CC(=O)NCC(=O)NCC1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001573518344 946589222 /nfs/dbraw/zinc/58/92/22/946589222.db2.gz ZRDRKPQRBRWJQW-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CC(=O)NCC(=O)NCCN1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001573520017 946589477 /nfs/dbraw/zinc/58/94/77/946589477.db2.gz AERLWUKPPBCBSK-UHFFFAOYSA-N -1 3 389.420 -1.795 20 0 GAADHM CC(=O)NCC(=O)NCCN1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001573520017 946589469 /nfs/dbraw/zinc/58/94/69/946589469.db2.gz AERLWUKPPBCBSK-UHFFFAOYSA-N -1 3 389.420 -1.795 20 0 GAADHM CC(=O)NCC(=O)NCCN1CCC(Nc2nccnc2-c2nnn[n-]2)CC1 ZINC001573520044 946590954 /nfs/dbraw/zinc/59/09/54/946590954.db2.gz AUSCIWPVUFWRKP-UHFFFAOYSA-N -1 3 388.436 -1.215 20 0 GAADHM CC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1 ZINC001573520096 946592151 /nfs/dbraw/zinc/59/21/51/946592151.db2.gz CQKNGHYZKIAJEC-LLVKDONJSA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1 ZINC001573520096 946592145 /nfs/dbraw/zinc/59/21/45/946592145.db2.gz CQKNGHYZKIAJEC-LLVKDONJSA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1 ZINC001573520097 946593785 /nfs/dbraw/zinc/59/37/85/946593785.db2.gz CQKNGHYZKIAJEC-NSHDSACASA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1 ZINC001573520097 946593775 /nfs/dbraw/zinc/59/37/75/946593775.db2.gz CQKNGHYZKIAJEC-NSHDSACASA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCCO1 ZINC001573520103 946593529 /nfs/dbraw/zinc/59/35/29/946593529.db2.gz DABIYCDCQIXVKM-GFCCVEGCSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCCO1 ZINC001573520103 946593521 /nfs/dbraw/zinc/59/35/21/946593521.db2.gz DABIYCDCQIXVKM-GFCCVEGCSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCCO1 ZINC001573520104 946592113 /nfs/dbraw/zinc/59/21/13/946592113.db2.gz DABIYCDCQIXVKM-LBPRGKRZSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCCO1 ZINC001573520104 946592108 /nfs/dbraw/zinc/59/21/08/946592108.db2.gz DABIYCDCQIXVKM-LBPRGKRZSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)CCO1 ZINC001573520111 946593188 /nfs/dbraw/zinc/59/31/88/946593188.db2.gz DJHGZVZICKOBOZ-LLVKDONJSA-N -1 3 378.368 -1.142 20 0 GAADHM CC(=O)NCC(=O)NC[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)CCO1 ZINC001573520111 946593175 /nfs/dbraw/zinc/59/31/75/946593175.db2.gz DJHGZVZICKOBOZ-LLVKDONJSA-N -1 3 378.368 -1.142 20 0 GAADHM CC(=O)NCC(=O)NC[C@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)CCO1 ZINC001573520112 946592054 /nfs/dbraw/zinc/59/20/54/946592054.db2.gz DJHGZVZICKOBOZ-NSHDSACASA-N -1 3 378.368 -1.142 20 0 GAADHM CC(=O)NCC(=O)NC[C@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)CCO1 ZINC001573520112 946592052 /nfs/dbraw/zinc/59/20/52/946592052.db2.gz DJHGZVZICKOBOZ-NSHDSACASA-N -1 3 378.368 -1.142 20 0 GAADHM CC(=O)NCC(=O)NCCN1CCC(Nc2cnc(-c3nnn[n-]3)cn2)CC1 ZINC001573520119 946592429 /nfs/dbraw/zinc/59/24/29/946592429.db2.gz DLNOAIRASLFKKS-UHFFFAOYSA-N -1 3 388.436 -1.215 20 0 GAADHM CC(=O)NCC(=O)NCCCN1CCN(c2ccnc(-c3nn[n-]n3)n2)CC1 ZINC001573520243 946592985 /nfs/dbraw/zinc/59/29/85/946592985.db2.gz FLIRCMGCOHKKHM-UHFFFAOYSA-N -1 3 388.436 -1.579 20 0 GAADHM CC(=O)NCC(=O)NCCCN1CCN(c2ccnc(-c3nnn[n-]3)n2)CC1 ZINC001573520243 946592976 /nfs/dbraw/zinc/59/29/76/946592976.db2.gz FLIRCMGCOHKKHM-UHFFFAOYSA-N -1 3 388.436 -1.579 20 0 GAADHM CC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCO1 ZINC001573520533 946597513 /nfs/dbraw/zinc/59/75/13/946597513.db2.gz JAOHVGTUFCZLBX-LLVKDONJSA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCO1 ZINC001573520533 946597502 /nfs/dbraw/zinc/59/75/02/946597502.db2.gz JAOHVGTUFCZLBX-LLVKDONJSA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCO1 ZINC001573520534 946598284 /nfs/dbraw/zinc/59/82/84/946598284.db2.gz JAOHVGTUFCZLBX-NSHDSACASA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCO1 ZINC001573520534 946598267 /nfs/dbraw/zinc/59/82/67/946598267.db2.gz JAOHVGTUFCZLBX-NSHDSACASA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCO1 ZINC001573520550 946598000 /nfs/dbraw/zinc/59/80/00/946598000.db2.gz JXMKGGZZCDMZAK-JTQLQIEISA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCO1 ZINC001573520550 946597993 /nfs/dbraw/zinc/59/79/93/946597993.db2.gz JXMKGGZZCDMZAK-JTQLQIEISA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCO1 ZINC001573520551 946598091 /nfs/dbraw/zinc/59/80/91/946598091.db2.gz JXMKGGZZCDMZAK-SNVBAGLBSA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCO1 ZINC001573520551 946598081 /nfs/dbraw/zinc/59/80/81/946598081.db2.gz JXMKGGZZCDMZAK-SNVBAGLBSA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)NCCN1CCC(Nc2ccc(-c3nnn[n-]3)nn2)CC1 ZINC001573520607 946597845 /nfs/dbraw/zinc/59/78/45/946597845.db2.gz MCTIVUKMDNNIMD-UHFFFAOYSA-N -1 3 388.436 -1.215 20 0 GAADHM CC(=O)NCC(=O)NCCN1CCN(c2nc(C)cc(-c3nnn[n-]3)n2)CC1 ZINC001573520832 946600959 /nfs/dbraw/zinc/60/09/59/946600959.db2.gz MYPCUOKKHBBEHT-UHFFFAOYSA-N -1 3 388.436 -1.661 20 0 GAADHM CC(=O)NCC(=O)NCCN1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001573520897 946602347 /nfs/dbraw/zinc/60/23/47/946602347.db2.gz PDTLXDIGXKQCPM-UHFFFAOYSA-N -1 3 389.420 -1.795 20 0 GAADHM CC(=O)NCC(=O)NCCN1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001573520897 946602342 /nfs/dbraw/zinc/60/23/42/946602342.db2.gz PDTLXDIGXKQCPM-UHFFFAOYSA-N -1 3 389.420 -1.795 20 0 GAADHM CC(=O)NCC(=O)NCCN1CCC(Nc2cncc(-c3nnn[n-]3)n2)CC1 ZINC001573521129 946602950 /nfs/dbraw/zinc/60/29/50/946602950.db2.gz RANCDYOSBGCFCP-UHFFFAOYSA-N -1 3 388.436 -1.215 20 0 GAADHM CC(=O)NCC(=O)NCCN1CCC(Nc2ccnc(-c3nn[n-]n3)n2)CC1 ZINC001573521140 946604618 /nfs/dbraw/zinc/60/46/18/946604618.db2.gz RSYLADIJVNFCFB-UHFFFAOYSA-N -1 3 388.436 -1.793 20 0 GAADHM CC(=O)NCC(=O)NCCN1CCC(Nc2ccnc(-c3nnn[n-]3)n2)CC1 ZINC001573521140 946604615 /nfs/dbraw/zinc/60/46/15/946604615.db2.gz RSYLADIJVNFCFB-UHFFFAOYSA-N -1 3 388.436 -1.793 20 0 GAADHM CC(=O)NCC(=O)NC[C@H]1COCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573521156 946603998 /nfs/dbraw/zinc/60/39/98/946603998.db2.gz SRXCCMQUDBPCNS-JTQLQIEISA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)NC[C@H]1COCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573521156 946603991 /nfs/dbraw/zinc/60/39/91/946603991.db2.gz SRXCCMQUDBPCNS-JTQLQIEISA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)NC[C@@H]1COCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573521158 946603355 /nfs/dbraw/zinc/60/33/55/946603355.db2.gz SRXCCMQUDBPCNS-SNVBAGLBSA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)NC[C@@H]1COCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573521158 946603347 /nfs/dbraw/zinc/60/33/47/946603347.db2.gz SRXCCMQUDBPCNS-SNVBAGLBSA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCCO1 ZINC001573521160 946604743 /nfs/dbraw/zinc/60/47/43/946604743.db2.gz SSQWEABKQRTUEO-LLVKDONJSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCCO1 ZINC001573521160 946604735 /nfs/dbraw/zinc/60/47/35/946604735.db2.gz SSQWEABKQRTUEO-LLVKDONJSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCCO1 ZINC001573521162 946604671 /nfs/dbraw/zinc/60/46/71/946604671.db2.gz SSQWEABKQRTUEO-NSHDSACASA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCCO1 ZINC001573521162 946604664 /nfs/dbraw/zinc/60/46/64/946604664.db2.gz SSQWEABKQRTUEO-NSHDSACASA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NCCN1CCN(c2ccc(-c3nn[n-]n3)c(C)n2)CC1 ZINC001573521434 946605668 /nfs/dbraw/zinc/60/56/68/946605668.db2.gz VWZQTEOLBARVIS-UHFFFAOYSA-N -1 3 387.448 -1.056 20 0 GAADHM CC(=O)NCC(=O)NCCN1CCN(c2ccc(-c3nnn[n-]3)c(C)n2)CC1 ZINC001573521434 946605663 /nfs/dbraw/zinc/60/56/63/946605663.db2.gz VWZQTEOLBARVIS-UHFFFAOYSA-N -1 3 387.448 -1.056 20 0 GAADHM CC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCCO1 ZINC001573521439 946606162 /nfs/dbraw/zinc/60/61/62/946606162.db2.gz WBKRVKPZMPPRJF-GFCCVEGCSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCCO1 ZINC001573521439 946606154 /nfs/dbraw/zinc/60/61/54/946606154.db2.gz WBKRVKPZMPPRJF-GFCCVEGCSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCCO1 ZINC001573521440 946607014 /nfs/dbraw/zinc/60/70/14/946607014.db2.gz WBKRVKPZMPPRJF-LBPRGKRZSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCCO1 ZINC001573521440 946607005 /nfs/dbraw/zinc/60/70/05/946607005.db2.gz WBKRVKPZMPPRJF-LBPRGKRZSA-N -1 3 390.404 -1.322 20 0 GAADHM CC(=O)NCC(=O)NCCN1CCN(c2nc(C)ccc2-c2nn[n-]n2)CC1 ZINC001573521467 946609452 /nfs/dbraw/zinc/60/94/52/946609452.db2.gz XEKNAPSMRVXFHP-UHFFFAOYSA-N -1 3 387.448 -1.056 20 0 GAADHM CC(=O)NCC(=O)NCCN1CCN(c2nc(C)ccc2-c2nnn[n-]2)CC1 ZINC001573521467 946609448 /nfs/dbraw/zinc/60/94/48/946609448.db2.gz XEKNAPSMRVXFHP-UHFFFAOYSA-N -1 3 387.448 -1.056 20 0 GAADHM CC(=O)NCC(=O)NC[C@@H]1COCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001573521495 946609181 /nfs/dbraw/zinc/60/91/81/946609181.db2.gz YBNUSVSNWKILTO-LLVKDONJSA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)NC[C@@H]1COCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001573521495 946609175 /nfs/dbraw/zinc/60/91/75/946609175.db2.gz YBNUSVSNWKILTO-LLVKDONJSA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)NC[C@H]1COCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001573521497 946609197 /nfs/dbraw/zinc/60/91/97/946609197.db2.gz YBNUSVSNWKILTO-NSHDSACASA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)NC[C@H]1COCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001573521497 946609192 /nfs/dbraw/zinc/60/91/92/946609192.db2.gz YBNUSVSNWKILTO-NSHDSACASA-N -1 3 376.377 -1.712 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2Cl)C[C@H]1O ZINC001573521761 946610924 /nfs/dbraw/zinc/61/09/24/946610924.db2.gz FMNGOHNEXOUWNC-GHMZBOCLSA-N -1 3 380.796 -1.283 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2Cl)C[C@H]1O ZINC001573521761 946610916 /nfs/dbraw/zinc/61/09/16/946610916.db2.gz FMNGOHNEXOUWNC-GHMZBOCLSA-N -1 3 380.796 -1.283 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2Cl)C[C@@H]1O ZINC001573521762 946610246 /nfs/dbraw/zinc/61/02/46/946610246.db2.gz FMNGOHNEXOUWNC-MNOVXSKESA-N -1 3 380.796 -1.283 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2Cl)C[C@@H]1O ZINC001573521762 946610239 /nfs/dbraw/zinc/61/02/39/946610239.db2.gz FMNGOHNEXOUWNC-MNOVXSKESA-N -1 3 380.796 -1.283 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C[C@@H]1O ZINC001573521805 946612780 /nfs/dbraw/zinc/61/27/80/946612780.db2.gz HVJJGSPHWQIKFU-KGLIPLIRSA-N -1 3 377.380 -1.197 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C[C@@H]1O ZINC001573521805 946612769 /nfs/dbraw/zinc/61/27/69/946612769.db2.gz HVJJGSPHWQIKFU-KGLIPLIRSA-N -1 3 377.380 -1.197 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C[C@H]1O ZINC001573521806 946612911 /nfs/dbraw/zinc/61/29/11/946612911.db2.gz HVJJGSPHWQIKFU-ZIAGYGMSSA-N -1 3 377.380 -1.197 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C[C@H]1O ZINC001573521806 946612903 /nfs/dbraw/zinc/61/29/03/946612903.db2.gz HVJJGSPHWQIKFU-ZIAGYGMSSA-N -1 3 377.380 -1.197 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001573521896 946616631 /nfs/dbraw/zinc/61/66/31/946616631.db2.gz NMZMPDAFZIUNLZ-KGLIPLIRSA-N -1 3 377.380 -1.197 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001573521896 946616624 /nfs/dbraw/zinc/61/66/24/946616624.db2.gz NMZMPDAFZIUNLZ-KGLIPLIRSA-N -1 3 377.380 -1.197 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001573521897 946616880 /nfs/dbraw/zinc/61/68/80/946616880.db2.gz NMZMPDAFZIUNLZ-ZIAGYGMSSA-N -1 3 377.380 -1.197 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001573521897 946616870 /nfs/dbraw/zinc/61/68/70/946616870.db2.gz NMZMPDAFZIUNLZ-ZIAGYGMSSA-N -1 3 377.380 -1.197 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(Cc2cc(F)ccc2-c2nn[n-]n2)C[C@@H]1O ZINC001573521980 946617461 /nfs/dbraw/zinc/61/74/61/946617461.db2.gz RUNGLURMWFUDPO-KGLIPLIRSA-N -1 3 377.380 -1.197 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(Cc2cc(F)ccc2-c2nn[n-]n2)C[C@H]1O ZINC001573521981 946618069 /nfs/dbraw/zinc/61/80/69/946618069.db2.gz RUNGLURMWFUDPO-ZIAGYGMSSA-N -1 3 377.380 -1.197 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C[C@@H]1O ZINC001573522030 946620188 /nfs/dbraw/zinc/62/01/88/946620188.db2.gz WMMPSLYKAAEDGW-KGLIPLIRSA-N -1 3 377.380 -1.197 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C[C@@H]1O ZINC001573522030 946620182 /nfs/dbraw/zinc/62/01/82/946620182.db2.gz WMMPSLYKAAEDGW-KGLIPLIRSA-N -1 3 377.380 -1.197 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C[C@H]1O ZINC001573522031 946620498 /nfs/dbraw/zinc/62/04/98/946620498.db2.gz WMMPSLYKAAEDGW-ZIAGYGMSSA-N -1 3 377.380 -1.197 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C[C@H]1O ZINC001573522031 946620491 /nfs/dbraw/zinc/62/04/91/946620491.db2.gz WMMPSLYKAAEDGW-ZIAGYGMSSA-N -1 3 377.380 -1.197 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(Cc2cc(-c3nn[n-]n3)ccc2F)C[C@@H]1O ZINC001573522036 946621474 /nfs/dbraw/zinc/62/14/74/946621474.db2.gz WVPWTTRRMLOQLZ-KGLIPLIRSA-N -1 3 377.380 -1.197 20 0 GAADHM CC(=O)NCC(=O)N[C@@H]1CN(Cc2cc(-c3nn[n-]n3)ccc2F)C[C@H]1O ZINC001573522037 946620014 /nfs/dbraw/zinc/62/00/14/946620014.db2.gz WVPWTTRRMLOQLZ-ZIAGYGMSSA-N -1 3 377.380 -1.197 20 0 GAADHM CC(=O)NCC[C@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCS1(=O)=O ZINC001573528400 946661002 /nfs/dbraw/zinc/66/10/02/946661002.db2.gz BHQXJQDKGRASOS-JTQLQIEISA-N -1 3 381.418 -1.040 20 0 GAADHM CC(=O)NCC[C@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCS1(=O)=O ZINC001573528400 946661000 /nfs/dbraw/zinc/66/10/00/946661000.db2.gz BHQXJQDKGRASOS-JTQLQIEISA-N -1 3 381.418 -1.040 20 0 GAADHM CC(=O)NCC[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCS1(=O)=O ZINC001573528403 946662329 /nfs/dbraw/zinc/66/23/29/946662329.db2.gz BHQXJQDKGRASOS-SNVBAGLBSA-N -1 3 381.418 -1.040 20 0 GAADHM CC(=O)NCC[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCS1(=O)=O ZINC001573528403 946662326 /nfs/dbraw/zinc/66/23/26/946662326.db2.gz BHQXJQDKGRASOS-SNVBAGLBSA-N -1 3 381.418 -1.040 20 0 GAADHM CC(=O)NCC[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCS1(=O)=O ZINC001573530145 946688220 /nfs/dbraw/zinc/68/82/20/946688220.db2.gz UPZIFVZBILUWJM-LLVKDONJSA-N -1 3 381.418 -1.040 20 0 GAADHM CC(=O)NCC[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCS1(=O)=O ZINC001573530145 946688210 /nfs/dbraw/zinc/68/82/10/946688210.db2.gz UPZIFVZBILUWJM-LLVKDONJSA-N -1 3 381.418 -1.040 20 0 GAADHM CC(=O)NCC[C@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCS1(=O)=O ZINC001573530146 946687066 /nfs/dbraw/zinc/68/70/66/946687066.db2.gz UPZIFVZBILUWJM-NSHDSACASA-N -1 3 381.418 -1.040 20 0 GAADHM CC(=O)NCC[C@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCS1(=O)=O ZINC001573530146 946687063 /nfs/dbraw/zinc/68/70/63/946687063.db2.gz UPZIFVZBILUWJM-NSHDSACASA-N -1 3 381.418 -1.040 20 0 GAADHM CC(=O)NCCOCCN1CC(O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573530150 946687382 /nfs/dbraw/zinc/68/73/82/946687382.db2.gz UVVUIAMUGNUEKX-UHFFFAOYSA-N -1 3 392.420 -1.876 20 0 GAADHM CC(=O)NCCOCCN1CC(O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573530150 946687376 /nfs/dbraw/zinc/68/73/76/946687376.db2.gz UVVUIAMUGNUEKX-UHFFFAOYSA-N -1 3 392.420 -1.876 20 0 GAADHM CC(=O)N[C@@H](CC(=O)NC1CN(Cc2ccc(-c3nn[n-]n3)cc2)C1)C(N)=O ZINC001573537450 946750285 /nfs/dbraw/zinc/75/02/85/946750285.db2.gz BPNYNKLPCPWECU-AWEZNQCLSA-N -1 3 386.416 -1.453 20 0 GAADHM CC(=O)N[C@@H](CC(=O)NC1CN(Cc2ccc(-c3nnn[n-]3)cc2)C1)C(N)=O ZINC001573537450 946750274 /nfs/dbraw/zinc/75/02/74/946750274.db2.gz BPNYNKLPCPWECU-AWEZNQCLSA-N -1 3 386.416 -1.453 20 0 GAADHM CC(=O)N[C@@H](CC(=O)N1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1)C(N)=O ZINC001573537702 946758156 /nfs/dbraw/zinc/75/81/56/946758156.db2.gz JWGKSYIZQWPMHX-LBPRGKRZSA-N -1 3 387.404 -1.710 20 0 GAADHM CC(=O)N[C@@H](CC(=O)N1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1)C(N)=O ZINC001573537702 946758149 /nfs/dbraw/zinc/75/81/49/946758149.db2.gz JWGKSYIZQWPMHX-LBPRGKRZSA-N -1 3 387.404 -1.710 20 0 GAADHM CC(=O)N[C@@H](CC(=O)N1CCN(c2ncccc2-c2nn[n-]n2)CC1)C(N)=O ZINC001573537703 946757799 /nfs/dbraw/zinc/75/77/99/946757799.db2.gz JWVYOSKCRGPWSK-LBPRGKRZSA-N -1 3 387.404 -1.710 20 0 GAADHM CC(=O)N[C@@H](CC(=O)N1CCN(c2ncccc2-c2nnn[n-]2)CC1)C(N)=O ZINC001573537703 946757792 /nfs/dbraw/zinc/75/77/92/946757792.db2.gz JWVYOSKCRGPWSK-LBPRGKRZSA-N -1 3 387.404 -1.710 20 0 GAADHM CC(=O)N[C@@H](CC(=O)N(C)CCN(C)c1ccc(-c2nn[n-]n2)cn1)C(N)=O ZINC001573537861 946757766 /nfs/dbraw/zinc/75/77/66/946757766.db2.gz LQRIVHIKGUEVMN-LBPRGKRZSA-N -1 3 389.420 -1.464 20 0 GAADHM CC(=O)N[C@@H](CC(=O)N(C)CCN(C)c1ccc(-c2nnn[n-]2)cn1)C(N)=O ZINC001573537861 946757756 /nfs/dbraw/zinc/75/77/56/946757756.db2.gz LQRIVHIKGUEVMN-LBPRGKRZSA-N -1 3 389.420 -1.464 20 0 GAADHM CC(=O)N[C@@H](CC(=O)N1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1)C(N)=O ZINC001573537999 946759556 /nfs/dbraw/zinc/75/95/56/946759556.db2.gz OFUSNTMCCZZUCA-ZDUSSCGKSA-N -1 3 387.404 -1.710 20 0 GAADHM CC(=O)N[C@@H](CC(=O)N1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1)C(N)=O ZINC001573537999 946759550 /nfs/dbraw/zinc/75/95/50/946759550.db2.gz OFUSNTMCCZZUCA-ZDUSSCGKSA-N -1 3 387.404 -1.710 20 0 GAADHM CC(=O)N[C@@H](CC(=O)NC1CN(Cc2ccc(-c3nnn[n-]3)s2)C1)C(N)=O ZINC001573538494 946767583 /nfs/dbraw/zinc/76/75/83/946767583.db2.gz UQJMYNHKOHOQCQ-NSHDSACASA-N -1 3 392.445 -1.391 20 0 GAADHM CC(=O)N[C@@H](CC(=O)NC1CN(Cc2ccccc2-c2nn[n-]n2)C1)C(N)=O ZINC001573538618 946773436 /nfs/dbraw/zinc/77/34/36/946773436.db2.gz YKKRWBQHKAKCBS-AWEZNQCLSA-N -1 3 386.416 -1.453 20 0 GAADHM CC(=O)N[C@@H](CC(=O)NC1CN(Cc2ccccc2-c2nnn[n-]2)C1)C(N)=O ZINC001573538618 946773422 /nfs/dbraw/zinc/77/34/22/946773422.db2.gz YKKRWBQHKAKCBS-AWEZNQCLSA-N -1 3 386.416 -1.453 20 0 GAADHM CC(=O)N[C@@H](CC(=O)NC1CN(Cc2cccc(-c3nn[n-]n3)c2)C1)C(N)=O ZINC001573538636 946773614 /nfs/dbraw/zinc/77/36/14/946773614.db2.gz ZEQFPAVCPSVVSY-AWEZNQCLSA-N -1 3 386.416 -1.453 20 0 GAADHM CC(=O)N[C@@H](CC(=O)NC1CN(Cc2cccc(-c3nnn[n-]3)c2)C1)C(N)=O ZINC001573538636 946773603 /nfs/dbraw/zinc/77/36/03/946773603.db2.gz ZEQFPAVCPSVVSY-AWEZNQCLSA-N -1 3 386.416 -1.453 20 0 GAADHM CC(=O)N[C@@H](CC(=O)NCCN(C)c1cccc(F)c1-c1nn[n-]n1)C(N)=O ZINC001573538649 946774383 /nfs/dbraw/zinc/77/43/83/946774383.db2.gz ZPHZGJYIJZPBDO-NSHDSACASA-N -1 3 392.395 -1.062 20 0 GAADHM CC(=O)N[C@@H](CC(=O)NCCN(C)c1cccc(F)c1-c1nnn[n-]1)C(N)=O ZINC001573538649 946774378 /nfs/dbraw/zinc/77/43/78/946774378.db2.gz ZPHZGJYIJZPBDO-NSHDSACASA-N -1 3 392.395 -1.062 20 0 GAADHM C[C@H](C(=O)N(C)C1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)S(C)(=O)=O ZINC001573591266 947307177 /nfs/dbraw/zinc/30/71/77/947307177.db2.gz ACLIEJYIHRDFCV-MRVPVSSYSA-N -1 3 381.418 -1.089 20 0 GAADHM C[C@H](C(=O)N(C)C1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)S(C)(=O)=O ZINC001573591266 947307163 /nfs/dbraw/zinc/30/71/63/947307163.db2.gz ACLIEJYIHRDFCV-MRVPVSSYSA-N -1 3 381.418 -1.089 20 0 GAADHM C[C@@H](C(=O)N(C)C1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)S(C)(=O)=O ZINC001573591275 947305679 /nfs/dbraw/zinc/30/56/79/947305679.db2.gz ACLIEJYIHRDFCV-QMMMGPOBSA-N -1 3 381.418 -1.089 20 0 GAADHM C[C@@H](C(=O)N(C)C1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)S(C)(=O)=O ZINC001573591275 947305671 /nfs/dbraw/zinc/30/56/71/947305671.db2.gz ACLIEJYIHRDFCV-QMMMGPOBSA-N -1 3 381.418 -1.089 20 0 GAADHM C[C@H](C(=O)N(C)C1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)S(C)(=O)=O ZINC001573592825 947353054 /nfs/dbraw/zinc/35/30/54/947353054.db2.gz NRVSLYTXCGQJOI-MRVPVSSYSA-N -1 3 381.418 -1.089 20 0 GAADHM C[C@H](C(=O)N(C)C1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)S(C)(=O)=O ZINC001573592825 947353042 /nfs/dbraw/zinc/35/30/42/947353042.db2.gz NRVSLYTXCGQJOI-MRVPVSSYSA-N -1 3 381.418 -1.089 20 0 GAADHM C[C@@H](C(=O)N(C)C1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)S(C)(=O)=O ZINC001573592826 947353934 /nfs/dbraw/zinc/35/39/34/947353934.db2.gz NRVSLYTXCGQJOI-QMMMGPOBSA-N -1 3 381.418 -1.089 20 0 GAADHM C[C@@H](C(=O)N(C)C1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)S(C)(=O)=O ZINC001573592826 947353922 /nfs/dbraw/zinc/35/39/22/947353922.db2.gz NRVSLYTXCGQJOI-QMMMGPOBSA-N -1 3 381.418 -1.089 20 0 GAADHM C[C@@H](C(=O)N(C)C)N1CC(CCO)(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573593515 947375237 /nfs/dbraw/zinc/37/52/37/947375237.db2.gz KBHUVOOPJKCORM-JTQLQIEISA-N -1 3 376.421 -1.162 20 0 GAADHM C[C@@H](C(=O)N(C)C)N1CC(CCO)(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573593515 947375222 /nfs/dbraw/zinc/37/52/22/947375222.db2.gz KBHUVOOPJKCORM-JTQLQIEISA-N -1 3 376.421 -1.162 20 0 GAADHM C[C@H](C(=O)N(C)C)N1CC(CCO)(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573593517 947374359 /nfs/dbraw/zinc/37/43/59/947374359.db2.gz KBHUVOOPJKCORM-SNVBAGLBSA-N -1 3 376.421 -1.162 20 0 GAADHM C[C@H](C(=O)N(C)C)N1CC(CCO)(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573593517 947374348 /nfs/dbraw/zinc/37/43/48/947374348.db2.gz KBHUVOOPJKCORM-SNVBAGLBSA-N -1 3 376.421 -1.162 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)n1cncn1 ZINC001573595550 947421768 /nfs/dbraw/zinc/42/17/68/947421768.db2.gz GNZWTUNZHRYQMV-GXSJLCMTSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)n1cncn1 ZINC001573595550 947421756 /nfs/dbraw/zinc/42/17/56/947421756.db2.gz GNZWTUNZHRYQMV-GXSJLCMTSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@H](C(=O)N(C)C[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)n1cncn1 ZINC001573595555 947421968 /nfs/dbraw/zinc/42/19/68/947421968.db2.gz GNZWTUNZHRYQMV-KOLCDFICSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@H](C(=O)N(C)C[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)n1cncn1 ZINC001573595555 947421959 /nfs/dbraw/zinc/42/19/59/947421959.db2.gz GNZWTUNZHRYQMV-KOLCDFICSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@H](C(=O)N(C)C[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)n1cncn1 ZINC001573595558 947421991 /nfs/dbraw/zinc/42/19/91/947421991.db2.gz GNZWTUNZHRYQMV-MWLCHTKSSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@H](C(=O)N(C)C[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)n1cncn1 ZINC001573595558 947421985 /nfs/dbraw/zinc/42/19/85/947421985.db2.gz GNZWTUNZHRYQMV-MWLCHTKSSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)n1cncn1 ZINC001573595561 947422066 /nfs/dbraw/zinc/42/20/66/947422066.db2.gz GNZWTUNZHRYQMV-ONGXEEELSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)n1cncn1 ZINC001573595561 947422057 /nfs/dbraw/zinc/42/20/57/947422057.db2.gz GNZWTUNZHRYQMV-ONGXEEELSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)N(C)C)N1CC(CCO)(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573595570 947421321 /nfs/dbraw/zinc/42/13/21/947421321.db2.gz YYLUWUWZNRCQLS-JTQLQIEISA-N -1 3 376.421 -1.162 20 0 GAADHM C[C@@H](C(=O)N(C)C)N1CC(CCO)(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573595570 947421312 /nfs/dbraw/zinc/42/13/12/947421312.db2.gz YYLUWUWZNRCQLS-JTQLQIEISA-N -1 3 376.421 -1.162 20 0 GAADHM C[C@H](C(=O)N(C)C)N1CC(CCO)(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573595573 947422794 /nfs/dbraw/zinc/42/27/94/947422794.db2.gz YYLUWUWZNRCQLS-SNVBAGLBSA-N -1 3 376.421 -1.162 20 0 GAADHM C[C@H](C(=O)N(C)C)N1CC(CCO)(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573595573 947422790 /nfs/dbraw/zinc/42/27/90/947422790.db2.gz YYLUWUWZNRCQLS-SNVBAGLBSA-N -1 3 376.421 -1.162 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@H](O)CNc1ccc(-c2nn[n-]n2)nc1)S(C)(=O)=O ZINC001573595606 947421906 /nfs/dbraw/zinc/42/19/06/947421906.db2.gz GVECMCWYZYSTMN-GXSJLCMTSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@H](O)CNc1ccc(-c2nnn[n-]2)nc1)S(C)(=O)=O ZINC001573595606 947421901 /nfs/dbraw/zinc/42/19/01/947421901.db2.gz GVECMCWYZYSTMN-GXSJLCMTSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@H](C(=O)N(C)C[C@@H](O)CNc1ccc(-c2nn[n-]n2)nc1)S(C)(=O)=O ZINC001573595614 947421291 /nfs/dbraw/zinc/42/12/91/947421291.db2.gz GVECMCWYZYSTMN-KOLCDFICSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@H](C(=O)N(C)C[C@@H](O)CNc1ccc(-c2nnn[n-]2)nc1)S(C)(=O)=O ZINC001573595614 947421288 /nfs/dbraw/zinc/42/12/88/947421288.db2.gz GVECMCWYZYSTMN-KOLCDFICSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@H](C(=O)N(C)C[C@H](O)CNc1ccc(-c2nn[n-]n2)nc1)S(C)(=O)=O ZINC001573595618 947422135 /nfs/dbraw/zinc/42/21/35/947422135.db2.gz GVECMCWYZYSTMN-MWLCHTKSSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@H](C(=O)N(C)C[C@H](O)CNc1ccc(-c2nnn[n-]2)nc1)S(C)(=O)=O ZINC001573595618 947422130 /nfs/dbraw/zinc/42/21/30/947422130.db2.gz GVECMCWYZYSTMN-MWLCHTKSSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@@H](O)CNc1ccc(-c2nn[n-]n2)nc1)S(C)(=O)=O ZINC001573595621 947421549 /nfs/dbraw/zinc/42/15/49/947421549.db2.gz GVECMCWYZYSTMN-ONGXEEELSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@@H](O)CNc1ccc(-c2nnn[n-]2)nc1)S(C)(=O)=O ZINC001573595621 947421541 /nfs/dbraw/zinc/42/15/41/947421541.db2.gz GVECMCWYZYSTMN-ONGXEEELSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@H](C(=O)N(C)C[C@H](O)CNc1ncccc1-c1nn[n-]n1)S(C)(=O)=O ZINC001573596470 947429642 /nfs/dbraw/zinc/42/96/42/947429642.db2.gz KKIUBPKELDQYKV-NXEZZACHSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@H](C(=O)N(C)C[C@H](O)CNc1ncccc1-c1nnn[n-]1)S(C)(=O)=O ZINC001573596470 947429623 /nfs/dbraw/zinc/42/96/23/947429623.db2.gz KKIUBPKELDQYKV-NXEZZACHSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@@H](O)CNc1ncccc1-c1nn[n-]n1)S(C)(=O)=O ZINC001573596472 947430200 /nfs/dbraw/zinc/43/02/00/947430200.db2.gz KKIUBPKELDQYKV-UWVGGRQHSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@@H](O)CNc1ncccc1-c1nnn[n-]1)S(C)(=O)=O ZINC001573596472 947430194 /nfs/dbraw/zinc/43/01/94/947430194.db2.gz KKIUBPKELDQYKV-UWVGGRQHSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@H](O)CNc1ncccc1-c1nn[n-]n1)S(C)(=O)=O ZINC001573596474 947429308 /nfs/dbraw/zinc/42/93/08/947429308.db2.gz KKIUBPKELDQYKV-VHSXEESVSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@H](O)CNc1ncccc1-c1nnn[n-]1)S(C)(=O)=O ZINC001573596474 947429301 /nfs/dbraw/zinc/42/93/01/947429301.db2.gz KKIUBPKELDQYKV-VHSXEESVSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@H](C(=O)N(C)C[C@@H](O)CNc1ncccc1-c1nn[n-]n1)S(C)(=O)=O ZINC001573596476 947429841 /nfs/dbraw/zinc/42/98/41/947429841.db2.gz KKIUBPKELDQYKV-ZJUUUORDSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@H](C(=O)N(C)C[C@@H](O)CNc1ncccc1-c1nnn[n-]1)S(C)(=O)=O ZINC001573596476 947429833 /nfs/dbraw/zinc/42/98/33/947429833.db2.gz KKIUBPKELDQYKV-ZJUUUORDSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@H](C(=O)N(C)C[C@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)n1cncn1 ZINC001573596814 947431400 /nfs/dbraw/zinc/43/14/00/947431400.db2.gz LGONKZGSWKQIFO-NXEZZACHSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@H](C(=O)N(C)C[C@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)n1cncn1 ZINC001573596814 947431394 /nfs/dbraw/zinc/43/13/94/947431394.db2.gz LGONKZGSWKQIFO-NXEZZACHSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)n1cncn1 ZINC001573596815 947432492 /nfs/dbraw/zinc/43/24/92/947432492.db2.gz LGONKZGSWKQIFO-UWVGGRQHSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)n1cncn1 ZINC001573596815 947432486 /nfs/dbraw/zinc/43/24/86/947432486.db2.gz LGONKZGSWKQIFO-UWVGGRQHSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)n1cncn1 ZINC001573596816 947431102 /nfs/dbraw/zinc/43/11/02/947431102.db2.gz LGONKZGSWKQIFO-VHSXEESVSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)n1cncn1 ZINC001573596816 947431096 /nfs/dbraw/zinc/43/10/96/947431096.db2.gz LGONKZGSWKQIFO-VHSXEESVSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@H](C(=O)N(C)C[C@@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)n1cncn1 ZINC001573596817 947431659 /nfs/dbraw/zinc/43/16/59/947431659.db2.gz LGONKZGSWKQIFO-ZJUUUORDSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@H](C(=O)N(C)C[C@@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)n1cncn1 ZINC001573596817 947431656 /nfs/dbraw/zinc/43/16/56/947431656.db2.gz LGONKZGSWKQIFO-ZJUUUORDSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@H](O)CNc1ccc(-c2nn[n-]n2)cn1)S(C)(=O)=O ZINC001573596848 947432575 /nfs/dbraw/zinc/43/25/75/947432575.db2.gz LLSAXNIBGANUFL-GXSJLCMTSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@H](O)CNc1ccc(-c2nnn[n-]2)cn1)S(C)(=O)=O ZINC001573596848 947432569 /nfs/dbraw/zinc/43/25/69/947432569.db2.gz LLSAXNIBGANUFL-GXSJLCMTSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@H](C(=O)N(C)C[C@@H](O)CNc1ccc(-c2nn[n-]n2)cn1)S(C)(=O)=O ZINC001573596850 947431564 /nfs/dbraw/zinc/43/15/64/947431564.db2.gz LLSAXNIBGANUFL-KOLCDFICSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@H](C(=O)N(C)C[C@@H](O)CNc1ccc(-c2nnn[n-]2)cn1)S(C)(=O)=O ZINC001573596850 947431560 /nfs/dbraw/zinc/43/15/60/947431560.db2.gz LLSAXNIBGANUFL-KOLCDFICSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@H](C(=O)N(C)C[C@H](O)CNc1ccc(-c2nn[n-]n2)cn1)S(C)(=O)=O ZINC001573596852 947431509 /nfs/dbraw/zinc/43/15/09/947431509.db2.gz LLSAXNIBGANUFL-MWLCHTKSSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@H](C(=O)N(C)C[C@H](O)CNc1ccc(-c2nnn[n-]2)cn1)S(C)(=O)=O ZINC001573596852 947431503 /nfs/dbraw/zinc/43/15/03/947431503.db2.gz LLSAXNIBGANUFL-MWLCHTKSSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@@H](O)CNc1ccc(-c2nn[n-]n2)cn1)S(C)(=O)=O ZINC001573596854 947432023 /nfs/dbraw/zinc/43/20/23/947432023.db2.gz LLSAXNIBGANUFL-ONGXEEELSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@@H](O)CNc1ccc(-c2nnn[n-]2)cn1)S(C)(=O)=O ZINC001573596854 947432015 /nfs/dbraw/zinc/43/20/15/947432015.db2.gz LLSAXNIBGANUFL-ONGXEEELSA-N -1 3 383.434 -1.074 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)n1cncn1 ZINC001573599313 947454682 /nfs/dbraw/zinc/45/46/82/947454682.db2.gz XIDCSQMAYAPAEC-GXSJLCMTSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)n1cncn1 ZINC001573599313 947454675 /nfs/dbraw/zinc/45/46/75/947454675.db2.gz XIDCSQMAYAPAEC-GXSJLCMTSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@H](C(=O)N(C)C[C@@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)n1cncn1 ZINC001573599315 947455889 /nfs/dbraw/zinc/45/58/89/947455889.db2.gz XIDCSQMAYAPAEC-KOLCDFICSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@H](C(=O)N(C)C[C@@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)n1cncn1 ZINC001573599315 947455885 /nfs/dbraw/zinc/45/58/85/947455885.db2.gz XIDCSQMAYAPAEC-KOLCDFICSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@H](C(=O)N(C)C[C@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)n1cncn1 ZINC001573599316 947455334 /nfs/dbraw/zinc/45/53/34/947455334.db2.gz XIDCSQMAYAPAEC-MWLCHTKSSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@H](C(=O)N(C)C[C@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)n1cncn1 ZINC001573599316 947455326 /nfs/dbraw/zinc/45/53/26/947455326.db2.gz XIDCSQMAYAPAEC-MWLCHTKSSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)n1cncn1 ZINC001573599319 947455747 /nfs/dbraw/zinc/45/57/47/947455747.db2.gz XIDCSQMAYAPAEC-ONGXEEELSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)N(C)C[C@@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)n1cncn1 ZINC001573599319 947455742 /nfs/dbraw/zinc/45/57/42/947455742.db2.gz XIDCSQMAYAPAEC-ONGXEEELSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)N(CCO)CCNc1ccc(-c2nn[n-]n2)nc1)S(C)(=O)=O ZINC001573603465 947486667 /nfs/dbraw/zinc/48/66/67/947486667.db2.gz HSFSWLWMRBPDDY-JTQLQIEISA-N -1 3 383.434 -1.072 20 0 GAADHM C[C@@H](C(=O)N(CCO)CCNc1ccc(-c2nnn[n-]2)nc1)S(C)(=O)=O ZINC001573603465 947486662 /nfs/dbraw/zinc/48/66/62/947486662.db2.gz HSFSWLWMRBPDDY-JTQLQIEISA-N -1 3 383.434 -1.072 20 0 GAADHM C[C@H](C(=O)N(CCO)CCNc1ccc(-c2nn[n-]n2)nc1)S(C)(=O)=O ZINC001573603466 947487968 /nfs/dbraw/zinc/48/79/68/947487968.db2.gz HSFSWLWMRBPDDY-SNVBAGLBSA-N -1 3 383.434 -1.072 20 0 GAADHM C[C@H](C(=O)N(CCO)CCNc1ccc(-c2nnn[n-]2)nc1)S(C)(=O)=O ZINC001573603466 947487961 /nfs/dbraw/zinc/48/79/61/947487961.db2.gz HSFSWLWMRBPDDY-SNVBAGLBSA-N -1 3 383.434 -1.072 20 0 GAADHM C[C@@H](C(=O)N(CCO)CCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)n1cncn1 ZINC001573604156 947505193 /nfs/dbraw/zinc/50/51/93/947505193.db2.gz LZQCUPSAMANNBF-JTQLQIEISA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@@H](C(=O)N(CCO)CCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)n1cncn1 ZINC001573604156 947505190 /nfs/dbraw/zinc/50/51/90/947505190.db2.gz LZQCUPSAMANNBF-JTQLQIEISA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@H](C(=O)N(CCO)CCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)n1cncn1 ZINC001573604157 947505214 /nfs/dbraw/zinc/50/52/14/947505214.db2.gz LZQCUPSAMANNBF-SNVBAGLBSA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@H](C(=O)N(CCO)CCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)n1cncn1 ZINC001573604157 947505210 /nfs/dbraw/zinc/50/52/10/947505210.db2.gz LZQCUPSAMANNBF-SNVBAGLBSA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@@H](C(=O)N(CCO)CCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)n1cncn1 ZINC001573604563 947512832 /nfs/dbraw/zinc/51/28/32/947512832.db2.gz PDVILOVYBQFLDC-JTQLQIEISA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@@H](C(=O)N(CCO)CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)n1cncn1 ZINC001573604563 947512822 /nfs/dbraw/zinc/51/28/22/947512822.db2.gz PDVILOVYBQFLDC-JTQLQIEISA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@H](C(=O)N(CCO)CCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)n1cncn1 ZINC001573604564 947514088 /nfs/dbraw/zinc/51/40/88/947514088.db2.gz PDVILOVYBQFLDC-SNVBAGLBSA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@H](C(=O)N(CCO)CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)n1cncn1 ZINC001573604564 947514078 /nfs/dbraw/zinc/51/40/78/947514078.db2.gz PDVILOVYBQFLDC-SNVBAGLBSA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@@H](C(=O)N(CCO)CCNc1ccc(-c2nn[n-]n2)cn1)S(C)(=O)=O ZINC001573605296 947528157 /nfs/dbraw/zinc/52/81/57/947528157.db2.gz VDCUTGIQOWFPER-JTQLQIEISA-N -1 3 383.434 -1.072 20 0 GAADHM C[C@@H](C(=O)N(CCO)CCNc1ccc(-c2nnn[n-]2)cn1)S(C)(=O)=O ZINC001573605296 947528153 /nfs/dbraw/zinc/52/81/53/947528153.db2.gz VDCUTGIQOWFPER-JTQLQIEISA-N -1 3 383.434 -1.072 20 0 GAADHM C[C@H](C(=O)N(CCO)CCNc1ccc(-c2nn[n-]n2)cn1)S(C)(=O)=O ZINC001573605297 947529819 /nfs/dbraw/zinc/52/98/19/947529819.db2.gz VDCUTGIQOWFPER-SNVBAGLBSA-N -1 3 383.434 -1.072 20 0 GAADHM C[C@H](C(=O)N(CCO)CCNc1ccc(-c2nnn[n-]2)cn1)S(C)(=O)=O ZINC001573605297 947529809 /nfs/dbraw/zinc/52/98/09/947529809.db2.gz VDCUTGIQOWFPER-SNVBAGLBSA-N -1 3 383.434 -1.072 20 0 GAADHM C[C@H](C(=O)N1CC(N(C)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)S(C)(=O)=O ZINC001573606931 947534139 /nfs/dbraw/zinc/53/41/39/947534139.db2.gz AWIHWVSSIJGDAV-MRVPVSSYSA-N -1 3 381.418 -1.089 20 0 GAADHM C[C@@H](C(=O)N1CC(N(C)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)S(C)(=O)=O ZINC001573606932 947534401 /nfs/dbraw/zinc/53/44/01/947534401.db2.gz AWIHWVSSIJGDAV-QMMMGPOBSA-N -1 3 381.418 -1.089 20 0 GAADHM C[C@H](C(=O)N1CC(N(C)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)S(C)(=O)=O ZINC001573606975 947535999 /nfs/dbraw/zinc/53/59/99/947535999.db2.gz BQKXKHCBMPFWFL-MRVPVSSYSA-N -1 3 381.418 -1.089 20 0 GAADHM C[C@H](C(=O)N1CC(N(C)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)S(C)(=O)=O ZINC001573606975 947535991 /nfs/dbraw/zinc/53/59/91/947535991.db2.gz BQKXKHCBMPFWFL-MRVPVSSYSA-N -1 3 381.418 -1.089 20 0 GAADHM C[C@@H](C(=O)N1CC(N(C)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)S(C)(=O)=O ZINC001573606976 947536038 /nfs/dbraw/zinc/53/60/38/947536038.db2.gz BQKXKHCBMPFWFL-QMMMGPOBSA-N -1 3 381.418 -1.089 20 0 GAADHM C[C@@H](C(=O)N1CC(N(C)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)S(C)(=O)=O ZINC001573606976 947536026 /nfs/dbraw/zinc/53/60/26/947536026.db2.gz BQKXKHCBMPFWFL-QMMMGPOBSA-N -1 3 381.418 -1.089 20 0 GAADHM C[C@H](C(=O)N1CC(N(C)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)S(C)(=O)=O ZINC001573607193 947541969 /nfs/dbraw/zinc/54/19/69/947541969.db2.gz GVVNHDVVMWWRTA-MRVPVSSYSA-N -1 3 381.418 -1.089 20 0 GAADHM C[C@H](C(=O)N1CC(N(C)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)S(C)(=O)=O ZINC001573607193 947541961 /nfs/dbraw/zinc/54/19/61/947541961.db2.gz GVVNHDVVMWWRTA-MRVPVSSYSA-N -1 3 381.418 -1.089 20 0 GAADHM C[C@@H](C(=O)N1CC(N(C)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)S(C)(=O)=O ZINC001573607194 947542024 /nfs/dbraw/zinc/54/20/24/947542024.db2.gz GVVNHDVVMWWRTA-QMMMGPOBSA-N -1 3 381.418 -1.089 20 0 GAADHM C[C@@H](C(=O)N1CC(N(C)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)S(C)(=O)=O ZINC001573607194 947542009 /nfs/dbraw/zinc/54/20/09/947542009.db2.gz GVVNHDVVMWWRTA-QMMMGPOBSA-N -1 3 381.418 -1.089 20 0 GAADHM C[C@H](C(=O)N1CC(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)S(C)(=O)=O ZINC001573608302 947558536 /nfs/dbraw/zinc/55/85/36/947558536.db2.gz YAXDHHWAFBJJNF-MRVPVSSYSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@@H](C(=O)N1CC(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)S(C)(=O)=O ZINC001573608303 947558361 /nfs/dbraw/zinc/55/83/61/947558361.db2.gz YAXDHHWAFBJJNF-QMMMGPOBSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@@H](C(=O)N(CCO)CCNc1ncccc1-c1nn[n-]n1)S(C)(=O)=O ZINC001573608334 947561246 /nfs/dbraw/zinc/56/12/46/947561246.db2.gz YMPKOAGKPDTPTR-JTQLQIEISA-N -1 3 383.434 -1.072 20 0 GAADHM C[C@@H](C(=O)N(CCO)CCNc1ncccc1-c1nnn[n-]1)S(C)(=O)=O ZINC001573608334 947561240 /nfs/dbraw/zinc/56/12/40/947561240.db2.gz YMPKOAGKPDTPTR-JTQLQIEISA-N -1 3 383.434 -1.072 20 0 GAADHM C[C@H](C(=O)N(CCO)CCNc1ncccc1-c1nn[n-]n1)S(C)(=O)=O ZINC001573608336 947560542 /nfs/dbraw/zinc/56/05/42/947560542.db2.gz YMPKOAGKPDTPTR-SNVBAGLBSA-N -1 3 383.434 -1.072 20 0 GAADHM C[C@H](C(=O)N(CCO)CCNc1ncccc1-c1nnn[n-]1)S(C)(=O)=O ZINC001573608336 947560535 /nfs/dbraw/zinc/56/05/35/947560535.db2.gz YMPKOAGKPDTPTR-SNVBAGLBSA-N -1 3 383.434 -1.072 20 0 GAADHM C[C@H](C(=O)N1CC(O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)n1cncn1 ZINC001573613607 947567020 /nfs/dbraw/zinc/56/70/20/947567020.db2.gz DGYNDBXJBOXCPX-SECBINFHSA-N -1 3 386.376 -1.649 20 0 GAADHM C[C@H](C(=O)N1CC(O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)n1cncn1 ZINC001573613607 947567013 /nfs/dbraw/zinc/56/70/13/947567013.db2.gz DGYNDBXJBOXCPX-SECBINFHSA-N -1 3 386.376 -1.649 20 0 GAADHM C[C@@H](C(=O)N1CC(O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)n1cncn1 ZINC001573613608 947566057 /nfs/dbraw/zinc/56/60/57/947566057.db2.gz DGYNDBXJBOXCPX-VIFPVBQESA-N -1 3 386.376 -1.649 20 0 GAADHM C[C@@H](C(=O)N1CC(O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)n1cncn1 ZINC001573613608 947566039 /nfs/dbraw/zinc/56/60/39/947566039.db2.gz DGYNDBXJBOXCPX-VIFPVBQESA-N -1 3 386.376 -1.649 20 0 GAADHM C[C@@H](C(=O)N1CC(O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)n1cccn1 ZINC001573613996 947576337 /nfs/dbraw/zinc/57/63/37/947576337.db2.gz KDQMRKISCMKFAV-JTQLQIEISA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@@H](C(=O)N1CC(O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)n1cccn1 ZINC001573613996 947576330 /nfs/dbraw/zinc/57/63/30/947576330.db2.gz KDQMRKISCMKFAV-JTQLQIEISA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@H](C(=O)N1CC(O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)n1cccn1 ZINC001573613997 947575857 /nfs/dbraw/zinc/57/58/57/947575857.db2.gz KDQMRKISCMKFAV-SNVBAGLBSA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@H](C(=O)N1CC(O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)n1cccn1 ZINC001573613997 947575851 /nfs/dbraw/zinc/57/58/51/947575851.db2.gz KDQMRKISCMKFAV-SNVBAGLBSA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@@H](C(=O)N1CC(O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)n1cccn1 ZINC001573615059 947598317 /nfs/dbraw/zinc/59/83/17/947598317.db2.gz PVSJESNNKCWHQR-JTQLQIEISA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@@H](C(=O)N1CC(O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)n1cccn1 ZINC001573615059 947598308 /nfs/dbraw/zinc/59/83/08/947598308.db2.gz PVSJESNNKCWHQR-JTQLQIEISA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@H](C(=O)N1CC(O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)n1cccn1 ZINC001573615060 947597531 /nfs/dbraw/zinc/59/75/31/947597531.db2.gz PVSJESNNKCWHQR-SNVBAGLBSA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@H](C(=O)N1CC(O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)n1cccn1 ZINC001573615060 947597523 /nfs/dbraw/zinc/59/75/23/947597523.db2.gz PVSJESNNKCWHQR-SNVBAGLBSA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@H](C(=O)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)S(C)(=O)=O ZINC001573615295 947604204 /nfs/dbraw/zinc/60/42/04/947604204.db2.gz DDHJLBJGXOUHQQ-BDAKNGLRSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)S(C)(=O)=O ZINC001573615295 947604201 /nfs/dbraw/zinc/60/42/01/947604201.db2.gz DDHJLBJGXOUHQQ-BDAKNGLRSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)S(C)(=O)=O ZINC001573615305 947604157 /nfs/dbraw/zinc/60/41/57/947604157.db2.gz DDHJLBJGXOUHQQ-IUCAKERBSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)S(C)(=O)=O ZINC001573615305 947604150 /nfs/dbraw/zinc/60/41/50/947604150.db2.gz DDHJLBJGXOUHQQ-IUCAKERBSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)S(C)(=O)=O ZINC001573616487 947622714 /nfs/dbraw/zinc/62/27/14/947622714.db2.gz IWCDWTWFSDDCMQ-PSASIEDQSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)S(C)(=O)=O ZINC001573616488 947622900 /nfs/dbraw/zinc/62/29/00/947622900.db2.gz IWCDWTWFSDDCMQ-SCZZXKLOSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)S(C)(=O)=O ZINC001573616489 947623457 /nfs/dbraw/zinc/62/34/57/947623457.db2.gz IWCDWTWFSDDCMQ-WCBMZHEXSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)S(C)(=O)=O ZINC001573616491 947623168 /nfs/dbraw/zinc/62/31/68/947623168.db2.gz IWCDWTWFSDDCMQ-WPRPVWTQSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC(O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)n1cccn1 ZINC001573616594 947625405 /nfs/dbraw/zinc/62/54/05/947625405.db2.gz XTWPQOLRPIABIC-JTQLQIEISA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@@H](C(=O)N1CC(O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)n1cccn1 ZINC001573616594 947625400 /nfs/dbraw/zinc/62/54/00/947625400.db2.gz XTWPQOLRPIABIC-JTQLQIEISA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@H](C(=O)N1CC(O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)n1cccn1 ZINC001573616597 947626039 /nfs/dbraw/zinc/62/60/39/947626039.db2.gz XTWPQOLRPIABIC-SNVBAGLBSA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@H](C(=O)N1CC(O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)n1cccn1 ZINC001573616597 947626030 /nfs/dbraw/zinc/62/60/30/947626030.db2.gz XTWPQOLRPIABIC-SNVBAGLBSA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@H](C(=O)N1CC(O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)n1cncn1 ZINC001573616912 947629135 /nfs/dbraw/zinc/62/91/35/947629135.db2.gz ZFNNLBWGCCEQHN-SECBINFHSA-N -1 3 386.376 -1.649 20 0 GAADHM C[C@H](C(=O)N1CC(O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)n1cncn1 ZINC001573616912 947629129 /nfs/dbraw/zinc/62/91/29/947629129.db2.gz ZFNNLBWGCCEQHN-SECBINFHSA-N -1 3 386.376 -1.649 20 0 GAADHM C[C@@H](C(=O)N1CC(O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)n1cncn1 ZINC001573616915 947629515 /nfs/dbraw/zinc/62/95/15/947629515.db2.gz ZFNNLBWGCCEQHN-VIFPVBQESA-N -1 3 386.376 -1.649 20 0 GAADHM C[C@@H](C(=O)N1CC(O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)n1cncn1 ZINC001573616915 947629510 /nfs/dbraw/zinc/62/95/10/947629510.db2.gz ZFNNLBWGCCEQHN-VIFPVBQESA-N -1 3 386.376 -1.649 20 0 GAADHM C[C@H](C(=O)N1CC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)S(C)(=O)=O ZINC001573623815 947691239 /nfs/dbraw/zinc/69/12/39/947691239.db2.gz IRELLDAACOALLD-BDAKNGLRSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N1CC[C@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)S(C)(=O)=O ZINC001573623815 947691231 /nfs/dbraw/zinc/69/12/31/947691231.db2.gz IRELLDAACOALLD-BDAKNGLRSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)S(C)(=O)=O ZINC001573623817 947691579 /nfs/dbraw/zinc/69/15/79/947691579.db2.gz IRELLDAACOALLD-DTWKUNHWSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC[C@@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)S(C)(=O)=O ZINC001573623817 947691572 /nfs/dbraw/zinc/69/15/72/947691572.db2.gz IRELLDAACOALLD-DTWKUNHWSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)S(C)(=O)=O ZINC001573623819 947692147 /nfs/dbraw/zinc/69/21/47/947692147.db2.gz IRELLDAACOALLD-IUCAKERBSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC[C@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)S(C)(=O)=O ZINC001573623819 947692140 /nfs/dbraw/zinc/69/21/40/947692140.db2.gz IRELLDAACOALLD-IUCAKERBSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N1CC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)S(C)(=O)=O ZINC001573623821 947691930 /nfs/dbraw/zinc/69/19/30/947691930.db2.gz IRELLDAACOALLD-RKDXNWHRSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N1CC[C@@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)S(C)(=O)=O ZINC001573623821 947691924 /nfs/dbraw/zinc/69/19/24/947691924.db2.gz IRELLDAACOALLD-RKDXNWHRSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N1CC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)S(C)(=O)=O ZINC001573625588 947701853 /nfs/dbraw/zinc/70/18/53/947701853.db2.gz PEOLQWAWAQHYDE-PSASIEDQSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N1CC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)S(C)(=O)=O ZINC001573625589 947701537 /nfs/dbraw/zinc/70/15/37/947701537.db2.gz PEOLQWAWAQHYDE-SCZZXKLOSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)S(C)(=O)=O ZINC001573625590 947701941 /nfs/dbraw/zinc/70/19/41/947701941.db2.gz PEOLQWAWAQHYDE-WCBMZHEXSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)S(C)(=O)=O ZINC001573625591 947701431 /nfs/dbraw/zinc/70/14/31/947701431.db2.gz PEOLQWAWAQHYDE-WPRPVWTQSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N1CC[C@@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)S(C)(=O)=O ZINC001573625598 947702305 /nfs/dbraw/zinc/70/23/05/947702305.db2.gz PGQXRXYDQGMPQB-PSASIEDQSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N1CC[C@@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)S(C)(=O)=O ZINC001573625598 947702298 /nfs/dbraw/zinc/70/22/98/947702298.db2.gz PGQXRXYDQGMPQB-PSASIEDQSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N1CC[C@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)S(C)(=O)=O ZINC001573625599 947702062 /nfs/dbraw/zinc/70/20/62/947702062.db2.gz PGQXRXYDQGMPQB-SCZZXKLOSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N1CC[C@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)S(C)(=O)=O ZINC001573625599 947702059 /nfs/dbraw/zinc/70/20/59/947702059.db2.gz PGQXRXYDQGMPQB-SCZZXKLOSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC[C@@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)S(C)(=O)=O ZINC001573625600 947702335 /nfs/dbraw/zinc/70/23/35/947702335.db2.gz PGQXRXYDQGMPQB-WCBMZHEXSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC[C@@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)S(C)(=O)=O ZINC001573625600 947702331 /nfs/dbraw/zinc/70/23/31/947702331.db2.gz PGQXRXYDQGMPQB-WCBMZHEXSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC[C@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)S(C)(=O)=O ZINC001573625601 947700927 /nfs/dbraw/zinc/70/09/27/947700927.db2.gz PGQXRXYDQGMPQB-WPRPVWTQSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC[C@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)S(C)(=O)=O ZINC001573625601 947700919 /nfs/dbraw/zinc/70/09/19/947700919.db2.gz PGQXRXYDQGMPQB-WPRPVWTQSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1)S(C)(=O)=O ZINC001573638088 947833997 /nfs/dbraw/zinc/83/39/97/947833997.db2.gz CLJQBYKEANRWSP-SECBINFHSA-N -1 3 381.418 -1.088 20 0 GAADHM C[C@H](C(=O)N1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1)S(C)(=O)=O ZINC001573638088 947833988 /nfs/dbraw/zinc/83/39/88/947833988.db2.gz CLJQBYKEANRWSP-SECBINFHSA-N -1 3 381.418 -1.088 20 0 GAADHM C[C@@H](C(=O)N1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1)S(C)(=O)=O ZINC001573638089 947833837 /nfs/dbraw/zinc/83/38/37/947833837.db2.gz CLJQBYKEANRWSP-VIFPVBQESA-N -1 3 381.418 -1.088 20 0 GAADHM C[C@@H](C(=O)N1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1)S(C)(=O)=O ZINC001573638089 947833834 /nfs/dbraw/zinc/83/38/34/947833834.db2.gz CLJQBYKEANRWSP-VIFPVBQESA-N -1 3 381.418 -1.088 20 0 GAADHM C[C@H](C(=O)N1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1)S(C)(=O)=O ZINC001573638157 947835988 /nfs/dbraw/zinc/83/59/88/947835988.db2.gz HGYSHVIPAJACDF-SECBINFHSA-N -1 3 381.418 -1.088 20 0 GAADHM C[C@@H](C(=O)N1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1)S(C)(=O)=O ZINC001573638158 947836475 /nfs/dbraw/zinc/83/64/75/947836475.db2.gz HGYSHVIPAJACDF-VIFPVBQESA-N -1 3 381.418 -1.088 20 0 GAADHM C[C@H](C(=O)N1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1)S(C)(=O)=O ZINC001573638409 947837949 /nfs/dbraw/zinc/83/79/49/947837949.db2.gz MXGRZQYAWLIESJ-SECBINFHSA-N -1 3 381.418 -1.088 20 0 GAADHM C[C@H](C(=O)N1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1)S(C)(=O)=O ZINC001573638409 947837945 /nfs/dbraw/zinc/83/79/45/947837945.db2.gz MXGRZQYAWLIESJ-SECBINFHSA-N -1 3 381.418 -1.088 20 0 GAADHM C[C@@H](C(=O)N1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1)S(C)(=O)=O ZINC001573638410 947840051 /nfs/dbraw/zinc/84/00/51/947840051.db2.gz MXGRZQYAWLIESJ-VIFPVBQESA-N -1 3 381.418 -1.088 20 0 GAADHM C[C@@H](C(=O)N1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1)S(C)(=O)=O ZINC001573638410 947840044 /nfs/dbraw/zinc/84/00/44/947840044.db2.gz MXGRZQYAWLIESJ-VIFPVBQESA-N -1 3 381.418 -1.088 20 0 GAADHM C[C@H](C(=O)N1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)S(C)(=O)=O ZINC001573641642 947857631 /nfs/dbraw/zinc/85/76/31/947857631.db2.gz MLDPKKFPJWBVLY-PSASIEDQSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)S(C)(=O)=O ZINC001573641642 947857627 /nfs/dbraw/zinc/85/76/27/947857627.db2.gz MLDPKKFPJWBVLY-PSASIEDQSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)S(C)(=O)=O ZINC001573641645 947856669 /nfs/dbraw/zinc/85/66/69/947856669.db2.gz MLDPKKFPJWBVLY-WCBMZHEXSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)S(C)(=O)=O ZINC001573641645 947856661 /nfs/dbraw/zinc/85/66/61/947856661.db2.gz MLDPKKFPJWBVLY-WCBMZHEXSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)S(C)(=O)=O ZINC001573646435 947875234 /nfs/dbraw/zinc/87/52/34/947875234.db2.gz MLDPKKFPJWBVLY-SCZZXKLOSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)S(C)(=O)=O ZINC001573646435 947875228 /nfs/dbraw/zinc/87/52/28/947875228.db2.gz MLDPKKFPJWBVLY-SCZZXKLOSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)S(C)(=O)=O ZINC001573646437 947875326 /nfs/dbraw/zinc/87/53/26/947875326.db2.gz MLDPKKFPJWBVLY-WPRPVWTQSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)S(C)(=O)=O ZINC001573646437 947875318 /nfs/dbraw/zinc/87/53/18/947875318.db2.gz MLDPKKFPJWBVLY-WPRPVWTQSA-N -1 3 381.418 -1.041 20 0 GAADHM 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C[C@@H](C(=O)N[C@H](CO)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1ccnn1C ZINC001573652559 947941771 /nfs/dbraw/zinc/94/17/71/947941771.db2.gz DOSBQWOFYHDQOK-ZJUUUORDSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cnn(C)c1 ZINC001573652730 947945967 /nfs/dbraw/zinc/94/59/67/947945967.db2.gz HAWSQDSHUKEWNS-BXKDBHETSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cnn(C)c1 ZINC001573652730 947945964 /nfs/dbraw/zinc/94/59/64/947945964.db2.gz HAWSQDSHUKEWNS-BXKDBHETSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cnn(C)c1 ZINC001573652731 947946055 /nfs/dbraw/zinc/94/60/55/947946055.db2.gz HAWSQDSHUKEWNS-CABZTGNLSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cnn(C)c1 ZINC001573652731 947946049 /nfs/dbraw/zinc/94/60/49/947946049.db2.gz HAWSQDSHUKEWNS-CABZTGNLSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cnn(C)c1 ZINC001573652732 947945856 /nfs/dbraw/zinc/94/58/56/947945856.db2.gz HAWSQDSHUKEWNS-JOYOIKCWSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cnn(C)c1 ZINC001573652732 947945851 /nfs/dbraw/zinc/94/58/51/947945851.db2.gz HAWSQDSHUKEWNS-JOYOIKCWSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cnn(C)c1 ZINC001573652733 947947177 /nfs/dbraw/zinc/94/71/77/947947177.db2.gz HAWSQDSHUKEWNS-SKDRFNHKSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cnn(C)c1 ZINC001573652733 947947169 /nfs/dbraw/zinc/94/71/69/947947169.db2.gz HAWSQDSHUKEWNS-SKDRFNHKSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@@H](CO)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1cnn(C)c1 ZINC001573653898 947960067 /nfs/dbraw/zinc/96/00/67/947960067.db2.gz NLTPFJRLLGGPEB-GXSJLCMTSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@@H](CO)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1cnn(C)c1 ZINC001573653898 947960064 /nfs/dbraw/zinc/96/00/64/947960064.db2.gz NLTPFJRLLGGPEB-GXSJLCMTSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@H](CO)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1cnn(C)c1 ZINC001573653899 947959231 /nfs/dbraw/zinc/95/92/31/947959231.db2.gz NLTPFJRLLGGPEB-KOLCDFICSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@H](CO)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1cnn(C)c1 ZINC001573653899 947959227 /nfs/dbraw/zinc/95/92/27/947959227.db2.gz NLTPFJRLLGGPEB-KOLCDFICSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@@H](CO)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1cnn(C)c1 ZINC001573653900 947960109 /nfs/dbraw/zinc/96/01/09/947960109.db2.gz NLTPFJRLLGGPEB-MWLCHTKSSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@@H](CO)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1cnn(C)c1 ZINC001573653900 947960105 /nfs/dbraw/zinc/96/01/05/947960105.db2.gz NLTPFJRLLGGPEB-MWLCHTKSSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@H](CO)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1cnn(C)c1 ZINC001573653901 947959651 /nfs/dbraw/zinc/95/96/51/947959651.db2.gz NLTPFJRLLGGPEB-ONGXEEELSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@H](CO)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1cnn(C)c1 ZINC001573653901 947959646 /nfs/dbraw/zinc/95/96/46/947959646.db2.gz NLTPFJRLLGGPEB-ONGXEEELSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1ccnn1C ZINC001573653936 947962032 /nfs/dbraw/zinc/96/20/32/947962032.db2.gz OKYLKNNACVBDRI-GXSJLCMTSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1ccnn1C ZINC001573653936 947962023 /nfs/dbraw/zinc/96/20/23/947962023.db2.gz OKYLKNNACVBDRI-GXSJLCMTSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1ccnn1C ZINC001573653937 947962484 /nfs/dbraw/zinc/96/24/84/947962484.db2.gz OKYLKNNACVBDRI-KOLCDFICSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1ccnn1C ZINC001573653937 947962481 /nfs/dbraw/zinc/96/24/81/947962481.db2.gz OKYLKNNACVBDRI-KOLCDFICSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1ccnn1C ZINC001573653938 947961695 /nfs/dbraw/zinc/96/16/95/947961695.db2.gz OKYLKNNACVBDRI-MWLCHTKSSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1ccnn1C ZINC001573653938 947961686 /nfs/dbraw/zinc/96/16/86/947961686.db2.gz OKYLKNNACVBDRI-MWLCHTKSSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1ccnn1C ZINC001573653939 947960814 /nfs/dbraw/zinc/96/08/14/947960814.db2.gz OKYLKNNACVBDRI-ONGXEEELSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1ccnn1C ZINC001573653939 947960805 /nfs/dbraw/zinc/96/08/05/947960805.db2.gz OKYLKNNACVBDRI-ONGXEEELSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1ccnn1C ZINC001573654483 947964906 /nfs/dbraw/zinc/96/49/06/947964906.db2.gz RLCQFPYUNQSYEX-GXSJLCMTSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1ccnn1C ZINC001573654483 947964897 /nfs/dbraw/zinc/96/48/97/947964897.db2.gz RLCQFPYUNQSYEX-GXSJLCMTSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1ccnn1C ZINC001573654484 947967490 /nfs/dbraw/zinc/96/74/90/947967490.db2.gz RLCQFPYUNQSYEX-KOLCDFICSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1ccnn1C ZINC001573654484 947967486 /nfs/dbraw/zinc/96/74/86/947967486.db2.gz RLCQFPYUNQSYEX-KOLCDFICSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1ccnn1C ZINC001573654485 947967794 /nfs/dbraw/zinc/96/77/94/947967794.db2.gz RLCQFPYUNQSYEX-MWLCHTKSSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1ccnn1C ZINC001573654485 947967787 /nfs/dbraw/zinc/96/77/87/947967787.db2.gz RLCQFPYUNQSYEX-MWLCHTKSSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1ccnn1C ZINC001573654486 947968412 /nfs/dbraw/zinc/96/84/12/947968412.db2.gz RLCQFPYUNQSYEX-ONGXEEELSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1ccnn1C ZINC001573654486 947968406 /nfs/dbraw/zinc/96/84/06/947968406.db2.gz RLCQFPYUNQSYEX-ONGXEEELSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1cnn(C)c1 ZINC001573654629 947967431 /nfs/dbraw/zinc/96/74/31/947967431.db2.gz SAAOUGYTJNPBTP-BXKDBHETSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1cnn(C)c1 ZINC001573654629 947967426 /nfs/dbraw/zinc/96/74/26/947967426.db2.gz SAAOUGYTJNPBTP-BXKDBHETSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1cnn(C)c1 ZINC001573654630 947968762 /nfs/dbraw/zinc/96/87/62/947968762.db2.gz SAAOUGYTJNPBTP-CABZTGNLSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1cnn(C)c1 ZINC001573654630 947968756 /nfs/dbraw/zinc/96/87/56/947968756.db2.gz SAAOUGYTJNPBTP-CABZTGNLSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1cnn(C)c1 ZINC001573654631 947968784 /nfs/dbraw/zinc/96/87/84/947968784.db2.gz SAAOUGYTJNPBTP-JOYOIKCWSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1cnn(C)c1 ZINC001573654631 947968776 /nfs/dbraw/zinc/96/87/76/947968776.db2.gz SAAOUGYTJNPBTP-JOYOIKCWSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1cnn(C)c1 ZINC001573654632 947968013 /nfs/dbraw/zinc/96/80/13/947968013.db2.gz SAAOUGYTJNPBTP-SKDRFNHKSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1cnn(C)c1 ZINC001573654632 947968001 /nfs/dbraw/zinc/96/80/01/947968001.db2.gz SAAOUGYTJNPBTP-SKDRFNHKSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@H]1CN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573655981 947984333 /nfs/dbraw/zinc/98/43/33/947984333.db2.gz ASSVHSWPWLCGJY-BDAKNGLRSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@H]1CN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573655981 947984326 /nfs/dbraw/zinc/98/43/26/947984326.db2.gz ASSVHSWPWLCGJY-BDAKNGLRSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@@H]1CN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573655982 947983247 /nfs/dbraw/zinc/98/32/47/947983247.db2.gz ASSVHSWPWLCGJY-DTWKUNHWSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@@H]1CN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573655982 947983239 /nfs/dbraw/zinc/98/32/39/947983239.db2.gz ASSVHSWPWLCGJY-DTWKUNHWSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@H]1CN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573655983 947983338 /nfs/dbraw/zinc/98/33/38/947983338.db2.gz ASSVHSWPWLCGJY-IUCAKERBSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@H]1CN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573655983 947983335 /nfs/dbraw/zinc/98/33/35/947983335.db2.gz ASSVHSWPWLCGJY-IUCAKERBSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@@H]1CN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001573655984 947983520 /nfs/dbraw/zinc/98/35/20/947983520.db2.gz ASSVHSWPWLCGJY-RKDXNWHRSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@@H]1CN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001573655984 947983517 /nfs/dbraw/zinc/98/35/17/947983517.db2.gz ASSVHSWPWLCGJY-RKDXNWHRSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@@H](N(C)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573656183 947986248 /nfs/dbraw/zinc/98/62/48/947986248.db2.gz DCVOFENREWULRT-PSASIEDQSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@@H](N(C)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573656183 947986243 /nfs/dbraw/zinc/98/62/43/947986243.db2.gz DCVOFENREWULRT-PSASIEDQSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@H](N(C)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573656184 947986444 /nfs/dbraw/zinc/98/64/44/947986444.db2.gz DCVOFENREWULRT-SCZZXKLOSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@H](N(C)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573656184 947986435 /nfs/dbraw/zinc/98/64/35/947986435.db2.gz DCVOFENREWULRT-SCZZXKLOSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@@H](N(C)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573656185 947986136 /nfs/dbraw/zinc/98/61/36/947986136.db2.gz DCVOFENREWULRT-WCBMZHEXSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@@H](N(C)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573656185 947986133 /nfs/dbraw/zinc/98/61/33/947986133.db2.gz DCVOFENREWULRT-WCBMZHEXSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@H](N(C)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001573656186 947986768 /nfs/dbraw/zinc/98/67/68/947986768.db2.gz DCVOFENREWULRT-WPRPVWTQSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@H](N(C)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001573656186 947986761 /nfs/dbraw/zinc/98/67/61/947986761.db2.gz DCVOFENREWULRT-WPRPVWTQSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1C[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H]2C1 ZINC001573656800 947992320 /nfs/dbraw/zinc/99/23/20/947992320.db2.gz ICPVGFRLBRRLRU-HOTUBEGUSA-N -1 3 387.404 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1C[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H]2C1 ZINC001573656801 947992583 /nfs/dbraw/zinc/99/25/83/947992583.db2.gz ICPVGFRLBRRLRU-VDDIYKPWSA-N -1 3 387.404 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1C[C@@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H]2C1 ZINC001573656868 947994088 /nfs/dbraw/zinc/99/40/88/947994088.db2.gz JBNGJEJPWAREFI-HOTUBEGUSA-N -1 3 387.404 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1C[C@@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H]2C1 ZINC001573656869 947995013 /nfs/dbraw/zinc/99/50/13/947995013.db2.gz JBNGJEJPWAREFI-VDDIYKPWSA-N -1 3 387.404 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@H](N(C)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573657037 947996804 /nfs/dbraw/zinc/99/68/04/947996804.db2.gz JWMBIMNTRFFDEZ-BDAKNGLRSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@H](N(C)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573657037 947996797 /nfs/dbraw/zinc/99/67/97/947996797.db2.gz JWMBIMNTRFFDEZ-BDAKNGLRSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@@H](N(C)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573657038 947996109 /nfs/dbraw/zinc/99/61/09/947996109.db2.gz JWMBIMNTRFFDEZ-DTWKUNHWSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@@H](N(C)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573657038 947996104 /nfs/dbraw/zinc/99/61/04/947996104.db2.gz JWMBIMNTRFFDEZ-DTWKUNHWSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@H](N(C)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573657039 947996278 /nfs/dbraw/zinc/99/62/78/947996278.db2.gz JWMBIMNTRFFDEZ-IUCAKERBSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@H](N(C)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573657039 947996271 /nfs/dbraw/zinc/99/62/71/947996271.db2.gz JWMBIMNTRFFDEZ-IUCAKERBSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@@H](N(C)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001573657040 947997000 /nfs/dbraw/zinc/99/70/00/947997000.db2.gz JWMBIMNTRFFDEZ-RKDXNWHRSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@@H](N(C)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001573657040 947996996 /nfs/dbraw/zinc/99/69/96/947996996.db2.gz JWMBIMNTRFFDEZ-RKDXNWHRSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@@H]1CN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001573657157 947998967 /nfs/dbraw/zinc/99/89/67/947998967.db2.gz LFYVRRVCPYEWTD-PSASIEDQSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@@H]1CN(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001573657157 947998959 /nfs/dbraw/zinc/99/89/59/947998959.db2.gz LFYVRRVCPYEWTD-PSASIEDQSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@H]1CN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001573657299 947998340 /nfs/dbraw/zinc/99/83/40/947998340.db2.gz LFYVRRVCPYEWTD-SCZZXKLOSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@H]1CN(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001573657299 947998332 /nfs/dbraw/zinc/99/83/32/947998332.db2.gz LFYVRRVCPYEWTD-SCZZXKLOSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@@H]1CN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001573657300 947998408 /nfs/dbraw/zinc/99/84/08/947998408.db2.gz LFYVRRVCPYEWTD-WCBMZHEXSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@@H]1CN(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001573657300 947998404 /nfs/dbraw/zinc/99/84/04/947998404.db2.gz LFYVRRVCPYEWTD-WCBMZHEXSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@H]1CN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001573657301 947998077 /nfs/dbraw/zinc/99/80/77/947998077.db2.gz LFYVRRVCPYEWTD-WPRPVWTQSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@H]1CN(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001573657301 947998072 /nfs/dbraw/zinc/99/80/72/947998072.db2.gz LFYVRRVCPYEWTD-WPRPVWTQSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@@H]1CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001573657628 948001254 /nfs/dbraw/zinc/00/12/54/948001254.db2.gz NUKKHTCRCXFNLR-PSASIEDQSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@@H]1CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001573657628 948001251 /nfs/dbraw/zinc/00/12/51/948001251.db2.gz NUKKHTCRCXFNLR-PSASIEDQSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@H]1CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001573657629 948001626 /nfs/dbraw/zinc/00/16/26/948001626.db2.gz NUKKHTCRCXFNLR-SCZZXKLOSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@H]1CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001573657629 948001612 /nfs/dbraw/zinc/00/16/12/948001612.db2.gz NUKKHTCRCXFNLR-SCZZXKLOSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@@H]1CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001573657630 948000426 /nfs/dbraw/zinc/00/04/26/948000426.db2.gz NUKKHTCRCXFNLR-WCBMZHEXSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@@H]1CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001573657630 948000419 /nfs/dbraw/zinc/00/04/19/948000419.db2.gz NUKKHTCRCXFNLR-WCBMZHEXSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@H]1CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001573657631 948000354 /nfs/dbraw/zinc/00/03/54/948000354.db2.gz NUKKHTCRCXFNLR-WPRPVWTQSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@H]1CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001573657631 948000343 /nfs/dbraw/zinc/00/03/43/948000343.db2.gz NUKKHTCRCXFNLR-WPRPVWTQSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H]2C1 ZINC001573657806 948003047 /nfs/dbraw/zinc/00/30/47/948003047.db2.gz OUAPYZLJMPAPHG-KBVBSXBZSA-N -1 3 387.404 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H]2C1 ZINC001573657806 948003040 /nfs/dbraw/zinc/00/30/40/948003040.db2.gz OUAPYZLJMPAPHG-KBVBSXBZSA-N -1 3 387.404 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H]2C1 ZINC001573657807 948002349 /nfs/dbraw/zinc/00/23/49/948002349.db2.gz OUAPYZLJMPAPHG-YGOYTEALSA-N -1 3 387.404 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H]2C1 ZINC001573657807 948002340 /nfs/dbraw/zinc/00/23/40/948002340.db2.gz OUAPYZLJMPAPHG-YGOYTEALSA-N -1 3 387.404 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H]2C1 ZINC001573657851 948005017 /nfs/dbraw/zinc/00/50/17/948005017.db2.gz PICVPGDEFQVENT-KBVBSXBZSA-N -1 3 387.404 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H]2C1 ZINC001573657851 948005009 /nfs/dbraw/zinc/00/50/09/948005009.db2.gz PICVPGDEFQVENT-KBVBSXBZSA-N -1 3 387.404 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H]2C1 ZINC001573657853 948004663 /nfs/dbraw/zinc/00/46/63/948004663.db2.gz PICVPGDEFQVENT-YGOYTEALSA-N -1 3 387.404 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H]2C1 ZINC001573657853 948004655 /nfs/dbraw/zinc/00/46/55/948004655.db2.gz PICVPGDEFQVENT-YGOYTEALSA-N -1 3 387.404 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CCCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001573658586 948009592 /nfs/dbraw/zinc/00/95/92/948009592.db2.gz SJJITOVKYDGDDI-SECBINFHSA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CCCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001573658586 948009583 /nfs/dbraw/zinc/00/95/83/948009583.db2.gz SJJITOVKYDGDDI-SECBINFHSA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CCCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001573658588 948009086 /nfs/dbraw/zinc/00/90/86/948009086.db2.gz SJJITOVKYDGDDI-VIFPVBQESA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CCCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001573658588 948009082 /nfs/dbraw/zinc/00/90/82/948009082.db2.gz SJJITOVKYDGDDI-VIFPVBQESA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CCCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001573658891 948010880 /nfs/dbraw/zinc/01/08/80/948010880.db2.gz UEPRIZLPGOVNQT-SECBINFHSA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CCCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001573658891 948010873 /nfs/dbraw/zinc/01/08/73/948010873.db2.gz UEPRIZLPGOVNQT-SECBINFHSA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CCCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001573658897 948010914 /nfs/dbraw/zinc/01/09/14/948010914.db2.gz UEPRIZLPGOVNQT-VIFPVBQESA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CCCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001573658897 948010907 /nfs/dbraw/zinc/01/09/07/948010907.db2.gz UEPRIZLPGOVNQT-VIFPVBQESA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@@H](N(C)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573659109 948013194 /nfs/dbraw/zinc/01/31/94/948013194.db2.gz VKNZSSFEJVOVEM-PSASIEDQSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)NC(N)=O)N1CC[C@H](N(C)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573659111 948013760 /nfs/dbraw/zinc/01/37/60/948013760.db2.gz VKNZSSFEJVOVEM-SCZZXKLOSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@@H](N(C)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573659114 948013007 /nfs/dbraw/zinc/01/30/07/948013007.db2.gz VKNZSSFEJVOVEM-WCBMZHEXSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](C(=O)NC(N)=O)N1CC[C@H](N(C)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001573659116 948014465 /nfs/dbraw/zinc/01/44/65/948014465.db2.gz VKNZSSFEJVOVEM-WPRPVWTQSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](C(=O)N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)S(C)(=O)=O ZINC001573665546 948075191 /nfs/dbraw/zinc/07/51/91/948075191.db2.gz LYQGLKWHASPHSG-PSASIEDQSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)S(C)(=O)=O ZINC001573665548 948075389 /nfs/dbraw/zinc/07/53/89/948075389.db2.gz LYQGLKWHASPHSG-SCZZXKLOSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)S(C)(=O)=O ZINC001573665552 948075240 /nfs/dbraw/zinc/07/52/40/948075240.db2.gz LYQGLKWHASPHSG-WCBMZHEXSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)S(C)(=O)=O ZINC001573665555 948075411 /nfs/dbraw/zinc/07/54/11/948075411.db2.gz LYQGLKWHASPHSG-WPRPVWTQSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)S(C)(=O)=O ZINC001573665739 948077245 /nfs/dbraw/zinc/07/72/45/948077245.db2.gz MQWNMVHOWTYIKQ-BDAKNGLRSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)S(C)(=O)=O ZINC001573665739 948077238 /nfs/dbraw/zinc/07/72/38/948077238.db2.gz MQWNMVHOWTYIKQ-BDAKNGLRSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)S(C)(=O)=O ZINC001573665740 948076660 /nfs/dbraw/zinc/07/66/60/948076660.db2.gz MQWNMVHOWTYIKQ-DTWKUNHWSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)S(C)(=O)=O ZINC001573665740 948076649 /nfs/dbraw/zinc/07/66/49/948076649.db2.gz MQWNMVHOWTYIKQ-DTWKUNHWSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)S(C)(=O)=O ZINC001573665741 948076375 /nfs/dbraw/zinc/07/63/75/948076375.db2.gz MQWNMVHOWTYIKQ-IUCAKERBSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)S(C)(=O)=O ZINC001573665741 948076367 /nfs/dbraw/zinc/07/63/67/948076367.db2.gz MQWNMVHOWTYIKQ-IUCAKERBSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)S(C)(=O)=O ZINC001573665743 948078124 /nfs/dbraw/zinc/07/81/24/948078124.db2.gz MQWNMVHOWTYIKQ-RKDXNWHRSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)S(C)(=O)=O ZINC001573665743 948078114 /nfs/dbraw/zinc/07/81/14/948078114.db2.gz MQWNMVHOWTYIKQ-RKDXNWHRSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)NC[C@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1cnn(C)c1 ZINC001573676870 948130963 /nfs/dbraw/zinc/13/09/63/948130963.db2.gz AYAGJBLXXAMZMQ-BXKDBHETSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1cnn(C)c1 ZINC001573676870 948130961 /nfs/dbraw/zinc/13/09/61/948130961.db2.gz AYAGJBLXXAMZMQ-BXKDBHETSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1cnn(C)c1 ZINC001573676873 948130804 /nfs/dbraw/zinc/13/08/04/948130804.db2.gz AYAGJBLXXAMZMQ-CABZTGNLSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1cnn(C)c1 ZINC001573676873 948130801 /nfs/dbraw/zinc/13/08/01/948130801.db2.gz AYAGJBLXXAMZMQ-CABZTGNLSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1cnn(C)c1 ZINC001573676875 948130831 /nfs/dbraw/zinc/13/08/31/948130831.db2.gz AYAGJBLXXAMZMQ-JOYOIKCWSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1cnn(C)c1 ZINC001573676875 948130824 /nfs/dbraw/zinc/13/08/24/948130824.db2.gz AYAGJBLXXAMZMQ-JOYOIKCWSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1cnn(C)c1 ZINC001573676877 948130907 /nfs/dbraw/zinc/13/09/07/948130907.db2.gz AYAGJBLXXAMZMQ-SKDRFNHKSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1cnn(C)c1 ZINC001573676877 948130904 /nfs/dbraw/zinc/13/09/04/948130904.db2.gz AYAGJBLXXAMZMQ-SKDRFNHKSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@@H](CO)Nc1ncc(-c2nn[n-]n2)cc1F)S(C)(=O)=O ZINC001573678401 948151903 /nfs/dbraw/zinc/15/19/03/948151903.db2.gz DIOAARJHDZCEAI-APPZFPTMSA-N -1 3 387.397 -1.277 20 0 GAADHM C[C@H](C(=O)NC[C@@H](CO)Nc1ncc(-c2nnn[n-]2)cc1F)S(C)(=O)=O ZINC001573678401 948151900 /nfs/dbraw/zinc/15/19/00/948151900.db2.gz DIOAARJHDZCEAI-APPZFPTMSA-N -1 3 387.397 -1.277 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](CO)Nc1ncc(-c2nn[n-]n2)cc1F)S(C)(=O)=O ZINC001573678402 948151174 /nfs/dbraw/zinc/15/11/74/948151174.db2.gz DIOAARJHDZCEAI-CBAPKCEASA-N -1 3 387.397 -1.277 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](CO)Nc1ncc(-c2nnn[n-]2)cc1F)S(C)(=O)=O ZINC001573678402 948151170 /nfs/dbraw/zinc/15/11/70/948151170.db2.gz DIOAARJHDZCEAI-CBAPKCEASA-N -1 3 387.397 -1.277 20 0 GAADHM C[C@@H](C(=O)NC[C@H](CO)Nc1ncc(-c2nn[n-]n2)cc1F)S(C)(=O)=O ZINC001573678403 948150459 /nfs/dbraw/zinc/15/04/59/948150459.db2.gz DIOAARJHDZCEAI-IONNQARKSA-N -1 3 387.397 -1.277 20 0 GAADHM C[C@@H](C(=O)NC[C@H](CO)Nc1ncc(-c2nnn[n-]2)cc1F)S(C)(=O)=O ZINC001573678403 948150451 /nfs/dbraw/zinc/15/04/51/948150451.db2.gz DIOAARJHDZCEAI-IONNQARKSA-N -1 3 387.397 -1.277 20 0 GAADHM C[C@H](C(=O)NC[C@H](CO)Nc1ncc(-c2nn[n-]n2)cc1F)S(C)(=O)=O ZINC001573678404 948150752 /nfs/dbraw/zinc/15/07/52/948150752.db2.gz DIOAARJHDZCEAI-VXNVDRBHSA-N -1 3 387.397 -1.277 20 0 GAADHM C[C@H](C(=O)NC[C@H](CO)Nc1ncc(-c2nnn[n-]2)cc1F)S(C)(=O)=O ZINC001573678404 948150747 /nfs/dbraw/zinc/15/07/47/948150747.db2.gz DIOAARJHDZCEAI-VXNVDRBHSA-N -1 3 387.397 -1.277 20 0 GAADHM C[C@@H](C(=O)NC[C@H](CO)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cnn(C)c1 ZINC001573679238 948159972 /nfs/dbraw/zinc/15/99/72/948159972.db2.gz KAVMNZODLGTESU-BXKDBHETSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@H](CO)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cnn(C)c1 ZINC001573679238 948159968 /nfs/dbraw/zinc/15/99/68/948159968.db2.gz KAVMNZODLGTESU-BXKDBHETSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@@H](CO)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cnn(C)c1 ZINC001573679240 948159801 /nfs/dbraw/zinc/15/98/01/948159801.db2.gz KAVMNZODLGTESU-CABZTGNLSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@@H](CO)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cnn(C)c1 ZINC001573679240 948159795 /nfs/dbraw/zinc/15/97/95/948159795.db2.gz KAVMNZODLGTESU-CABZTGNLSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@H](CO)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cnn(C)c1 ZINC001573679242 948160422 /nfs/dbraw/zinc/16/04/22/948160422.db2.gz KAVMNZODLGTESU-JOYOIKCWSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@H](CO)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cnn(C)c1 ZINC001573679242 948160417 /nfs/dbraw/zinc/16/04/17/948160417.db2.gz KAVMNZODLGTESU-JOYOIKCWSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](CO)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cnn(C)c1 ZINC001573679244 948161054 /nfs/dbraw/zinc/16/10/54/948161054.db2.gz KAVMNZODLGTESU-SKDRFNHKSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](CO)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cnn(C)c1 ZINC001573679244 948161045 /nfs/dbraw/zinc/16/10/45/948161045.db2.gz KAVMNZODLGTESU-SKDRFNHKSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)N1C(=O)CCC1=O ZINC001573680258 948175238 /nfs/dbraw/zinc/17/52/38/948175238.db2.gz OYUKEETVVWKZDR-MRVPVSSYSA-N -1 3 386.372 -1.327 20 0 GAADHM C[C@H](C(=O)NC1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)N1C(=O)CCC1=O ZINC001573680258 948175233 /nfs/dbraw/zinc/17/52/33/948175233.db2.gz OYUKEETVVWKZDR-MRVPVSSYSA-N -1 3 386.372 -1.327 20 0 GAADHM C[C@@H](C(=O)NC1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)N1C(=O)CCC1=O ZINC001573680259 948174577 /nfs/dbraw/zinc/17/45/77/948174577.db2.gz OYUKEETVVWKZDR-QMMMGPOBSA-N -1 3 386.372 -1.327 20 0 GAADHM C[C@@H](C(=O)NC1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)N1C(=O)CCC1=O ZINC001573680259 948174566 /nfs/dbraw/zinc/17/45/66/948174566.db2.gz OYUKEETVVWKZDR-QMMMGPOBSA-N -1 3 386.372 -1.327 20 0 GAADHM C[C@H](C(=O)NC[C@H](CO)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1cnn(C)c1 ZINC001573680960 948192384 /nfs/dbraw/zinc/19/23/84/948192384.db2.gz SZLALMGDOGBWLE-GXSJLCMTSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@H](CO)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1cnn(C)c1 ZINC001573680960 948192377 /nfs/dbraw/zinc/19/23/77/948192377.db2.gz SZLALMGDOGBWLE-GXSJLCMTSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](CO)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1cnn(C)c1 ZINC001573680961 948191917 /nfs/dbraw/zinc/19/19/17/948191917.db2.gz SZLALMGDOGBWLE-KOLCDFICSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](CO)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1cnn(C)c1 ZINC001573680961 948191910 /nfs/dbraw/zinc/19/19/10/948191910.db2.gz SZLALMGDOGBWLE-KOLCDFICSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@H](CO)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1cnn(C)c1 ZINC001573680962 948191981 /nfs/dbraw/zinc/19/19/81/948191981.db2.gz SZLALMGDOGBWLE-MWLCHTKSSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@H](CO)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1cnn(C)c1 ZINC001573680962 948191975 /nfs/dbraw/zinc/19/19/75/948191975.db2.gz SZLALMGDOGBWLE-MWLCHTKSSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@@H](CO)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1cnn(C)c1 ZINC001573680963 948191314 /nfs/dbraw/zinc/19/13/14/948191314.db2.gz SZLALMGDOGBWLE-ONGXEEELSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@@H](CO)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1cnn(C)c1 ZINC001573680963 948191309 /nfs/dbraw/zinc/19/13/09/948191309.db2.gz SZLALMGDOGBWLE-ONGXEEELSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1ccnn1C ZINC001573689912 948221501 /nfs/dbraw/zinc/22/15/01/948221501.db2.gz AJBAZJJRTOLBOD-GXSJLCMTSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1ccnn1C ZINC001573689912 948221492 /nfs/dbraw/zinc/22/14/92/948221492.db2.gz AJBAZJJRTOLBOD-GXSJLCMTSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1ccnn1C ZINC001573689913 948220638 /nfs/dbraw/zinc/22/06/38/948220638.db2.gz AJBAZJJRTOLBOD-KOLCDFICSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1ccnn1C ZINC001573689913 948220630 /nfs/dbraw/zinc/22/06/30/948220630.db2.gz AJBAZJJRTOLBOD-KOLCDFICSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1ccnn1C ZINC001573689914 948221942 /nfs/dbraw/zinc/22/19/42/948221942.db2.gz AJBAZJJRTOLBOD-MWLCHTKSSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1ccnn1C ZINC001573689914 948221935 /nfs/dbraw/zinc/22/19/35/948221935.db2.gz AJBAZJJRTOLBOD-MWLCHTKSSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1ccnn1C ZINC001573689915 948220222 /nfs/dbraw/zinc/22/02/22/948220222.db2.gz AJBAZJJRTOLBOD-ONGXEEELSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1ccnn1C ZINC001573689915 948220213 /nfs/dbraw/zinc/22/02/13/948220213.db2.gz AJBAZJJRTOLBOD-ONGXEEELSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cnn(C)c1 ZINC001573690254 948224000 /nfs/dbraw/zinc/22/40/00/948224000.db2.gz BXDCQMCYCIKSPW-BXKDBHETSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cnn(C)c1 ZINC001573690254 948223992 /nfs/dbraw/zinc/22/39/92/948223992.db2.gz BXDCQMCYCIKSPW-BXKDBHETSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cnn(C)c1 ZINC001573690255 948222634 /nfs/dbraw/zinc/22/26/34/948222634.db2.gz BXDCQMCYCIKSPW-CABZTGNLSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cnn(C)c1 ZINC001573690255 948222621 /nfs/dbraw/zinc/22/26/21/948222621.db2.gz BXDCQMCYCIKSPW-CABZTGNLSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cnn(C)c1 ZINC001573690256 948222599 /nfs/dbraw/zinc/22/25/99/948222599.db2.gz BXDCQMCYCIKSPW-JOYOIKCWSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cnn(C)c1 ZINC001573690256 948222591 /nfs/dbraw/zinc/22/25/91/948222591.db2.gz BXDCQMCYCIKSPW-JOYOIKCWSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cnn(C)c1 ZINC001573690257 948224092 /nfs/dbraw/zinc/22/40/92/948224092.db2.gz BXDCQMCYCIKSPW-SKDRFNHKSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cnn(C)c1 ZINC001573690257 948224089 /nfs/dbraw/zinc/22/40/89/948224089.db2.gz BXDCQMCYCIKSPW-SKDRFNHKSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@@H](O)CNc1ncc(-c2nn[n-]n2)cc1F)S(C)(=O)=O ZINC001573692411 948263276 /nfs/dbraw/zinc/26/32/76/948263276.db2.gz OMRDQPJJFBPLLI-APPZFPTMSA-N -1 3 387.397 -1.277 20 0 GAADHM C[C@H](C(=O)NC[C@@H](O)CNc1ncc(-c2nnn[n-]2)cc1F)S(C)(=O)=O ZINC001573692411 948263268 /nfs/dbraw/zinc/26/32/68/948263268.db2.gz OMRDQPJJFBPLLI-APPZFPTMSA-N -1 3 387.397 -1.277 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](O)CNc1ncc(-c2nn[n-]n2)cc1F)S(C)(=O)=O ZINC001573692413 948262698 /nfs/dbraw/zinc/26/26/98/948262698.db2.gz OMRDQPJJFBPLLI-CBAPKCEASA-N -1 3 387.397 -1.277 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](O)CNc1ncc(-c2nnn[n-]2)cc1F)S(C)(=O)=O ZINC001573692413 948262692 /nfs/dbraw/zinc/26/26/92/948262692.db2.gz OMRDQPJJFBPLLI-CBAPKCEASA-N -1 3 387.397 -1.277 20 0 GAADHM C[C@@H](C(=O)NC[C@H](O)CNc1ncc(-c2nn[n-]n2)cc1F)S(C)(=O)=O ZINC001573692415 948263946 /nfs/dbraw/zinc/26/39/46/948263946.db2.gz OMRDQPJJFBPLLI-IONNQARKSA-N -1 3 387.397 -1.277 20 0 GAADHM C[C@@H](C(=O)NC[C@H](O)CNc1ncc(-c2nnn[n-]2)cc1F)S(C)(=O)=O ZINC001573692415 948263939 /nfs/dbraw/zinc/26/39/39/948263939.db2.gz OMRDQPJJFBPLLI-IONNQARKSA-N -1 3 387.397 -1.277 20 0 GAADHM C[C@H](C(=O)NC[C@H](O)CNc1ncc(-c2nn[n-]n2)cc1F)S(C)(=O)=O ZINC001573692417 948264004 /nfs/dbraw/zinc/26/40/04/948264004.db2.gz OMRDQPJJFBPLLI-VXNVDRBHSA-N -1 3 387.397 -1.277 20 0 GAADHM C[C@H](C(=O)NC[C@H](O)CNc1ncc(-c2nnn[n-]2)cc1F)S(C)(=O)=O ZINC001573692417 948263998 /nfs/dbraw/zinc/26/39/98/948263998.db2.gz OMRDQPJJFBPLLI-VXNVDRBHSA-N -1 3 387.397 -1.277 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](O)CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1)n1cncn1 ZINC001573694997 948300148 /nfs/dbraw/zinc/30/01/48/948300148.db2.gz WMEFNEBDOLXNQQ-GXSJLCMTSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](O)CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1)n1cncn1 ZINC001573694997 948300139 /nfs/dbraw/zinc/30/01/39/948300139.db2.gz WMEFNEBDOLXNQQ-GXSJLCMTSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@H](C(=O)NC[C@H](O)CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1)n1cncn1 ZINC001573695000 948299858 /nfs/dbraw/zinc/29/98/58/948299858.db2.gz WMEFNEBDOLXNQQ-KOLCDFICSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@H](C(=O)NC[C@H](O)CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1)n1cncn1 ZINC001573695000 948299846 /nfs/dbraw/zinc/29/98/46/948299846.db2.gz WMEFNEBDOLXNQQ-KOLCDFICSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@H](C(=O)NC[C@@H](O)CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1)n1cncn1 ZINC001573695002 948300086 /nfs/dbraw/zinc/30/00/86/948300086.db2.gz WMEFNEBDOLXNQQ-MWLCHTKSSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@H](C(=O)NC[C@@H](O)CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1)n1cncn1 ZINC001573695002 948300076 /nfs/dbraw/zinc/30/00/76/948300076.db2.gz WMEFNEBDOLXNQQ-MWLCHTKSSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)NC[C@H](O)CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1)n1cncn1 ZINC001573695008 948300685 /nfs/dbraw/zinc/30/06/85/948300685.db2.gz WMEFNEBDOLXNQQ-ONGXEEELSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)NC[C@H](O)CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1)n1cncn1 ZINC001573695008 948300673 /nfs/dbraw/zinc/30/06/73/948300673.db2.gz WMEFNEBDOLXNQQ-ONGXEEELSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1ccnn1C ZINC001573695032 948300233 /nfs/dbraw/zinc/30/02/33/948300233.db2.gz WQPGWSNGNNIKKI-NXEZZACHSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1ccnn1C ZINC001573695032 948300218 /nfs/dbraw/zinc/30/02/18/948300218.db2.gz WQPGWSNGNNIKKI-NXEZZACHSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1ccnn1C ZINC001573695033 948300353 /nfs/dbraw/zinc/30/03/53/948300353.db2.gz WQPGWSNGNNIKKI-UWVGGRQHSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1ccnn1C ZINC001573695033 948300337 /nfs/dbraw/zinc/30/03/37/948300337.db2.gz WQPGWSNGNNIKKI-UWVGGRQHSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1ccnn1C ZINC001573695035 948301376 /nfs/dbraw/zinc/30/13/76/948301376.db2.gz WQPGWSNGNNIKKI-VHSXEESVSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1ccnn1C ZINC001573695035 948301366 /nfs/dbraw/zinc/30/13/66/948301366.db2.gz WQPGWSNGNNIKKI-VHSXEESVSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1ccnn1C ZINC001573695038 948301661 /nfs/dbraw/zinc/30/16/61/948301661.db2.gz WQPGWSNGNNIKKI-ZJUUUORDSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@H](C(=O)NC[C@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1ccnn1C ZINC001573695038 948301651 /nfs/dbraw/zinc/30/16/51/948301651.db2.gz WQPGWSNGNNIKKI-ZJUUUORDSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@H](C(=O)NC[C@@H](O)CN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1)n1cncn1 ZINC001573695070 948300556 /nfs/dbraw/zinc/30/05/56/948300556.db2.gz WSWFPAJVFVPWTQ-NXEZZACHSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@H](C(=O)NC[C@@H](O)CN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1)n1cncn1 ZINC001573695070 948300544 /nfs/dbraw/zinc/30/05/44/948300544.db2.gz WSWFPAJVFVPWTQ-NXEZZACHSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)NC[C@H](O)CN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1)n1cncn1 ZINC001573695073 948300411 /nfs/dbraw/zinc/30/04/11/948300411.db2.gz WSWFPAJVFVPWTQ-UWVGGRQHSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)NC[C@H](O)CN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1)n1cncn1 ZINC001573695073 948300399 /nfs/dbraw/zinc/30/03/99/948300399.db2.gz WSWFPAJVFVPWTQ-UWVGGRQHSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](O)CN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1)n1cncn1 ZINC001573695077 948301505 /nfs/dbraw/zinc/30/15/05/948301505.db2.gz WSWFPAJVFVPWTQ-VHSXEESVSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](O)CN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1)n1cncn1 ZINC001573695077 948301494 /nfs/dbraw/zinc/30/14/94/948301494.db2.gz WSWFPAJVFVPWTQ-VHSXEESVSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@H](C(=O)NC[C@H](O)CN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1)n1cncn1 ZINC001573695081 948301323 /nfs/dbraw/zinc/30/13/23/948301323.db2.gz WSWFPAJVFVPWTQ-ZJUUUORDSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@H](C(=O)NC[C@H](O)CN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1)n1cncn1 ZINC001573695081 948301308 /nfs/dbraw/zinc/30/13/08/948301308.db2.gz WSWFPAJVFVPWTQ-ZJUUUORDSA-N -1 3 388.392 -1.403 20 0 GAADHM C[C@@H](C(=O)NCC1(O)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)n1cccn1 ZINC001573695546 948308027 /nfs/dbraw/zinc/30/80/27/948308027.db2.gz HBFIMTCCSAMMDQ-JTQLQIEISA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@@H](C(=O)NCC1(O)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)n1cccn1 ZINC001573695546 948308018 /nfs/dbraw/zinc/30/80/18/948308018.db2.gz HBFIMTCCSAMMDQ-JTQLQIEISA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@H](C(=O)NCC1(O)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)n1cccn1 ZINC001573695547 948306249 /nfs/dbraw/zinc/30/62/49/948306249.db2.gz HBFIMTCCSAMMDQ-SNVBAGLBSA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@H](C(=O)NCC1(O)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)n1cccn1 ZINC001573695547 948306240 /nfs/dbraw/zinc/30/62/40/948306240.db2.gz HBFIMTCCSAMMDQ-SNVBAGLBSA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@@H](C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)n1cccn1 ZINC001573696556 948327889 /nfs/dbraw/zinc/32/78/89/948327889.db2.gz RXVLPPMYFMLSEA-JTQLQIEISA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@@H](C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)n1cccn1 ZINC001573696556 948327884 /nfs/dbraw/zinc/32/78/84/948327884.db2.gz RXVLPPMYFMLSEA-JTQLQIEISA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@H](C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)n1cccn1 ZINC001573696557 948328783 /nfs/dbraw/zinc/32/87/83/948328783.db2.gz RXVLPPMYFMLSEA-SNVBAGLBSA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@H](C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)n1cccn1 ZINC001573696557 948328775 /nfs/dbraw/zinc/32/87/75/948328775.db2.gz RXVLPPMYFMLSEA-SNVBAGLBSA-N -1 3 385.388 -1.044 20 0 GAADHM C[C@H](C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)n1cncn1 ZINC001573696654 948331380 /nfs/dbraw/zinc/33/13/80/948331380.db2.gz UQEOHFWUZDZPMN-SECBINFHSA-N -1 3 386.376 -1.649 20 0 GAADHM C[C@H](C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)n1cncn1 ZINC001573696654 948331371 /nfs/dbraw/zinc/33/13/71/948331371.db2.gz UQEOHFWUZDZPMN-SECBINFHSA-N -1 3 386.376 -1.649 20 0 GAADHM C[C@@H](C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)n1cncn1 ZINC001573696655 948330891 /nfs/dbraw/zinc/33/08/91/948330891.db2.gz UQEOHFWUZDZPMN-VIFPVBQESA-N -1 3 386.376 -1.649 20 0 GAADHM C[C@@H](C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)n1cncn1 ZINC001573696655 948330882 /nfs/dbraw/zinc/33/08/82/948330882.db2.gz UQEOHFWUZDZPMN-VIFPVBQESA-N -1 3 386.376 -1.649 20 0 GAADHM C[C@H](C(=O)NCC1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)S(C)(=O)=O ZINC001573704557 948375576 /nfs/dbraw/zinc/37/55/76/948375576.db2.gz BYOLPIIHAXBRQD-MRVPVSSYSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@H](C(=O)NCC1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)S(C)(=O)=O ZINC001573704557 948375568 /nfs/dbraw/zinc/37/55/68/948375568.db2.gz BYOLPIIHAXBRQD-MRVPVSSYSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@@H](C(=O)NCC1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)S(C)(=O)=O ZINC001573704558 948376134 /nfs/dbraw/zinc/37/61/34/948376134.db2.gz BYOLPIIHAXBRQD-QMMMGPOBSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@@H](C(=O)NCC1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)S(C)(=O)=O ZINC001573704558 948376127 /nfs/dbraw/zinc/37/61/27/948376127.db2.gz BYOLPIIHAXBRQD-QMMMGPOBSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@H](C(=O)NC[C@@H]1CCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1)S(C)(=O)=O ZINC001573706800 948423996 /nfs/dbraw/zinc/42/39/96/948423996.db2.gz MCXIGYNCTPTCEO-BDAKNGLRSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)NC[C@@H]1CCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1)S(C)(=O)=O ZINC001573706800 948423992 /nfs/dbraw/zinc/42/39/92/948423992.db2.gz MCXIGYNCTPTCEO-BDAKNGLRSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)NC[C@H]1CCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1)S(C)(=O)=O ZINC001573706803 948424218 /nfs/dbraw/zinc/42/42/18/948424218.db2.gz MCXIGYNCTPTCEO-DTWKUNHWSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)NC[C@H]1CCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1)S(C)(=O)=O ZINC001573706803 948424213 /nfs/dbraw/zinc/42/42/13/948424213.db2.gz MCXIGYNCTPTCEO-DTWKUNHWSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)NC[C@@H]1CCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1)S(C)(=O)=O ZINC001573706806 948424197 /nfs/dbraw/zinc/42/41/97/948424197.db2.gz MCXIGYNCTPTCEO-IUCAKERBSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)NC[C@@H]1CCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1)S(C)(=O)=O ZINC001573706806 948424196 /nfs/dbraw/zinc/42/41/96/948424196.db2.gz MCXIGYNCTPTCEO-IUCAKERBSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)NC[C@H]1CCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1)S(C)(=O)=O ZINC001573706809 948425257 /nfs/dbraw/zinc/42/52/57/948425257.db2.gz MCXIGYNCTPTCEO-RKDXNWHRSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)NC[C@H]1CCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1)S(C)(=O)=O ZINC001573706809 948425251 /nfs/dbraw/zinc/42/52/51/948425251.db2.gz MCXIGYNCTPTCEO-RKDXNWHRSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)NCC1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)S(C)(=O)=O ZINC001573708178 948444856 /nfs/dbraw/zinc/44/48/56/948444856.db2.gz SETOYHBOHQVUGE-MRVPVSSYSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@H](C(=O)NCC1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)S(C)(=O)=O ZINC001573708178 948444848 /nfs/dbraw/zinc/44/48/48/948444848.db2.gz SETOYHBOHQVUGE-MRVPVSSYSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@@H](C(=O)NCC1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)S(C)(=O)=O ZINC001573708179 948444562 /nfs/dbraw/zinc/44/45/62/948444562.db2.gz SETOYHBOHQVUGE-QMMMGPOBSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@@H](C(=O)NCC1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)S(C)(=O)=O ZINC001573708179 948444552 /nfs/dbraw/zinc/44/45/52/948444552.db2.gz SETOYHBOHQVUGE-QMMMGPOBSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@H](C(=O)NCC1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)S(C)(=O)=O ZINC001573708583 948453170 /nfs/dbraw/zinc/45/31/70/948453170.db2.gz VXZKESCCPUSXKW-MRVPVSSYSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@H](C(=O)NCC1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)S(C)(=O)=O ZINC001573708583 948453166 /nfs/dbraw/zinc/45/31/66/948453166.db2.gz VXZKESCCPUSXKW-MRVPVSSYSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@@H](C(=O)NCC1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)S(C)(=O)=O ZINC001573708584 948454159 /nfs/dbraw/zinc/45/41/59/948454159.db2.gz VXZKESCCPUSXKW-QMMMGPOBSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@@H](C(=O)NCC1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)S(C)(=O)=O ZINC001573708584 948454149 /nfs/dbraw/zinc/45/41/49/948454149.db2.gz VXZKESCCPUSXKW-QMMMGPOBSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@H](C(=O)NC[C@H]1CCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1)S(C)(=O)=O ZINC001573708595 948453066 /nfs/dbraw/zinc/45/30/66/948453066.db2.gz WHKYNNNJBVZEBZ-PSASIEDQSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)NC[C@H]1CCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1)S(C)(=O)=O ZINC001573708595 948453062 /nfs/dbraw/zinc/45/30/62/948453062.db2.gz WHKYNNNJBVZEBZ-PSASIEDQSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)NC[C@@H]1CCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1)S(C)(=O)=O ZINC001573708596 948453664 /nfs/dbraw/zinc/45/36/64/948453664.db2.gz WHKYNNNJBVZEBZ-SCZZXKLOSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)NC[C@@H]1CCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1)S(C)(=O)=O ZINC001573708596 948453659 /nfs/dbraw/zinc/45/36/59/948453659.db2.gz WHKYNNNJBVZEBZ-SCZZXKLOSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)NC[C@H]1CCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1)S(C)(=O)=O ZINC001573708597 948453560 /nfs/dbraw/zinc/45/35/60/948453560.db2.gz WHKYNNNJBVZEBZ-WCBMZHEXSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)NC[C@H]1CCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1)S(C)(=O)=O ZINC001573708597 948453555 /nfs/dbraw/zinc/45/35/55/948453555.db2.gz WHKYNNNJBVZEBZ-WCBMZHEXSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)NC[C@@H]1CCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1)S(C)(=O)=O ZINC001573708598 948454359 /nfs/dbraw/zinc/45/43/59/948454359.db2.gz WHKYNNNJBVZEBZ-WPRPVWTQSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)NC[C@@H]1CCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1)S(C)(=O)=O ZINC001573708598 948454356 /nfs/dbraw/zinc/45/43/56/948454356.db2.gz WHKYNNNJBVZEBZ-WPRPVWTQSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)NCCN(CCO)C(=O)c1c[nH]c(-c2nn[n-]n2)c1)n1cncn1 ZINC001573717128 948504338 /nfs/dbraw/zinc/50/43/38/948504338.db2.gz BUGMOOXSCVQLQI-JTQLQIEISA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@@H](C(=O)NCCN(CCO)C(=O)c1c[nH]c(-c2nnn[n-]2)c1)n1cncn1 ZINC001573717128 948504331 /nfs/dbraw/zinc/50/43/31/948504331.db2.gz BUGMOOXSCVQLQI-JTQLQIEISA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@H](C(=O)NCCN(CCO)C(=O)c1c[nH]c(-c2nn[n-]n2)c1)n1cncn1 ZINC001573717130 948504946 /nfs/dbraw/zinc/50/49/46/948504946.db2.gz BUGMOOXSCVQLQI-SNVBAGLBSA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@H](C(=O)NCCN(CCO)C(=O)c1c[nH]c(-c2nnn[n-]2)c1)n1cncn1 ZINC001573717130 948504940 /nfs/dbraw/zinc/50/49/40/948504940.db2.gz BUGMOOXSCVQLQI-SNVBAGLBSA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@@H](C(=O)NCCN(CCO)C(=O)c1ccc(-c2nn[n-]n2)[nH]1)n1cncn1 ZINC001573717532 948510316 /nfs/dbraw/zinc/51/03/16/948510316.db2.gz FEVURRZQUSBHRY-JTQLQIEISA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@@H](C(=O)NCCN(CCO)C(=O)c1ccc(-c2nnn[n-]2)[nH]1)n1cncn1 ZINC001573717532 948510312 /nfs/dbraw/zinc/51/03/12/948510312.db2.gz FEVURRZQUSBHRY-JTQLQIEISA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@H](C(=O)NCCN(CCO)C(=O)c1ccc(-c2nn[n-]n2)[nH]1)n1cncn1 ZINC001573717533 948510413 /nfs/dbraw/zinc/51/04/13/948510413.db2.gz FEVURRZQUSBHRY-SNVBAGLBSA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@H](C(=O)NCCN(CCO)C(=O)c1ccc(-c2nnn[n-]2)[nH]1)n1cncn1 ZINC001573717533 948510406 /nfs/dbraw/zinc/51/04/06/948510406.db2.gz FEVURRZQUSBHRY-SNVBAGLBSA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@@H](C(=O)NCCN(CCO)C(=O)c1cc(-c2nn[n-]n2)c[nH]1)n1cncn1 ZINC001573720163 948529913 /nfs/dbraw/zinc/52/99/13/948529913.db2.gz PNDJIWSVQLDWIW-JTQLQIEISA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@@H](C(=O)NCCN(CCO)C(=O)c1cc(-c2nnn[n-]2)c[nH]1)n1cncn1 ZINC001573720163 948529906 /nfs/dbraw/zinc/52/99/06/948529906.db2.gz PNDJIWSVQLDWIW-JTQLQIEISA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@H](C(=O)NCCN(CCO)C(=O)c1cc(-c2nn[n-]n2)c[nH]1)n1cncn1 ZINC001573720164 948530195 /nfs/dbraw/zinc/53/01/95/948530195.db2.gz PNDJIWSVQLDWIW-SNVBAGLBSA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@H](C(=O)NCCN(CCO)C(=O)c1cc(-c2nnn[n-]2)c[nH]1)n1cncn1 ZINC001573720164 948530184 /nfs/dbraw/zinc/53/01/84/948530184.db2.gz PNDJIWSVQLDWIW-SNVBAGLBSA-N -1 3 388.392 -1.402 20 0 GAADHM C[C@H](C(=O)NC[C@@]1(CO)COC[C@@H]2CCCN21)n1cnc(-c2nn[n-]n2)n1 ZINC001573725981 948545395 /nfs/dbraw/zinc/54/53/95/948545395.db2.gz DYMJHOUPFXIMKZ-JRPNMDOOSA-N -1 3 377.409 -1.639 20 0 GAADHM C[C@H](C(=O)NC[C@@]1(CO)COC[C@@H]2CCCN21)n1cnc(-c2nnn[n-]2)n1 ZINC001573725981 948545392 /nfs/dbraw/zinc/54/53/92/948545392.db2.gz DYMJHOUPFXIMKZ-JRPNMDOOSA-N -1 3 377.409 -1.639 20 0 GAADHM C[C@@H](C(=O)NC[C@@]1(CO)COC[C@@H]2CCCN21)n1cnc(-c2nn[n-]n2)n1 ZINC001573725982 948546646 /nfs/dbraw/zinc/54/66/46/948546646.db2.gz DYMJHOUPFXIMKZ-ZIBATOQPSA-N -1 3 377.409 -1.639 20 0 GAADHM C[C@@H](C(=O)NC[C@@]1(CO)COC[C@@H]2CCCN21)n1cnc(-c2nnn[n-]2)n1 ZINC001573725982 948546637 /nfs/dbraw/zinc/54/66/37/948546637.db2.gz DYMJHOUPFXIMKZ-ZIBATOQPSA-N -1 3 377.409 -1.639 20 0 GAADHM C[C@H](C(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)S(C)(=O)=O ZINC001573736491 948616017 /nfs/dbraw/zinc/61/60/17/948616017.db2.gz YBOXLOWWQLINAS-PSASIEDQSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@H](C(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)S(C)(=O)=O ZINC001573736491 948616013 /nfs/dbraw/zinc/61/60/13/948616013.db2.gz YBOXLOWWQLINAS-PSASIEDQSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)S(C)(=O)=O ZINC001573736492 948616038 /nfs/dbraw/zinc/61/60/38/948616038.db2.gz YBOXLOWWQLINAS-WCBMZHEXSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)S(C)(=O)=O ZINC001573736492 948616036 /nfs/dbraw/zinc/61/60/36/948616036.db2.gz YBOXLOWWQLINAS-WCBMZHEXSA-N -1 3 381.418 -1.041 20 0 GAADHM C[C@@H](C(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O)n1cncn1 ZINC001573739239 948617557 /nfs/dbraw/zinc/61/75/57/948617557.db2.gz BHYQSWCRIFTEKL-AXTRIDKLSA-N -1 3 388.367 -1.081 20 0 GAADHM C[C@@H](C(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O)n1cncn1 ZINC001573739239 948617552 /nfs/dbraw/zinc/61/75/52/948617552.db2.gz BHYQSWCRIFTEKL-AXTRIDKLSA-N -1 3 388.367 -1.081 20 0 GAADHM C[C@H](C(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O)n1cncn1 ZINC001573739240 948617591 /nfs/dbraw/zinc/61/75/91/948617591.db2.gz BHYQSWCRIFTEKL-FXAINCCUSA-N -1 3 388.367 -1.081 20 0 GAADHM C[C@H](C(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O)n1cncn1 ZINC001573739240 948617586 /nfs/dbraw/zinc/61/75/86/948617586.db2.gz BHYQSWCRIFTEKL-FXAINCCUSA-N -1 3 388.367 -1.081 20 0 GAADHM C[C@H](C(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O)n1cncn1 ZINC001573739241 948617689 /nfs/dbraw/zinc/61/76/89/948617689.db2.gz BHYQSWCRIFTEKL-GGZOMVNGSA-N -1 3 388.367 -1.081 20 0 GAADHM C[C@H](C(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O)n1cncn1 ZINC001573739241 948617687 /nfs/dbraw/zinc/61/76/87/948617687.db2.gz BHYQSWCRIFTEKL-GGZOMVNGSA-N -1 3 388.367 -1.081 20 0 GAADHM C[C@@H](C(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O)n1cncn1 ZINC001573739242 948617898 /nfs/dbraw/zinc/61/78/98/948617898.db2.gz BHYQSWCRIFTEKL-XXILOJSOSA-N -1 3 388.367 -1.081 20 0 GAADHM C[C@@H](C(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O)n1cncn1 ZINC001573739242 948617895 /nfs/dbraw/zinc/61/78/95/948617895.db2.gz BHYQSWCRIFTEKL-XXILOJSOSA-N -1 3 388.367 -1.081 20 0 GAADHM C[C@H](CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)NC(=O)[C@H](C)N1C(=O)CCC1=O ZINC001573739909 948625776 /nfs/dbraw/zinc/62/57/76/948625776.db2.gz INEJDTVVBRXBEW-BDAKNGLRSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@H](CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)NC(=O)[C@H](C)N1C(=O)CCC1=O ZINC001573739909 948625771 /nfs/dbraw/zinc/62/57/71/948625771.db2.gz INEJDTVVBRXBEW-BDAKNGLRSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@H](CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)NC(=O)[C@@H](C)N1C(=O)CCC1=O ZINC001573739913 948626497 /nfs/dbraw/zinc/62/64/97/948626497.db2.gz INEJDTVVBRXBEW-RKDXNWHRSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@H](CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)NC(=O)[C@@H](C)N1C(=O)CCC1=O ZINC001573739913 948626491 /nfs/dbraw/zinc/62/64/91/948626491.db2.gz INEJDTVVBRXBEW-RKDXNWHRSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@@H](C(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O)n1cncn1 ZINC001573740303 948633093 /nfs/dbraw/zinc/63/30/93/948633093.db2.gz IEUXSPOIQQWVPL-AXTRIDKLSA-N -1 3 386.376 -1.651 20 0 GAADHM C[C@@H](C(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O)n1cncn1 ZINC001573740303 948633092 /nfs/dbraw/zinc/63/30/92/948633092.db2.gz IEUXSPOIQQWVPL-AXTRIDKLSA-N -1 3 386.376 -1.651 20 0 GAADHM C[C@H](C(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O)n1cncn1 ZINC001573740304 948632170 /nfs/dbraw/zinc/63/21/70/948632170.db2.gz IEUXSPOIQQWVPL-FXAINCCUSA-N -1 3 386.376 -1.651 20 0 GAADHM C[C@H](C(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O)n1cncn1 ZINC001573740304 948632165 /nfs/dbraw/zinc/63/21/65/948632165.db2.gz IEUXSPOIQQWVPL-FXAINCCUSA-N -1 3 386.376 -1.651 20 0 GAADHM 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C[C@H](C(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O)n1cccn1 ZINC001573741468 948654301 /nfs/dbraw/zinc/65/43/01/948654301.db2.gz XMJRJVPNRGPTCQ-OASPWFOLSA-N -1 3 385.388 -1.046 20 0 GAADHM C[C@H](C(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O)n1cccn1 ZINC001573741468 948654292 /nfs/dbraw/zinc/65/42/92/948654292.db2.gz XMJRJVPNRGPTCQ-OASPWFOLSA-N -1 3 385.388 -1.046 20 0 GAADHM C[C@H](C(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O)n1cccn1 ZINC001573741470 948654239 /nfs/dbraw/zinc/65/42/39/948654239.db2.gz XMJRJVPNRGPTCQ-WQAKAFBOSA-N -1 3 385.388 -1.046 20 0 GAADHM C[C@H](C(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O)n1cccn1 ZINC001573741470 948654236 /nfs/dbraw/zinc/65/42/36/948654236.db2.gz XMJRJVPNRGPTCQ-WQAKAFBOSA-N -1 3 385.388 -1.046 20 0 GAADHM C[C@@H](C(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O)n1cccn1 ZINC001573741472 948654331 /nfs/dbraw/zinc/65/43/31/948654331.db2.gz XMJRJVPNRGPTCQ-ZWKOPEQDSA-N -1 3 385.388 -1.046 20 0 GAADHM 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C[C@H](CC(=O)N(C)C1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)NC(N)=O ZINC001574478056 949692465 /nfs/dbraw/zinc/69/24/65/949692465.db2.gz XFOZSKCMSHXRLA-MRVPVSSYSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](CC(=O)N(C)C1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)NC(N)=O ZINC001574478058 949693391 /nfs/dbraw/zinc/69/33/91/949693391.db2.gz XFOZSKCMSHXRLA-QMMMGPOBSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@@H](CC(=O)N(C)C1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)NC(N)=O ZINC001574478058 949693387 /nfs/dbraw/zinc/69/33/87/949693387.db2.gz XFOZSKCMSHXRLA-QMMMGPOBSA-N -1 3 375.393 -1.076 20 0 GAADHM C[C@H](CC(=O)N1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1)NC(N)=O ZINC001574483765 949843892 /nfs/dbraw/zinc/84/38/92/949843892.db2.gz LMQANSCBWCYKPN-SECBINFHSA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@H](CC(=O)N1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1)NC(N)=O ZINC001574483765 949843885 /nfs/dbraw/zinc/84/38/85/949843885.db2.gz LMQANSCBWCYKPN-SECBINFHSA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@@H](CC(=O)N1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1)NC(N)=O ZINC001574483766 949844939 /nfs/dbraw/zinc/84/49/39/949844939.db2.gz LMQANSCBWCYKPN-VIFPVBQESA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@@H](CC(=O)N1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1)NC(N)=O ZINC001574483766 949844919 /nfs/dbraw/zinc/84/49/19/949844919.db2.gz LMQANSCBWCYKPN-VIFPVBQESA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@H](CC(=O)N1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1)NC(N)=O ZINC001574483885 949841715 /nfs/dbraw/zinc/84/17/15/949841715.db2.gz OHUICUFNCGCTCH-SECBINFHSA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@H](CC(=O)N1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1)NC(N)=O ZINC001574483885 949841697 /nfs/dbraw/zinc/84/16/97/949841697.db2.gz OHUICUFNCGCTCH-SECBINFHSA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@@H](CC(=O)N1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1)NC(N)=O ZINC001574483886 949841274 /nfs/dbraw/zinc/84/12/74/949841274.db2.gz OHUICUFNCGCTCH-VIFPVBQESA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@@H](CC(=O)N1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1)NC(N)=O ZINC001574483886 949841259 /nfs/dbraw/zinc/84/12/59/949841259.db2.gz OHUICUFNCGCTCH-VIFPVBQESA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@H](CC(=O)N1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1)NC(N)=O ZINC001574483893 949847773 /nfs/dbraw/zinc/84/77/73/949847773.db2.gz OTLGINHJPVQLEI-SECBINFHSA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@H](CC(=O)N1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1)NC(N)=O ZINC001574483893 949847755 /nfs/dbraw/zinc/84/77/55/949847755.db2.gz OTLGINHJPVQLEI-SECBINFHSA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@@H](CC(=O)N1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1)NC(N)=O ZINC001574483894 949846542 /nfs/dbraw/zinc/84/65/42/949846542.db2.gz OTLGINHJPVQLEI-VIFPVBQESA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@@H](CC(=O)N1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1)NC(N)=O ZINC001574483894 949846528 /nfs/dbraw/zinc/84/65/28/949846528.db2.gz OTLGINHJPVQLEI-VIFPVBQESA-N -1 3 375.393 -1.074 20 0 GAADHM C[C@H](CC(=O)NCC1(O)CN(Cc2cccc(-c3nn[n-]n3)c2)C1)NC(N)=O ZINC001574498485 950276156 /nfs/dbraw/zinc/27/61/56/950276156.db2.gz OEQOZCWCQTYNAS-LLVKDONJSA-N -1 3 388.432 -1.024 20 0 GAADHM C[C@H](CC(=O)NCC1(O)CN(Cc2cccc(-c3nnn[n-]3)c2)C1)NC(N)=O ZINC001574498485 950276140 /nfs/dbraw/zinc/27/61/40/950276140.db2.gz OEQOZCWCQTYNAS-LLVKDONJSA-N -1 3 388.432 -1.024 20 0 GAADHM C[C@@H](CC(=O)NCC1(O)CN(Cc2cccc(-c3nn[n-]n3)c2)C1)NC(N)=O ZINC001574498487 950274029 /nfs/dbraw/zinc/27/40/29/950274029.db2.gz OEQOZCWCQTYNAS-NSHDSACASA-N -1 3 388.432 -1.024 20 0 GAADHM C[C@@H](CC(=O)NCC1(O)CN(Cc2cccc(-c3nnn[n-]3)c2)C1)NC(N)=O ZINC001574498487 950274015 /nfs/dbraw/zinc/27/40/15/950274015.db2.gz OEQOZCWCQTYNAS-NSHDSACASA-N -1 3 388.432 -1.024 20 0 GAADHM C[C@H](CC(=O)NCC1(O)CN(Cc2ccccc2-c2nn[n-]n2)C1)NC(N)=O ZINC001574499374 950297822 /nfs/dbraw/zinc/29/78/22/950297822.db2.gz UDSLRDZWFIBFDX-LLVKDONJSA-N -1 3 388.432 -1.024 20 0 GAADHM C[C@H](CC(=O)NCC1(O)CN(Cc2ccccc2-c2nnn[n-]2)C1)NC(N)=O ZINC001574499374 950297802 /nfs/dbraw/zinc/29/78/02/950297802.db2.gz UDSLRDZWFIBFDX-LLVKDONJSA-N -1 3 388.432 -1.024 20 0 GAADHM C[C@@H](CC(=O)NCC1(O)CN(Cc2ccccc2-c2nn[n-]n2)C1)NC(N)=O ZINC001574499375 950299563 /nfs/dbraw/zinc/29/95/63/950299563.db2.gz UDSLRDZWFIBFDX-NSHDSACASA-N -1 3 388.432 -1.024 20 0 GAADHM C[C@@H](CC(=O)NCC1(O)CN(Cc2ccccc2-c2nnn[n-]2)C1)NC(N)=O ZINC001574499375 950299539 /nfs/dbraw/zinc/29/95/39/950299539.db2.gz UDSLRDZWFIBFDX-NSHDSACASA-N -1 3 388.432 -1.024 20 0 GAADHM C[C@H](CC(=O)NCC1(O)CN(Cc2ccc(-c3nn[n-]n3)cc2)C1)NC(N)=O ZINC001574499727 950302686 /nfs/dbraw/zinc/30/26/86/950302686.db2.gz WKLPFQAFVMALPQ-LLVKDONJSA-N -1 3 388.432 -1.024 20 0 GAADHM C[C@H](CC(=O)NCC1(O)CN(Cc2ccc(-c3nnn[n-]3)cc2)C1)NC(N)=O ZINC001574499727 950302663 /nfs/dbraw/zinc/30/26/63/950302663.db2.gz WKLPFQAFVMALPQ-LLVKDONJSA-N -1 3 388.432 -1.024 20 0 GAADHM C[C@@H](CC(=O)NCC1(O)CN(Cc2ccc(-c3nn[n-]n3)cc2)C1)NC(N)=O ZINC001574499728 950304589 /nfs/dbraw/zinc/30/45/89/950304589.db2.gz WKLPFQAFVMALPQ-NSHDSACASA-N -1 3 388.432 -1.024 20 0 GAADHM C[C@@H](CC(=O)NCC1(O)CN(Cc2ccc(-c3nnn[n-]3)cc2)C1)NC(N)=O ZINC001574499728 950304569 /nfs/dbraw/zinc/30/45/69/950304569.db2.gz WKLPFQAFVMALPQ-NSHDSACASA-N -1 3 388.432 -1.024 20 0 GAADHM O=C(CNC(=O)C1(C(=O)[O-])CCS(=O)(=O)CC1)NCCN1CCCCC1 ZINC001574527081 961889137 /nfs/dbraw/zinc/88/91/37/961889137.db2.gz KESIFMRBQURHIQ-UHFFFAOYSA-N -1 3 389.474 -1.016 20 0 GAADHM C[C@@H](CN(C)C(=O)[C@H]1CN(C)C(=O)N1)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001574710855 949516087 /nfs/dbraw/zinc/51/60/87/949516087.db2.gz BQWYOQIONXQOFO-GZMMTYOYSA-N -1 3 375.393 -1.205 20 0 GAADHM C[C@@H](CN(C)C(=O)[C@H]1CN(C)C(=O)N1)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001574710855 949516069 /nfs/dbraw/zinc/51/60/69/949516069.db2.gz BQWYOQIONXQOFO-GZMMTYOYSA-N -1 3 375.393 -1.205 20 0 GAADHM C[C@H](CN(C)C(=O)[C@@H]1CN(C)C(=O)N1)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001574710857 949516428 /nfs/dbraw/zinc/51/64/28/949516428.db2.gz BQWYOQIONXQOFO-KCJUWKMLSA-N -1 3 375.393 -1.205 20 0 GAADHM C[C@H](CN(C)C(=O)[C@@H]1CN(C)C(=O)N1)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001574710857 949516413 /nfs/dbraw/zinc/51/64/13/949516413.db2.gz BQWYOQIONXQOFO-KCJUWKMLSA-N -1 3 375.393 -1.205 20 0 GAADHM C[C@@H](CN(C)C(=O)[C@@H]1CN(C)C(=O)N1)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001574710859 949518203 /nfs/dbraw/zinc/51/82/03/949518203.db2.gz BQWYOQIONXQOFO-KWQFWETISA-N -1 3 375.393 -1.205 20 0 GAADHM C[C@@H](CN(C)C(=O)[C@@H]1CN(C)C(=O)N1)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001574710859 949518172 /nfs/dbraw/zinc/51/81/72/949518172.db2.gz BQWYOQIONXQOFO-KWQFWETISA-N -1 3 375.393 -1.205 20 0 GAADHM C[C@H](CN(C)C(=O)[C@H]1CN(C)C(=O)N1)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001574710861 949517290 /nfs/dbraw/zinc/51/72/90/949517290.db2.gz BQWYOQIONXQOFO-LDYMZIIASA-N -1 3 375.393 -1.205 20 0 GAADHM C[C@H](CN(C)C(=O)[C@H]1CN(C)C(=O)N1)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001574710861 949517275 /nfs/dbraw/zinc/51/72/75/949517275.db2.gz BQWYOQIONXQOFO-LDYMZIIASA-N -1 3 375.393 -1.205 20 0 GAADHM C[C@H](CN(C)C(=O)C1CS(=O)(=O)C1)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001574711863 949559889 /nfs/dbraw/zinc/55/98/89/949559889.db2.gz NGSUQXRYFQQRAO-MRVPVSSYSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@H](CN(C)C(=O)C1CS(=O)(=O)C1)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001574711863 949559876 /nfs/dbraw/zinc/55/98/76/949559876.db2.gz NGSUQXRYFQQRAO-MRVPVSSYSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@@H](CN(C)C(=O)C1CS(=O)(=O)C1)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001574711864 949562197 /nfs/dbraw/zinc/56/21/97/949562197.db2.gz NGSUQXRYFQQRAO-QMMMGPOBSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@@H](CN(C)C(=O)C1CS(=O)(=O)C1)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001574711864 949562180 /nfs/dbraw/zinc/56/21/80/949562180.db2.gz NGSUQXRYFQQRAO-QMMMGPOBSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@@H](CN(C)C(=O)[C@H]1CN(C)C(=O)N1)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001574713395 949598586 /nfs/dbraw/zinc/59/85/86/949598586.db2.gz XHHFICFKWIYZRL-GZMMTYOYSA-N -1 3 375.393 -1.205 20 0 GAADHM C[C@@H](CN(C)C(=O)[C@H]1CN(C)C(=O)N1)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001574713395 949598565 /nfs/dbraw/zinc/59/85/65/949598565.db2.gz XHHFICFKWIYZRL-GZMMTYOYSA-N -1 3 375.393 -1.205 20 0 GAADHM C[C@H](CN(C)C(=O)[C@@H]1CN(C)C(=O)N1)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001574713397 949597592 /nfs/dbraw/zinc/59/75/92/949597592.db2.gz XHHFICFKWIYZRL-KCJUWKMLSA-N -1 3 375.393 -1.205 20 0 GAADHM C[C@H](CN(C)C(=O)[C@@H]1CN(C)C(=O)N1)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001574713397 949597573 /nfs/dbraw/zinc/59/75/73/949597573.db2.gz XHHFICFKWIYZRL-KCJUWKMLSA-N -1 3 375.393 -1.205 20 0 GAADHM C[C@@H](CN(C)C(=O)[C@@H]1CN(C)C(=O)N1)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001574713399 949600510 /nfs/dbraw/zinc/60/05/10/949600510.db2.gz XHHFICFKWIYZRL-KWQFWETISA-N -1 3 375.393 -1.205 20 0 GAADHM C[C@@H](CN(C)C(=O)[C@@H]1CN(C)C(=O)N1)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001574713399 949600488 /nfs/dbraw/zinc/60/04/88/949600488.db2.gz XHHFICFKWIYZRL-KWQFWETISA-N -1 3 375.393 -1.205 20 0 GAADHM 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C[C@H](CN(C)CC(=O)N1CCNC(=O)C1)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001574765318 950783063 /nfs/dbraw/zinc/78/30/63/950783063.db2.gz BSIRELOXGWQTLY-SNVBAGLBSA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@@H](CN(C)CC(=O)N1CCNC(=O)C1)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001574767064 950838831 /nfs/dbraw/zinc/83/88/31/950838831.db2.gz LJPYFYSJHLXVFJ-JTQLQIEISA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@@H](CN(C)CC(=O)N1CCNC(=O)C1)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001574767064 950838807 /nfs/dbraw/zinc/83/88/07/950838807.db2.gz LJPYFYSJHLXVFJ-JTQLQIEISA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@H](CN(C)CC(=O)N1CCNC(=O)C1)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001574767066 950838245 /nfs/dbraw/zinc/83/82/45/950838245.db2.gz LJPYFYSJHLXVFJ-SNVBAGLBSA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@H](CN(C)CC(=O)N1CCNC(=O)C1)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001574767066 950838228 /nfs/dbraw/zinc/83/82/28/950838228.db2.gz LJPYFYSJHLXVFJ-SNVBAGLBSA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@@H](CN(C)CC(=O)N1CCNC(=O)C1)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001574767068 950837548 /nfs/dbraw/zinc/83/75/48/950837548.db2.gz LJUMIFNTFVNSRL-JTQLQIEISA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@@H](CN(C)CC(=O)N1CCNC(=O)C1)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001574767068 950837534 /nfs/dbraw/zinc/83/75/34/950837534.db2.gz LJUMIFNTFVNSRL-JTQLQIEISA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@H](CN(C)CC(=O)N1CCNC(=O)C1)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001574767070 950835473 /nfs/dbraw/zinc/83/54/73/950835473.db2.gz LJUMIFNTFVNSRL-SNVBAGLBSA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@H](CN(C)CC(=O)N1CCNC(=O)C1)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001574767070 950835453 /nfs/dbraw/zinc/83/54/53/950835453.db2.gz LJUMIFNTFVNSRL-SNVBAGLBSA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@H](CNC(=O)CCn1ncn(C)c1=O)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001574923265 948941378 /nfs/dbraw/zinc/94/13/78/948941378.db2.gz IQIPJFIDFQDTEU-SECBINFHSA-N -1 3 388.392 -1.585 20 0 GAADHM 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948981664 /nfs/dbraw/zinc/98/16/64/948981664.db2.gz FJVDHXWGPWXXGS-SECBINFHSA-N -1 3 375.393 -1.155 20 0 GAADHM C[C@@H](CNC(=O)CN1CCCNC1=O)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001574925848 948980776 /nfs/dbraw/zinc/98/07/76/948980776.db2.gz FJVDHXWGPWXXGS-VIFPVBQESA-N -1 3 375.393 -1.155 20 0 GAADHM C[C@@H](CNC(=O)CN1CCCNC1=O)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001574925848 948980763 /nfs/dbraw/zinc/98/07/63/948980763.db2.gz FJVDHXWGPWXXGS-VIFPVBQESA-N -1 3 375.393 -1.155 20 0 GAADHM C[C@H](CNC(=O)CN(C)S(C)(=O)=O)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001574926110 948986398 /nfs/dbraw/zinc/98/63/98/948986398.db2.gz IPAIVHDEGXXHPS-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM C[C@H](CNC(=O)CN(C)S(C)(=O)=O)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001574926110 948986384 /nfs/dbraw/zinc/98/63/84/948986384.db2.gz IPAIVHDEGXXHPS-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM C[C@@H](CNC(=O)CN(C)S(C)(=O)=O)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001574926111 948987821 /nfs/dbraw/zinc/98/78/21/948987821.db2.gz 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949011569 /nfs/dbraw/zinc/01/15/69/949011569.db2.gz ANAMGURBFXZFIN-VIFPVBQESA-N -1 3 376.377 -1.712 20 0 GAADHM C[C@@H](CNC(=O)CN1CCOCC1=O)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001574926600 949011551 /nfs/dbraw/zinc/01/15/51/949011551.db2.gz ANAMGURBFXZFIN-VIFPVBQESA-N -1 3 376.377 -1.712 20 0 GAADHM C[C@@H](CNC(=O)CN1CCNC(=O)C1)N(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001574926615 949010587 /nfs/dbraw/zinc/01/05/87/949010587.db2.gz AZICFAYDOGSBIX-JTQLQIEISA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@@H](CNC(=O)CN1CCNC(=O)C1)N(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001574926615 949010569 /nfs/dbraw/zinc/01/05/69/949010569.db2.gz AZICFAYDOGSBIX-JTQLQIEISA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@H](CNC(=O)CN1CCNC(=O)C1)N(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001574926616 949010088 /nfs/dbraw/zinc/01/00/88/949010088.db2.gz AZICFAYDOGSBIX-SNVBAGLBSA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@H](CNC(=O)CN1CCNC(=O)C1)N(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001574926616 949010071 /nfs/dbraw/zinc/01/00/71/949010071.db2.gz 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C[C@@H](CNC(=O)CN1CCOCC1=O)N(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001574926655 949014047 /nfs/dbraw/zinc/01/40/47/949014047.db2.gz BWWGIXZASXUCOL-JTQLQIEISA-N -1 3 390.404 -1.370 20 0 GAADHM C[C@H](CNC(=O)CN1CCOCC1=O)N(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001574926656 949013896 /nfs/dbraw/zinc/01/38/96/949013896.db2.gz BWWGIXZASXUCOL-SNVBAGLBSA-N -1 3 390.404 -1.370 20 0 GAADHM C[C@H](CNC(=O)CN1CCOCC1=O)N(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001574926656 949013877 /nfs/dbraw/zinc/01/38/77/949013877.db2.gz BWWGIXZASXUCOL-SNVBAGLBSA-N -1 3 390.404 -1.370 20 0 GAADHM C[C@H](CNC(=O)CN1CCCNC1=O)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001574926832 949027691 /nfs/dbraw/zinc/02/76/91/949027691.db2.gz YKJIQWKNRLGJSR-SECBINFHSA-N -1 3 375.393 -1.155 20 0 GAADHM C[C@H](CNC(=O)CN1CCCNC1=O)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001574926832 949027670 /nfs/dbraw/zinc/02/76/70/949027670.db2.gz YKJIQWKNRLGJSR-SECBINFHSA-N -1 3 375.393 -1.155 20 0 GAADHM C[C@@H](CNC(=O)CN1CCCNC1=O)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001574926833 949028582 /nfs/dbraw/zinc/02/85/82/949028582.db2.gz YKJIQWKNRLGJSR-VIFPVBQESA-N -1 3 375.393 -1.155 20 0 GAADHM C[C@@H](CNC(=O)CN1CCCNC1=O)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001574926833 949028559 /nfs/dbraw/zinc/02/85/59/949028559.db2.gz YKJIQWKNRLGJSR-VIFPVBQESA-N -1 3 375.393 -1.155 20 0 GAADHM C[C@H](CNC(=O)CN1C(=O)CNC1=O)N(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001574926905 949032407 /nfs/dbraw/zinc/03/24/07/949032407.db2.gz ZOTGASWHZDHTRV-MRVPVSSYSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@H](CNC(=O)CN1C(=O)CNC1=O)N(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001574926905 949032390 /nfs/dbraw/zinc/03/23/90/949032390.db2.gz ZOTGASWHZDHTRV-MRVPVSSYSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@@H](CNC(=O)CN1C(=O)CNC1=O)N(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001574926908 949029207 /nfs/dbraw/zinc/02/92/07/949029207.db2.gz ZOTGASWHZDHTRV-QMMMGPOBSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@@H](CNC(=O)CN1C(=O)CNC1=O)N(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001574926908 949029191 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383.438 -1.426 20 0 GAADHM C[C@H](CNC(=O)CNS(=O)(=O)N(C)C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001574926970 949032692 /nfs/dbraw/zinc/03/26/92/949032692.db2.gz DRSWDJDSMHHZOC-SECBINFHSA-N -1 3 383.438 -1.426 20 0 GAADHM C[C@@H](CNC(=O)CNS(=O)(=O)N(C)C)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001574926971 949032461 /nfs/dbraw/zinc/03/24/61/949032461.db2.gz DRSWDJDSMHHZOC-VIFPVBQESA-N -1 3 383.438 -1.426 20 0 GAADHM C[C@@H](CNC(=O)CNS(=O)(=O)N(C)C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001574926971 949032444 /nfs/dbraw/zinc/03/24/44/949032444.db2.gz DRSWDJDSMHHZOC-VIFPVBQESA-N -1 3 383.438 -1.426 20 0 GAADHM C[C@@H](CNC(=O)CN1CCN(C)C(=O)C1)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001574927143 949034620 /nfs/dbraw/zinc/03/46/20/949034620.db2.gz GAVSDIJLAOKAQN-JTQLQIEISA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@@H](CNC(=O)CN1CCN(C)C(=O)C1)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001574927143 949034593 /nfs/dbraw/zinc/03/45/93/949034593.db2.gz GAVSDIJLAOKAQN-JTQLQIEISA-N -1 3 389.420 -1.797 20 0 GAADHM 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949042535 /nfs/dbraw/zinc/04/25/35/949042535.db2.gz HDIRHANZXYGEGE-VIFPVBQESA-N -1 3 383.438 -1.426 20 0 GAADHM C[C@@H](CNC(=O)CN1CCNC(=O)C1)N(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001574927447 949042764 /nfs/dbraw/zinc/04/27/64/949042764.db2.gz IVDMCWLPLMOXDG-JTQLQIEISA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@@H](CNC(=O)CN1CCNC(=O)C1)N(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001574927447 949042746 /nfs/dbraw/zinc/04/27/46/949042746.db2.gz IVDMCWLPLMOXDG-JTQLQIEISA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@H](CNC(=O)CN1CCNC(=O)C1)N(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001574927448 949039079 /nfs/dbraw/zinc/03/90/79/949039079.db2.gz IVDMCWLPLMOXDG-SNVBAGLBSA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@H](CNC(=O)CN1CCNC(=O)C1)N(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001574927448 949039057 /nfs/dbraw/zinc/03/90/57/949039057.db2.gz IVDMCWLPLMOXDG-SNVBAGLBSA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@@H](CNC(=O)CN1CCNC(=O)C1)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001574927489 949045515 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NAEHRIRRKZDSGK-GFCCVEGCSA-N -1 3 387.448 -1.023 20 0 GAADHM C[C@@H](CNC(=O)CN1CCN(C)C(=O)C1)N(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001574928218 949054938 /nfs/dbraw/zinc/05/49/38/949054938.db2.gz NAEHRIRRKZDSGK-LBPRGKRZSA-N -1 3 387.448 -1.023 20 0 GAADHM C[C@@H](CNC(=O)CN1CCN(C)C(=O)C1)N(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001574928218 949054920 /nfs/dbraw/zinc/05/49/20/949054920.db2.gz NAEHRIRRKZDSGK-LBPRGKRZSA-N -1 3 387.448 -1.023 20 0 GAADHM C[C@@H](CNC(=O)CN1CCOCC1=O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001574928289 949056170 /nfs/dbraw/zinc/05/61/70/949056170.db2.gz OJWTWTIBICTAAQ-JTQLQIEISA-N -1 3 390.404 -1.464 20 0 GAADHM C[C@@H](CNC(=O)CN1CCOCC1=O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001574928289 949056149 /nfs/dbraw/zinc/05/61/49/949056149.db2.gz OJWTWTIBICTAAQ-JTQLQIEISA-N -1 3 390.404 -1.464 20 0 GAADHM C[C@H](CNC(=O)CN1CCOCC1=O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001574928290 949054063 /nfs/dbraw/zinc/05/40/63/949054063.db2.gz OJWTWTIBICTAAQ-SNVBAGLBSA-N -1 3 390.404 -1.464 20 0 GAADHM 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ZINC001574928862 949062597 /nfs/dbraw/zinc/06/25/97/949062597.db2.gz RTUMCKZXFMAKPX-JTQLQIEISA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@@H](CNC(=O)CN1CCN(C)C(=O)C1)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001574928862 949062573 /nfs/dbraw/zinc/06/25/73/949062573.db2.gz RTUMCKZXFMAKPX-JTQLQIEISA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@H](CNC(=O)CN1CCN(C)C(=O)C1)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001574928863 949062996 /nfs/dbraw/zinc/06/29/96/949062996.db2.gz RTUMCKZXFMAKPX-SNVBAGLBSA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@H](CNC(=O)CN1CCN(C)C(=O)C1)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001574928863 949062974 /nfs/dbraw/zinc/06/29/74/949062974.db2.gz RTUMCKZXFMAKPX-SNVBAGLBSA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@@H](CNC(=O)CN1CCNC(=O)C1)N(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001574928965 949068662 /nfs/dbraw/zinc/06/86/62/949068662.db2.gz UOFDCDQSYXDWCD-JTQLQIEISA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@@H](CNC(=O)CN1CCNC(=O)C1)N(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001574928965 949068645 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949071961 /nfs/dbraw/zinc/07/19/61/949071961.db2.gz WCDJHBCAMZHTOB-JTQLQIEISA-N -1 3 390.404 -1.464 20 0 GAADHM C[C@H](CNC(=O)CN1CCOCC1=O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001574929030 949072232 /nfs/dbraw/zinc/07/22/32/949072232.db2.gz WCDJHBCAMZHTOB-SNVBAGLBSA-N -1 3 390.404 -1.464 20 0 GAADHM C[C@H](CNC(=O)CN1CCOCC1=O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001574929030 949072212 /nfs/dbraw/zinc/07/22/12/949072212.db2.gz WCDJHBCAMZHTOB-SNVBAGLBSA-N -1 3 390.404 -1.464 20 0 GAADHM C[C@@H](CNC(=O)CN1CCOCC1=O)N(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001574929055 949073669 /nfs/dbraw/zinc/07/36/69/949073669.db2.gz XBEBXLABQOFZLY-JTQLQIEISA-N -1 3 390.404 -1.370 20 0 GAADHM C[C@@H](CNC(=O)CN1CCOCC1=O)N(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001574929055 949073648 /nfs/dbraw/zinc/07/36/48/949073648.db2.gz XBEBXLABQOFZLY-JTQLQIEISA-N -1 3 390.404 -1.370 20 0 GAADHM C[C@H](CNC(=O)CN1CCOCC1=O)N(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001574929056 949072071 /nfs/dbraw/zinc/07/20/71/949072071.db2.gz 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WELJCXKJIHXTDJ-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM C[C@@H](CNC(=O)Cn1cc(-c2nn[n-]n2)c(=O)[nH]c1=O)N1CCN(C)CC1 ZINC001574944577 949399364 /nfs/dbraw/zinc/39/93/64/949399364.db2.gz FRWPISUSJPNFQJ-JTQLQIEISA-N -1 3 377.409 -2.119 20 0 GAADHM C[C@@H](CNC(=O)Cn1cc(-c2nnn[n-]2)c(=O)[nH]c1=O)N1CCN(C)CC1 ZINC001574944577 949399343 /nfs/dbraw/zinc/39/93/43/949399343.db2.gz FRWPISUSJPNFQJ-JTQLQIEISA-N -1 3 377.409 -2.119 20 0 GAADHM C[C@H](CNC(=O)Cn1cc(-c2nn[n-]n2)c(=O)[nH]c1=O)N1CCN(C)CC1 ZINC001574944578 949397408 /nfs/dbraw/zinc/39/74/08/949397408.db2.gz FRWPISUSJPNFQJ-SNVBAGLBSA-N -1 3 377.409 -2.119 20 0 GAADHM C[C@H](CNC(=O)Cn1cc(-c2nnn[n-]2)c(=O)[nH]c1=O)N1CCN(C)CC1 ZINC001574944578 949397385 /nfs/dbraw/zinc/39/73/85/949397385.db2.gz FRWPISUSJPNFQJ-SNVBAGLBSA-N -1 3 377.409 -2.119 20 0 GAADHM C[C@H](CNC(=O)Cn1ncn(C)c1=O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001574947413 949446811 /nfs/dbraw/zinc/44/68/11/949446811.db2.gz AMBKQWGLQKIYLY-SECBINFHSA-N -1 3 388.392 -1.728 20 0 GAADHM C[C@H](CNC(=O)Cn1ncn(C)c1=O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001574947413 949446795 /nfs/dbraw/zinc/44/67/95/949446795.db2.gz AMBKQWGLQKIYLY-SECBINFHSA-N -1 3 388.392 -1.728 20 0 GAADHM C[C@@H](CNC(=O)Cn1ncn(C)c1=O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001574947417 949447858 /nfs/dbraw/zinc/44/78/58/949447858.db2.gz AMBKQWGLQKIYLY-VIFPVBQESA-N -1 3 388.392 -1.728 20 0 GAADHM C[C@@H](CNC(=O)Cn1ncn(C)c1=O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001574947417 949447851 /nfs/dbraw/zinc/44/78/51/949447851.db2.gz AMBKQWGLQKIYLY-VIFPVBQESA-N -1 3 388.392 -1.728 20 0 GAADHM C[C@H](CNC(=O)Cn1ncn(C)c1=O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001574948231 949457550 /nfs/dbraw/zinc/45/75/50/949457550.db2.gz GXHLMHPVLVOPJZ-SECBINFHSA-N -1 3 388.392 -1.728 20 0 GAADHM C[C@H](CNC(=O)Cn1ncn(C)c1=O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001574948231 949457543 /nfs/dbraw/zinc/45/75/43/949457543.db2.gz GXHLMHPVLVOPJZ-SECBINFHSA-N -1 3 388.392 -1.728 20 0 GAADHM C[C@@H](CNC(=O)Cn1ncn(C)c1=O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001574948233 949455783 /nfs/dbraw/zinc/45/57/83/949455783.db2.gz GXHLMHPVLVOPJZ-VIFPVBQESA-N -1 3 388.392 -1.728 20 0 GAADHM C[C@@H](CNC(=O)Cn1ncn(C)c1=O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001574948233 949455769 /nfs/dbraw/zinc/45/57/69/949455769.db2.gz GXHLMHPVLVOPJZ-VIFPVBQESA-N -1 3 388.392 -1.728 20 0 GAADHM C[C@@H](CNC(=O)Cn1ccc(=O)n(C)c1=O)Nc1ncccc1-c1nn[n-]n1 ZINC001574948479 949461417 /nfs/dbraw/zinc/46/14/17/949461417.db2.gz JNHNPFKMDVVERC-JTQLQIEISA-N -1 3 385.388 -1.261 20 0 GAADHM C[C@@H](CNC(=O)Cn1ccc(=O)n(C)c1=O)Nc1ncccc1-c1nnn[n-]1 ZINC001574948479 949461402 /nfs/dbraw/zinc/46/14/02/949461402.db2.gz JNHNPFKMDVVERC-JTQLQIEISA-N -1 3 385.388 -1.261 20 0 GAADHM C[C@H](CNC(=O)Cn1ccc(=O)n(C)c1=O)Nc1ncccc1-c1nn[n-]n1 ZINC001574948480 949462085 /nfs/dbraw/zinc/46/20/85/949462085.db2.gz JNHNPFKMDVVERC-SNVBAGLBSA-N -1 3 385.388 -1.261 20 0 GAADHM C[C@H](CNC(=O)Cn1ccc(=O)n(C)c1=O)Nc1ncccc1-c1nnn[n-]1 ZINC001574948480 949462072 /nfs/dbraw/zinc/46/20/72/949462072.db2.gz JNHNPFKMDVVERC-SNVBAGLBSA-N -1 3 385.388 -1.261 20 0 GAADHM C[C@@H](CNC(=O)Cn1ccc(=O)n(C)c1=O)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001574948786 949472071 /nfs/dbraw/zinc/47/20/71/949472071.db2.gz MPEZQHFZTURNCR-JTQLQIEISA-N -1 3 385.388 -1.261 20 0 GAADHM C[C@@H](CNC(=O)Cn1ccc(=O)n(C)c1=O)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001574948786 949472063 /nfs/dbraw/zinc/47/20/63/949472063.db2.gz MPEZQHFZTURNCR-JTQLQIEISA-N -1 3 385.388 -1.261 20 0 GAADHM C[C@H](CNC(=O)Cn1ccc(=O)n(C)c1=O)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001574948790 949473083 /nfs/dbraw/zinc/47/30/83/949473083.db2.gz MPEZQHFZTURNCR-SNVBAGLBSA-N -1 3 385.388 -1.261 20 0 GAADHM C[C@H](CNC(=O)Cn1ccc(=O)n(C)c1=O)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001574948790 949473069 /nfs/dbraw/zinc/47/30/69/949473069.db2.gz MPEZQHFZTURNCR-SNVBAGLBSA-N -1 3 385.388 -1.261 20 0 GAADHM C[C@@H](CNC(=O)Cn1ccc(=O)n(C)c1=O)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001574949380 949491271 /nfs/dbraw/zinc/49/12/71/949491271.db2.gz VHUSMYJUWGYVHY-JTQLQIEISA-N -1 3 385.388 -1.261 20 0 GAADHM C[C@@H](CNC(=O)Cn1ccc(=O)n(C)c1=O)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001574949380 949491260 /nfs/dbraw/zinc/49/12/60/949491260.db2.gz VHUSMYJUWGYVHY-JTQLQIEISA-N -1 3 385.388 -1.261 20 0 GAADHM C[C@H](CNC(=O)Cn1ccc(=O)n(C)c1=O)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001574949381 949496039 /nfs/dbraw/zinc/49/60/39/949496039.db2.gz VHUSMYJUWGYVHY-SNVBAGLBSA-N -1 3 385.388 -1.261 20 0 GAADHM C[C@H](CNC(=O)Cn1ccc(=O)n(C)c1=O)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001574949381 949496032 /nfs/dbraw/zinc/49/60/32/949496032.db2.gz VHUSMYJUWGYVHY-SNVBAGLBSA-N -1 3 385.388 -1.261 20 0 GAADHM C[C@H](CNC(=O)Cn1ncn(C)c1=O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001574949422 949495683 /nfs/dbraw/zinc/49/56/83/949495683.db2.gz WABGFHUKOQVEQZ-SECBINFHSA-N -1 3 388.392 -1.728 20 0 GAADHM C[C@H](CNC(=O)Cn1ncn(C)c1=O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001574949422 949495670 /nfs/dbraw/zinc/49/56/70/949495670.db2.gz WABGFHUKOQVEQZ-SECBINFHSA-N -1 3 388.392 -1.728 20 0 GAADHM 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/nfs/dbraw/zinc/53/11/42/949531142.db2.gz LXBVKSAYODKSPH-SECBINFHSA-N -1 3 388.392 -1.633 20 0 GAADHM C[C@@H](CNC(=O)Cn1ncn(C)c1=O)N(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001574950150 949529086 /nfs/dbraw/zinc/52/90/86/949529086.db2.gz LXBVKSAYODKSPH-VIFPVBQESA-N -1 3 388.392 -1.633 20 0 GAADHM C[C@@H](CNC(=O)Cn1ncn(C)c1=O)N(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001574950150 949529069 /nfs/dbraw/zinc/52/90/69/949529069.db2.gz LXBVKSAYODKSPH-VIFPVBQESA-N -1 3 388.392 -1.633 20 0 GAADHM C[C@H](CNC(=O)[C@@H]1CC(=O)NC(=O)N1)N(C)c1ncc(-c2nn[n-]n2)cc1F ZINC001574950789 949542247 /nfs/dbraw/zinc/54/22/47/949542247.db2.gz ULMHJKNCSXNANI-XCBNKYQSSA-N -1 3 391.367 -1.060 20 0 GAADHM C[C@H](CNC(=O)[C@@H]1CC(=O)NC(=O)N1)N(C)c1ncc(-c2nnn[n-]2)cc1F ZINC001574950789 949542238 /nfs/dbraw/zinc/54/22/38/949542238.db2.gz ULMHJKNCSXNANI-XCBNKYQSSA-N -1 3 391.367 -1.060 20 0 GAADHM C[C@@H](CNC(=O)[C@@H]1CC(=O)NC(=O)N1)N(C)c1ncc(-c2nn[n-]n2)cc1F ZINC001574950790 949541736 /nfs/dbraw/zinc/54/17/36/949541736.db2.gz 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C[C@H](CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)NC(=O)CN1CCCNC1=O ZINC001574991894 950422463 /nfs/dbraw/zinc/42/24/63/950422463.db2.gz TXQAMBOPGFJLFV-SECBINFHSA-N -1 3 375.393 -1.155 20 0 GAADHM C[C@@H](CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)NC(=O)CN1CCCNC1=O ZINC001574991896 950421704 /nfs/dbraw/zinc/42/17/04/950421704.db2.gz TXQAMBOPGFJLFV-VIFPVBQESA-N -1 3 375.393 -1.155 20 0 GAADHM C[C@@H](CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)NC(=O)CN1CCCNC1=O ZINC001574991896 950421692 /nfs/dbraw/zinc/42/16/92/950421692.db2.gz TXQAMBOPGFJLFV-VIFPVBQESA-N -1 3 375.393 -1.155 20 0 GAADHM C[C@@H](CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)NC(=O)CN1CCN(C)C(=O)C1 ZINC001574992014 950426362 /nfs/dbraw/zinc/42/63/62/950426362.db2.gz VJOBWCJQCPWOFL-JTQLQIEISA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@@H](CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)NC(=O)CN1CCN(C)C(=O)C1 ZINC001574992014 950426340 /nfs/dbraw/zinc/42/63/40/950426340.db2.gz VJOBWCJQCPWOFL-JTQLQIEISA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@H](CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)NC(=O)CN1CCN(C)C(=O)C1 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375.393 -1.205 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)N(C)C(=O)[C@@H]1CN(C)C(=O)N1 ZINC001575009029 950768390 /nfs/dbraw/zinc/76/83/90/950768390.db2.gz MQQZPEAMEFZJMO-KCJUWKMLSA-N -1 3 375.393 -1.205 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)N(C)C(=O)[C@@H]1CN(C)C(=O)N1 ZINC001575009029 950768381 /nfs/dbraw/zinc/76/83/81/950768381.db2.gz MQQZPEAMEFZJMO-KCJUWKMLSA-N -1 3 375.393 -1.205 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)N(C)C(=O)[C@@H]1CN(C)C(=O)N1 ZINC001575009030 950772016 /nfs/dbraw/zinc/77/20/16/950772016.db2.gz MQQZPEAMEFZJMO-KWQFWETISA-N -1 3 375.393 -1.205 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)N(C)C(=O)[C@@H]1CN(C)C(=O)N1 ZINC001575009030 950772003 /nfs/dbraw/zinc/77/20/03/950772003.db2.gz MQQZPEAMEFZJMO-KWQFWETISA-N -1 3 375.393 -1.205 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)N(C)C(=O)[C@H]1CN(C)C(=O)N1 ZINC001575009031 950769773 /nfs/dbraw/zinc/76/97/73/950769773.db2.gz MQQZPEAMEFZJMO-LDYMZIIASA-N -1 3 375.393 -1.205 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)N(C)C(=O)[C@H]1CN(C)C(=O)N1 ZINC001575009031 950769758 /nfs/dbraw/zinc/76/97/58/950769758.db2.gz MQQZPEAMEFZJMO-LDYMZIIASA-N -1 3 375.393 -1.205 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)CNC(=O)[C@H]1CN(C)C(=O)N1 ZINC001575009275 950783024 /nfs/dbraw/zinc/78/30/24/950783024.db2.gz ROECUSQXEQOHJV-GZMMTYOYSA-N -1 3 375.393 -1.300 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)CNC(=O)[C@H]1CN(C)C(=O)N1 ZINC001575009275 950783010 /nfs/dbraw/zinc/78/30/10/950783010.db2.gz ROECUSQXEQOHJV-GZMMTYOYSA-N -1 3 375.393 -1.300 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)CNC(=O)[C@@H]1CN(C)C(=O)N1 ZINC001575009276 950783863 /nfs/dbraw/zinc/78/38/63/950783863.db2.gz ROECUSQXEQOHJV-KCJUWKMLSA-N -1 3 375.393 -1.300 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)CNC(=O)[C@@H]1CN(C)C(=O)N1 ZINC001575009276 950783847 /nfs/dbraw/zinc/78/38/47/950783847.db2.gz ROECUSQXEQOHJV-KCJUWKMLSA-N -1 3 375.393 -1.300 20 0 GAADHM 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C[C@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)N(C)CC(=O)N1CCNC(=O)C1 ZINC001575010644 950834202 /nfs/dbraw/zinc/83/42/02/950834202.db2.gz HQFMDBUVELRDHL-SNVBAGLBSA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)N(C)CC(=O)N1CCNC(=O)C1 ZINC001575010644 950834177 /nfs/dbraw/zinc/83/41/77/950834177.db2.gz HQFMDBUVELRDHL-SNVBAGLBSA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)CN1CCN(C)C(=O)C1 ZINC001575013639 950896251 /nfs/dbraw/zinc/89/62/51/950896251.db2.gz BJJRQFKNYWDSIE-JTQLQIEISA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)CN1CCN(C)C(=O)C1 ZINC001575013639 950896231 /nfs/dbraw/zinc/89/62/31/950896231.db2.gz BJJRQFKNYWDSIE-JTQLQIEISA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)CN1CCN(C)C(=O)C1 ZINC001575013640 950895815 /nfs/dbraw/zinc/89/58/15/950895815.db2.gz BJJRQFKNYWDSIE-SNVBAGLBSA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)CN1CCN(C)C(=O)C1 ZINC001575013640 950895800 /nfs/dbraw/zinc/89/58/00/950895800.db2.gz BJJRQFKNYWDSIE-SNVBAGLBSA-N -1 3 389.420 -1.797 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)CN1CCNC(=O)C1 ZINC001575014137 950900394 /nfs/dbraw/zinc/90/03/94/950900394.db2.gz DNZNPWCBADYXSP-SECBINFHSA-N -1 3 375.393 -2.139 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)CN1CCNC(=O)C1 ZINC001575014137 950900378 /nfs/dbraw/zinc/90/03/78/950900378.db2.gz DNZNPWCBADYXSP-SECBINFHSA-N -1 3 375.393 -2.139 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)CN1CCNC(=O)C1 ZINC001575014138 950899388 /nfs/dbraw/zinc/89/93/88/950899388.db2.gz DNZNPWCBADYXSP-VIFPVBQESA-N -1 3 375.393 -2.139 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)CN1CCNC(=O)C1 ZINC001575014138 950899369 /nfs/dbraw/zinc/89/93/69/950899369.db2.gz DNZNPWCBADYXSP-VIFPVBQESA-N -1 3 375.393 -2.139 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)CN(C)S(C)(=O)=O ZINC001575014429 950906514 /nfs/dbraw/zinc/90/65/14/950906514.db2.gz FUOKEYHPURDUGK-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)CN(C)S(C)(=O)=O ZINC001575014429 950906498 /nfs/dbraw/zinc/90/64/98/950906498.db2.gz FUOKEYHPURDUGK-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)CN(C)S(C)(=O)=O ZINC001575014431 950906566 /nfs/dbraw/zinc/90/65/66/950906566.db2.gz FUOKEYHPURDUGK-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)CN(C)S(C)(=O)=O ZINC001575014431 950906547 /nfs/dbraw/zinc/90/65/47/950906547.db2.gz FUOKEYHPURDUGK-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)CS(=O)(=O)N(C)C ZINC001575014674 950910910 /nfs/dbraw/zinc/91/09/10/950910910.db2.gz HSJVRLKOPQKZKU-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)CS(=O)(=O)N(C)C ZINC001575014674 950910889 /nfs/dbraw/zinc/91/08/89/950910889.db2.gz HSJVRLKOPQKZKU-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)CS(=O)(=O)N(C)C ZINC001575014675 950907879 /nfs/dbraw/zinc/90/78/79/950907879.db2.gz HSJVRLKOPQKZKU-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)CS(=O)(=O)N(C)C ZINC001575014675 950907861 /nfs/dbraw/zinc/90/78/61/950907861.db2.gz HSJVRLKOPQKZKU-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)[C@H]1CCS(=O)(=O)C1 ZINC001575015014 950919426 /nfs/dbraw/zinc/91/94/26/950919426.db2.gz LPMIAMVVZLPWED-BDAKNGLRSA-N -1 3 381.418 -1.136 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)[C@H]1CCS(=O)(=O)C1 ZINC001575015014 950919410 /nfs/dbraw/zinc/91/94/10/950919410.db2.gz LPMIAMVVZLPWED-BDAKNGLRSA-N -1 3 381.418 -1.136 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)[C@@H]1CCS(=O)(=O)C1 ZINC001575015015 950919215 /nfs/dbraw/zinc/91/92/15/950919215.db2.gz LPMIAMVVZLPWED-DTWKUNHWSA-N -1 3 381.418 -1.136 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)[C@@H]1CCS(=O)(=O)C1 ZINC001575015015 950919199 /nfs/dbraw/zinc/91/91/99/950919199.db2.gz LPMIAMVVZLPWED-DTWKUNHWSA-N -1 3 381.418 -1.136 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)[C@H]1CCS(=O)(=O)C1 ZINC001575015016 950919644 /nfs/dbraw/zinc/91/96/44/950919644.db2.gz LPMIAMVVZLPWED-IUCAKERBSA-N -1 3 381.418 -1.136 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)[C@H]1CCS(=O)(=O)C1 ZINC001575015016 950919630 /nfs/dbraw/zinc/91/96/30/950919630.db2.gz LPMIAMVVZLPWED-IUCAKERBSA-N -1 3 381.418 -1.136 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)[C@@H]1CCS(=O)(=O)C1 ZINC001575015017 950921604 /nfs/dbraw/zinc/92/16/04/950921604.db2.gz LPMIAMVVZLPWED-RKDXNWHRSA-N -1 3 381.418 -1.136 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)[C@@H]1CCS(=O)(=O)C1 ZINC001575015017 950921591 /nfs/dbraw/zinc/92/15/91/950921591.db2.gz LPMIAMVVZLPWED-RKDXNWHRSA-N -1 3 381.418 -1.136 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)COCc1ncnn1C ZINC001575015307 950927786 /nfs/dbraw/zinc/92/77/86/950927786.db2.gz PACWQKBSGWNOCE-SECBINFHSA-N -1 3 388.392 -1.225 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)COCc1ncnn1C ZINC001575015307 950927767 /nfs/dbraw/zinc/92/77/67/950927767.db2.gz PACWQKBSGWNOCE-SECBINFHSA-N -1 3 388.392 -1.225 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)COCc1ncnn1C ZINC001575015308 950930313 /nfs/dbraw/zinc/93/03/13/950930313.db2.gz PACWQKBSGWNOCE-VIFPVBQESA-N -1 3 388.392 -1.225 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)COCc1ncnn1C ZINC001575015308 950930293 /nfs/dbraw/zinc/93/02/93/950930293.db2.gz PACWQKBSGWNOCE-VIFPVBQESA-N -1 3 388.392 -1.225 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)CN1CCCNC1=O ZINC001575015622 950937995 /nfs/dbraw/zinc/93/79/95/950937995.db2.gz SUMQWJCZNFSPPP-SECBINFHSA-N -1 3 375.393 -1.155 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)CN1CCCNC1=O ZINC001575015622 950937971 /nfs/dbraw/zinc/93/79/71/950937971.db2.gz SUMQWJCZNFSPPP-SECBINFHSA-N -1 3 375.393 -1.155 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)CN1CCCNC1=O ZINC001575015623 950939479 /nfs/dbraw/zinc/93/94/79/950939479.db2.gz SUMQWJCZNFSPPP-VIFPVBQESA-N -1 3 375.393 -1.155 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)CN1CCCNC1=O ZINC001575015623 950939467 /nfs/dbraw/zinc/93/94/67/950939467.db2.gz SUMQWJCZNFSPPP-VIFPVBQESA-N -1 3 375.393 -1.155 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)CCn1ncn(C)c1=O ZINC001575015889 950949510 /nfs/dbraw/zinc/94/95/10/950949510.db2.gz XQKLIWPNVWLLMW-SECBINFHSA-N -1 3 388.392 -1.585 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)CCn1ncn(C)c1=O ZINC001575015889 950949496 /nfs/dbraw/zinc/94/94/96/950949496.db2.gz XQKLIWPNVWLLMW-SECBINFHSA-N -1 3 388.392 -1.585 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)CCn1ncn(C)c1=O ZINC001575015891 950948665 /nfs/dbraw/zinc/94/86/65/950948665.db2.gz XQKLIWPNVWLLMW-VIFPVBQESA-N -1 3 388.392 -1.585 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)CCn1ncn(C)c1=O ZINC001575015891 950948649 /nfs/dbraw/zinc/94/86/49/950948649.db2.gz XQKLIWPNVWLLMW-VIFPVBQESA-N -1 3 388.392 -1.585 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)CC1CS(=O)(=O)C1 ZINC001575015940 950953498 /nfs/dbraw/zinc/95/34/98/950953498.db2.gz YLNJGDJHHYCBKF-MRVPVSSYSA-N -1 3 381.418 -1.136 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)CC1CS(=O)(=O)C1 ZINC001575015940 950953483 /nfs/dbraw/zinc/95/34/83/950953483.db2.gz YLNJGDJHHYCBKF-MRVPVSSYSA-N -1 3 381.418 -1.136 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)CC1CS(=O)(=O)C1 ZINC001575015941 950953713 /nfs/dbraw/zinc/95/37/13/950953713.db2.gz YLNJGDJHHYCBKF-QMMMGPOBSA-N -1 3 381.418 -1.136 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)CC1CS(=O)(=O)C1 ZINC001575015941 950953695 /nfs/dbraw/zinc/95/36/95/950953695.db2.gz YLNJGDJHHYCBKF-QMMMGPOBSA-N -1 3 381.418 -1.136 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)COCc1nncn1C ZINC001575015956 950954552 /nfs/dbraw/zinc/95/45/52/950954552.db2.gz YTOPMMGZQXOYIL-SECBINFHSA-N -1 3 388.392 -1.225 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)COCc1nncn1C ZINC001575015956 950954545 /nfs/dbraw/zinc/95/45/45/950954545.db2.gz YTOPMMGZQXOYIL-SECBINFHSA-N -1 3 388.392 -1.225 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)COCc1nncn1C ZINC001575015957 950952546 /nfs/dbraw/zinc/95/25/46/950952546.db2.gz YTOPMMGZQXOYIL-VIFPVBQESA-N -1 3 388.392 -1.225 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)COCc1nncn1C ZINC001575015957 950952530 /nfs/dbraw/zinc/95/25/30/950952530.db2.gz YTOPMMGZQXOYIL-VIFPVBQESA-N -1 3 388.392 -1.225 20 0 GAADHM C[C@H](CNC(=O)c1cn(C)c(=O)n(C)c1=O)Nc1ncccc1-c1nn[n-]n1 ZINC001575041973 951356582 /nfs/dbraw/zinc/35/65/82/951356582.db2.gz FHEJZAQFFQHNEU-SECBINFHSA-N -1 3 385.388 -1.111 20 0 GAADHM C[C@H](CNC(=O)c1cn(C)c(=O)n(C)c1=O)Nc1ncccc1-c1nnn[n-]1 ZINC001575041973 951356570 /nfs/dbraw/zinc/35/65/70/951356570.db2.gz FHEJZAQFFQHNEU-SECBINFHSA-N -1 3 385.388 -1.111 20 0 GAADHM C[C@@H](CNC(=O)c1cn(C)c(=O)n(C)c1=O)Nc1ncccc1-c1nn[n-]n1 ZINC001575041974 951355712 /nfs/dbraw/zinc/35/57/12/951355712.db2.gz FHEJZAQFFQHNEU-VIFPVBQESA-N -1 3 385.388 -1.111 20 0 GAADHM C[C@@H](CNC(=O)c1cn(C)c(=O)n(C)c1=O)Nc1ncccc1-c1nnn[n-]1 ZINC001575041974 951355696 /nfs/dbraw/zinc/35/56/96/951355696.db2.gz FHEJZAQFFQHNEU-VIFPVBQESA-N -1 3 385.388 -1.111 20 0 GAADHM C[C@H](CNC(=O)c1cn(C)c(=O)n(C)c1=O)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001575043934 951405772 /nfs/dbraw/zinc/40/57/72/951405772.db2.gz WULKKUNUJCQABU-SECBINFHSA-N -1 3 385.388 -1.111 20 0 GAADHM C[C@H](CNC(=O)c1cn(C)c(=O)n(C)c1=O)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001575043934 951405763 /nfs/dbraw/zinc/40/57/63/951405763.db2.gz WULKKUNUJCQABU-SECBINFHSA-N -1 3 385.388 -1.111 20 0 GAADHM C[C@@H](CNC(=O)c1cn(C)c(=O)n(C)c1=O)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001575043937 951406086 /nfs/dbraw/zinc/40/60/86/951406086.db2.gz WULKKUNUJCQABU-VIFPVBQESA-N -1 3 385.388 -1.111 20 0 GAADHM C[C@@H](CNC(=O)c1cn(C)c(=O)n(C)c1=O)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001575043937 951406079 /nfs/dbraw/zinc/40/60/79/951406079.db2.gz WULKKUNUJCQABU-VIFPVBQESA-N -1 3 385.388 -1.111 20 0 GAADHM C[C@@H](CS(C)(=O)=O)C(=O)NC[C@H](O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001575184905 952425737 /nfs/dbraw/zinc/42/57/37/952425737.db2.gz HBJZNHYKFHKQKD-GXSJLCMTSA-N -1 3 383.434 -1.169 20 0 GAADHM C[C@@H](CS(C)(=O)=O)C(=O)NC[C@H](O)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001575184905 952425736 /nfs/dbraw/zinc/42/57/36/952425736.db2.gz HBJZNHYKFHKQKD-GXSJLCMTSA-N -1 3 383.434 -1.169 20 0 GAADHM C[C@H](CS(C)(=O)=O)C(=O)NC[C@@H](O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001575184906 952425486 /nfs/dbraw/zinc/42/54/86/952425486.db2.gz HBJZNHYKFHKQKD-KOLCDFICSA-N -1 3 383.434 -1.169 20 0 GAADHM C[C@H](CS(C)(=O)=O)C(=O)NC[C@@H](O)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001575184906 952425481 /nfs/dbraw/zinc/42/54/81/952425481.db2.gz HBJZNHYKFHKQKD-KOLCDFICSA-N -1 3 383.434 -1.169 20 0 GAADHM C[C@H](CS(C)(=O)=O)C(=O)NC[C@H](O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001575184907 952425154 /nfs/dbraw/zinc/42/51/54/952425154.db2.gz HBJZNHYKFHKQKD-MWLCHTKSSA-N -1 3 383.434 -1.169 20 0 GAADHM C[C@H](CS(C)(=O)=O)C(=O)NC[C@H](O)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001575184907 952425147 /nfs/dbraw/zinc/42/51/47/952425147.db2.gz HBJZNHYKFHKQKD-MWLCHTKSSA-N -1 3 383.434 -1.169 20 0 GAADHM C[C@@H](CS(C)(=O)=O)C(=O)NC[C@@H](O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001575184908 952425600 /nfs/dbraw/zinc/42/56/00/952425600.db2.gz HBJZNHYKFHKQKD-ONGXEEELSA-N -1 3 383.434 -1.169 20 0 GAADHM C[C@@H](CS(C)(=O)=O)C(=O)NC[C@@H](O)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001575184908 952425598 /nfs/dbraw/zinc/42/55/98/952425598.db2.gz HBJZNHYKFHKQKD-ONGXEEELSA-N -1 3 383.434 -1.169 20 0 GAADHM C[C@H](CS(C)(=O)=O)C(=O)NC[C@H](O)CNc1ncccc1-c1nn[n-]n1 ZINC001575185061 952428231 /nfs/dbraw/zinc/42/82/31/952428231.db2.gz KLDKSVAMBQLXGO-NXEZZACHSA-N -1 3 383.434 -1.169 20 0 GAADHM C[C@H](CS(C)(=O)=O)C(=O)NC[C@H](O)CNc1ncccc1-c1nnn[n-]1 ZINC001575185061 952428228 /nfs/dbraw/zinc/42/82/28/952428228.db2.gz KLDKSVAMBQLXGO-NXEZZACHSA-N -1 3 383.434 -1.169 20 0 GAADHM C[C@@H](CS(C)(=O)=O)C(=O)NC[C@@H](O)CNc1ncccc1-c1nn[n-]n1 ZINC001575185062 952427958 /nfs/dbraw/zinc/42/79/58/952427958.db2.gz KLDKSVAMBQLXGO-UWVGGRQHSA-N -1 3 383.434 -1.169 20 0 GAADHM C[C@@H](CS(C)(=O)=O)C(=O)NC[C@@H](O)CNc1ncccc1-c1nnn[n-]1 ZINC001575185062 952427956 /nfs/dbraw/zinc/42/79/56/952427956.db2.gz KLDKSVAMBQLXGO-UWVGGRQHSA-N -1 3 383.434 -1.169 20 0 GAADHM C[C@@H](CS(C)(=O)=O)C(=O)NC[C@H](O)CNc1ncccc1-c1nn[n-]n1 ZINC001575185063 952427449 /nfs/dbraw/zinc/42/74/49/952427449.db2.gz KLDKSVAMBQLXGO-VHSXEESVSA-N -1 3 383.434 -1.169 20 0 GAADHM C[C@@H](CS(C)(=O)=O)C(=O)NC[C@H](O)CNc1ncccc1-c1nnn[n-]1 ZINC001575185063 952427445 /nfs/dbraw/zinc/42/74/45/952427445.db2.gz KLDKSVAMBQLXGO-VHSXEESVSA-N -1 3 383.434 -1.169 20 0 GAADHM C[C@H](CS(C)(=O)=O)C(=O)NC[C@@H](O)CNc1ncccc1-c1nn[n-]n1 ZINC001575185064 952428001 /nfs/dbraw/zinc/42/80/01/952428001.db2.gz KLDKSVAMBQLXGO-ZJUUUORDSA-N -1 3 383.434 -1.169 20 0 GAADHM C[C@H](CS(C)(=O)=O)C(=O)NC[C@@H](O)CNc1ncccc1-c1nnn[n-]1 ZINC001575185064 952427999 /nfs/dbraw/zinc/42/79/99/952427999.db2.gz KLDKSVAMBQLXGO-ZJUUUORDSA-N -1 3 383.434 -1.169 20 0 GAADHM C[C@H](CS(C)(=O)=O)C(=O)NC[C@H](CO)Nc1ncccc1-c1nn[n-]n1 ZINC001575185089 952427482 /nfs/dbraw/zinc/42/74/82/952427482.db2.gz KTAYTZJTSVJFTJ-NXEZZACHSA-N -1 3 383.434 -1.169 20 0 GAADHM C[C@H](CS(C)(=O)=O)C(=O)NC[C@H](CO)Nc1ncccc1-c1nnn[n-]1 ZINC001575185089 952427479 /nfs/dbraw/zinc/42/74/79/952427479.db2.gz KTAYTZJTSVJFTJ-NXEZZACHSA-N -1 3 383.434 -1.169 20 0 GAADHM C[C@@H](CS(C)(=O)=O)C(=O)NC[C@@H](CO)Nc1ncccc1-c1nn[n-]n1 ZINC001575185090 952427435 /nfs/dbraw/zinc/42/74/35/952427435.db2.gz KTAYTZJTSVJFTJ-UWVGGRQHSA-N -1 3 383.434 -1.169 20 0 GAADHM 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/nfs/dbraw/zinc/30/57/69/1075305769.db2.gz RLESBERUCRUTNK-NSHDSACASA-N -1 3 375.393 -1.155 20 0 GAADHM CCCN(CCNC(=O)[C@H]1CNC(=O)N1)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001577598936 1075305709 /nfs/dbraw/zinc/30/57/09/1075305709.db2.gz WVNKHFFFGZAXTG-LLVKDONJSA-N -1 3 375.393 -1.155 20 0 GAADHM CCCN(CCNC(=O)[C@H]1CNC(=O)N1)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001577598936 1075305703 /nfs/dbraw/zinc/30/57/03/1075305703.db2.gz WVNKHFFFGZAXTG-LLVKDONJSA-N -1 3 375.393 -1.155 20 0 GAADHM CCCN(CCNC(=O)[C@@H]1CNC(=O)N1)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001577598937 1075305847 /nfs/dbraw/zinc/30/58/47/1075305847.db2.gz WVNKHFFFGZAXTG-NSHDSACASA-N -1 3 375.393 -1.155 20 0 GAADHM CCCN(CCNC(=O)[C@@H]1CNC(=O)N1)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001577598937 1075305845 /nfs/dbraw/zinc/30/58/45/1075305845.db2.gz WVNKHFFFGZAXTG-NSHDSACASA-N -1 3 375.393 -1.155 20 0 GAADHM CCCN(CCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)C(=O)[C@H]1CNC(=O)N1 ZINC001577636185 1075308665 /nfs/dbraw/zinc/30/86/65/1075308665.db2.gz PMTCOWJFTHUBGF-LLVKDONJSA-N -1 3 375.393 -1.155 20 0 GAADHM CCCN(CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)C(=O)[C@H]1CNC(=O)N1 ZINC001577636185 1075308659 /nfs/dbraw/zinc/30/86/59/1075308659.db2.gz PMTCOWJFTHUBGF-LLVKDONJSA-N -1 3 375.393 -1.155 20 0 GAADHM CCCN(CCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)C(=O)[C@@H]1CNC(=O)N1 ZINC001577636186 1075308457 /nfs/dbraw/zinc/30/84/57/1075308457.db2.gz PMTCOWJFTHUBGF-NSHDSACASA-N -1 3 375.393 -1.155 20 0 GAADHM CCCN(CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)C(=O)[C@@H]1CNC(=O)N1 ZINC001577636186 1075308453 /nfs/dbraw/zinc/30/84/53/1075308453.db2.gz PMTCOWJFTHUBGF-NSHDSACASA-N -1 3 375.393 -1.155 20 0 GAADHM CCCNC(=O)[C@H](C)N1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001577675741 1075316114 /nfs/dbraw/zinc/31/61/14/1075316114.db2.gz CPUYODSUTYYDKK-BIMULSAOSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@H](C)N1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001577675741 1075316111 /nfs/dbraw/zinc/31/61/11/1075316111.db2.gz CPUYODSUTYYDKK-BIMULSAOSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@@H](C)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001577675742 1075316193 /nfs/dbraw/zinc/31/61/93/1075316193.db2.gz CPUYODSUTYYDKK-OASPWFOLSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@@H](C)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001577675742 1075316191 /nfs/dbraw/zinc/31/61/91/1075316191.db2.gz CPUYODSUTYYDKK-OASPWFOLSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@@H](C)N1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001577675743 1075316084 /nfs/dbraw/zinc/31/60/84/1075316084.db2.gz CPUYODSUTYYDKK-WQAKAFBOSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@@H](C)N1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001577675743 1075316080 /nfs/dbraw/zinc/31/60/80/1075316080.db2.gz CPUYODSUTYYDKK-WQAKAFBOSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@H](C)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001577675744 1075316012 /nfs/dbraw/zinc/31/60/12/1075316012.db2.gz CPUYODSUTYYDKK-ZWKOPEQDSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@H](C)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001577675744 1075316007 /nfs/dbraw/zinc/31/60/07/1075316007.db2.gz CPUYODSUTYYDKK-ZWKOPEQDSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@H](C)N1CC(O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001577675775 1075316036 /nfs/dbraw/zinc/31/60/36/1075316036.db2.gz DILVLQVSLGFFNQ-JTQLQIEISA-N -1 3 376.421 -1.114 20 0 GAADHM CCCNC(=O)[C@H](C)N1CC(O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001577675775 1075316033 /nfs/dbraw/zinc/31/60/33/1075316033.db2.gz DILVLQVSLGFFNQ-JTQLQIEISA-N -1 3 376.421 -1.114 20 0 GAADHM CCCNC(=O)[C@@H](C)N1CC(O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001577675776 1075316244 /nfs/dbraw/zinc/31/62/44/1075316244.db2.gz DILVLQVSLGFFNQ-SNVBAGLBSA-N -1 3 376.421 -1.114 20 0 GAADHM CCCNC(=O)[C@@H](C)N1CC(O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001577675776 1075316238 /nfs/dbraw/zinc/31/62/38/1075316238.db2.gz DILVLQVSLGFFNQ-SNVBAGLBSA-N -1 3 376.421 -1.114 20 0 GAADHM CCCNC(=O)[C@H](C)N1CC(O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001577675808 1075316097 /nfs/dbraw/zinc/31/60/97/1075316097.db2.gz FEOBOIALIWYHFY-JTQLQIEISA-N -1 3 376.421 -1.114 20 0 GAADHM CCCNC(=O)[C@H](C)N1CC(O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001577675808 1075316091 /nfs/dbraw/zinc/31/60/91/1075316091.db2.gz FEOBOIALIWYHFY-JTQLQIEISA-N -1 3 376.421 -1.114 20 0 GAADHM CCCNC(=O)[C@@H](C)N1CC(O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001577675809 1075316023 /nfs/dbraw/zinc/31/60/23/1075316023.db2.gz FEOBOIALIWYHFY-SNVBAGLBSA-N -1 3 376.421 -1.114 20 0 GAADHM CCCNC(=O)[C@@H](C)N1CC(O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001577675809 1075316021 /nfs/dbraw/zinc/31/60/21/1075316021.db2.gz FEOBOIALIWYHFY-SNVBAGLBSA-N -1 3 376.421 -1.114 20 0 GAADHM CCCNC(=O)[C@@H](C)N1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001577675950 1075316270 /nfs/dbraw/zinc/31/62/70/1075316270.db2.gz IGZTYVJMMSNZTL-OASPWFOLSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@@H](C)N1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001577675950 1075316265 /nfs/dbraw/zinc/31/62/65/1075316265.db2.gz IGZTYVJMMSNZTL-OASPWFOLSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@H](C)N1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001577675951 1075316164 /nfs/dbraw/zinc/31/61/64/1075316164.db2.gz IGZTYVJMMSNZTL-ZWKOPEQDSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@H](C)N1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001577675951 1075316158 /nfs/dbraw/zinc/31/61/58/1075316158.db2.gz IGZTYVJMMSNZTL-ZWKOPEQDSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@H](C)N1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001577676521 1075316571 /nfs/dbraw/zinc/31/65/71/1075316571.db2.gz VVIGWWCXMVWIBT-BIMULSAOSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@H](C)N1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001577676521 1075316567 /nfs/dbraw/zinc/31/65/67/1075316567.db2.gz VVIGWWCXMVWIBT-BIMULSAOSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@@H](C)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001577676522 1075316495 /nfs/dbraw/zinc/31/64/95/1075316495.db2.gz VVIGWWCXMVWIBT-OASPWFOLSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@@H](C)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001577676522 1075316491 /nfs/dbraw/zinc/31/64/91/1075316491.db2.gz VVIGWWCXMVWIBT-OASPWFOLSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@@H](C)N1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001577676523 1075316696 /nfs/dbraw/zinc/31/66/96/1075316696.db2.gz VVIGWWCXMVWIBT-WQAKAFBOSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@@H](C)N1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001577676523 1075316693 /nfs/dbraw/zinc/31/66/93/1075316693.db2.gz VVIGWWCXMVWIBT-WQAKAFBOSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@H](C)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001577676524 1075316606 /nfs/dbraw/zinc/31/66/06/1075316606.db2.gz VVIGWWCXMVWIBT-ZWKOPEQDSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@H](C)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001577676524 1075316598 /nfs/dbraw/zinc/31/65/98/1075316598.db2.gz VVIGWWCXMVWIBT-ZWKOPEQDSA-N -1 3 376.421 -1.116 20 0 GAADHM CCCNC(=O)[C@H](C)N1CC(O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001577676718 1075316719 /nfs/dbraw/zinc/31/67/19/1075316719.db2.gz ZPGBILBVJVVYSP-JTQLQIEISA-N -1 3 376.421 -1.114 20 0 GAADHM CCCNC(=O)[C@H](C)N1CC(O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001577676718 1075316718 /nfs/dbraw/zinc/31/67/18/1075316718.db2.gz ZPGBILBVJVVYSP-JTQLQIEISA-N -1 3 376.421 -1.114 20 0 GAADHM CCCNC(=O)[C@@H](C)N1CC(O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001577676719 1075316507 /nfs/dbraw/zinc/31/65/07/1075316507.db2.gz ZPGBILBVJVVYSP-SNVBAGLBSA-N -1 3 376.421 -1.114 20 0 GAADHM CCCNC(=O)[C@@H](C)N1CC(O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001577676719 1075316503 /nfs/dbraw/zinc/31/65/03/1075316503.db2.gz ZPGBILBVJVVYSP-SNVBAGLBSA-N -1 3 376.421 -1.114 20 0 GAADHM CCCNC(=O)CN1CC[C@](O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001577681711 1075319060 /nfs/dbraw/zinc/31/90/60/1075319060.db2.gz FNNACGHJOIFGHP-INIZCTEOSA-N -1 3 376.421 -1.112 20 0 GAADHM CCCNC(=O)CN1CC[C@](O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001577681711 1075319058 /nfs/dbraw/zinc/31/90/58/1075319058.db2.gz FNNACGHJOIFGHP-INIZCTEOSA-N -1 3 376.421 -1.112 20 0 GAADHM CCCNC(=O)CN1CC[C@@](O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001577681712 1075319029 /nfs/dbraw/zinc/31/90/29/1075319029.db2.gz FNNACGHJOIFGHP-MRXNPFEDSA-N -1 3 376.421 -1.112 20 0 GAADHM CCCNC(=O)CN1CC[C@@](O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001577681712 1075319027 /nfs/dbraw/zinc/31/90/27/1075319027.db2.gz FNNACGHJOIFGHP-MRXNPFEDSA-N -1 3 376.421 -1.112 20 0 GAADHM CCCNC(=O)CN1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001577681751 1075318850 /nfs/dbraw/zinc/31/88/50/1075318850.db2.gz GVHVNUQLMLVRSL-AAEUAGOBSA-N -1 3 376.421 -1.114 20 0 GAADHM 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CCCNC(=O)CN1CC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001577681754 1075319095 /nfs/dbraw/zinc/31/90/95/1075319095.db2.gz GVHVNUQLMLVRSL-YPMHNXCESA-N -1 3 376.421 -1.114 20 0 GAADHM CCCNC(=O)CN1CC[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001577681754 1075319091 /nfs/dbraw/zinc/31/90/91/1075319091.db2.gz GVHVNUQLMLVRSL-YPMHNXCESA-N -1 3 376.421 -1.114 20 0 GAADHM CCCNC(=O)CN1CC(CCO)(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001577681756 1075319009 /nfs/dbraw/zinc/31/90/09/1075319009.db2.gz GWBJYRNKLLEFIM-UHFFFAOYSA-N -1 3 376.421 -1.112 20 0 GAADHM CCCNC(=O)CN1CC(CCO)(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001577681756 1075319008 /nfs/dbraw/zinc/31/90/08/1075319008.db2.gz GWBJYRNKLLEFIM-UHFFFAOYSA-N -1 3 376.421 -1.112 20 0 GAADHM CCCNC(=O)CN1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001577681759 1075318945 /nfs/dbraw/zinc/31/89/45/1075318945.db2.gz GXXRLDVTAKHBSU-AAEUAGOBSA-N -1 3 376.421 -1.114 20 0 GAADHM 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CCCS(=O)(=O)CC(=O)NC[C@@H](CO)Nc1ncccc1-c1nnn[n-]1 ZINC001577694632 1075323903 /nfs/dbraw/zinc/32/39/03/1075323903.db2.gz OLSFYPTYOYWPDI-JTQLQIEISA-N -1 3 383.434 -1.025 20 0 GAADHM CCCS(=O)(=O)CC(=O)NC[C@H](CO)Nc1ncccc1-c1nn[n-]n1 ZINC001577694633 1075323784 /nfs/dbraw/zinc/32/37/84/1075323784.db2.gz OLSFYPTYOYWPDI-SNVBAGLBSA-N -1 3 383.434 -1.025 20 0 GAADHM CCCS(=O)(=O)CC(=O)NC[C@H](CO)Nc1ncccc1-c1nnn[n-]1 ZINC001577694633 1075323779 /nfs/dbraw/zinc/32/37/79/1075323779.db2.gz OLSFYPTYOYWPDI-SNVBAGLBSA-N -1 3 383.434 -1.025 20 0 GAADHM CCCS(=O)(=O)CC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O ZINC001577694713 1075323843 /nfs/dbraw/zinc/32/38/43/1075323843.db2.gz RZCDUMSSBPHGTR-CHWSQXEVSA-N -1 3 395.445 -1.248 20 0 GAADHM CCCS(=O)(=O)CC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O ZINC001577694713 1075323841 /nfs/dbraw/zinc/32/38/41/1075323841.db2.gz RZCDUMSSBPHGTR-CHWSQXEVSA-N -1 3 395.445 -1.248 20 0 GAADHM CCCS(=O)(=O)CC(=O)NC1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001577694728 1075323817 /nfs/dbraw/zinc/32/38/17/1075323817.db2.gz SMHPEOMDRPPCNS-UHFFFAOYSA-N -1 3 381.418 -1.040 20 0 GAADHM CCCS(=O)(=O)CC(=O)N1CC(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001577694732 1075323763 /nfs/dbraw/zinc/32/37/63/1075323763.db2.gz SPIVGCSZFVFCTQ-UHFFFAOYSA-N -1 3 381.418 -1.040 20 0 GAADHM CCCS(=O)(=O)CC(=O)N1CC(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001577694732 1075323759 /nfs/dbraw/zinc/32/37/59/1075323759.db2.gz SPIVGCSZFVFCTQ-UHFFFAOYSA-N -1 3 381.418 -1.040 20 0 GAADHM CCCS(=O)(=O)CC(=O)NC[C@H](O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001577694850 1075323861 /nfs/dbraw/zinc/32/38/61/1075323861.db2.gz YUJJXBOHVMMDOJ-LLVKDONJSA-N -1 3 383.434 -1.025 20 0 GAADHM CCCS(=O)(=O)CC(=O)NC[C@@H](O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001577694851 1075323852 /nfs/dbraw/zinc/32/38/52/1075323852.db2.gz YUJJXBOHVMMDOJ-NSHDSACASA-N -1 3 383.434 -1.025 20 0 GAADHM CCCS(=O)(=O)CC(=O)NC[C@H](O)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001577694853 1075323749 /nfs/dbraw/zinc/32/37/49/1075323749.db2.gz YWNBCAORNGUIAE-LLVKDONJSA-N -1 3 383.434 -1.025 20 0 GAADHM CCCS(=O)(=O)CC(=O)NC[C@H](O)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001577694853 1075323745 /nfs/dbraw/zinc/32/37/45/1075323745.db2.gz YWNBCAORNGUIAE-LLVKDONJSA-N -1 3 383.434 -1.025 20 0 GAADHM CCCS(=O)(=O)CC(=O)NC[C@@H](O)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001577694854 1075323857 /nfs/dbraw/zinc/32/38/57/1075323857.db2.gz YWNBCAORNGUIAE-NSHDSACASA-N -1 3 383.434 -1.025 20 0 GAADHM CCCS(=O)(=O)CC(=O)NC[C@@H](O)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001577694854 1075323855 /nfs/dbraw/zinc/32/38/55/1075323855.db2.gz YWNBCAORNGUIAE-NSHDSACASA-N -1 3 383.434 -1.025 20 0 GAADHM CCCn1nnnc1CN1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001577782829 1075341906 /nfs/dbraw/zinc/34/19/06/1075341906.db2.gz COOYHWCQWYSUKJ-VXGBXAGGSA-N -1 3 387.408 -1.434 20 0 GAADHM CCCn1nnnc1CN1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001577782829 1075341902 /nfs/dbraw/zinc/34/19/02/1075341902.db2.gz COOYHWCQWYSUKJ-VXGBXAGGSA-N -1 3 387.408 -1.434 20 0 GAADHM CCCn1nnnc1CN1CC(O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001577782855 1075341950 /nfs/dbraw/zinc/34/19/50/1075341950.db2.gz DIIOYUQKEHBUMM-UHFFFAOYSA-N -1 3 387.408 -1.432 20 0 GAADHM CCCn1nnnc1CN1CC(O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001577782855 1075341943 /nfs/dbraw/zinc/34/19/43/1075341943.db2.gz DIIOYUQKEHBUMM-UHFFFAOYSA-N -1 3 387.408 -1.432 20 0 GAADHM CCCn1nnnc1CN1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001577783020 1075342065 /nfs/dbraw/zinc/34/20/65/1075342065.db2.gz GIHXJQMREKGLKC-NEPJUHHUSA-N -1 3 387.408 -1.434 20 0 GAADHM CCCn1nnnc1CN1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001577783020 1075342060 /nfs/dbraw/zinc/34/20/60/1075342060.db2.gz GIHXJQMREKGLKC-NEPJUHHUSA-N -1 3 387.408 -1.434 20 0 GAADHM CCCn1nnnc1CN1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001577783021 1075342076 /nfs/dbraw/zinc/34/20/76/1075342076.db2.gz GIHXJQMREKGLKC-VXGBXAGGSA-N -1 3 387.408 -1.434 20 0 GAADHM CCCn1nnnc1CN1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001577783021 1075342073 /nfs/dbraw/zinc/34/20/73/1075342073.db2.gz GIHXJQMREKGLKC-VXGBXAGGSA-N -1 3 387.408 -1.434 20 0 GAADHM CCCn1nnnc1CNC[C@@H](O)CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001577783209 1075342030 /nfs/dbraw/zinc/34/20/30/1075342030.db2.gz HMLYZHDTJDZFKH-LLVKDONJSA-N -1 3 389.424 -1.186 20 0 GAADHM CCCn1nnnc1CNC[C@@H](O)CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001577783209 1075342025 /nfs/dbraw/zinc/34/20/25/1075342025.db2.gz HMLYZHDTJDZFKH-LLVKDONJSA-N -1 3 389.424 -1.186 20 0 GAADHM CCCn1nnnc1CNC[C@H](O)CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001577783210 1075341998 /nfs/dbraw/zinc/34/19/98/1075341998.db2.gz HMLYZHDTJDZFKH-NSHDSACASA-N -1 3 389.424 -1.186 20 0 GAADHM CCCn1nnnc1CNC[C@H](O)CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001577783210 1075341992 /nfs/dbraw/zinc/34/19/92/1075341992.db2.gz HMLYZHDTJDZFKH-NSHDSACASA-N -1 3 389.424 -1.186 20 0 GAADHM CCCn1nnnc1CN1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001577783276 1075341881 /nfs/dbraw/zinc/34/18/81/1075341881.db2.gz JCOCUYADHUYDLW-VXGBXAGGSA-N -1 3 387.408 -1.434 20 0 GAADHM CCCn1nnnc1CN1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001577783276 1075341877 /nfs/dbraw/zinc/34/18/77/1075341877.db2.gz JCOCUYADHUYDLW-VXGBXAGGSA-N -1 3 387.408 -1.434 20 0 GAADHM CCCn1nnnc1CNC[C@@H](O)CN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001577783453 1075341844 /nfs/dbraw/zinc/34/18/44/1075341844.db2.gz KDEQQEPMRXYSSZ-LLVKDONJSA-N -1 3 389.424 -1.186 20 0 GAADHM CCCn1nnnc1CNC[C@H](O)CN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001577783454 1075341865 /nfs/dbraw/zinc/34/18/65/1075341865.db2.gz KDEQQEPMRXYSSZ-NSHDSACASA-N -1 3 389.424 -1.186 20 0 GAADHM CCCn1nnnc1CN1CC(O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001577783677 1075342042 /nfs/dbraw/zinc/34/20/42/1075342042.db2.gz NCTLPQIOQTWBKY-UHFFFAOYSA-N -1 3 387.408 -1.432 20 0 GAADHM CCCn1nnnc1CN1CC(O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001577783677 1075342037 /nfs/dbraw/zinc/34/20/37/1075342037.db2.gz NCTLPQIOQTWBKY-UHFFFAOYSA-N -1 3 387.408 -1.432 20 0 GAADHM CCCn1nnnc1CN1CC(O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001577783729 1075341893 /nfs/dbraw/zinc/34/18/93/1075341893.db2.gz OCJVOCFUSSFQCP-UHFFFAOYSA-N -1 3 387.408 -1.432 20 0 GAADHM CCCn1nnnc1CN1CC(O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001577783729 1075341891 /nfs/dbraw/zinc/34/18/91/1075341891.db2.gz OCJVOCFUSSFQCP-UHFFFAOYSA-N -1 3 387.408 -1.432 20 0 GAADHM CCN(C(=O)[C@@H]1CNC(=O)N1)[C@H](C)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001577794023 1075342421 /nfs/dbraw/zinc/34/24/21/1075342421.db2.gz AAGIDPJRWRBIOB-KCJUWKMLSA-N -1 3 375.393 -1.157 20 0 GAADHM CCN(C(=O)[C@@H]1CNC(=O)N1)[C@H](C)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001577794023 1075342416 /nfs/dbraw/zinc/34/24/16/1075342416.db2.gz AAGIDPJRWRBIOB-KCJUWKMLSA-N -1 3 375.393 -1.157 20 0 GAADHM CCN(C(=O)[C@H]1CNC(=O)N1)[C@H](C)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001577794024 1075342611 /nfs/dbraw/zinc/34/26/11/1075342611.db2.gz 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PJRKZPACINVBTB-JQWIXIFHSA-N -1 3 387.404 -1.061 20 0 GAADHM CCN(C(=O)[C@@H]1CNC(=O)N1)[C@@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001577794771 1075342536 /nfs/dbraw/zinc/34/25/36/1075342536.db2.gz PJRKZPACINVBTB-PWSUYJOCSA-N -1 3 387.404 -1.061 20 0 GAADHM CCN(C(=O)[C@@H]1CNC(=O)N1)[C@@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001577794771 1075342532 /nfs/dbraw/zinc/34/25/32/1075342532.db2.gz PJRKZPACINVBTB-PWSUYJOCSA-N -1 3 387.404 -1.061 20 0 GAADHM CCN(C(=O)[C@H]1CNC(=O)N1)[C@@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001577794772 1075342797 /nfs/dbraw/zinc/34/27/97/1075342797.db2.gz PJRKZPACINVBTB-ZYHUDNBSSA-N -1 3 387.404 -1.061 20 0 GAADHM CCN(C(=O)[C@H]1CNC(=O)N1)[C@@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001577794772 1075342794 /nfs/dbraw/zinc/34/27/94/1075342794.db2.gz PJRKZPACINVBTB-ZYHUDNBSSA-N -1 3 387.404 -1.061 20 0 GAADHM CCN(C(=O)[C@@H]1CNC(=O)N1)[C@H](C)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001577794884 1075343100 /nfs/dbraw/zinc/34/31/00/1075343100.db2.gz 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CCN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@H]1CCN(C(=O)Cn2ncnn2)C1 ZINC001577826722 1075345740 /nfs/dbraw/zinc/34/57/40/1075345740.db2.gz ZYHPSXRGDPEUQH-JTQLQIEISA-N -1 3 385.392 -1.056 20 0 GAADHM CCN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@@H]1CCN(C(=O)Cn2ncnn2)C1 ZINC001577826723 1075345732 /nfs/dbraw/zinc/34/57/32/1075345732.db2.gz ZYHPSXRGDPEUQH-SNVBAGLBSA-N -1 3 385.392 -1.056 20 0 GAADHM CCN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@@H]1CCN(C(=O)Cn2ncnn2)C1 ZINC001577826723 1075345727 /nfs/dbraw/zinc/34/57/27/1075345727.db2.gz ZYHPSXRGDPEUQH-SNVBAGLBSA-N -1 3 385.392 -1.056 20 0 GAADHM CCN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@H](C)CNC(=O)[C@@H]1CNC(=O)N1 ZINC001577829258 1075345615 /nfs/dbraw/zinc/34/56/15/1075345615.db2.gz XPQVCKXEOQCUFF-KCJUWKMLSA-N -1 3 375.393 -1.157 20 0 GAADHM CCN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@H](C)CNC(=O)[C@@H]1CNC(=O)N1 ZINC001577829258 1075345610 /nfs/dbraw/zinc/34/56/10/1075345610.db2.gz XPQVCKXEOQCUFF-KCJUWKMLSA-N -1 3 375.393 -1.157 20 0 GAADHM CCN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@H](C)CNC(=O)[C@H]1CNC(=O)N1 ZINC001577829259 1075345689 /nfs/dbraw/zinc/34/56/89/1075345689.db2.gz XPQVCKXEOQCUFF-LDYMZIIASA-N -1 3 375.393 -1.157 20 0 GAADHM CCN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@H](C)CNC(=O)[C@H]1CNC(=O)N1 ZINC001577829259 1075345684 /nfs/dbraw/zinc/34/56/84/1075345684.db2.gz XPQVCKXEOQCUFF-LDYMZIIASA-N -1 3 375.393 -1.157 20 0 GAADHM CCN(C)C(=O)CN1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001577844492 1075346184 /nfs/dbraw/zinc/34/61/84/1075346184.db2.gz JPLYRXJXMIIJIZ-AAEUAGOBSA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(C)C(=O)CN1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001577844492 1075346183 /nfs/dbraw/zinc/34/61/83/1075346183.db2.gz JPLYRXJXMIIJIZ-AAEUAGOBSA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(C)C(=O)CN1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@H](O)C1 ZINC001577844493 1075346241 /nfs/dbraw/zinc/34/62/41/1075346241.db2.gz JPLYRXJXMIIJIZ-DGCLKSJQSA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(C)C(=O)CN1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@H](O)C1 ZINC001577844493 1075346235 /nfs/dbraw/zinc/34/62/35/1075346235.db2.gz JPLYRXJXMIIJIZ-DGCLKSJQSA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(C)C(=O)CN1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@H](O)C1 ZINC001577844494 1075346726 /nfs/dbraw/zinc/34/67/26/1075346726.db2.gz JPLYRXJXMIIJIZ-WCQYABFASA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(C)C(=O)CN1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@H](O)C1 ZINC001577844494 1075346722 /nfs/dbraw/zinc/34/67/22/1075346722.db2.gz JPLYRXJXMIIJIZ-WCQYABFASA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(C)C(=O)CN1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001577844495 1075346888 /nfs/dbraw/zinc/34/68/88/1075346888.db2.gz JPLYRXJXMIIJIZ-YPMHNXCESA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(C)C(=O)CN1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001577844495 1075346883 /nfs/dbraw/zinc/34/68/83/1075346883.db2.gz JPLYRXJXMIIJIZ-YPMHNXCESA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(C)C(=O)CN1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001577844765 1075346864 /nfs/dbraw/zinc/34/68/64/1075346864.db2.gz NHNXPTHKGCUCKL-AAEUAGOBSA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(C)C(=O)CN1CC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@H](O)C1 ZINC001577844766 1075346949 /nfs/dbraw/zinc/34/69/49/1075346949.db2.gz NHNXPTHKGCUCKL-DGCLKSJQSA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(C)C(=O)CN1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@H](O)C1 ZINC001577844767 1075346707 /nfs/dbraw/zinc/34/67/07/1075346707.db2.gz NHNXPTHKGCUCKL-WCQYABFASA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(C)C(=O)CN1CC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001577844768 1075346655 /nfs/dbraw/zinc/34/66/55/1075346655.db2.gz NHNXPTHKGCUCKL-YPMHNXCESA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(C)C(=O)CN1CC(CCO)(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001577844773 1075346620 /nfs/dbraw/zinc/34/66/20/1075346620.db2.gz NMEBVYLCODENGV-UHFFFAOYSA-N -1 3 376.421 -1.160 20 0 GAADHM CCN(C)C(=O)CN1CC(CCO)(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001577844773 1075346619 /nfs/dbraw/zinc/34/66/19/1075346619.db2.gz NMEBVYLCODENGV-UHFFFAOYSA-N -1 3 376.421 -1.160 20 0 GAADHM CCN(C)C(=O)CN1CC(CCO)(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001577844823 1075346760 /nfs/dbraw/zinc/34/67/60/1075346760.db2.gz OTIWIPRQEBPYFE-UHFFFAOYSA-N -1 3 376.421 -1.160 20 0 GAADHM CCN(C)C(=O)CN1CC(CCO)(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001577844823 1075346757 /nfs/dbraw/zinc/34/67/57/1075346757.db2.gz OTIWIPRQEBPYFE-UHFFFAOYSA-N -1 3 376.421 -1.160 20 0 GAADHM CCN(C)C(=O)CN1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001577845049 1075346841 /nfs/dbraw/zinc/34/68/41/1075346841.db2.gz WVISEJINBAHVBC-GWCFXTLKSA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(C)C(=O)CN1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1 ZINC001577845050 1075346910 /nfs/dbraw/zinc/34/69/10/1075346910.db2.gz WVISEJINBAHVBC-GXFFZTMASA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(C)C(=O)CN1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001577845051 1075346809 /nfs/dbraw/zinc/34/68/09/1075346809.db2.gz WVISEJINBAHVBC-MFKMUULPSA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(C)C(=O)CN1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1 ZINC001577845052 1075346686 /nfs/dbraw/zinc/34/66/86/1075346686.db2.gz WVISEJINBAHVBC-ZWNOBZJWSA-N -1 3 376.421 -1.162 20 0 GAADHM O=C(CCCc1c[nH]nn1)N[C@@H]1CCN(C(=O)c2cc(=O)n3[n-]cnc3n2)C1 ZINC001577847599 1075346753 /nfs/dbraw/zinc/34/67/53/1075346753.db2.gz PTOZBRWZIWQIBZ-LLVKDONJSA-N -1 3 385.388 -1.111 20 0 GAADHM O=C(CCCc1cn[nH]n1)N[C@@H]1CCN(C(=O)c2cc(=O)n3[n-]cnc3n2)C1 ZINC001577847599 1075346749 /nfs/dbraw/zinc/34/67/49/1075346749.db2.gz PTOZBRWZIWQIBZ-LLVKDONJSA-N -1 3 385.388 -1.111 20 0 GAADHM O=C(CCCc1c[nH]nn1)N[C@H]1CCN(C(=O)c2cc(=O)n3[n-]cnc3n2)C1 ZINC001577847600 1075346777 /nfs/dbraw/zinc/34/67/77/1075346777.db2.gz PTOZBRWZIWQIBZ-NSHDSACASA-N -1 3 385.388 -1.111 20 0 GAADHM O=C(CCCc1cn[nH]n1)N[C@H]1CCN(C(=O)c2cc(=O)n3[n-]cnc3n2)C1 ZINC001577847600 1075346773 /nfs/dbraw/zinc/34/67/73/1075346773.db2.gz PTOZBRWZIWQIBZ-NSHDSACASA-N -1 3 385.388 -1.111 20 0 GAADHM O=C(CCCn1c(=O)[n-][nH]c1=O)N1CCCO[C@H](CNCc2cn[nH]n2)C1 ZINC001577873097 1075350717 /nfs/dbraw/zinc/35/07/17/1075350717.db2.gz VRUXUGKIHAHJQO-GFCCVEGCSA-N -1 3 380.409 -1.005 20 0 GAADHM O=C(CCCn1c(=O)[n-][nH]c1=O)N1CCCO[C@@H](CNCc2cn[nH]n2)C1 ZINC001577873098 1075350501 /nfs/dbraw/zinc/35/05/01/1075350501.db2.gz VRUXUGKIHAHJQO-LBPRGKRZSA-N -1 3 380.409 -1.005 20 0 GAADHM O=C(CCCn1c(=O)[n-][nH]c1=O)N1CCC(O)(CNCc2cn[nH]n2)CC1 ZINC001577873101 1075350625 /nfs/dbraw/zinc/35/06/25/1075350625.db2.gz VVYFJXLMVNJZDD-UHFFFAOYSA-N -1 3 380.409 -1.269 20 0 GAADHM CCN(CC)C(=O)CN1CC(O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001577877598 1075350966 /nfs/dbraw/zinc/35/09/66/1075350966.db2.gz IQYSILMPEKELEA-UHFFFAOYSA-N -1 3 376.421 -1.160 20 0 GAADHM CCN(CC)C(=O)CN1CC(O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001577877598 1075350961 /nfs/dbraw/zinc/35/09/61/1075350961.db2.gz IQYSILMPEKELEA-UHFFFAOYSA-N -1 3 376.421 -1.160 20 0 GAADHM CCN(CC)C(=O)CN1CC(O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001577877823 1075350861 /nfs/dbraw/zinc/35/08/61/1075350861.db2.gz ORKIHADPYAOZJB-UHFFFAOYSA-N -1 3 376.421 -1.160 20 0 GAADHM CCN(CC)C(=O)CN1CC(O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001577877823 1075350858 /nfs/dbraw/zinc/35/08/58/1075350858.db2.gz ORKIHADPYAOZJB-UHFFFAOYSA-N -1 3 376.421 -1.160 20 0 GAADHM CCN(CC)C(=O)CN1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001577879411 1075351442 /nfs/dbraw/zinc/35/14/42/1075351442.db2.gz ANPNOKGEANNMRJ-CHWSQXEVSA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(CC)C(=O)CN1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001577879411 1075351440 /nfs/dbraw/zinc/35/14/40/1075351440.db2.gz ANPNOKGEANNMRJ-CHWSQXEVSA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(CC)C(=O)CN1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001577879412 1075351362 /nfs/dbraw/zinc/35/13/62/1075351362.db2.gz ANPNOKGEANNMRJ-OLZOCXBDSA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(CC)C(=O)CN1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001577879412 1075351357 /nfs/dbraw/zinc/35/13/57/1075351357.db2.gz ANPNOKGEANNMRJ-OLZOCXBDSA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(CC)C(=O)CN1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001577879448 1075351465 /nfs/dbraw/zinc/35/14/65/1075351465.db2.gz BOXAJIALBJADDU-OLZOCXBDSA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(CC)C(=O)CN1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001577879448 1075351463 /nfs/dbraw/zinc/35/14/63/1075351463.db2.gz BOXAJIALBJADDU-OLZOCXBDSA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(CC)C(=O)CN1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001577880008 1075351726 /nfs/dbraw/zinc/35/17/26/1075351726.db2.gz QJYFZKSRJVUKAH-CHWSQXEVSA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(CC)C(=O)CN1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001577880008 1075351721 /nfs/dbraw/zinc/35/17/21/1075351721.db2.gz QJYFZKSRJVUKAH-CHWSQXEVSA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(CC)C(=O)CN1C[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001577880009 1075351667 /nfs/dbraw/zinc/35/16/67/1075351667.db2.gz QJYFZKSRJVUKAH-OLZOCXBDSA-N -1 3 376.421 -1.162 20 0 GAADHM CCN(CC)C(=O)CN1C[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001577880009 1075351664 /nfs/dbraw/zinc/35/16/64/1075351664.db2.gz QJYFZKSRJVUKAH-OLZOCXBDSA-N -1 3 376.421 -1.162 20 0 GAADHM O=C(CCOCc1cn[nH]n1)NC[C@@]1(O)CCN(C(=O)c2cnc[n-]c2=O)C1 ZINC001577884680 1075352700 /nfs/dbraw/zinc/35/27/00/1075352700.db2.gz KRNNMFWFNQGCMI-INIZCTEOSA-N -1 3 391.388 -1.400 20 0 GAADHM O=C(CCOCc1cn[nH]n1)NC[C@]1(O)CCN(C(=O)c2cnc[n-]c2=O)C1 ZINC001577884681 1075352678 /nfs/dbraw/zinc/35/26/78/1075352678.db2.gz KRNNMFWFNQGCMI-MRXNPFEDSA-N -1 3 391.388 -1.400 20 0 GAADHM CCN(CC)CC(=O)N1CCN(c2[nH]c(=O)n(C)c(=O)c2-c2nnn[n-]2)CC1 ZINC001577885433 1075353112 /nfs/dbraw/zinc/35/31/12/1075353112.db2.gz CAIMSCMPYKNWDP-UHFFFAOYSA-N -1 3 391.436 -1.756 20 0 GAADHM CCN(CC)CC(=O)N1CCN(c2[nH]c(=O)n(C)c(=O)c2-c2nn[n-]n2)CC1 ZINC001577885433 1075353110 /nfs/dbraw/zinc/35/31/10/1075353110.db2.gz CAIMSCMPYKNWDP-UHFFFAOYSA-N -1 3 391.436 -1.756 20 0 GAADHM O=C(CCc1n[nH]c(=O)[n-]c1=O)N1CCCO[C@H](CNCc2c[nH]nn2)C1 ZINC001577903541 1075354995 /nfs/dbraw/zinc/35/49/95/1075354995.db2.gz FQNULDSQGIWZLX-LLVKDONJSA-N -1 3 378.393 -1.259 20 0 GAADHM O=C(CCc1n[nH]c(=O)[n-]c1=O)N1CCCO[C@@H](CNCc2c[nH]nn2)C1 ZINC001577903542 1075355084 /nfs/dbraw/zinc/35/50/84/1075355084.db2.gz FQNULDSQGIWZLX-NSHDSACASA-N -1 3 378.393 -1.259 20 0 GAADHM O=C(CCn1cc[n-]c(=O)c1=O)N[C@H]1COC2(CN(Cc3c[nH]nn3)C2)C1 ZINC001577906605 1075355094 /nfs/dbraw/zinc/35/50/94/1075355094.db2.gz GCXDLHYGQIXUKP-LLVKDONJSA-N -1 3 375.389 -1.796 20 0 GAADHM O=C(CCn1cc[n-]c(=O)c1=O)N[C@@H]1COC2(CN(Cc3c[nH]nn3)C2)C1 ZINC001577906606 1075354967 /nfs/dbraw/zinc/35/49/67/1075354967.db2.gz GCXDLHYGQIXUKP-NSHDSACASA-N -1 3 375.389 -1.796 20 0 GAADHM O=C(CCn1cc[n-]c(=O)c1=O)NCCN1CCN(CCc2cn[nH]n2)CC1 ZINC001577906612 1075355108 /nfs/dbraw/zinc/35/51/08/1075355108.db2.gz GLAYGOPWALAHBJ-UHFFFAOYSA-N -1 3 390.448 -1.979 20 0 GAADHM CCN(CCCNC(=O)[C@H]1CNC(=O)N1)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001577911044 1075355593 /nfs/dbraw/zinc/35/55/93/1075355593.db2.gz BISUHNCEAASFMA-LLVKDONJSA-N -1 3 375.393 -1.155 20 0 GAADHM CCN(CCCNC(=O)[C@H]1CNC(=O)N1)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001577911044 1075355584 /nfs/dbraw/zinc/35/55/84/1075355584.db2.gz BISUHNCEAASFMA-LLVKDONJSA-N -1 3 375.393 -1.155 20 0 GAADHM CCN(CCCNC(=O)[C@@H]1CNC(=O)N1)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001577911045 1075355670 /nfs/dbraw/zinc/35/56/70/1075355670.db2.gz BISUHNCEAASFMA-NSHDSACASA-N -1 3 375.393 -1.155 20 0 GAADHM CCN(CCCNC(=O)[C@@H]1CNC(=O)N1)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001577911045 1075355661 /nfs/dbraw/zinc/35/56/61/1075355661.db2.gz BISUHNCEAASFMA-NSHDSACASA-N -1 3 375.393 -1.155 20 0 GAADHM O=C(CCn1cc[n-]c(=O)c1=O)N[C@@H]1CCN(CC(=O)NCc2cn[nH]n2)C1 ZINC001577920619 1075359926 /nfs/dbraw/zinc/35/99/26/1075359926.db2.gz UUCHYKAKVXVNNW-LLVKDONJSA-N -1 3 390.404 -2.448 20 0 GAADHM O=C(CCn1cc[n-]c(=O)c1=O)N[C@H]1CCN(CC(=O)NCc2cn[nH]n2)C1 ZINC001577920620 1075360130 /nfs/dbraw/zinc/36/01/30/1075360130.db2.gz UUCHYKAKVXVNNW-NSHDSACASA-N -1 3 390.404 -2.448 20 0 GAADHM CCN(CCNC(=O)[C@H]1CCS(=O)(=O)N1)c1ccc(-c2nn[n-]n2)cn1 ZINC001577949643 1075371671 /nfs/dbraw/zinc/37/16/71/1075371671.db2.gz NHPHPMYCYLTARK-LLVKDONJSA-N -1 3 380.434 -1.104 20 0 GAADHM CCN(CCNC(=O)[C@H]1CCS(=O)(=O)N1)c1ccc(-c2nnn[n-]2)cn1 ZINC001577949643 1075371665 /nfs/dbraw/zinc/37/16/65/1075371665.db2.gz NHPHPMYCYLTARK-LLVKDONJSA-N -1 3 380.434 -1.104 20 0 GAADHM CCN(CCNC(=O)[C@@H]1CCS(=O)(=O)N1)c1ccc(-c2nn[n-]n2)cn1 ZINC001577949644 1075371820 /nfs/dbraw/zinc/37/18/20/1075371820.db2.gz NHPHPMYCYLTARK-NSHDSACASA-N -1 3 380.434 -1.104 20 0 GAADHM CCN(CCNC(=O)[C@@H]1CCS(=O)(=O)N1)c1ccc(-c2nnn[n-]2)cn1 ZINC001577949644 1075371817 /nfs/dbraw/zinc/37/18/17/1075371817.db2.gz NHPHPMYCYLTARK-NSHDSACASA-N -1 3 380.434 -1.104 20 0 GAADHM CCN(CCNC(=O)[C@H]1CCS(=O)(=O)N1)c1ncccc1-c1nn[n-]n1 ZINC001577949772 1075371617 /nfs/dbraw/zinc/37/16/17/1075371617.db2.gz QGUMGUSYTZNVME-LLVKDONJSA-N -1 3 380.434 -1.104 20 0 GAADHM CCN(CCNC(=O)[C@H]1CCS(=O)(=O)N1)c1ncccc1-c1nnn[n-]1 ZINC001577949772 1075371611 /nfs/dbraw/zinc/37/16/11/1075371611.db2.gz QGUMGUSYTZNVME-LLVKDONJSA-N -1 3 380.434 -1.104 20 0 GAADHM CCN(CCNC(=O)[C@@H]1CCS(=O)(=O)N1)c1ncccc1-c1nn[n-]n1 ZINC001577949773 1075371778 /nfs/dbraw/zinc/37/17/78/1075371778.db2.gz QGUMGUSYTZNVME-NSHDSACASA-N -1 3 380.434 -1.104 20 0 GAADHM CCN(CCNC(=O)[C@@H]1CCS(=O)(=O)N1)c1ncccc1-c1nnn[n-]1 ZINC001577949773 1075371774 /nfs/dbraw/zinc/37/17/74/1075371774.db2.gz QGUMGUSYTZNVME-NSHDSACASA-N -1 3 380.434 -1.104 20 0 GAADHM CCN(CCNC(=O)[C@H]1CCS(=O)(=O)N1)c1ccc(-c2nn[n-]n2)nc1 ZINC001577950179 1075371855 /nfs/dbraw/zinc/37/18/55/1075371855.db2.gz ZSQJEVNIQJYBNN-GFCCVEGCSA-N -1 3 380.434 -1.104 20 0 GAADHM CCN(CCNC(=O)[C@H]1CCS(=O)(=O)N1)c1ccc(-c2nnn[n-]2)nc1 ZINC001577950179 1075371852 /nfs/dbraw/zinc/37/18/52/1075371852.db2.gz ZSQJEVNIQJYBNN-GFCCVEGCSA-N -1 3 380.434 -1.104 20 0 GAADHM CCN(CCNC(=O)[C@@H]1CCS(=O)(=O)N1)c1ccc(-c2nn[n-]n2)nc1 ZINC001577950180 1075371793 /nfs/dbraw/zinc/37/17/93/1075371793.db2.gz ZSQJEVNIQJYBNN-LBPRGKRZSA-N -1 3 380.434 -1.104 20 0 GAADHM CCN(CCNC(=O)[C@@H]1CCS(=O)(=O)N1)c1ccc(-c2nnn[n-]2)nc1 ZINC001577950180 1075371788 /nfs/dbraw/zinc/37/17/88/1075371788.db2.gz ZSQJEVNIQJYBNN-LBPRGKRZSA-N -1 3 380.434 -1.104 20 0 GAADHM CCN(CCNC(=O)C1CS(=O)(=O)C1)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001577952063 1075372244 /nfs/dbraw/zinc/37/22/44/1075372244.db2.gz HDWNJQCLPRNTGJ-UHFFFAOYSA-N -1 3 381.418 -1.182 20 0 GAADHM CCN(CCNC(=O)C1CS(=O)(=O)C1)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001577952063 1075372240 /nfs/dbraw/zinc/37/22/40/1075372240.db2.gz HDWNJQCLPRNTGJ-UHFFFAOYSA-N -1 3 381.418 -1.182 20 0 GAADHM CCN(CCNC(=O)[C@H]1CN(C)C(=O)N1)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001577952107 1075372298 /nfs/dbraw/zinc/37/22/98/1075372298.db2.gz IDUCDWDNHQZQBH-LLVKDONJSA-N -1 3 375.393 -1.203 20 0 GAADHM CCN(CCNC(=O)[C@H]1CN(C)C(=O)N1)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001577952107 1075372296 /nfs/dbraw/zinc/37/22/96/1075372296.db2.gz IDUCDWDNHQZQBH-LLVKDONJSA-N -1 3 375.393 -1.203 20 0 GAADHM CCN(CCNC(=O)[C@@H]1CN(C)C(=O)N1)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001577952108 1075372335 /nfs/dbraw/zinc/37/23/35/1075372335.db2.gz IDUCDWDNHQZQBH-NSHDSACASA-N -1 3 375.393 -1.203 20 0 GAADHM CCN(CCNC(=O)[C@@H]1CN(C)C(=O)N1)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001577952108 1075372333 /nfs/dbraw/zinc/37/23/33/1075372333.db2.gz IDUCDWDNHQZQBH-NSHDSACASA-N -1 3 375.393 -1.203 20 0 GAADHM CCN(CCNC(=O)C1CS(=O)(=O)C1)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001577952478 1075372635 /nfs/dbraw/zinc/37/26/35/1075372635.db2.gz MQDFJMYZIHFHNF-UHFFFAOYSA-N -1 3 381.418 -1.182 20 0 GAADHM CCN(CCNC(=O)C1CS(=O)(=O)C1)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001577952478 1075372627 /nfs/dbraw/zinc/37/26/27/1075372627.db2.gz MQDFJMYZIHFHNF-UHFFFAOYSA-N -1 3 381.418 -1.182 20 0 GAADHM CCN(CCNC(=O)[C@H]1CN(C)C(=O)N1)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001577952734 1075372766 /nfs/dbraw/zinc/37/27/66/1075372766.db2.gz RSTUPLUTUGTAPA-LLVKDONJSA-N -1 3 375.393 -1.203 20 0 GAADHM CCN(CCNC(=O)[C@H]1CN(C)C(=O)N1)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001577952734 1075372762 /nfs/dbraw/zinc/37/27/62/1075372762.db2.gz RSTUPLUTUGTAPA-LLVKDONJSA-N -1 3 375.393 -1.203 20 0 GAADHM CCN(CCNC(=O)[C@@H]1CN(C)C(=O)N1)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001577952735 1075372698 /nfs/dbraw/zinc/37/26/98/1075372698.db2.gz RSTUPLUTUGTAPA-NSHDSACASA-N -1 3 375.393 -1.203 20 0 GAADHM CCN(CCNC(=O)[C@@H]1CN(C)C(=O)N1)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001577952735 1075372695 /nfs/dbraw/zinc/37/26/95/1075372695.db2.gz RSTUPLUTUGTAPA-NSHDSACASA-N -1 3 375.393 -1.203 20 0 GAADHM CCN(CCNC(=O)C1CS(=O)(=O)C1)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001577952738 1075372689 /nfs/dbraw/zinc/37/26/89/1075372689.db2.gz RVFXOUHSLXAKLQ-UHFFFAOYSA-N -1 3 381.418 -1.182 20 0 GAADHM CCN(CCNC(=O)C1CS(=O)(=O)C1)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001577952738 1075372687 /nfs/dbraw/zinc/37/26/87/1075372687.db2.gz RVFXOUHSLXAKLQ-UHFFFAOYSA-N -1 3 381.418 -1.182 20 0 GAADHM CCN(CCNC(=O)[C@H]1CN(C)C(=O)N1)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001577953037 1075372718 /nfs/dbraw/zinc/37/27/18/1075372718.db2.gz WTIVOMOXAPLPBY-LLVKDONJSA-N -1 3 375.393 -1.203 20 0 GAADHM CCN(CCNC(=O)[C@H]1CN(C)C(=O)N1)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001577953037 1075372716 /nfs/dbraw/zinc/37/27/16/1075372716.db2.gz WTIVOMOXAPLPBY-LLVKDONJSA-N -1 3 375.393 -1.203 20 0 GAADHM CCN(CCNC(=O)[C@@H]1CN(C)C(=O)N1)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001577953038 1075372735 /nfs/dbraw/zinc/37/27/35/1075372735.db2.gz WTIVOMOXAPLPBY-NSHDSACASA-N -1 3 375.393 -1.203 20 0 GAADHM CCN(CCNC(=O)[C@@H]1CN(C)C(=O)N1)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001577953038 1075372732 /nfs/dbraw/zinc/37/27/32/1075372732.db2.gz WTIVOMOXAPLPBY-NSHDSACASA-N -1 3 375.393 -1.203 20 0 GAADHM O=C(Cn1c(=O)[n-][nH]c1=O)N1CCN(C2CN(CCc3c[nH]nn3)C2)CC1 ZINC001577967962 1075374502 /nfs/dbraw/zinc/37/45/02/1075374502.db2.gz MPIKGNPQFOCXOQ-UHFFFAOYSA-N -1 3 377.409 -2.122 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)c1cnc[n-]c1=O)c1cncc(-c2c[nH]nn2)c1 ZINC001577974681 1075376044 /nfs/dbraw/zinc/37/60/44/1075376044.db2.gz KWDBVCDIFSVPGW-LLVKDONJSA-N -1 3 384.356 -1.117 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)c1cnc[n-]c1=O)c1cncc(-c2c[nH]nn2)c1 ZINC001577974682 1075376309 /nfs/dbraw/zinc/37/63/09/1075376309.db2.gz KWDBVCDIFSVPGW-NSHDSACASA-N -1 3 384.356 -1.117 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)[C@@H]1CCCN1Cc1c[nH]nn1)c1ncccc1[O-] ZINC001577976704 1075376031 /nfs/dbraw/zinc/37/60/31/1075376031.db2.gz ZPQZQWJJCRBKRM-OLZOCXBDSA-N -1 3 389.416 -1.223 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)[C@@H]1CCCN1Cc1c[nH]nn1)c1ncccc1[O-] ZINC001577976706 1075376060 /nfs/dbraw/zinc/37/60/60/1075376060.db2.gz ZPQZQWJJCRBKRM-STQMWFEESA-N -1 3 389.416 -1.223 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cnc[n-]c1=O)c1ccc(-c2c[nH]nn2)cn1 ZINC001577992123 1075377937 /nfs/dbraw/zinc/37/79/37/1075377937.db2.gz UPMBFKZIYSDXRT-JTQLQIEISA-N -1 3 384.356 -1.117 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cnc[n-]c1=O)c1ccc(-c2c[nH]nn2)cn1 ZINC001577992125 1075378006 /nfs/dbraw/zinc/37/80/06/1075378006.db2.gz UPMBFKZIYSDXRT-SNVBAGLBSA-N -1 3 384.356 -1.117 20 0 GAADHM O=C(CCOCc1cn[nH]n1)N1CC(O)(CNC(=O)c2cnc[n-]c2=O)C1 ZINC001577993934 1075378665 /nfs/dbraw/zinc/37/86/65/1075378665.db2.gz XIYAHJYJWCHKBR-UHFFFAOYSA-N -1 3 377.361 -1.790 20 0 GAADHM CCN(CCNC(=O)CN1CCN(C)C(=O)C1)c1ccc(-c2nn[n-]n2)nc1 ZINC001578004164 1075379628 /nfs/dbraw/zinc/37/96/28/1075379628.db2.gz ATKODGRVOHUSOE-UHFFFAOYSA-N -1 3 387.448 -1.022 20 0 GAADHM CCN(CCNC(=O)CN1CCN(C)C(=O)C1)c1ccc(-c2nnn[n-]2)nc1 ZINC001578004164 1075379621 /nfs/dbraw/zinc/37/96/21/1075379621.db2.gz ATKODGRVOHUSOE-UHFFFAOYSA-N -1 3 387.448 -1.022 20 0 GAADHM CCN(CCNC(=O)CNC(=O)CNC(C)=O)c1ccc(-c2nn[n-]n2)nc1 ZINC001578004229 1075379615 /nfs/dbraw/zinc/37/96/15/1075379615.db2.gz CLGFBNPPNHMIJR-UHFFFAOYSA-N -1 3 389.420 -1.544 20 0 GAADHM CCN(CCNC(=O)CNC(=O)CNC(C)=O)c1ccc(-c2nnn[n-]2)nc1 ZINC001578004229 1075379609 /nfs/dbraw/zinc/37/96/09/1075379609.db2.gz CLGFBNPPNHMIJR-UHFFFAOYSA-N -1 3 389.420 -1.544 20 0 GAADHM CCN(CCNC(=O)CNC(=O)CNC(C)=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001578004335 1075379504 /nfs/dbraw/zinc/37/95/04/1075379504.db2.gz FDPNGAFSOZGICF-UHFFFAOYSA-N -1 3 389.420 -1.544 20 0 GAADHM CCN(CCNC(=O)CNC(=O)CNC(C)=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001578004335 1075379501 /nfs/dbraw/zinc/37/95/01/1075379501.db2.gz FDPNGAFSOZGICF-UHFFFAOYSA-N -1 3 389.420 -1.544 20 0 GAADHM CCN(CCNC(=O)CN1CCNC(=O)C1)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001578004361 1075379664 /nfs/dbraw/zinc/37/96/64/1075379664.db2.gz FMPJEKOQRZVSHO-UHFFFAOYSA-N -1 3 389.420 -1.795 20 0 GAADHM CCN(CCNC(=O)CN1CCNC(=O)C1)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001578004361 1075379660 /nfs/dbraw/zinc/37/96/60/1075379660.db2.gz FMPJEKOQRZVSHO-UHFFFAOYSA-N -1 3 389.420 -1.795 20 0 GAADHM CCN(CCNC(=O)CNS(=O)(=O)NC)c1ccc(-c2nn[n-]n2)nc1 ZINC001578004388 1075379949 /nfs/dbraw/zinc/37/99/49/1075379949.db2.gz GDQPQJIROVQZMN-UHFFFAOYSA-N -1 3 383.438 -1.742 20 0 GAADHM CCN(CCNC(=O)CNS(=O)(=O)NC)c1ccc(-c2nnn[n-]2)nc1 ZINC001578004388 1075379943 /nfs/dbraw/zinc/37/99/43/1075379943.db2.gz GDQPQJIROVQZMN-UHFFFAOYSA-N -1 3 383.438 -1.742 20 0 GAADHM CCN(CCNC(=O)CN1CCNC(=O)C1)c1nc(C)ccc1-c1nn[n-]n1 ZINC001578004400 1075380046 /nfs/dbraw/zinc/38/00/46/1075380046.db2.gz GNWRTMURHLLCOB-UHFFFAOYSA-N -1 3 387.448 -1.056 20 0 GAADHM CCN(CCNC(=O)CN1CCNC(=O)C1)c1nc(C)ccc1-c1nnn[n-]1 ZINC001578004400 1075380043 /nfs/dbraw/zinc/38/00/43/1075380043.db2.gz GNWRTMURHLLCOB-UHFFFAOYSA-N -1 3 387.448 -1.056 20 0 GAADHM CCN(CCNC(=O)CN1CCN(C)C(=O)C1)c1ccc(-c2nn[n-]n2)cn1 ZINC001578004483 1075380036 /nfs/dbraw/zinc/38/00/36/1075380036.db2.gz IASVDQDNSTWKJM-UHFFFAOYSA-N -1 3 387.448 -1.022 20 0 GAADHM CCN(CCNC(=O)CN1CCN(C)C(=O)C1)c1ccc(-c2nnn[n-]2)cn1 ZINC001578004483 1075380033 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FGEMOSWTADUIRQ-SNVBAGLBSA-N -1 3 392.420 -1.076 20 0 GAADHM CCN(CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)C(=O)[C@@H](C)NC(=O)COC ZINC001578069514 1075390930 /nfs/dbraw/zinc/39/09/30/1075390930.db2.gz FGEMOSWTADUIRQ-SNVBAGLBSA-N -1 3 392.420 -1.076 20 0 GAADHM CCN(CCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)C(=O)C1CS(=O)(=O)C1 ZINC001578071534 1075390997 /nfs/dbraw/zinc/39/09/97/1075390997.db2.gz BJHGOWBOTBPNEM-UHFFFAOYSA-N -1 3 381.418 -1.182 20 0 GAADHM CCN(CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)C(=O)C1CS(=O)(=O)C1 ZINC001578071534 1075390993 /nfs/dbraw/zinc/39/09/93/1075390993.db2.gz BJHGOWBOTBPNEM-UHFFFAOYSA-N -1 3 381.418 -1.182 20 0 GAADHM CCN(CCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)C(=O)CN1CCNC(=O)C1 ZINC001578071727 1075391078 /nfs/dbraw/zinc/39/10/78/1075391078.db2.gz GHWMCKSZCBDWSC-UHFFFAOYSA-N -1 3 389.420 -1.795 20 0 GAADHM CCN(CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)C(=O)CN1CCNC(=O)C1 ZINC001578071727 1075391074 /nfs/dbraw/zinc/39/10/74/1075391074.db2.gz GHWMCKSZCBDWSC-UHFFFAOYSA-N -1 3 389.420 -1.795 20 0 GAADHM CCN(CCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)C(=O)CS(=O)(=O)NC ZINC001578071738 1075390767 /nfs/dbraw/zinc/39/07/67/1075390767.db2.gz GSNFFHXZXUQGQU-UHFFFAOYSA-N -1 3 384.422 -1.678 20 0 GAADHM CCN(CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)C(=O)CS(=O)(=O)NC ZINC001578071738 1075390760 /nfs/dbraw/zinc/39/07/60/1075390760.db2.gz GSNFFHXZXUQGQU-UHFFFAOYSA-N -1 3 384.422 -1.678 20 0 GAADHM CCN(CCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)C(=O)Cn1ncn(C)c1=O ZINC001578072077 1075390822 /nfs/dbraw/zinc/39/08/22/1075390822.db2.gz LUOXRAIZWPLZIQ-UHFFFAOYSA-N -1 3 388.392 -1.632 20 0 GAADHM CCN(CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)C(=O)Cn1ncn(C)c1=O ZINC001578072077 1075390818 /nfs/dbraw/zinc/39/08/18/1075390818.db2.gz LUOXRAIZWPLZIQ-UHFFFAOYSA-N -1 3 388.392 -1.632 20 0 GAADHM CCN(CCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)C(=O)[C@H]1CN(C)C(=O)N1 ZINC001578072437 1075390808 /nfs/dbraw/zinc/39/08/08/1075390808.db2.gz RUBFPBFGMVKCCC-LLVKDONJSA-N -1 3 375.393 -1.203 20 0 GAADHM CCN(CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)C(=O)[C@H]1CN(C)C(=O)N1 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389.420 -1.226 20 0 GAADHM CCN(CCNc1ccc(-c2nnn[n-]2)nc1)C(=O)CNC(=O)CNC(C)=O ZINC001578118481 1075391481 /nfs/dbraw/zinc/39/14/81/1075391481.db2.gz PEEMSKDLKQCBPJ-UHFFFAOYSA-N -1 3 389.420 -1.226 20 0 GAADHM CCN(CCNc1ncccc1-c1nn[n-]n1)C(=O)CNC(=O)CNC(C)=O ZINC001578161070 1075393682 /nfs/dbraw/zinc/39/36/82/1075393682.db2.gz PVUKSNKBYHPQIU-UHFFFAOYSA-N -1 3 389.420 -1.226 20 0 GAADHM CCN(CCNc1ncccc1-c1nnn[n-]1)C(=O)CNC(=O)CNC(C)=O ZINC001578161070 1075393678 /nfs/dbraw/zinc/39/36/78/1075393678.db2.gz PVUKSNKBYHPQIU-UHFFFAOYSA-N -1 3 389.420 -1.226 20 0 GAADHM CCN(CCNc1ncccc1-c1nn[n-]n1)C(=O)CNS(=O)(=O)NC ZINC001578161177 1075393698 /nfs/dbraw/zinc/39/36/98/1075393698.db2.gz RUHWUTMPCJXXGX-UHFFFAOYSA-N -1 3 383.438 -1.424 20 0 GAADHM CCN(CCNc1ncccc1-c1nnn[n-]1)C(=O)CNS(=O)(=O)NC ZINC001578161177 1075393692 /nfs/dbraw/zinc/39/36/92/1075393692.db2.gz RUHWUTMPCJXXGX-UHFFFAOYSA-N -1 3 383.438 -1.424 20 0 GAADHM CCN1C[C@H](C(=O)N[C@@H](CO)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1=O ZINC001578211097 1075394620 /nfs/dbraw/zinc/39/46/20/1075394620.db2.gz RTHMECUROJWLCX-GHMZBOCLSA-N -1 3 390.404 -1.730 20 0 GAADHM CCN1C[C@H](C(=O)N[C@@H](CO)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1=O ZINC001578211097 1075394613 /nfs/dbraw/zinc/39/46/13/1075394613.db2.gz RTHMECUROJWLCX-GHMZBOCLSA-N -1 3 390.404 -1.730 20 0 GAADHM CCN1C[C@H](C(=O)N[C@H](CO)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1=O ZINC001578211098 1075395103 /nfs/dbraw/zinc/39/51/03/1075395103.db2.gz RTHMECUROJWLCX-MNOVXSKESA-N -1 3 390.404 -1.730 20 0 GAADHM CCN1C[C@H](C(=O)N[C@H](CO)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1=O ZINC001578211098 1075395098 /nfs/dbraw/zinc/39/50/98/1075395098.db2.gz RTHMECUROJWLCX-MNOVXSKESA-N -1 3 390.404 -1.730 20 0 GAADHM CCN1C[C@@H](C(=O)N[C@H](CO)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1=O ZINC001578211099 1075395206 /nfs/dbraw/zinc/39/52/06/1075395206.db2.gz RTHMECUROJWLCX-QWRGUYRKSA-N -1 3 390.404 -1.730 20 0 GAADHM CCN1C[C@@H](C(=O)N[C@H](CO)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1=O ZINC001578211099 1075395203 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SDYPWLPSIRRGMH-DGCLKSJQSA-N -1 3 392.420 -1.878 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001578226518 1075406862 /nfs/dbraw/zinc/40/68/62/1075406862.db2.gz SDYPWLPSIRRGMH-DGCLKSJQSA-N -1 3 392.420 -1.878 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)N[C@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001578226519 1075406941 /nfs/dbraw/zinc/40/69/41/1075406941.db2.gz SDYPWLPSIRRGMH-WCQYABFASA-N -1 3 392.420 -1.878 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)N[C@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001578226519 1075406938 /nfs/dbraw/zinc/40/69/38/1075406938.db2.gz SDYPWLPSIRRGMH-WCQYABFASA-N -1 3 392.420 -1.878 20 0 GAADHM CCN1CCOC[C@H]1C(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001578226520 1075406995 /nfs/dbraw/zinc/40/69/95/1075406995.db2.gz SDYPWLPSIRRGMH-YPMHNXCESA-N -1 3 392.420 -1.878 20 0 GAADHM CCN1CCOC[C@H]1C(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001578226520 1075406989 /nfs/dbraw/zinc/40/69/89/1075406989.db2.gz SDYPWLPSIRRGMH-YPMHNXCESA-N -1 3 392.420 -1.878 20 0 GAADHM CCN1CCOC[C@H]1C(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001578226549 1075407085 /nfs/dbraw/zinc/40/70/85/1075407085.db2.gz SUNLDZZTWJABPY-AAEUAGOBSA-N -1 3 392.420 -1.878 20 0 GAADHM CCN1CCOC[C@H]1C(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001578226549 1075407080 /nfs/dbraw/zinc/40/70/80/1075407080.db2.gz SUNLDZZTWJABPY-AAEUAGOBSA-N -1 3 392.420 -1.878 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001578226550 1075407011 /nfs/dbraw/zinc/40/70/11/1075407011.db2.gz SUNLDZZTWJABPY-DGCLKSJQSA-N -1 3 392.420 -1.878 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001578226550 1075407007 /nfs/dbraw/zinc/40/70/07/1075407007.db2.gz SUNLDZZTWJABPY-DGCLKSJQSA-N -1 3 392.420 -1.878 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001578226551 1075407069 /nfs/dbraw/zinc/40/70/69/1075407069.db2.gz SUNLDZZTWJABPY-WCQYABFASA-N -1 3 392.420 -1.878 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001578226551 1075407064 /nfs/dbraw/zinc/40/70/64/1075407064.db2.gz SUNLDZZTWJABPY-WCQYABFASA-N -1 3 392.420 -1.878 20 0 GAADHM CCN1CCOC[C@H]1C(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001578226552 1075406951 /nfs/dbraw/zinc/40/69/51/1075406951.db2.gz SUNLDZZTWJABPY-YPMHNXCESA-N -1 3 392.420 -1.878 20 0 GAADHM CCN1CCOC[C@H]1C(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001578226552 1075406949 /nfs/dbraw/zinc/40/69/49/1075406949.db2.gz SUNLDZZTWJABPY-YPMHNXCESA-N -1 3 392.420 -1.878 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)NC[C@H](O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001578226669 1075406897 /nfs/dbraw/zinc/40/68/97/1075406897.db2.gz VPVORUYPDZXFDD-CHWSQXEVSA-N -1 3 376.421 -1.129 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)NC[C@H](O)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001578226669 1075406894 /nfs/dbraw/zinc/40/68/94/1075406894.db2.gz VPVORUYPDZXFDD-CHWSQXEVSA-N -1 3 376.421 -1.129 20 0 GAADHM CCN1CCOC[C@H]1C(=O)NC[C@H](O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001578226670 1075407529 /nfs/dbraw/zinc/40/75/29/1075407529.db2.gz VPVORUYPDZXFDD-OLZOCXBDSA-N -1 3 376.421 -1.129 20 0 GAADHM CCN1CCOC[C@H]1C(=O)NC[C@H](O)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001578226670 1075407527 /nfs/dbraw/zinc/40/75/27/1075407527.db2.gz VPVORUYPDZXFDD-OLZOCXBDSA-N -1 3 376.421 -1.129 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)NC[C@@H](O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001578226671 1075407550 /nfs/dbraw/zinc/40/75/50/1075407550.db2.gz VPVORUYPDZXFDD-QWHCGFSZSA-N -1 3 376.421 -1.129 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)NC[C@@H](O)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001578226671 1075407547 /nfs/dbraw/zinc/40/75/47/1075407547.db2.gz VPVORUYPDZXFDD-QWHCGFSZSA-N -1 3 376.421 -1.129 20 0 GAADHM CCN1CCOC[C@H]1C(=O)NC[C@@H](O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001578226672 1075407520 /nfs/dbraw/zinc/40/75/20/1075407520.db2.gz VPVORUYPDZXFDD-STQMWFEESA-N -1 3 376.421 -1.129 20 0 GAADHM CCN1CCOC[C@H]1C(=O)NC[C@@H](O)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001578226672 1075407513 /nfs/dbraw/zinc/40/75/13/1075407513.db2.gz VPVORUYPDZXFDD-STQMWFEESA-N -1 3 376.421 -1.129 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)NC[C@@H](O)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001578226893 1075407867 /nfs/dbraw/zinc/40/78/67/1075407867.db2.gz ZRVJJXLVVDRJFO-GXTWGEPZSA-N -1 3 376.421 -1.129 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)NC[C@@H](O)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001578226893 1075407865 /nfs/dbraw/zinc/40/78/65/1075407865.db2.gz ZRVJJXLVVDRJFO-GXTWGEPZSA-N -1 3 376.421 -1.129 20 0 GAADHM CCN1CCOC[C@H]1C(=O)NC[C@@H](O)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001578226894 1075407884 /nfs/dbraw/zinc/40/78/84/1075407884.db2.gz ZRVJJXLVVDRJFO-JSGCOSHPSA-N -1 3 376.421 -1.129 20 0 GAADHM CCN1CCOC[C@H]1C(=O)NC[C@@H](O)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001578226894 1075407882 /nfs/dbraw/zinc/40/78/82/1075407882.db2.gz ZRVJJXLVVDRJFO-JSGCOSHPSA-N -1 3 376.421 -1.129 20 0 GAADHM CCN1CCOC[C@H]1C(=O)NC[C@H](O)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001578226895 1075408025 /nfs/dbraw/zinc/40/80/25/1075408025.db2.gz ZRVJJXLVVDRJFO-OCCSQVGLSA-N -1 3 376.421 -1.129 20 0 GAADHM CCN1CCOC[C@H]1C(=O)NC[C@H](O)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001578226895 1075408023 /nfs/dbraw/zinc/40/80/23/1075408023.db2.gz ZRVJJXLVVDRJFO-OCCSQVGLSA-N -1 3 376.421 -1.129 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)NC[C@H](O)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001578226896 1075407835 /nfs/dbraw/zinc/40/78/35/1075407835.db2.gz ZRVJJXLVVDRJFO-TZMCWYRMSA-N -1 3 376.421 -1.129 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)NC[C@H](O)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001578226896 1075407831 /nfs/dbraw/zinc/40/78/31/1075407831.db2.gz ZRVJJXLVVDRJFO-TZMCWYRMSA-N -1 3 376.421 -1.129 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001578227729 1075408447 /nfs/dbraw/zinc/40/84/47/1075408447.db2.gz SUBDIAUFGYALIA-MCIONIFRSA-N -1 3 388.432 -1.352 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001578227729 1075408443 /nfs/dbraw/zinc/40/84/43/1075408443.db2.gz SUBDIAUFGYALIA-MCIONIFRSA-N -1 3 388.432 -1.352 20 0 GAADHM CCN1CCOC[C@H]1C(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001578227730 1075408518 /nfs/dbraw/zinc/40/85/18/1075408518.db2.gz SUBDIAUFGYALIA-RDBSUJKOSA-N -1 3 388.432 -1.352 20 0 GAADHM CCN1CCOC[C@H]1C(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001578227730 1075408515 /nfs/dbraw/zinc/40/85/15/1075408515.db2.gz SUBDIAUFGYALIA-RDBSUJKOSA-N -1 3 388.432 -1.352 20 0 GAADHM CCN1CCOC[C@H]1C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1O ZINC001578227899 1075408384 /nfs/dbraw/zinc/40/83/84/1075408384.db2.gz ZPLLNQKCGGLXFG-HZSPNIEDSA-N -1 3 388.432 -1.352 20 0 GAADHM CCN1CCOC[C@H]1C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@H]1O ZINC001578227899 1075408382 /nfs/dbraw/zinc/40/83/82/1075408382.db2.gz ZPLLNQKCGGLXFG-HZSPNIEDSA-N -1 3 388.432 -1.352 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001578227900 1075408542 /nfs/dbraw/zinc/40/85/42/1075408542.db2.gz ZPLLNQKCGGLXFG-MCIONIFRSA-N -1 3 388.432 -1.352 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001578227900 1075408537 /nfs/dbraw/zinc/40/85/37/1075408537.db2.gz ZPLLNQKCGGLXFG-MCIONIFRSA-N -1 3 388.432 -1.352 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1O ZINC001578227901 1075408959 /nfs/dbraw/zinc/40/89/59/1075408959.db2.gz ZPLLNQKCGGLXFG-MGPQQGTHSA-N -1 3 388.432 -1.352 20 0 GAADHM CCN1CCOC[C@@H]1C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@H]1O ZINC001578227901 1075408952 /nfs/dbraw/zinc/40/89/52/1075408952.db2.gz ZPLLNQKCGGLXFG-MGPQQGTHSA-N -1 3 388.432 -1.352 20 0 GAADHM CCN1CCOC[C@H]1C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001578227902 1075408906 /nfs/dbraw/zinc/40/89/06/1075408906.db2.gz ZPLLNQKCGGLXFG-RDBSUJKOSA-N -1 3 388.432 -1.352 20 0 GAADHM CCN1CCOC[C@H]1C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001578227902 1075408900 /nfs/dbraw/zinc/40/89/00/1075408900.db2.gz ZPLLNQKCGGLXFG-RDBSUJKOSA-N -1 3 388.432 -1.352 20 0 GAADHM CCNC(=O)CC(=O)NC[C@@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001578228132 1075408864 /nfs/dbraw/zinc/40/88/64/1075408864.db2.gz ACKLMGRSGHEUGW-INIZCTEOSA-N -1 3 390.404 -1.586 20 0 GAADHM CCNC(=O)CC(=O)NC[C@@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001578228132 1075408861 /nfs/dbraw/zinc/40/88/61/1075408861.db2.gz ACKLMGRSGHEUGW-INIZCTEOSA-N -1 3 390.404 -1.586 20 0 GAADHM CCNC(=O)CC(=O)NC[C@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001578228133 1075408854 /nfs/dbraw/zinc/40/88/54/1075408854.db2.gz ACKLMGRSGHEUGW-MRXNPFEDSA-N -1 3 390.404 -1.586 20 0 GAADHM CCNC(=O)CC(=O)NC[C@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001578228133 1075408850 /nfs/dbraw/zinc/40/88/50/1075408850.db2.gz ACKLMGRSGHEUGW-MRXNPFEDSA-N -1 3 390.404 -1.586 20 0 GAADHM CCNC(=O)CC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1OC ZINC001578228194 1075408999 /nfs/dbraw/zinc/40/89/99/1075408999.db2.gz BYJNUOKOBJKLFC-VXGBXAGGSA-N -1 3 390.404 -1.323 20 0 GAADHM CCNC(=O)CC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1OC ZINC001578228194 1075408997 /nfs/dbraw/zinc/40/89/97/1075408997.db2.gz BYJNUOKOBJKLFC-VXGBXAGGSA-N -1 3 390.404 -1.323 20 0 GAADHM CCNC(=O)CC(=O)NC[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCO1 ZINC001578228356 1075408790 /nfs/dbraw/zinc/40/87/90/1075408790.db2.gz HINZHHQOGURBHS-LLVKDONJSA-N -1 3 390.404 -1.322 20 0 GAADHM CCNC(=O)CC(=O)NC[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCO1 ZINC001578228356 1075408787 /nfs/dbraw/zinc/40/87/87/1075408787.db2.gz HINZHHQOGURBHS-LLVKDONJSA-N -1 3 390.404 -1.322 20 0 GAADHM CCNC(=O)CC(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCO1 ZINC001578228357 1075408988 /nfs/dbraw/zinc/40/89/88/1075408988.db2.gz HINZHHQOGURBHS-NSHDSACASA-N -1 3 390.404 -1.322 20 0 GAADHM CCNC(=O)CC(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCO1 ZINC001578228357 1075408980 /nfs/dbraw/zinc/40/89/80/1075408980.db2.gz HINZHHQOGURBHS-NSHDSACASA-N -1 3 390.404 -1.322 20 0 GAADHM CCNC(=O)CC(=O)N(CCO)CCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001578228387 1075408810 /nfs/dbraw/zinc/40/88/10/1075408810.db2.gz IKZOMIZXUYSWHI-UHFFFAOYSA-N -1 3 378.393 -1.728 20 0 GAADHM CCNC(=O)CC(=O)N(CCO)CCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001578228387 1075408806 /nfs/dbraw/zinc/40/88/06/1075408806.db2.gz IKZOMIZXUYSWHI-UHFFFAOYSA-N -1 3 378.393 -1.728 20 0 GAADHM CCNC(=O)CC(=O)NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001578228928 1075409029 /nfs/dbraw/zinc/40/90/29/1075409029.db2.gz SUTVLXZFDYQHJT-INIZCTEOSA-N -1 3 390.404 -1.586 20 0 GAADHM CCNC(=O)CC(=O)NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001578228928 1075409026 /nfs/dbraw/zinc/40/90/26/1075409026.db2.gz SUTVLXZFDYQHJT-INIZCTEOSA-N -1 3 390.404 -1.586 20 0 GAADHM CCNC(=O)CC(=O)NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001578228929 1075408829 /nfs/dbraw/zinc/40/88/29/1075408829.db2.gz SUTVLXZFDYQHJT-MRXNPFEDSA-N -1 3 390.404 -1.586 20 0 GAADHM CCNC(=O)CC(=O)NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001578228929 1075408824 /nfs/dbraw/zinc/40/88/24/1075408824.db2.gz SUTVLXZFDYQHJT-MRXNPFEDSA-N -1 3 390.404 -1.586 20 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1075423703 /nfs/dbraw/zinc/42/37/03/1075423703.db2.gz ZESJYVFTHBNHQI-UHFFFAOYSA-N -1 3 382.406 -1.925 20 0 GAADHM CCS(=O)(=O)NCC(=O)N[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001578415230 1075424269 /nfs/dbraw/zinc/42/42/69/1075424269.db2.gz CLUDGOWLWWOFJG-JTQLQIEISA-N -1 3 380.434 -1.104 20 0 GAADHM CCS(=O)(=O)NCC(=O)N[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001578415230 1075424265 /nfs/dbraw/zinc/42/42/65/1075424265.db2.gz CLUDGOWLWWOFJG-JTQLQIEISA-N -1 3 380.434 -1.104 20 0 GAADHM CCS(=O)(=O)NCC(=O)N[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001578415231 1075424167 /nfs/dbraw/zinc/42/41/67/1075424167.db2.gz CLUDGOWLWWOFJG-SNVBAGLBSA-N -1 3 380.434 -1.104 20 0 GAADHM CCS(=O)(=O)NCC(=O)N[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001578415231 1075424164 /nfs/dbraw/zinc/42/41/64/1075424164.db2.gz CLUDGOWLWWOFJG-SNVBAGLBSA-N -1 3 380.434 -1.104 20 0 GAADHM CCS(=O)(=O)NCCN1CC[C@@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001578415279 1075424629 /nfs/dbraw/zinc/42/46/29/1075424629.db2.gz 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ZINC001578464789 1075428464 /nfs/dbraw/zinc/42/84/64/1075428464.db2.gz WJLFDCYRXPDSBC-KPXOXKRLSA-N -1 3 387.404 -1.015 20 0 GAADHM CC[C@@H]1[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCN1C(=O)[C@H]1CNC(=O)N1 ZINC001578464791 1075428303 /nfs/dbraw/zinc/42/83/03/1075428303.db2.gz WJLFDCYRXPDSBC-XXILOJSOSA-N -1 3 387.404 -1.015 20 0 GAADHM CC[C@@H]1[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCN1C(=O)[C@H]1CNC(=O)N1 ZINC001578464791 1075428302 /nfs/dbraw/zinc/42/83/02/1075428302.db2.gz WJLFDCYRXPDSBC-XXILOJSOSA-N -1 3 387.404 -1.015 20 0 GAADHM CCc1c[nH]c(CC(=O)N[C@@H]2CN(c3cnc(-c4nnn[n-]4)cn3)C[C@H]2O)n1 ZINC001578555445 1075430345 /nfs/dbraw/zinc/43/03/45/1075430345.db2.gz VKGBBJHHTIMQCB-VXGBXAGGSA-N -1 3 384.404 -1.149 20 0 GAADHM CCc1nc(-c2nnn[n-]2)cc(N(C)C[C@@H](O)CN(C)C(=O)c2nc[nH]n2)n1 ZINC001578564709 1075430248 /nfs/dbraw/zinc/43/02/48/1075430248.db2.gz FTZUFXPONKGQSO-SECBINFHSA-N -1 3 387.408 -1.094 20 0 GAADHM CCc1nc(-c2nnn[n-]2)cc(N(C)C[C@H](O)CN(C)C(=O)c2nc[nH]n2)n1 ZINC001578564710 1075430373 /nfs/dbraw/zinc/43/03/73/1075430373.db2.gz FTZUFXPONKGQSO-VIFPVBQESA-N -1 3 387.408 -1.094 20 0 GAADHM CCc1nc(-c2nnn[n-]2)cc(N(C)C[C@@H](O)CN(C)C(=O)c2cn[nH]n2)n1 ZINC001578565798 1075430224 /nfs/dbraw/zinc/43/02/24/1075430224.db2.gz NNQSKFJMJUEQRE-SECBINFHSA-N -1 3 387.408 -1.094 20 0 GAADHM CCc1nc(-c2nnn[n-]2)cc(N(C)C[C@H](O)CN(C)C(=O)c2cn[nH]n2)n1 ZINC001578565803 1075430237 /nfs/dbraw/zinc/43/02/37/1075430237.db2.gz NNQSKFJMJUEQRE-VIFPVBQESA-N -1 3 387.408 -1.094 20 0 GAADHM CCc1nc(-c2nn[n-]n2)cc(N2C[C@@H](O)[C@H](NC(=O)Cc3c[nH]cn3)C2)n1 ZINC001578596910 1075432541 /nfs/dbraw/zinc/43/25/41/1075432541.db2.gz GRUMEBUNLABUDU-VXGBXAGGSA-N -1 3 384.404 -1.149 20 0 GAADHM CCc1nc(-c2nnn[n-]2)cc(N2C[C@@H](O)[C@H](NC(=O)Cc3c[nH]cn3)C2)n1 ZINC001578596910 1075432536 /nfs/dbraw/zinc/43/25/36/1075432536.db2.gz GRUMEBUNLABUDU-VXGBXAGGSA-N -1 3 384.404 -1.149 20 0 GAADHM CCc1nc(-c2nn[n-]n2)cc(N2C[C@@H](NC(=O)Cc3c[nH]cn3)[C@@H](O)C2)n1 ZINC001578597564 1075433570 /nfs/dbraw/zinc/43/35/70/1075433570.db2.gz GRUMEBUNLABUDU-NEPJUHHUSA-N -1 3 384.404 -1.149 20 0 GAADHM CCc1nc(-c2nnn[n-]2)cc(N2C[C@@H](NC(=O)Cc3c[nH]cn3)[C@@H](O)C2)n1 ZINC001578597564 1075433562 /nfs/dbraw/zinc/43/35/62/1075433562.db2.gz GRUMEBUNLABUDU-NEPJUHHUSA-N -1 3 384.404 -1.149 20 0 GAADHM CCc1nc(-c2nnn[n-]2)cc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCCN3C)C2)n1 ZINC001578597762 1075433553 /nfs/dbraw/zinc/43/35/53/1075433553.db2.gz WTHDMXIXUXZHJK-FRRDWIJNSA-N -1 3 387.448 -1.021 20 0 GAADHM CCc1nc(-c2nnn[n-]2)cc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCCN3C)C2)n1 ZINC001578597768 1075434099 /nfs/dbraw/zinc/43/40/99/1075434099.db2.gz WTHDMXIXUXZHJK-JHJVBQTASA-N -1 3 387.448 -1.021 20 0 GAADHM CCc1nc(-c2nnn[n-]2)cc(N2C[C@@H](O)[C@H](NC(=O)CN3CCCC3)C2)n1 ZINC001578598083 1075434177 /nfs/dbraw/zinc/43/41/77/1075434177.db2.gz ZTMXXTGCUPKLIK-CHWSQXEVSA-N -1 3 387.448 -1.019 20 0 GAADHM CCc1nc(-c2nnn[n-]2)cc(N2C[C@@H](NC(=O)Cn3ccnc3)[C@@H](O)C2)n1 ZINC001578598242 1075434020 /nfs/dbraw/zinc/43/40/20/1075434020.db2.gz PFITVNRIQKCTGJ-NEPJUHHUSA-N -1 3 384.404 -1.219 20 0 GAADHM CCc1nc(-c2nnn[n-]2)cc(N2C[C@@H](NC(=O)[C@@H]3CCCN3C)[C@@H](O)C2)n1 ZINC001578598596 1075434043 /nfs/dbraw/zinc/43/40/43/1075434043.db2.gz WTHDMXIXUXZHJK-AGIUHOORSA-N -1 3 387.448 -1.021 20 0 GAADHM CCc1nc(-c2nnn[n-]2)cc(N2C[C@@H](NC(=O)[C@H]3CCCN3C)[C@@H](O)C2)n1 ZINC001578598597 1075434237 /nfs/dbraw/zinc/43/42/37/1075434237.db2.gz WTHDMXIXUXZHJK-UPJWGTAASA-N -1 3 387.448 -1.021 20 0 GAADHM CCc1nc(N[C@H](CO)CNC(=O)[C@H]2CN(C)CCO2)cc(-c2nn[n-]n2)n1 ZINC001578633764 1075434692 /nfs/dbraw/zinc/43/46/92/1075434692.db2.gz NKOJEHXZJLCOJG-CMPLNLGQSA-N -1 3 391.436 -1.561 20 0 GAADHM CCc1nc(N[C@H](CO)CNC(=O)[C@H]2CN(C)CCO2)cc(-c2nnn[n-]2)n1 ZINC001578633764 1075434689 /nfs/dbraw/zinc/43/46/89/1075434689.db2.gz NKOJEHXZJLCOJG-CMPLNLGQSA-N -1 3 391.436 -1.561 20 0 GAADHM CCc1nc(N[C@H](CO)CNC(=O)[C@@H]2CN(C)CCO2)cc(-c2nn[n-]n2)n1 ZINC001578633765 1075435275 /nfs/dbraw/zinc/43/52/75/1075435275.db2.gz NKOJEHXZJLCOJG-JQWIXIFHSA-N -1 3 391.436 -1.561 20 0 GAADHM CCc1nc(N[C@H](CO)CNC(=O)[C@@H]2CN(C)CCO2)cc(-c2nnn[n-]2)n1 ZINC001578633765 1075435270 /nfs/dbraw/zinc/43/52/70/1075435270.db2.gz NKOJEHXZJLCOJG-JQWIXIFHSA-N -1 3 391.436 -1.561 20 0 GAADHM CCc1nc(N[C@@H](CO)CNC(=O)[C@@H]2CN(C)CCO2)cc(-c2nn[n-]n2)n1 ZINC001578633766 1075435085 /nfs/dbraw/zinc/43/50/85/1075435085.db2.gz NKOJEHXZJLCOJG-PWSUYJOCSA-N -1 3 391.436 -1.561 20 0 GAADHM CCc1nc(N[C@@H](CO)CNC(=O)[C@@H]2CN(C)CCO2)cc(-c2nnn[n-]2)n1 ZINC001578633766 1075435080 /nfs/dbraw/zinc/43/50/80/1075435080.db2.gz NKOJEHXZJLCOJG-PWSUYJOCSA-N -1 3 391.436 -1.561 20 0 GAADHM CCc1nc(N[C@@H](CO)CNC(=O)[C@H]2CN(C)CCO2)cc(-c2nn[n-]n2)n1 ZINC001578633768 1075435339 /nfs/dbraw/zinc/43/53/39/1075435339.db2.gz NKOJEHXZJLCOJG-ZYHUDNBSSA-N -1 3 391.436 -1.561 20 0 GAADHM CCc1nc(N[C@@H](CO)CNC(=O)[C@H]2CN(C)CCO2)cc(-c2nnn[n-]2)n1 ZINC001578633768 1075435334 /nfs/dbraw/zinc/43/53/34/1075435334.db2.gz NKOJEHXZJLCOJG-ZYHUDNBSSA-N -1 3 391.436 -1.561 20 0 GAADHM CCn1cc(C(=O)N(C)C[C@@H](O)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)nn1 ZINC001578736164 1075438081 /nfs/dbraw/zinc/43/80/81/1075438081.db2.gz ABVRFKLNEPCMPX-JTQLQIEISA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1cc(C(=O)N(C)C[C@@H](O)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)nn1 ZINC001578736164 1075438078 /nfs/dbraw/zinc/43/80/78/1075438078.db2.gz ABVRFKLNEPCMPX-JTQLQIEISA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1cc(C(=O)N(C)C[C@H](O)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)nn1 ZINC001578736166 1075437976 /nfs/dbraw/zinc/43/79/76/1075437976.db2.gz ABVRFKLNEPCMPX-SNVBAGLBSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1cc(C(=O)N(C)C[C@H](O)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)nn1 ZINC001578736166 1075437974 /nfs/dbraw/zinc/43/79/74/1075437974.db2.gz ABVRFKLNEPCMPX-SNVBAGLBSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1cc(C(=O)N(C)C[C@H](O)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)nn1 ZINC001578736451 1075437965 /nfs/dbraw/zinc/43/79/65/1075437965.db2.gz DXYLCUAKGOBIOP-SECBINFHSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1cc(C(=O)N(C)C[C@H](O)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)nn1 ZINC001578736451 1075437960 /nfs/dbraw/zinc/43/79/60/1075437960.db2.gz DXYLCUAKGOBIOP-SECBINFHSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1cc(C(=O)N(C)C[C@@H](O)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)nn1 ZINC001578736452 1075437903 /nfs/dbraw/zinc/43/79/03/1075437903.db2.gz DXYLCUAKGOBIOP-VIFPVBQESA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1cc(C(=O)N(C)C[C@@H](O)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)nn1 ZINC001578736452 1075437898 /nfs/dbraw/zinc/43/78/98/1075437898.db2.gz DXYLCUAKGOBIOP-VIFPVBQESA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1cc(C(=O)N(CCO)CCNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)nn1 ZINC001578738938 1075438421 /nfs/dbraw/zinc/43/84/21/1075438421.db2.gz HWIJZWMVBBKKIB-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1cc(C(=O)N(CCO)CCNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)nn1 ZINC001578738938 1075438418 /nfs/dbraw/zinc/43/84/18/1075438418.db2.gz HWIJZWMVBBKKIB-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1cc(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)nn1 ZINC001578739152 1075438401 /nfs/dbraw/zinc/43/84/01/1075438401.db2.gz OPVYLNHYHZIIDG-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1cc(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)nn1 ZINC001578739152 1075438399 /nfs/dbraw/zinc/43/83/99/1075438399.db2.gz OPVYLNHYHZIIDG-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1cc(C(=O)N(CCO)CCNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)nn1 ZINC001578739214 1075438446 /nfs/dbraw/zinc/43/84/46/1075438446.db2.gz QBPYBCYXVFPSQC-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1cc(C(=O)N(CCO)CCNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)nn1 ZINC001578739214 1075438445 /nfs/dbraw/zinc/43/84/45/1075438445.db2.gz QBPYBCYXVFPSQC-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1cc(C(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)nn1 ZINC001578739278 1075438464 /nfs/dbraw/zinc/43/84/64/1075438464.db2.gz SHQZAAUAQWLXQY-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1cc(C(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)nn1 ZINC001578739278 1075438462 /nfs/dbraw/zinc/43/84/62/1075438462.db2.gz SHQZAAUAQWLXQY-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1cc(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)nn1 ZINC001578739284 1075438452 /nfs/dbraw/zinc/43/84/52/1075438452.db2.gz SILSZMCKGZMRFS-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1cc(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)nn1 ZINC001578739284 1075438450 /nfs/dbraw/zinc/43/84/50/1075438450.db2.gz SILSZMCKGZMRFS-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1cc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)nn1 ZINC001578740072 1075438485 /nfs/dbraw/zinc/43/84/85/1075438485.db2.gz LNVBMDBQBKBSMW-PWSUYJOCSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1cc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)nn1 ZINC001578740072 1075438483 /nfs/dbraw/zinc/43/84/83/1075438483.db2.gz LNVBMDBQBKBSMW-PWSUYJOCSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)nn1 ZINC001578740073 1075438490 /nfs/dbraw/zinc/43/84/90/1075438490.db2.gz LNVBMDBQBKBSMW-ZYHUDNBSSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)nn1 ZINC001578740073 1075438489 /nfs/dbraw/zinc/43/84/89/1075438489.db2.gz LNVBMDBQBKBSMW-ZYHUDNBSSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1cc(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)nn1 ZINC001578740571 1075438473 /nfs/dbraw/zinc/43/84/73/1075438473.db2.gz WMKGCNVYTVDUMZ-PWSUYJOCSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1cc(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)nn1 ZINC001578740571 1075438472 /nfs/dbraw/zinc/43/84/72/1075438472.db2.gz WMKGCNVYTVDUMZ-PWSUYJOCSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1cc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)nn1 ZINC001578740594 1075438442 /nfs/dbraw/zinc/43/84/42/1075438442.db2.gz XVJXONMRIXZTOM-PWSUYJOCSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1cc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)nn1 ZINC001578740594 1075438438 /nfs/dbraw/zinc/43/84/38/1075438438.db2.gz XVJXONMRIXZTOM-PWSUYJOCSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1cc(C(=O)NC[C@H](O)CN(C)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)nn1 ZINC001578747163 1075438960 /nfs/dbraw/zinc/43/89/60/1075438960.db2.gz AMFQBEVYIAPJNG-JTQLQIEISA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1cc(C(=O)NC[C@H](O)CN(C)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)nn1 ZINC001578747163 1075438958 /nfs/dbraw/zinc/43/89/58/1075438958.db2.gz AMFQBEVYIAPJNG-JTQLQIEISA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1cc(C(=O)NC[C@@H](O)CN(C)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)nn1 ZINC001578747164 1075438976 /nfs/dbraw/zinc/43/89/76/1075438976.db2.gz AMFQBEVYIAPJNG-SNVBAGLBSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1cc(C(=O)NC[C@@H](O)CN(C)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)nn1 ZINC001578747164 1075438974 /nfs/dbraw/zinc/43/89/74/1075438974.db2.gz AMFQBEVYIAPJNG-SNVBAGLBSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1cc(C(=O)NCC2(O)CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)nn1 ZINC001578747266 1075439252 /nfs/dbraw/zinc/43/92/52/1075439252.db2.gz DPHQALHIZJVPOW-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1cc(C(=O)NCC2(O)CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)nn1 ZINC001578747266 1075439248 /nfs/dbraw/zinc/43/92/48/1075439248.db2.gz DPHQALHIZJVPOW-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1cc(C(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)nn1 ZINC001578747349 1075439447 /nfs/dbraw/zinc/43/94/47/1075439447.db2.gz HCMJHGUSGOJQHS-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1cc(C(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)nn1 ZINC001578747349 1075439444 /nfs/dbraw/zinc/43/94/44/1075439444.db2.gz HCMJHGUSGOJQHS-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1cc(C(=O)NC[C@@H](O)CN(C)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)nn1 ZINC001578747756 1075439302 /nfs/dbraw/zinc/43/93/02/1075439302.db2.gz PRDRTWVQWFXOET-SECBINFHSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1cc(C(=O)NC[C@@H](O)CN(C)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)nn1 ZINC001578747756 1075439300 /nfs/dbraw/zinc/43/93/00/1075439300.db2.gz PRDRTWVQWFXOET-SECBINFHSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1cc(C(=O)NC[C@H](O)CN(C)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)nn1 ZINC001578747757 1075439293 /nfs/dbraw/zinc/43/92/93/1075439293.db2.gz PRDRTWVQWFXOET-VIFPVBQESA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1cc(C(=O)NC[C@H](O)CN(C)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)nn1 ZINC001578747757 1075439292 /nfs/dbraw/zinc/43/92/92/1075439292.db2.gz PRDRTWVQWFXOET-VIFPVBQESA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1cc(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)nn1 ZINC001578748365 1075439321 /nfs/dbraw/zinc/43/93/21/1075439321.db2.gz WTUZRCIQMNEHLY-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1cc(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)nn1 ZINC001578748365 1075439317 /nfs/dbraw/zinc/43/93/17/1075439317.db2.gz WTUZRCIQMNEHLY-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1cc(C(=O)NCCN(CCO)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)nn1 ZINC001578749369 1075439280 /nfs/dbraw/zinc/43/92/80/1075439280.db2.gz HBEKKFFCUUPMIF-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1cc(C(=O)NCCN(CCO)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)nn1 ZINC001578749369 1075439275 /nfs/dbraw/zinc/43/92/75/1075439275.db2.gz HBEKKFFCUUPMIF-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1cc(C(=O)NCCN(CCO)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)nn1 ZINC001578750254 1075439973 /nfs/dbraw/zinc/43/99/73/1075439973.db2.gz PELVGJBWFLBAKD-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1cc(C(=O)NCCN(CCO)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)nn1 ZINC001578750254 1075439971 /nfs/dbraw/zinc/43/99/71/1075439971.db2.gz PELVGJBWFLBAKD-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1cc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)nn1 ZINC001578750837 1075439833 /nfs/dbraw/zinc/43/98/33/1075439833.db2.gz NBOZZWXANHBAIL-PWSUYJOCSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1cc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)nn1 ZINC001578750837 1075439829 /nfs/dbraw/zinc/43/98/29/1075439829.db2.gz NBOZZWXANHBAIL-PWSUYJOCSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1cc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)nn1 ZINC001578750838 1075439963 /nfs/dbraw/zinc/43/99/63/1075439963.db2.gz NBOZZWXANHBAIL-ZYHUDNBSSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1cc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)nn1 ZINC001578750838 1075439961 /nfs/dbraw/zinc/43/99/61/1075439961.db2.gz NBOZZWXANHBAIL-ZYHUDNBSSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1cc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)nn1 ZINC001578750921 1075439878 /nfs/dbraw/zinc/43/98/78/1075439878.db2.gz SWVZTYLXOUKSJI-PWSUYJOCSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1cc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)nn1 ZINC001578750921 1075439871 /nfs/dbraw/zinc/43/98/71/1075439871.db2.gz SWVZTYLXOUKSJI-PWSUYJOCSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1cc(C(=O)N[C@@H]2CN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]2O)nn1 ZINC001578751904 1075439766 /nfs/dbraw/zinc/43/97/66/1075439766.db2.gz JOVQLQFCAQQYBG-ZYHUDNBSSA-N -1 3 388.367 -1.008 20 0 GAADHM CCn1cc(C(=O)N[C@@H]2CN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]2O)nn1 ZINC001578751904 1075439764 /nfs/dbraw/zinc/43/97/64/1075439764.db2.gz JOVQLQFCAQQYBG-ZYHUDNBSSA-N -1 3 388.367 -1.008 20 0 GAADHM CCn1cc(CC(=O)NC[C@@H](O)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)cn1 ZINC001578756089 1075440474 /nfs/dbraw/zinc/44/04/74/1075440474.db2.gz HDIFWJBESPHQJI-LLVKDONJSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1cc(CC(=O)NC[C@@H](O)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cn1 ZINC001578756089 1075440473 /nfs/dbraw/zinc/44/04/73/1075440473.db2.gz HDIFWJBESPHQJI-LLVKDONJSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1cc(CC(=O)NC[C@H](O)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)cn1 ZINC001578756094 1075440306 /nfs/dbraw/zinc/44/03/06/1075440306.db2.gz HDIFWJBESPHQJI-NSHDSACASA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1cc(CC(=O)NC[C@H](O)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cn1 ZINC001578756094 1075440295 /nfs/dbraw/zinc/44/02/95/1075440295.db2.gz HDIFWJBESPHQJI-NSHDSACASA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1cc(CC(=O)NC[C@H](CO)NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)cn1 ZINC001578756402 1075440515 /nfs/dbraw/zinc/44/05/15/1075440515.db2.gz INJFMYFJGGVQGG-GFCCVEGCSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1cc(CC(=O)NC[C@H](CO)NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)cn1 ZINC001578756402 1075440514 /nfs/dbraw/zinc/44/05/14/1075440514.db2.gz INJFMYFJGGVQGG-GFCCVEGCSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1cc(CC(=O)NC[C@@H](CO)NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)cn1 ZINC001578756403 1075440507 /nfs/dbraw/zinc/44/05/07/1075440507.db2.gz INJFMYFJGGVQGG-LBPRGKRZSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1cc(CC(=O)NC[C@@H](CO)NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)cn1 ZINC001578756403 1075440506 /nfs/dbraw/zinc/44/05/06/1075440506.db2.gz INJFMYFJGGVQGG-LBPRGKRZSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1cc(CC(=O)NC[C@@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)cn1 ZINC001578757259 1075440450 /nfs/dbraw/zinc/44/04/50/1075440450.db2.gz PQZIEOBPLTULKG-GFCCVEGCSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1cc(CC(=O)NC[C@@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cn1 ZINC001578757259 1075440448 /nfs/dbraw/zinc/44/04/48/1075440448.db2.gz PQZIEOBPLTULKG-GFCCVEGCSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1cc(CC(=O)NC[C@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)cn1 ZINC001578757260 1075440493 /nfs/dbraw/zinc/44/04/93/1075440493.db2.gz PQZIEOBPLTULKG-LBPRGKRZSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1cc(CC(=O)NC[C@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cn1 ZINC001578757260 1075440490 /nfs/dbraw/zinc/44/04/90/1075440490.db2.gz PQZIEOBPLTULKG-LBPRGKRZSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1cc(CC(=O)N[C@@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)cn1 ZINC001578757269 1075440422 /nfs/dbraw/zinc/44/04/22/1075440422.db2.gz PRRVDWHBRBUVPY-GFCCVEGCSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1cc(CC(=O)N[C@@H](CO)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cn1 ZINC001578757269 1075440418 /nfs/dbraw/zinc/44/04/18/1075440418.db2.gz PRRVDWHBRBUVPY-GFCCVEGCSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1cc(CC(=O)N[C@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)cn1 ZINC001578757271 1075440335 /nfs/dbraw/zinc/44/03/35/1075440335.db2.gz PRRVDWHBRBUVPY-LBPRGKRZSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1cc(CC(=O)N[C@H](CO)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cn1 ZINC001578757271 1075440326 /nfs/dbraw/zinc/44/03/26/1075440326.db2.gz PRRVDWHBRBUVPY-LBPRGKRZSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1cc(CC(=O)NC[C@H](CO)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)cn1 ZINC001578757745 1075440512 /nfs/dbraw/zinc/44/05/12/1075440512.db2.gz SFPVONDYJRIVGR-LLVKDONJSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1cc(CC(=O)NC[C@H](CO)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cn1 ZINC001578757745 1075440511 /nfs/dbraw/zinc/44/05/11/1075440511.db2.gz SFPVONDYJRIVGR-LLVKDONJSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1cc(CC(=O)NC[C@@H](CO)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)cn1 ZINC001578757746 1075440503 /nfs/dbraw/zinc/44/05/03/1075440503.db2.gz SFPVONDYJRIVGR-NSHDSACASA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1cc(CC(=O)NC[C@@H](CO)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cn1 ZINC001578757746 1075440502 /nfs/dbraw/zinc/44/05/02/1075440502.db2.gz SFPVONDYJRIVGR-NSHDSACASA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)n1 ZINC001578772558 1075440914 /nfs/dbraw/zinc/44/09/14/1075440914.db2.gz XDJDGNCHVWEDJA-KGLIPLIRSA-N -1 3 399.415 -1.045 20 0 GAADHM CCn1ccc(CC(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)n1 ZINC001578772558 1075440909 /nfs/dbraw/zinc/44/09/09/1075440909.db2.gz XDJDGNCHVWEDJA-KGLIPLIRSA-N -1 3 399.415 -1.045 20 0 GAADHM CCn1ccc(CC(=O)N[C@@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001578772618 1075440932 /nfs/dbraw/zinc/44/09/32/1075440932.db2.gz ACWYVMBFYFAZLY-GFCCVEGCSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)N[C@@H](CO)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001578772618 1075440928 /nfs/dbraw/zinc/44/09/28/1075440928.db2.gz ACWYVMBFYFAZLY-GFCCVEGCSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)N[C@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001578772619 1075440994 /nfs/dbraw/zinc/44/09/94/1075440994.db2.gz ACWYVMBFYFAZLY-LBPRGKRZSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)N[C@H](CO)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001578772619 1075440988 /nfs/dbraw/zinc/44/09/88/1075440988.db2.gz ACWYVMBFYFAZLY-LBPRGKRZSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001578772745 1075440863 /nfs/dbraw/zinc/44/08/63/1075440863.db2.gz DLMIBXBRMJZHLJ-GFCCVEGCSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001578772745 1075440856 /nfs/dbraw/zinc/44/08/56/1075440856.db2.gz DLMIBXBRMJZHLJ-GFCCVEGCSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001578772746 1075440847 /nfs/dbraw/zinc/44/08/47/1075440847.db2.gz DLMIBXBRMJZHLJ-LBPRGKRZSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001578772746 1075440841 /nfs/dbraw/zinc/44/08/41/1075440841.db2.gz DLMIBXBRMJZHLJ-LBPRGKRZSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@H](CO)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001578772926 1075440893 /nfs/dbraw/zinc/44/08/93/1075440893.db2.gz GRMHKDLATSFFMP-LLVKDONJSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@H](CO)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001578772926 1075440889 /nfs/dbraw/zinc/44/08/89/1075440889.db2.gz GRMHKDLATSFFMP-LLVKDONJSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@@H](CO)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001578772927 1075440820 /nfs/dbraw/zinc/44/08/20/1075440820.db2.gz GRMHKDLATSFFMP-NSHDSACASA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@@H](CO)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001578772927 1075440815 /nfs/dbraw/zinc/44/08/15/1075440815.db2.gz GRMHKDLATSFFMP-NSHDSACASA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@@H](O)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001578773087 1075440806 /nfs/dbraw/zinc/44/08/06/1075440806.db2.gz LBXGUHUIWQIQHV-GFCCVEGCSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@@H](O)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001578773087 1075440801 /nfs/dbraw/zinc/44/08/01/1075440801.db2.gz LBXGUHUIWQIQHV-GFCCVEGCSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@H](O)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001578773088 1075440954 /nfs/dbraw/zinc/44/09/54/1075440954.db2.gz LBXGUHUIWQIQHV-LBPRGKRZSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@H](O)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001578773088 1075440949 /nfs/dbraw/zinc/44/09/49/1075440949.db2.gz LBXGUHUIWQIQHV-LBPRGKRZSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)N[C@@H](CO)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001578773316 1075440787 /nfs/dbraw/zinc/44/07/87/1075440787.db2.gz RZGUYDKCJMDVIJ-LLVKDONJSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)N[C@@H](CO)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001578773316 1075440783 /nfs/dbraw/zinc/44/07/83/1075440783.db2.gz RZGUYDKCJMDVIJ-LLVKDONJSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)N[C@H](CO)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001578773317 1075440978 /nfs/dbraw/zinc/44/09/78/1075440978.db2.gz RZGUYDKCJMDVIJ-NSHDSACASA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)N[C@H](CO)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001578773317 1075440975 /nfs/dbraw/zinc/44/09/75/1075440975.db2.gz RZGUYDKCJMDVIJ-NSHDSACASA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)N[C@@H](CO)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001578773427 1075440710 /nfs/dbraw/zinc/44/07/10/1075440710.db2.gz VFDATOXOTDOIKD-GFCCVEGCSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)N[C@@H](CO)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001578773427 1075440706 /nfs/dbraw/zinc/44/07/06/1075440706.db2.gz VFDATOXOTDOIKD-GFCCVEGCSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)N[C@H](CO)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001578773428 1075440833 /nfs/dbraw/zinc/44/08/33/1075440833.db2.gz VFDATOXOTDOIKD-LBPRGKRZSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)N[C@H](CO)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001578773428 1075440830 /nfs/dbraw/zinc/44/08/30/1075440830.db2.gz VFDATOXOTDOIKD-LBPRGKRZSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@H](CO)NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001578773434 1075441321 /nfs/dbraw/zinc/44/13/21/1075441321.db2.gz VMGHDYWBXSEIFO-GFCCVEGCSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@H](CO)NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001578773434 1075441319 /nfs/dbraw/zinc/44/13/19/1075441319.db2.gz VMGHDYWBXSEIFO-GFCCVEGCSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@@H](CO)NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001578773435 1075441346 /nfs/dbraw/zinc/44/13/46/1075441346.db2.gz VMGHDYWBXSEIFO-LBPRGKRZSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@@H](CO)NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001578773435 1075441344 /nfs/dbraw/zinc/44/13/44/1075441344.db2.gz VMGHDYWBXSEIFO-LBPRGKRZSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@H](CO)NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001578773682 1075441375 /nfs/dbraw/zinc/44/13/75/1075441375.db2.gz YTQSOMWNSLIJFN-GFCCVEGCSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@H](CO)NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001578773682 1075441373 /nfs/dbraw/zinc/44/13/73/1075441373.db2.gz YTQSOMWNSLIJFN-GFCCVEGCSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@@H](CO)NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001578773683 1075441291 /nfs/dbraw/zinc/44/12/91/1075441291.db2.gz YTQSOMWNSLIJFN-LBPRGKRZSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ccc(CC(=O)NC[C@@H](CO)NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001578773683 1075441288 /nfs/dbraw/zinc/44/12/88/1075441288.db2.gz YTQSOMWNSLIJFN-LBPRGKRZSA-N -1 3 387.404 -1.139 20 0 GAADHM CCn1ncc(C(=O)N(C)C[C@@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001578811760 1075441921 /nfs/dbraw/zinc/44/19/21/1075441921.db2.gz FTDHESIARKOJPD-JTQLQIEISA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1ncc(C(=O)N(C)C[C@@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001578811760 1075441919 /nfs/dbraw/zinc/44/19/19/1075441919.db2.gz FTDHESIARKOJPD-JTQLQIEISA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1ncc(C(=O)N(C)C[C@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001578811761 1075441818 /nfs/dbraw/zinc/44/18/18/1075441818.db2.gz FTDHESIARKOJPD-SNVBAGLBSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1ncc(C(=O)N(C)C[C@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001578811761 1075441814 /nfs/dbraw/zinc/44/18/14/1075441814.db2.gz FTDHESIARKOJPD-SNVBAGLBSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1ncc(C(=O)N(C)C[C@H](O)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001578811943 1075441868 /nfs/dbraw/zinc/44/18/68/1075441868.db2.gz HQRYHLBLRGIURM-SECBINFHSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1ncc(C(=O)N(C)C[C@H](O)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001578811943 1075441865 /nfs/dbraw/zinc/44/18/65/1075441865.db2.gz HQRYHLBLRGIURM-SECBINFHSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1ncc(C(=O)N(C)C[C@@H](O)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001578811945 1075441960 /nfs/dbraw/zinc/44/19/60/1075441960.db2.gz HQRYHLBLRGIURM-VIFPVBQESA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1ncc(C(=O)N(C)C[C@@H](O)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001578811945 1075441956 /nfs/dbraw/zinc/44/19/56/1075441956.db2.gz HQRYHLBLRGIURM-VIFPVBQESA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1ncc(C(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001578812021 1075441916 /nfs/dbraw/zinc/44/19/16/1075441916.db2.gz JCQLIHBFQPPXNJ-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1ncc(C(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001578812021 1075441913 /nfs/dbraw/zinc/44/19/13/1075441913.db2.gz JCQLIHBFQPPXNJ-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1ncc(C(=O)N(CCO)CCNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001578812296 1075441951 /nfs/dbraw/zinc/44/19/51/1075441951.db2.gz MNHBFZCLGBKJQF-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1ncc(C(=O)N(CCO)CCNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001578812296 1075441947 /nfs/dbraw/zinc/44/19/47/1075441947.db2.gz MNHBFZCLGBKJQF-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1ncc(C(=O)N(CCO)CCNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001578812442 1075441838 /nfs/dbraw/zinc/44/18/38/1075441838.db2.gz NUMLOAFSFZPPHR-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1ncc(C(=O)N(CCO)CCNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001578812442 1075441836 /nfs/dbraw/zinc/44/18/36/1075441836.db2.gz NUMLOAFSFZPPHR-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1ncc(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001578812463 1075441784 /nfs/dbraw/zinc/44/17/84/1075441784.db2.gz OEUOGESDGAKSIQ-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1ncc(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001578812463 1075441777 /nfs/dbraw/zinc/44/17/77/1075441777.db2.gz OEUOGESDGAKSIQ-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1ncc(C(=O)N(CCO)CCNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001578812656 1075441907 /nfs/dbraw/zinc/44/19/07/1075441907.db2.gz QXQCQRXCNQQGRW-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1ncc(C(=O)N(CCO)CCNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001578812656 1075441903 /nfs/dbraw/zinc/44/19/03/1075441903.db2.gz QXQCQRXCNQQGRW-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1ncc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001578814278 1075441894 /nfs/dbraw/zinc/44/18/94/1075441894.db2.gz CYTJLMRNEUZJMU-VXGBXAGGSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001578814278 1075441891 /nfs/dbraw/zinc/44/18/91/1075441891.db2.gz CYTJLMRNEUZJMU-VXGBXAGGSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001578814434 1075442440 /nfs/dbraw/zinc/44/24/40/1075442440.db2.gz KTESNDXDTFSUJY-VXGBXAGGSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001578814434 1075442438 /nfs/dbraw/zinc/44/24/38/1075442438.db2.gz KTESNDXDTFSUJY-VXGBXAGGSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001578814809 1075442278 /nfs/dbraw/zinc/44/22/78/1075442278.db2.gz USPQHRNKXMJBRH-VXGBXAGGSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001578814809 1075442275 /nfs/dbraw/zinc/44/22/75/1075442275.db2.gz USPQHRNKXMJBRH-VXGBXAGGSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)n1 ZINC001578815459 1075442257 /nfs/dbraw/zinc/44/22/57/1075442257.db2.gz CYTJLMRNEUZJMU-NEPJUHHUSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)n1 ZINC001578815459 1075442253 /nfs/dbraw/zinc/44/22/53/1075442253.db2.gz CYTJLMRNEUZJMU-NEPJUHHUSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)n1 ZINC001578816084 1075442324 /nfs/dbraw/zinc/44/23/24/1075442324.db2.gz KTESNDXDTFSUJY-NEPJUHHUSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)n1 ZINC001578816084 1075442321 /nfs/dbraw/zinc/44/23/21/1075442321.db2.gz KTESNDXDTFSUJY-NEPJUHHUSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)n1 ZINC001578816677 1075442841 /nfs/dbraw/zinc/44/28/41/1075442841.db2.gz USPQHRNKXMJBRH-NEPJUHHUSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)n1 ZINC001578816677 1075442839 /nfs/dbraw/zinc/44/28/39/1075442839.db2.gz USPQHRNKXMJBRH-NEPJUHHUSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)NC[C@H](O)CN(C)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001578817457 1075442793 /nfs/dbraw/zinc/44/27/93/1075442793.db2.gz JFROEDVFSYMYIG-JTQLQIEISA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1ncc(C(=O)NC[C@H](O)CN(C)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001578817457 1075442791 /nfs/dbraw/zinc/44/27/91/1075442791.db2.gz JFROEDVFSYMYIG-JTQLQIEISA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1ncc(C(=O)NC[C@@H](O)CN(C)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001578817458 1075442802 /nfs/dbraw/zinc/44/28/02/1075442802.db2.gz JFROEDVFSYMYIG-SNVBAGLBSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1ncc(C(=O)NC[C@@H](O)CN(C)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001578817458 1075442800 /nfs/dbraw/zinc/44/28/00/1075442800.db2.gz JFROEDVFSYMYIG-SNVBAGLBSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1ncc(C(=O)NC[C@H](O)CN(C)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001578817957 1075442870 /nfs/dbraw/zinc/44/28/70/1075442870.db2.gz MJFWPCFCFFJNBL-JTQLQIEISA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1ncc(C(=O)NC[C@H](O)CN(C)C(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001578817957 1075442869 /nfs/dbraw/zinc/44/28/69/1075442869.db2.gz MJFWPCFCFFJNBL-JTQLQIEISA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1ncc(C(=O)NC[C@@H](O)CN(C)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001578817958 1075442734 /nfs/dbraw/zinc/44/27/34/1075442734.db2.gz MJFWPCFCFFJNBL-SNVBAGLBSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1ncc(C(=O)NC[C@@H](O)CN(C)C(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001578817958 1075442729 /nfs/dbraw/zinc/44/27/29/1075442729.db2.gz MJFWPCFCFFJNBL-SNVBAGLBSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1ncc(C(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001578818187 1075443282 /nfs/dbraw/zinc/44/32/82/1075443282.db2.gz PLBOIZCDNKCISG-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1ncc(C(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001578818187 1075443280 /nfs/dbraw/zinc/44/32/80/1075443280.db2.gz PLBOIZCDNKCISG-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1ncc(C(=O)NCC2(O)CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001578818410 1075443260 /nfs/dbraw/zinc/44/32/60/1075443260.db2.gz UBRRSRAFSOOIPT-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1ncc(C(=O)NCC2(O)CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001578818410 1075443256 /nfs/dbraw/zinc/44/32/56/1075443256.db2.gz UBRRSRAFSOOIPT-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1ncc(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001578818609 1075443199 /nfs/dbraw/zinc/44/31/99/1075443199.db2.gz ZDSSDTKGQZRJQL-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1ncc(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001578818609 1075443197 /nfs/dbraw/zinc/44/31/97/1075443197.db2.gz ZDSSDTKGQZRJQL-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1ncc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)n1 ZINC001578818736 1075443227 /nfs/dbraw/zinc/44/32/27/1075443227.db2.gz CCSDQRMADVYIBL-NEPJUHHUSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)n1 ZINC001578818736 1075443224 /nfs/dbraw/zinc/44/32/24/1075443224.db2.gz CCSDQRMADVYIBL-NEPJUHHUSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)n1 ZINC001578818737 1075443272 /nfs/dbraw/zinc/44/32/72/1075443272.db2.gz CCSDQRMADVYIBL-VXGBXAGGSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)n1 ZINC001578818737 1075443268 /nfs/dbraw/zinc/44/32/68/1075443268.db2.gz CCSDQRMADVYIBL-VXGBXAGGSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)NCCN(CCO)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001578819135 1075443160 /nfs/dbraw/zinc/44/31/60/1075443160.db2.gz OQBMEJBTGIKWKU-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1ncc(C(=O)NCCN(CCO)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001578819135 1075443157 /nfs/dbraw/zinc/44/31/57/1075443157.db2.gz OQBMEJBTGIKWKU-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1ncc(C(=O)NCCN(CCO)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001578819450 1075443183 /nfs/dbraw/zinc/44/31/83/1075443183.db2.gz UKCRXNUAHADOAK-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1ncc(C(=O)NCCN(CCO)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001578819450 1075443181 /nfs/dbraw/zinc/44/31/81/1075443181.db2.gz UKCRXNUAHADOAK-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1ncc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)n1 ZINC001578820070 1075443883 /nfs/dbraw/zinc/44/38/83/1075443883.db2.gz FNTYPIVKBVAUPP-NEPJUHHUSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)n1 ZINC001578820070 1075443881 /nfs/dbraw/zinc/44/38/81/1075443881.db2.gz FNTYPIVKBVAUPP-NEPJUHHUSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)n1 ZINC001578820071 1075443760 /nfs/dbraw/zinc/44/37/60/1075443760.db2.gz FNTYPIVKBVAUPP-VXGBXAGGSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)n1 ZINC001578820071 1075443757 /nfs/dbraw/zinc/44/37/57/1075443757.db2.gz FNTYPIVKBVAUPP-VXGBXAGGSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)n1 ZINC001578820078 1075443794 /nfs/dbraw/zinc/44/37/94/1075443794.db2.gz FXVWUNCBYRXITL-NEPJUHHUSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)n1 ZINC001578820078 1075443792 /nfs/dbraw/zinc/44/37/92/1075443792.db2.gz FXVWUNCBYRXITL-NEPJUHHUSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1ncc(C(=O)N[C@@H]2CN(c3ncc(-c4nn[n-]n4)cc3F)C[C@@H]2O)n1 ZINC001578820766 1075443843 /nfs/dbraw/zinc/44/38/43/1075443843.db2.gz UTAOKFKTMFEWQK-NEPJUHHUSA-N -1 3 388.367 -1.008 20 0 GAADHM CCn1ncc(C(=O)N[C@@H]2CN(c3ncc(-c4nnn[n-]4)cc3F)C[C@@H]2O)n1 ZINC001578820766 1075443842 /nfs/dbraw/zinc/44/38/42/1075443842.db2.gz UTAOKFKTMFEWQK-NEPJUHHUSA-N -1 3 388.367 -1.008 20 0 GAADHM CCn1ncc(C(=O)N[C@@H]2CN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]2O)n1 ZINC001578820767 1075443769 /nfs/dbraw/zinc/44/37/69/1075443769.db2.gz UTAOKFKTMFEWQK-VXGBXAGGSA-N -1 3 388.367 -1.008 20 0 GAADHM CCn1ncc(C(=O)N[C@@H]2CN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]2O)n1 ZINC001578820767 1075443767 /nfs/dbraw/zinc/44/37/67/1075443767.db2.gz UTAOKFKTMFEWQK-VXGBXAGGSA-N -1 3 388.367 -1.008 20 0 GAADHM CCn1nncc1C(=O)N1CC(O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001578831463 1075443874 /nfs/dbraw/zinc/44/38/74/1075443874.db2.gz CYDUGCNXEUQLEN-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1nncc1C(=O)N1CC(O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001578831463 1075443870 /nfs/dbraw/zinc/44/38/70/1075443870.db2.gz CYDUGCNXEUQLEN-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1nncc1C(=O)N1CC(O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001578831634 1075443733 /nfs/dbraw/zinc/44/37/33/1075443733.db2.gz GLFHUIODPNIZAB-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1nncc1C(=O)N1CC(O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001578831634 1075443730 /nfs/dbraw/zinc/44/37/30/1075443730.db2.gz GLFHUIODPNIZAB-UHFFFAOYSA-N -1 3 386.376 -1.577 20 0 GAADHM CCn1nncc1C(=O)N(CCO)CCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001578831779 1075443812 /nfs/dbraw/zinc/44/38/12/1075443812.db2.gz HRMLABDFFUBWPO-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1nncc1C(=O)N(CCO)CCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001578831779 1075443810 /nfs/dbraw/zinc/44/38/10/1075443810.db2.gz HRMLABDFFUBWPO-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1nncc1C(=O)N(C)C[C@@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001578832086 1075444396 /nfs/dbraw/zinc/44/43/96/1075444396.db2.gz LLOPPKSZUDDPDP-JTQLQIEISA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1nncc1C(=O)N(C)C[C@@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001578832086 1075444391 /nfs/dbraw/zinc/44/43/91/1075444391.db2.gz LLOPPKSZUDDPDP-JTQLQIEISA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1nncc1C(=O)N(C)C[C@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001578832087 1075444305 /nfs/dbraw/zinc/44/43/05/1075444305.db2.gz LLOPPKSZUDDPDP-SNVBAGLBSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1nncc1C(=O)N(C)C[C@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001578832087 1075444300 /nfs/dbraw/zinc/44/43/00/1075444300.db2.gz LLOPPKSZUDDPDP-SNVBAGLBSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1nncc1C(=O)N(C)C[C@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001578832132 1075444446 /nfs/dbraw/zinc/44/44/46/1075444446.db2.gz MMTKJFRRRYURKR-SECBINFHSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1nncc1C(=O)N(C)C[C@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001578832132 1075444444 /nfs/dbraw/zinc/44/44/44/1075444444.db2.gz MMTKJFRRRYURKR-SECBINFHSA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1nncc1C(=O)N(C)C[C@@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001578832133 1075444453 /nfs/dbraw/zinc/44/44/53/1075444453.db2.gz MMTKJFRRRYURKR-VIFPVBQESA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1nncc1C(=O)N(C)C[C@@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001578832133 1075444450 /nfs/dbraw/zinc/44/44/50/1075444450.db2.gz MMTKJFRRRYURKR-VIFPVBQESA-N -1 3 388.392 -1.331 20 0 GAADHM CCn1nncc1C(=O)N(CCO)CCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001578832763 1075444384 /nfs/dbraw/zinc/44/43/84/1075444384.db2.gz SXYOZFULZRBPAO-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1nncc1C(=O)N(CCO)CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001578832763 1075444377 /nfs/dbraw/zinc/44/43/77/1075444377.db2.gz SXYOZFULZRBPAO-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1nncc1C(=O)N(CCO)CCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001578832995 1075444290 /nfs/dbraw/zinc/44/42/90/1075444290.db2.gz VTKXSEGEONOJBL-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1nncc1C(=O)N(CCO)CCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001578832995 1075444288 /nfs/dbraw/zinc/44/42/88/1075444288.db2.gz VTKXSEGEONOJBL-UHFFFAOYSA-N -1 3 388.392 -1.329 20 0 GAADHM CCn1nncc1C(=O)N1C[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001578833966 1075444278 /nfs/dbraw/zinc/44/42/78/1075444278.db2.gz OOICFCKQXAEYLE-PWSUYJOCSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1nncc1C(=O)N1C[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001578833966 1075444272 /nfs/dbraw/zinc/44/42/72/1075444272.db2.gz OOICFCKQXAEYLE-PWSUYJOCSA-N -1 3 386.376 -1.579 20 0 GAADHM CCn1nncc1C(=O)N1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001578834155 1075444345 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CN(C(=O)c1cc(-c2nnn[n-]2)c[nH]1)C1CN(C(=O)CN2CCOCC2=O)C1 ZINC001578907768 1075453531 /nfs/dbraw/zinc/45/35/31/1075453531.db2.gz RNLDUBGKISBERZ-UHFFFAOYSA-N -1 3 388.388 -1.664 20 0 GAADHM CN(C(=O)c1cc(=O)n(C)cn1)C1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001578907954 1075453571 /nfs/dbraw/zinc/45/35/71/1075453571.db2.gz SOGSTIXHPQWKSH-UHFFFAOYSA-N -1 3 383.372 -1.115 20 0 GAADHM CN(C(=O)c1cc(=O)n(C)cn1)C1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001578907954 1075453569 /nfs/dbraw/zinc/45/35/69/1075453569.db2.gz SOGSTIXHPQWKSH-UHFFFAOYSA-N -1 3 383.372 -1.115 20 0 GAADHM CN(C(=O)c1cc(-c2nn[n-]n2)c[nH]1)C1CN(C(=O)C2CC(=O)NC(=O)C2)C1 ZINC001578908176 1075453410 /nfs/dbraw/zinc/45/34/10/1075453410.db2.gz XTZYYWUOLUHYKQ-UHFFFAOYSA-N -1 3 386.372 -1.470 20 0 GAADHM CN(C(=O)c1cc(-c2nnn[n-]2)c[nH]1)C1CN(C(=O)C2CC(=O)NC(=O)C2)C1 ZINC001578908176 1075453407 /nfs/dbraw/zinc/45/34/07/1075453407.db2.gz XTZYYWUOLUHYKQ-UHFFFAOYSA-N -1 3 386.372 -1.470 20 0 GAADHM CN(C(=O)c1cc(-c2nn[n-]n2)c[nH]1)C1CN(C(=O)c2ccc(=O)n(C)n2)C1 ZINC001578908376 1075453555 /nfs/dbraw/zinc/45/35/55/1075453555.db2.gz YXAOBMONSLNUOY-UHFFFAOYSA-N -1 3 383.372 -1.115 20 0 GAADHM CN(C(=O)c1cc(-c2nnn[n-]2)c[nH]1)C1CN(C(=O)c2ccc(=O)n(C)n2)C1 ZINC001578908376 1075453553 /nfs/dbraw/zinc/45/35/53/1075453553.db2.gz YXAOBMONSLNUOY-UHFFFAOYSA-N -1 3 383.372 -1.115 20 0 GAADHM CN(C(=O)c1cc(=O)n(C)cn1)C1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001578908419 1075453456 /nfs/dbraw/zinc/45/34/56/1075453456.db2.gz ZVRXMRGVBVFOEJ-UHFFFAOYSA-N -1 3 383.372 -1.115 20 0 GAADHM CN(C(=O)c1cc(=O)n(C)cn1)C1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001578908419 1075453454 /nfs/dbraw/zinc/45/34/54/1075453454.db2.gz ZVRXMRGVBVFOEJ-UHFFFAOYSA-N -1 3 383.372 -1.115 20 0 GAADHM CN(C(=O)c1cc(-c2nn[n-]n2)c[nH]1)C1CN(CC(=O)NC(=O)NC2CC2)C1 ZINC001578908421 1075453547 /nfs/dbraw/zinc/45/35/47/1075453547.db2.gz ZVUDXKFJXUYWHG-UHFFFAOYSA-N -1 3 387.404 -1.061 20 0 GAADHM CN(C(=O)c1cc(-c2nnn[n-]2)c[nH]1)C1CN(CC(=O)NC(=O)NC2CC2)C1 ZINC001578908421 1075453545 /nfs/dbraw/zinc/45/35/45/1075453545.db2.gz ZVUDXKFJXUYWHG-UHFFFAOYSA-N -1 3 387.404 -1.061 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@@H](CNC(=O)[C@H]1CNC(=O)N1)C1CC1 ZINC001578912909 1075453448 /nfs/dbraw/zinc/45/34/48/1075453448.db2.gz NCLKJOVDJXXYEP-NEPJUHHUSA-N -1 3 387.404 -1.157 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@@H](CNC(=O)[C@H]1CNC(=O)N1)C1CC1 ZINC001578912909 1075453444 /nfs/dbraw/zinc/45/34/44/1075453444.db2.gz NCLKJOVDJXXYEP-NEPJUHHUSA-N -1 3 387.404 -1.157 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@H](CNC(=O)[C@@H]1CNC(=O)N1)C1CC1 ZINC001578912912 1075453563 /nfs/dbraw/zinc/45/35/63/1075453563.db2.gz NCLKJOVDJXXYEP-NWDGAFQWSA-N -1 3 387.404 -1.157 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@H](CNC(=O)[C@@H]1CNC(=O)N1)C1CC1 ZINC001578912912 1075453560 /nfs/dbraw/zinc/45/35/60/1075453560.db2.gz NCLKJOVDJXXYEP-NWDGAFQWSA-N -1 3 387.404 -1.157 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@@H](CNC(=O)[C@@H]1CNC(=O)N1)C1CC1 ZINC001578912913 1075453587 /nfs/dbraw/zinc/45/35/87/1075453587.db2.gz NCLKJOVDJXXYEP-RYUDHWBXSA-N -1 3 387.404 -1.157 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@@H](CNC(=O)[C@@H]1CNC(=O)N1)C1CC1 ZINC001578912913 1075453585 /nfs/dbraw/zinc/45/35/85/1075453585.db2.gz NCLKJOVDJXXYEP-RYUDHWBXSA-N -1 3 387.404 -1.157 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@H](CNC(=O)[C@H]1CNC(=O)N1)C1CC1 ZINC001578912914 1075453475 /nfs/dbraw/zinc/45/34/75/1075453475.db2.gz NCLKJOVDJXXYEP-VXGBXAGGSA-N -1 3 387.404 -1.157 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@H](CNC(=O)[C@H]1CNC(=O)N1)C1CC1 ZINC001578912914 1075453472 /nfs/dbraw/zinc/45/34/72/1075453472.db2.gz NCLKJOVDJXXYEP-VXGBXAGGSA-N -1 3 387.404 -1.157 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)C1CC(NC(=O)CCn2cnnn2)C1 ZINC001578913372 1075453540 /nfs/dbraw/zinc/45/35/40/1075453540.db2.gz AALJNQAFZNAMPP-UHFFFAOYSA-N -1 3 385.392 -1.009 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)C1CC(NC(=O)CCn2cnnn2)C1 ZINC001578913372 1075453538 /nfs/dbraw/zinc/45/35/38/1075453538.db2.gz AALJNQAFZNAMPP-UHFFFAOYSA-N -1 3 385.392 -1.009 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@H](CNC(=O)Cn1ncnn1)C1CC1 ZINC001578913414 1075453434 /nfs/dbraw/zinc/45/34/34/1075453434.db2.gz AHYYXIVPCVFLBC-GFCCVEGCSA-N -1 3 385.392 -1.152 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@H](CNC(=O)Cn1ncnn1)C1CC1 ZINC001578913414 1075453431 /nfs/dbraw/zinc/45/34/31/1075453431.db2.gz AHYYXIVPCVFLBC-GFCCVEGCSA-N -1 3 385.392 -1.152 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@@H](CNC(=O)Cn1ncnn1)C1CC1 ZINC001578913416 1075453502 /nfs/dbraw/zinc/45/35/02/1075453502.db2.gz AHYYXIVPCVFLBC-LBPRGKRZSA-N -1 3 385.392 -1.152 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@@H](CNC(=O)Cn1ncnn1)C1CC1 ZINC001578913416 1075453498 /nfs/dbraw/zinc/45/34/98/1075453498.db2.gz AHYYXIVPCVFLBC-LBPRGKRZSA-N -1 3 385.392 -1.152 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@H](CNC(=O)c1nnn(C)n1)C1CC1 ZINC001578913724 1075453580 /nfs/dbraw/zinc/45/35/80/1075453580.db2.gz DZTFLSRLRYURKS-LLVKDONJSA-N -1 3 385.392 -1.001 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@H](CNC(=O)c1nnn(C)n1)C1CC1 ZINC001578913724 1075453577 /nfs/dbraw/zinc/45/35/77/1075453577.db2.gz DZTFLSRLRYURKS-LLVKDONJSA-N -1 3 385.392 -1.001 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@@H](CNC(=O)c1nnn(C)n1)C1CC1 ZINC001578913725 1075453510 /nfs/dbraw/zinc/45/35/10/1075453510.db2.gz DZTFLSRLRYURKS-NSHDSACASA-N -1 3 385.392 -1.001 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@@H](CNC(=O)c1nnn(C)n1)C1CC1 ZINC001578913725 1075453507 /nfs/dbraw/zinc/45/35/07/1075453507.db2.gz DZTFLSRLRYURKS-NSHDSACASA-N -1 3 385.392 -1.001 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@H](CNC(=O)Cn1cnnn1)C1CC1 ZINC001578913815 1075453525 /nfs/dbraw/zinc/45/35/25/1075453525.db2.gz IJCSMGKHEWTLHI-GFCCVEGCSA-N -1 3 385.392 -1.152 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@H](CNC(=O)Cn1cnnn1)C1CC1 ZINC001578913815 1075453524 /nfs/dbraw/zinc/45/35/24/1075453524.db2.gz IJCSMGKHEWTLHI-GFCCVEGCSA-N -1 3 385.392 -1.152 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@@H](CNC(=O)Cn1cnnn1)C1CC1 ZINC001578913816 1075453518 /nfs/dbraw/zinc/45/35/18/1075453518.db2.gz IJCSMGKHEWTLHI-LBPRGKRZSA-N -1 3 385.392 -1.152 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@@H](CNC(=O)Cn1cnnn1)C1CC1 ZINC001578913816 1075453516 /nfs/dbraw/zinc/45/35/16/1075453516.db2.gz IJCSMGKHEWTLHI-LBPRGKRZSA-N -1 3 385.392 -1.152 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)C1CC(NC(=O)CS(C)(=O)=O)C1 ZINC001578914221 1075453466 /nfs/dbraw/zinc/45/34/66/1075453466.db2.gz YOZKYFWQXYZUIC-UHFFFAOYSA-N -1 3 381.418 -1.041 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)C1CCN(C(=O)Cn2ncnn2)CC1 ZINC001578915751 1075453421 /nfs/dbraw/zinc/45/34/21/1075453421.db2.gz BXTSLCFFKOOUBH-UHFFFAOYSA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)C1CCN(C(=O)Cn2ncnn2)CC1 ZINC001578915751 1075453419 /nfs/dbraw/zinc/45/34/19/1075453419.db2.gz BXTSLCFFKOOUBH-UHFFFAOYSA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)C1CCN(C(=O)Cn2cnnn2)CC1 ZINC001578915893 1075454054 /nfs/dbraw/zinc/45/40/54/1075454054.db2.gz CLCPKPWWGIBPER-UHFFFAOYSA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)C1CCN(C(=O)Cn2cnnn2)CC1 ZINC001578915893 1075454053 /nfs/dbraw/zinc/45/40/53/1075454053.db2.gz CLCPKPWWGIBPER-UHFFFAOYSA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@H]1CCN(C(=O)CCn2cnnn2)C1 ZINC001578915907 1075454111 /nfs/dbraw/zinc/45/41/11/1075454111.db2.gz CPRGLPZYARZWTK-JTQLQIEISA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@H]1CCN(C(=O)CCn2cnnn2)C1 ZINC001578915907 1075454108 /nfs/dbraw/zinc/45/41/08/1075454108.db2.gz CPRGLPZYARZWTK-JTQLQIEISA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@@H]1CCN(C(=O)CCn2cnnn2)C1 ZINC001578915909 1075454119 /nfs/dbraw/zinc/45/41/19/1075454119.db2.gz CPRGLPZYARZWTK-SNVBAGLBSA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@@H]1CCN(C(=O)CCn2cnnn2)C1 ZINC001578915909 1075454116 /nfs/dbraw/zinc/45/41/16/1075454116.db2.gz CPRGLPZYARZWTK-SNVBAGLBSA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@H]1CCCN(C(=O)Cn2cnnn2)C1 ZINC001578916010 1075453959 /nfs/dbraw/zinc/45/39/59/1075453959.db2.gz DZQUMCPVVAHSGI-JTQLQIEISA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@H]1CCCN(C(=O)Cn2cnnn2)C1 ZINC001578916010 1075453956 /nfs/dbraw/zinc/45/39/56/1075453956.db2.gz DZQUMCPVVAHSGI-JTQLQIEISA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@@H]1CCCN(C(=O)Cn2cnnn2)C1 ZINC001578916012 1075454046 /nfs/dbraw/zinc/45/40/46/1075454046.db2.gz DZQUMCPVVAHSGI-SNVBAGLBSA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@@H]1CCCN(C(=O)Cn2cnnn2)C1 ZINC001578916012 1075454043 /nfs/dbraw/zinc/45/40/43/1075454043.db2.gz DZQUMCPVVAHSGI-SNVBAGLBSA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@@H]1CCCN(C(=O)[C@H]2CNC(=O)N2)C1 ZINC001578917402 1075454161 /nfs/dbraw/zinc/45/41/61/1075454161.db2.gz QVHPTOPHSIWFPN-BXKDBHETSA-N -1 3 387.404 -1.061 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@@H]1CCCN(C(=O)[C@H]2CNC(=O)N2)C1 ZINC001578917402 1075454158 /nfs/dbraw/zinc/45/41/58/1075454158.db2.gz QVHPTOPHSIWFPN-BXKDBHETSA-N -1 3 387.404 -1.061 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@H]1CCCN(C(=O)[C@@H]2CNC(=O)N2)C1 ZINC001578917404 1075453974 /nfs/dbraw/zinc/45/39/74/1075453974.db2.gz QVHPTOPHSIWFPN-CABZTGNLSA-N -1 3 387.404 -1.061 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@H]1CCCN(C(=O)[C@@H]2CNC(=O)N2)C1 ZINC001578917404 1075453971 /nfs/dbraw/zinc/45/39/71/1075453971.db2.gz QVHPTOPHSIWFPN-CABZTGNLSA-N -1 3 387.404 -1.061 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@H]1CCCN(C(=O)[C@H]2CNC(=O)N2)C1 ZINC001578917406 1075454125 /nfs/dbraw/zinc/45/41/25/1075454125.db2.gz QVHPTOPHSIWFPN-JOYOIKCWSA-N -1 3 387.404 -1.061 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@H]1CCCN(C(=O)[C@H]2CNC(=O)N2)C1 ZINC001578917406 1075454124 /nfs/dbraw/zinc/45/41/24/1075454124.db2.gz QVHPTOPHSIWFPN-JOYOIKCWSA-N -1 3 387.404 -1.061 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@@H]1CCCN(C(=O)[C@@H]2CNC(=O)N2)C1 ZINC001578917409 1075454031 /nfs/dbraw/zinc/45/40/31/1075454031.db2.gz QVHPTOPHSIWFPN-SKDRFNHKSA-N -1 3 387.404 -1.061 20 0 GAADHM CN(C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@@H]1CCCN(C(=O)[C@@H]2CNC(=O)N2)C1 ZINC001578917409 1075454028 /nfs/dbraw/zinc/45/40/28/1075454028.db2.gz QVHPTOPHSIWFPN-SKDRFNHKSA-N -1 3 387.404 -1.061 20 0 GAADHM CN(C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@@H]1CCN(C(=O)CCNC(N)=O)C1 ZINC001578917822 1075454093 /nfs/dbraw/zinc/45/40/93/1075454093.db2.gz XNIPCAPXYSVYSH-SECBINFHSA-N -1 3 375.393 -1.074 20 0 GAADHM 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CN(C)C(=O)CC(=O)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001578955014 1075455045 /nfs/dbraw/zinc/45/50/45/1075455045.db2.gz CACJMJPFOJTVRX-CABZTGNLSA-N -1 3 390.404 -1.635 20 0 GAADHM CN(C)C(=O)CC(=O)N1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001578955014 1075455043 /nfs/dbraw/zinc/45/50/43/1075455043.db2.gz CACJMJPFOJTVRX-CABZTGNLSA-N -1 3 390.404 -1.635 20 0 GAADHM CN(C)C(=O)CC(=O)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1 ZINC001578955015 1075455054 /nfs/dbraw/zinc/45/50/54/1075455054.db2.gz CACJMJPFOJTVRX-JOYOIKCWSA-N -1 3 390.404 -1.635 20 0 GAADHM CN(C)C(=O)CC(=O)N1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H](O)C1 ZINC001578955015 1075455053 /nfs/dbraw/zinc/45/50/53/1075455053.db2.gz CACJMJPFOJTVRX-JOYOIKCWSA-N -1 3 390.404 -1.635 20 0 GAADHM CN(C)C(=O)CC(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001578955016 1075454995 /nfs/dbraw/zinc/45/49/95/1075454995.db2.gz CACJMJPFOJTVRX-SKDRFNHKSA-N -1 3 390.404 -1.635 20 0 GAADHM CN(C)C(=O)CC(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001578955016 1075454992 /nfs/dbraw/zinc/45/49/92/1075454992.db2.gz CACJMJPFOJTVRX-SKDRFNHKSA-N -1 3 390.404 -1.635 20 0 GAADHM CN(C)C(=O)CCCC(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001578955372 1075455099 /nfs/dbraw/zinc/45/50/99/1075455099.db2.gz HYTQCLSMVWMRMV-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001578955372 1075455098 /nfs/dbraw/zinc/45/50/98/1075455098.db2.gz HYTQCLSMVWMRMV-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)N[C@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001578955373 1075455132 /nfs/dbraw/zinc/45/51/32/1075455132.db2.gz HYTQCLSMVWMRMV-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)N[C@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001578955373 1075455130 /nfs/dbraw/zinc/45/51/30/1075455130.db2.gz HYTQCLSMVWMRMV-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001578955507 1075455027 /nfs/dbraw/zinc/45/50/27/1075455027.db2.gz KYMZQVVZHDABBC-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001578955507 1075455024 /nfs/dbraw/zinc/45/50/24/1075455024.db2.gz KYMZQVVZHDABBC-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001578955509 1075455060 /nfs/dbraw/zinc/45/50/60/1075455060.db2.gz KYMZQVVZHDABBC-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001578955509 1075455057 /nfs/dbraw/zinc/45/50/57/1075455057.db2.gz KYMZQVVZHDABBC-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001578956483 1075455086 /nfs/dbraw/zinc/45/50/86/1075455086.db2.gz AAKGMXNLJOJJFQ-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001578956483 1075455083 /nfs/dbraw/zinc/45/50/83/1075455083.db2.gz AAKGMXNLJOJJFQ-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001578956484 1075455076 /nfs/dbraw/zinc/45/50/76/1075455076.db2.gz AAKGMXNLJOJJFQ-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001578956484 1075455074 /nfs/dbraw/zinc/45/50/74/1075455074.db2.gz AAKGMXNLJOJJFQ-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@@H](CO)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001578956556 1075455650 /nfs/dbraw/zinc/45/56/50/1075455650.db2.gz DIYUARQQUIYXJY-JTQLQIEISA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@@H](CO)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001578956556 1075455647 /nfs/dbraw/zinc/45/56/47/1075455647.db2.gz DIYUARQQUIYXJY-JTQLQIEISA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@H](CO)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001578956557 1075455706 /nfs/dbraw/zinc/45/57/06/1075455706.db2.gz DIYUARQQUIYXJY-SNVBAGLBSA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@H](CO)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001578956557 1075455705 /nfs/dbraw/zinc/45/57/05/1075455705.db2.gz DIYUARQQUIYXJY-SNVBAGLBSA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CN1CCC(CO)(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001578956689 1075455669 /nfs/dbraw/zinc/45/56/69/1075455669.db2.gz FUNWJOOIYAEPDT-UHFFFAOYSA-N -1 3 376.421 -1.160 20 0 GAADHM CN(C)C(=O)CN1CCC(CO)(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001578956689 1075455666 /nfs/dbraw/zinc/45/56/66/1075455666.db2.gz FUNWJOOIYAEPDT-UHFFFAOYSA-N -1 3 376.421 -1.160 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001578956690 1075455700 /nfs/dbraw/zinc/45/57/00/1075455700.db2.gz FVNRFXDYRGPOMB-JTQLQIEISA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001578956690 1075455699 /nfs/dbraw/zinc/45/56/99/1075455699.db2.gz FVNRFXDYRGPOMB-JTQLQIEISA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001578956691 1075455598 /nfs/dbraw/zinc/45/55/98/1075455598.db2.gz FVNRFXDYRGPOMB-SNVBAGLBSA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001578956691 1075455595 /nfs/dbraw/zinc/45/55/95/1075455595.db2.gz FVNRFXDYRGPOMB-SNVBAGLBSA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CN1CCC(CO)(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001578956727 1075455715 /nfs/dbraw/zinc/45/57/15/1075455715.db2.gz HIHCDWXRKPRWQD-UHFFFAOYSA-N -1 3 376.421 -1.160 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001578956753 1075455642 /nfs/dbraw/zinc/45/56/42/1075455642.db2.gz IJANOXAITVKXDF-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001578956753 1075455640 /nfs/dbraw/zinc/45/56/40/1075455640.db2.gz IJANOXAITVKXDF-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001578956754 1075455685 /nfs/dbraw/zinc/45/56/85/1075455685.db2.gz IJANOXAITVKXDF-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001578956754 1075455684 /nfs/dbraw/zinc/45/56/84/1075455684.db2.gz IJANOXAITVKXDF-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@H](CO)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001578956760 1075455656 /nfs/dbraw/zinc/45/56/56/1075455656.db2.gz IOGHOXFMYOSRQA-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@H](CO)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001578956760 1075455654 /nfs/dbraw/zinc/45/56/54/1075455654.db2.gz IOGHOXFMYOSRQA-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@@H](CO)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001578956761 1075455584 /nfs/dbraw/zinc/45/55/84/1075455584.db2.gz IOGHOXFMYOSRQA-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@@H](CO)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001578956761 1075455579 /nfs/dbraw/zinc/45/55/79/1075455579.db2.gz IOGHOXFMYOSRQA-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CN1CC(N2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)C1 ZINC001578957204 1075456104 /nfs/dbraw/zinc/45/61/04/1075456104.db2.gz STICZUIGXIPPOL-UHFFFAOYSA-N -1 3 387.448 -1.275 20 0 GAADHM CN(C)C(=O)CN1CC(N2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)C1 ZINC001578957204 1075456100 /nfs/dbraw/zinc/45/61/00/1075456100.db2.gz STICZUIGXIPPOL-UHFFFAOYSA-N -1 3 387.448 -1.275 20 0 GAADHM CN(C)C(=O)CN1CCC(CO)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001578957238 1075456036 /nfs/dbraw/zinc/45/60/36/1075456036.db2.gz UTEAUSAYQNYSOV-UHFFFAOYSA-N -1 3 376.421 -1.160 20 0 GAADHM CN(C)C(=O)CN1CCC[C@](CO)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001578957408 1075456621 /nfs/dbraw/zinc/45/66/21/1075456621.db2.gz WTVPNIJZWWEBIW-INIZCTEOSA-N -1 3 376.421 -1.160 20 0 GAADHM CN(C)C(=O)CN1CCC[C@](CO)(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001578957408 1075456618 /nfs/dbraw/zinc/45/66/18/1075456618.db2.gz WTVPNIJZWWEBIW-INIZCTEOSA-N -1 3 376.421 -1.160 20 0 GAADHM CN(C)C(=O)CN1CCC[C@@](CO)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001578957409 1075456434 /nfs/dbraw/zinc/45/64/34/1075456434.db2.gz WTVPNIJZWWEBIW-MRXNPFEDSA-N -1 3 376.421 -1.160 20 0 GAADHM CN(C)C(=O)CN1CCC[C@@](CO)(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001578957409 1075456428 /nfs/dbraw/zinc/45/64/28/1075456428.db2.gz WTVPNIJZWWEBIW-MRXNPFEDSA-N -1 3 376.421 -1.160 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001578957461 1075456582 /nfs/dbraw/zinc/45/65/82/1075456582.db2.gz ZBQMJGWSYCUREN-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CN(C)C(=O)CCCC(=O)NC[C@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001578957461 1075456577 /nfs/dbraw/zinc/45/65/77/1075456577.db2.gz ZBQMJGWSYCUREN-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM 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1075462662 /nfs/dbraw/zinc/46/26/62/1075462662.db2.gz JOLJITCPKCIPAJ-UHFFFAOYSA-N -1 3 382.450 -1.110 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)NC[C@@H](CO)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001578996093 1075462651 /nfs/dbraw/zinc/46/26/51/1075462651.db2.gz KPZXKFCAENAGCT-JTQLQIEISA-N -1 3 384.422 -1.958 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001578996093 1075462644 /nfs/dbraw/zinc/46/26/44/1075462644.db2.gz KPZXKFCAENAGCT-JTQLQIEISA-N -1 3 384.422 -1.958 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)NC[C@H](CO)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001578996094 1075462938 /nfs/dbraw/zinc/46/29/38/1075462938.db2.gz KPZXKFCAENAGCT-SNVBAGLBSA-N -1 3 384.422 -1.958 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)NC[C@H](CO)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001578996094 1075462935 /nfs/dbraw/zinc/46/29/35/1075462935.db2.gz KPZXKFCAENAGCT-SNVBAGLBSA-N -1 3 384.422 -1.958 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)NC1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001578996289 1075462684 /nfs/dbraw/zinc/46/26/84/1075462684.db2.gz 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CN(C)S(=O)(=O)NCC(=O)N1CC(Nc2cccc(-c3nn[n-]n3)c2)C1 ZINC001578996432 1075463178 /nfs/dbraw/zinc/46/31/78/1075463178.db2.gz NVXPRDCRISMXCG-UHFFFAOYSA-N -1 3 380.434 -1.115 20 0 GAADHM CN(C)S(=O)(=O)NCC(=O)N1CC(Nc2cccc(-c3nnn[n-]3)c2)C1 ZINC001578996432 1075463174 /nfs/dbraw/zinc/46/31/74/1075463174.db2.gz NVXPRDCRISMXCG-UHFFFAOYSA-N -1 3 380.434 -1.115 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)N[C@@H]1[C@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]21 ZINC001578996464 1075463161 /nfs/dbraw/zinc/46/31/61/1075463161.db2.gz OPVUIGMUYKQNCD-PJXYFTJBSA-N -1 3 392.445 -1.296 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)N[C@@H]1[C@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]21 ZINC001578996464 1075463158 /nfs/dbraw/zinc/46/31/58/1075463158.db2.gz OPVUIGMUYKQNCD-PJXYFTJBSA-N -1 3 392.445 -1.296 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)NC[C@@H](CO)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001578996554 1075463755 /nfs/dbraw/zinc/46/37/55/1075463755.db2.gz UCYUVXGHNPEOQF-JTQLQIEISA-N -1 3 384.422 -1.958 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001578996554 1075463751 /nfs/dbraw/zinc/46/37/51/1075463751.db2.gz UCYUVXGHNPEOQF-JTQLQIEISA-N -1 3 384.422 -1.958 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)NC[C@H](CO)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001578996555 1075463817 /nfs/dbraw/zinc/46/38/17/1075463817.db2.gz UCYUVXGHNPEOQF-SNVBAGLBSA-N -1 3 384.422 -1.958 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)NC[C@H](CO)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001578996555 1075463814 /nfs/dbraw/zinc/46/38/14/1075463814.db2.gz UCYUVXGHNPEOQF-SNVBAGLBSA-N -1 3 384.422 -1.958 20 0 GAADHM CN(C)S(=O)(=O)CCCN1CC(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001578996559 1075463731 /nfs/dbraw/zinc/46/37/31/1075463731.db2.gz UGDKHXYQZMATGH-UHFFFAOYSA-N -1 3 382.450 -1.110 20 0 GAADHM CN(C)S(=O)(=O)CCCN1CC(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001578996559 1075463730 /nfs/dbraw/zinc/46/37/30/1075463730.db2.gz UGDKHXYQZMATGH-UHFFFAOYSA-N -1 3 382.450 -1.110 20 0 GAADHM CN(C)S(=O)(=O)NCC(=O)N1CCc2c(sc(N)c2-c2nn[n-]n2)C1 ZINC001578996564 1075463794 /nfs/dbraw/zinc/46/37/94/1075463794.db2.gz ULAZPABMLSOFGJ-UHFFFAOYSA-N -1 3 386.463 -1.209 20 0 GAADHM CN(C)S(=O)(=O)NCC(=O)N1CCc2c(sc(N)c2-c2nnn[n-]2)C1 ZINC001578996564 1075463792 /nfs/dbraw/zinc/46/37/92/1075463792.db2.gz ULAZPABMLSOFGJ-UHFFFAOYSA-N -1 3 386.463 -1.209 20 0 GAADHM CN(C)S(=O)(=O)CCS(=O)(=O)NCc1cncc(-c2nn[n-]n2)c1 ZINC001578996578 1075463741 /nfs/dbraw/zinc/46/37/41/1075463741.db2.gz VLXZQNLPMHZWBI-UHFFFAOYSA-N -1 3 375.436 -1.428 20 0 GAADHM CN(C)S(=O)(=O)CCS(=O)(=O)NCc1cncc(-c2nnn[n-]2)c1 ZINC001578996578 1075463738 /nfs/dbraw/zinc/46/37/38/1075463738.db2.gz VLXZQNLPMHZWBI-UHFFFAOYSA-N -1 3 375.436 -1.428 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)N1C[C@@H]2C[C@H]1CN2c1ncccc1-c1nn[n-]n1 ZINC001578996655 1075463786 /nfs/dbraw/zinc/46/37/86/1075463786.db2.gz VTXFGQMTOKRNOI-QWRGUYRKSA-N -1 3 392.445 -1.057 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)N1C[C@@H]2C[C@H]1CN2c1ncccc1-c1nnn[n-]1 ZINC001578996655 1075463784 /nfs/dbraw/zinc/46/37/84/1075463784.db2.gz VTXFGQMTOKRNOI-QWRGUYRKSA-N -1 3 392.445 -1.057 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)N[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001578996685 1075463646 /nfs/dbraw/zinc/46/36/46/1075463646.db2.gz XNUOWPRAWMXIHO-JTQLQIEISA-N -1 3 380.434 -1.152 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)N[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001578996685 1075463644 /nfs/dbraw/zinc/46/36/44/1075463644.db2.gz XNUOWPRAWMXIHO-JTQLQIEISA-N -1 3 380.434 -1.152 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)N[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001578996686 1075464263 /nfs/dbraw/zinc/46/42/63/1075464263.db2.gz XNUOWPRAWMXIHO-SNVBAGLBSA-N -1 3 380.434 -1.152 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)N[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001578996686 1075464260 /nfs/dbraw/zinc/46/42/60/1075464260.db2.gz XNUOWPRAWMXIHO-SNVBAGLBSA-N -1 3 380.434 -1.152 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]21 ZINC001578996706 1075464328 /nfs/dbraw/zinc/46/43/28/1075464328.db2.gz YUVUGJZDWURHTN-YABSGUDNSA-N -1 3 392.445 -1.296 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]21 ZINC001578996706 1075464325 /nfs/dbraw/zinc/46/43/25/1075464325.db2.gz YUVUGJZDWURHTN-YABSGUDNSA-N -1 3 392.445 -1.296 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)N1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001578996729 1075464270 /nfs/dbraw/zinc/46/42/70/1075464270.db2.gz ZYTCYJSLMPUNGB-UHFFFAOYSA-N -1 3 380.434 -1.198 20 0 GAADHM CN(C)S(=O)(=O)CC(=O)N1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001578996729 1075464267 /nfs/dbraw/zinc/46/42/67/1075464267.db2.gz ZYTCYJSLMPUNGB-UHFFFAOYSA-N -1 3 380.434 -1.198 20 0 GAADHM CN(C)c1noc(CN2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)n1 ZINC001579000772 1075464253 /nfs/dbraw/zinc/46/42/53/1075464253.db2.gz BSTZDMHADVPVGA-MNOVXSKESA-N -1 3 388.392 -1.381 20 0 GAADHM CN(C)c1noc(CN2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)n1 ZINC001579000772 1075464249 /nfs/dbraw/zinc/46/42/49/1075464249.db2.gz BSTZDMHADVPVGA-MNOVXSKESA-N -1 3 388.392 -1.381 20 0 GAADHM CN(C)c1noc(CN2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001579000993 1075464277 /nfs/dbraw/zinc/46/42/77/1075464277.db2.gz GLIDCLHWASFFBU-GHMZBOCLSA-N -1 3 388.392 -1.381 20 0 GAADHM CN(C)c1noc(CN2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001579000993 1075464276 /nfs/dbraw/zinc/46/42/76/1075464276.db2.gz GLIDCLHWASFFBU-GHMZBOCLSA-N -1 3 388.392 -1.381 20 0 GAADHM CN(C)c1noc(CN2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)n1 ZINC001579000996 1075464179 /nfs/dbraw/zinc/46/41/79/1075464179.db2.gz GLIDCLHWASFFBU-MNOVXSKESA-N -1 3 388.392 -1.381 20 0 GAADHM CN(C)c1noc(CN2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)n1 ZINC001579000996 1075464175 /nfs/dbraw/zinc/46/41/75/1075464175.db2.gz GLIDCLHWASFFBU-MNOVXSKESA-N -1 3 388.392 -1.381 20 0 GAADHM CN(C)c1noc(CN2CC(O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001579001111 1075464623 /nfs/dbraw/zinc/46/46/23/1075464623.db2.gz JARHSYNGGRNTDQ-UHFFFAOYSA-N -1 3 388.392 -1.380 20 0 GAADHM CN(C)c1noc(CN2CC(O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001579001111 1075464619 /nfs/dbraw/zinc/46/46/19/1075464619.db2.gz JARHSYNGGRNTDQ-UHFFFAOYSA-N -1 3 388.392 -1.380 20 0 GAADHM CN(C)c1noc(CN2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001579001113 1075464652 /nfs/dbraw/zinc/46/46/52/1075464652.db2.gz JHWTWPMTCKSBNT-GHMZBOCLSA-N -1 3 388.392 -1.381 20 0 GAADHM CN(C)c1noc(CN2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001579001113 1075464647 /nfs/dbraw/zinc/46/46/47/1075464647.db2.gz JHWTWPMTCKSBNT-GHMZBOCLSA-N -1 3 388.392 -1.381 20 0 GAADHM CN(C)c1noc(CN2C[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)n1 ZINC001579001114 1075464705 /nfs/dbraw/zinc/46/47/05/1075464705.db2.gz JHWTWPMTCKSBNT-MNOVXSKESA-N -1 3 388.392 -1.381 20 0 GAADHM CN(C)c1noc(CN2C[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)n1 ZINC001579001114 1075464702 /nfs/dbraw/zinc/46/47/02/1075464702.db2.gz JHWTWPMTCKSBNT-MNOVXSKESA-N -1 3 388.392 -1.381 20 0 GAADHM CN(C)c1nc(CNC[C@@H](O)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)ns1 ZINC001579001545 1075464821 /nfs/dbraw/zinc/46/48/21/1075464821.db2.gz FSWVPZWAIGSIEW-MRVPVSSYSA-N -1 3 392.449 -1.007 20 0 GAADHM CN(C)c1nc(CNC[C@@H](O)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)ns1 ZINC001579001545 1075464815 /nfs/dbraw/zinc/46/48/15/1075464815.db2.gz FSWVPZWAIGSIEW-MRVPVSSYSA-N -1 3 392.449 -1.007 20 0 GAADHM CN(C)c1nc(CNC[C@H](O)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)ns1 ZINC001579001546 1075464914 /nfs/dbraw/zinc/46/49/14/1075464914.db2.gz FSWVPZWAIGSIEW-QMMMGPOBSA-N -1 3 392.449 -1.007 20 0 GAADHM CN(C)c1nc(CNC[C@H](O)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)ns1 ZINC001579001546 1075464909 /nfs/dbraw/zinc/46/49/09/1075464909.db2.gz FSWVPZWAIGSIEW-QMMMGPOBSA-N -1 3 392.449 -1.007 20 0 GAADHM CN(C)c1nc(CN[C@@H](CO)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)ns1 ZINC001579001748 1075464561 /nfs/dbraw/zinc/46/45/61/1075464561.db2.gz FSYAOVLQLMDVDT-SECBINFHSA-N -1 3 392.449 -1.007 20 0 GAADHM CN(C)c1nc(CN[C@@H](CO)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)ns1 ZINC001579001748 1075464558 /nfs/dbraw/zinc/46/45/58/1075464558.db2.gz FSYAOVLQLMDVDT-SECBINFHSA-N -1 3 392.449 -1.007 20 0 GAADHM CN(C)c1nc(CN[C@H](CO)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)ns1 ZINC001579001749 1075464664 /nfs/dbraw/zinc/46/46/64/1075464664.db2.gz FSYAOVLQLMDVDT-VIFPVBQESA-N -1 3 392.449 -1.007 20 0 GAADHM CN(C)c1nc(CN[C@H](CO)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)ns1 ZINC001579001749 1075464660 /nfs/dbraw/zinc/46/46/60/1075464660.db2.gz FSYAOVLQLMDVDT-VIFPVBQESA-N -1 3 392.449 -1.007 20 0 GAADHM CN(C)c1nc(CN[C@@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)ns1 ZINC001579001911 1075464759 /nfs/dbraw/zinc/46/47/59/1075464759.db2.gz JHYZJUGSHZKSON-SECBINFHSA-N -1 3 392.449 -1.007 20 0 GAADHM CN(C)c1nc(CN[C@@H](CO)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)ns1 ZINC001579001911 1075464751 /nfs/dbraw/zinc/46/47/51/1075464751.db2.gz JHYZJUGSHZKSON-SECBINFHSA-N -1 3 392.449 -1.007 20 0 GAADHM CN(C)c1nc(CN[C@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)ns1 ZINC001579001912 1075464776 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CN(C[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)C(=O)[C@]1(F)CCOC1 ZINC001579033436 1075488508 /nfs/dbraw/zinc/48/85/08/1075488508.db2.gz AUJTUUYTANYVBZ-BMIGLBTASA-N -1 3 381.368 -1.128 20 0 GAADHM CN(C[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)C(=O)[C@]1(F)CCOC1 ZINC001579033436 1075488507 /nfs/dbraw/zinc/48/85/07/1075488507.db2.gz AUJTUUYTANYVBZ-BMIGLBTASA-N -1 3 381.368 -1.128 20 0 GAADHM CN(C[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)C(=O)[C@]1(F)CCOC1 ZINC001579033437 1075488391 /nfs/dbraw/zinc/48/83/91/1075488391.db2.gz AUJTUUYTANYVBZ-BONVTDFDSA-N -1 3 381.368 -1.128 20 0 GAADHM CN(C[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)C(=O)[C@]1(F)CCOC1 ZINC001579033437 1075488386 /nfs/dbraw/zinc/48/83/86/1075488386.db2.gz AUJTUUYTANYVBZ-BONVTDFDSA-N -1 3 381.368 -1.128 20 0 GAADHM CN(C[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)C(=O)[C@@]1(F)CCOC1 ZINC001579033438 1075488529 /nfs/dbraw/zinc/48/85/29/1075488529.db2.gz AUJTUUYTANYVBZ-MEBBXXQBSA-N -1 3 381.368 -1.128 20 0 GAADHM 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CN(C[C@@H](O)CNC(=O)CN1CCCC1=O)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579033443 1075488532 /nfs/dbraw/zinc/48/85/32/1075488532.db2.gz AWOQBNQCCCZMHS-NSHDSACASA-N -1 3 390.404 -1.634 20 0 GAADHM CN(C[C@@H](O)CNC(=O)CN1CCCC1=O)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579033443 1075488531 /nfs/dbraw/zinc/48/85/31/1075488531.db2.gz AWOQBNQCCCZMHS-NSHDSACASA-N -1 3 390.404 -1.634 20 0 GAADHM CN(C[C@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)C(=O)CN1CCOCC1 ZINC001579033448 1075488421 /nfs/dbraw/zinc/48/84/21/1075488421.db2.gz BCZCXCLKNBVSDZ-GFCCVEGCSA-N -1 3 392.420 -1.924 20 0 GAADHM CN(C[C@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)C(=O)CN1CCOCC1 ZINC001579033448 1075488418 /nfs/dbraw/zinc/48/84/18/1075488418.db2.gz BCZCXCLKNBVSDZ-GFCCVEGCSA-N -1 3 392.420 -1.924 20 0 GAADHM CN(C[C@@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)C(=O)CN1CCOCC1 ZINC001579033449 1075488464 /nfs/dbraw/zinc/48/84/64/1075488464.db2.gz BCZCXCLKNBVSDZ-LBPRGKRZSA-N -1 3 392.420 -1.924 20 0 GAADHM CN(C[C@@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)C(=O)CN1CCOCC1 ZINC001579033449 1075488461 /nfs/dbraw/zinc/48/84/61/1075488461.db2.gz BCZCXCLKNBVSDZ-LBPRGKRZSA-N -1 3 392.420 -1.924 20 0 GAADHM CN(C[C@@H](O)CNC(=O)[C@]12C[C@H]1COC2)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579033452 1075488490 /nfs/dbraw/zinc/48/84/90/1075488490.db2.gz BDZSSSFGRXOMED-MMPTUQATSA-N -1 3 375.389 -1.220 20 0 GAADHM CN(C[C@@H](O)CNC(=O)[C@]12C[C@H]1COC2)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579033452 1075488486 /nfs/dbraw/zinc/48/84/86/1075488486.db2.gz BDZSSSFGRXOMED-MMPTUQATSA-N -1 3 375.389 -1.220 20 0 GAADHM CN(C[C@H](O)CNC(=O)[C@]12C[C@H]1COC2)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579033453 1075488412 /nfs/dbraw/zinc/48/84/12/1075488412.db2.gz BDZSSSFGRXOMED-USBNGQNGSA-N -1 3 375.389 -1.220 20 0 GAADHM CN(C[C@H](O)CNC(=O)[C@]12C[C@H]1COC2)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579033453 1075488408 /nfs/dbraw/zinc/48/84/08/1075488408.db2.gz BDZSSSFGRXOMED-USBNGQNGSA-N -1 3 375.389 -1.220 20 0 GAADHM 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GAADHM CN(C[C@H](O)CNc1ccc(-c2nnn[n-]2)cn1)C(=O)C(=O)NCC(F)F ZINC001579041110 1075496346 /nfs/dbraw/zinc/49/63/46/1075496346.db2.gz QHDSWTLIPWGNQG-SECBINFHSA-N -1 3 384.347 -1.126 20 0 GAADHM CN(C[C@@H](O)CNc1ccc(-c2nn[n-]n2)cn1)C(=O)C(=O)NCC(F)F ZINC001579041111 1075496365 /nfs/dbraw/zinc/49/63/65/1075496365.db2.gz QHDSWTLIPWGNQG-VIFPVBQESA-N -1 3 384.347 -1.126 20 0 GAADHM CN(C[C@@H](O)CNc1ccc(-c2nnn[n-]2)cn1)C(=O)C(=O)NCC(F)F ZINC001579041111 1075496363 /nfs/dbraw/zinc/49/63/63/1075496363.db2.gz QHDSWTLIPWGNQG-VIFPVBQESA-N -1 3 384.347 -1.126 20 0 GAADHM CN(C[C@H](O)CNc1ccc(-c2nn[n-]n2)cn1)C(=O)Cn1ncn(C)c1=O ZINC001579041294 1075496774 /nfs/dbraw/zinc/49/67/74/1075496774.db2.gz AUSFWDPTUVIHNU-LLVKDONJSA-N -1 3 388.392 -1.912 20 0 GAADHM CN(C[C@H](O)CNc1ccc(-c2nnn[n-]2)cn1)C(=O)Cn1ncn(C)c1=O ZINC001579041294 1075496771 /nfs/dbraw/zinc/49/67/71/1075496771.db2.gz AUSFWDPTUVIHNU-LLVKDONJSA-N -1 3 388.392 -1.912 20 0 GAADHM CN(C[C@@H](O)CNc1ccc(-c2nn[n-]n2)cn1)C(=O)Cn1ncn(C)c1=O ZINC001579041295 1075496637 /nfs/dbraw/zinc/49/66/37/1075496637.db2.gz AUSFWDPTUVIHNU-NSHDSACASA-N -1 3 388.392 -1.912 20 0 GAADHM CN(C[C@@H](O)CNc1ccc(-c2nnn[n-]2)cn1)C(=O)Cn1ncn(C)c1=O ZINC001579041295 1075496634 /nfs/dbraw/zinc/49/66/34/1075496634.db2.gz AUSFWDPTUVIHNU-NSHDSACASA-N -1 3 388.392 -1.912 20 0 GAADHM CN(C)c1noc(CNC[C@@H](O)CN(C)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001579041696 1075496785 /nfs/dbraw/zinc/49/67/85/1075496785.db2.gz UXPWXBDPARZXIY-SECBINFHSA-N -1 3 390.408 -1.134 20 0 GAADHM CN(C)c1noc(CNC[C@@H](O)CN(C)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001579041696 1075496783 /nfs/dbraw/zinc/49/67/83/1075496783.db2.gz UXPWXBDPARZXIY-SECBINFHSA-N -1 3 390.408 -1.134 20 0 GAADHM CN(C)c1noc(CNC[C@H](O)CN(C)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001579041697 1075496764 /nfs/dbraw/zinc/49/67/64/1075496764.db2.gz UXPWXBDPARZXIY-VIFPVBQESA-N -1 3 390.408 -1.134 20 0 GAADHM CN(C)c1noc(CNC[C@H](O)CN(C)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001579041697 1075496762 /nfs/dbraw/zinc/49/67/62/1075496762.db2.gz UXPWXBDPARZXIY-VIFPVBQESA-N -1 3 390.408 -1.134 20 0 GAADHM CN(C[C@H](O)CNCc1ncnn1CCF)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579041797 1075496662 /nfs/dbraw/zinc/49/66/62/1075496662.db2.gz VTPGPMINWLXWGG-LLVKDONJSA-N -1 3 392.399 -1.022 20 0 GAADHM CN(C[C@@H](O)CNCc1ncnn1CCF)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579041798 1075496742 /nfs/dbraw/zinc/49/67/42/1075496742.db2.gz VTPGPMINWLXWGG-NSHDSACASA-N -1 3 392.399 -1.022 20 0 GAADHM CN(C[C@H](O)CNc1ccc(-c2nn[n-]n2)cn1)C(=O)CN1CCOCC1=O ZINC001579041870 1075496715 /nfs/dbraw/zinc/49/67/15/1075496715.db2.gz FFXRNAZSYDTKRH-GFCCVEGCSA-N -1 3 390.404 -1.648 20 0 GAADHM CN(C[C@H](O)CNc1ccc(-c2nnn[n-]2)cn1)C(=O)CN1CCOCC1=O ZINC001579041870 1075496712 /nfs/dbraw/zinc/49/67/12/1075496712.db2.gz FFXRNAZSYDTKRH-GFCCVEGCSA-N -1 3 390.404 -1.648 20 0 GAADHM CN(C[C@@H](O)CNc1ccc(-c2nn[n-]n2)cn1)C(=O)CN1CCOCC1=O ZINC001579041871 1075496748 /nfs/dbraw/zinc/49/67/48/1075496748.db2.gz FFXRNAZSYDTKRH-LBPRGKRZSA-N -1 3 390.404 -1.648 20 0 GAADHM CN(C[C@@H](O)CNc1ccc(-c2nnn[n-]2)cn1)C(=O)CN1CCOCC1=O ZINC001579041871 1075496746 /nfs/dbraw/zinc/49/67/46/1075496746.db2.gz FFXRNAZSYDTKRH-LBPRGKRZSA-N -1 3 390.404 -1.648 20 0 GAADHM CN(C[C@H](O)CNc1ccc(-c2nn[n-]n2)cn1)C(=O)c1cc(=O)n(C)cn1 ZINC001579042103 1075496699 /nfs/dbraw/zinc/49/66/99/1075496699.db2.gz HNIIQDNRDOCHKY-LLVKDONJSA-N -1 3 385.388 -1.100 20 0 GAADHM CN(C[C@H](O)CNc1ccc(-c2nnn[n-]2)cn1)C(=O)c1cc(=O)n(C)cn1 ZINC001579042103 1075496697 /nfs/dbraw/zinc/49/66/97/1075496697.db2.gz HNIIQDNRDOCHKY-LLVKDONJSA-N -1 3 385.388 -1.100 20 0 GAADHM CN(C[C@@H](O)CNc1ccc(-c2nn[n-]n2)cn1)C(=O)c1cc(=O)n(C)cn1 ZINC001579042106 1075496805 /nfs/dbraw/zinc/49/68/05/1075496805.db2.gz HNIIQDNRDOCHKY-NSHDSACASA-N -1 3 385.388 -1.100 20 0 GAADHM CN(C[C@@H](O)CNc1ccc(-c2nnn[n-]2)cn1)C(=O)c1cc(=O)n(C)cn1 ZINC001579042106 1075496803 /nfs/dbraw/zinc/49/68/03/1075496803.db2.gz HNIIQDNRDOCHKY-NSHDSACASA-N -1 3 385.388 -1.100 20 0 GAADHM 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/nfs/dbraw/zinc/49/71/26/1075497126.db2.gz LEOHAXHEMHNTIX-GFCCVEGCSA-N -1 3 389.420 -1.092 20 0 GAADHM CN(C[C@H](O)CNc1ccc(-c2nnn[n-]2)nc1)C(=O)CN1CCCNC1=O ZINC001579042716 1075497123 /nfs/dbraw/zinc/49/71/23/1075497123.db2.gz LEOHAXHEMHNTIX-GFCCVEGCSA-N -1 3 389.420 -1.092 20 0 GAADHM CN(C[C@@H](O)CNc1ccc(-c2nn[n-]n2)nc1)C(=O)CN1CCCNC1=O ZINC001579042717 1075497150 /nfs/dbraw/zinc/49/71/50/1075497150.db2.gz LEOHAXHEMHNTIX-LBPRGKRZSA-N -1 3 389.420 -1.092 20 0 GAADHM CN(C[C@@H](O)CNc1ccc(-c2nnn[n-]2)nc1)C(=O)CN1CCCNC1=O ZINC001579042717 1075497149 /nfs/dbraw/zinc/49/71/49/1075497149.db2.gz LEOHAXHEMHNTIX-LBPRGKRZSA-N -1 3 389.420 -1.092 20 0 GAADHM CN(C[C@H](O)CNc1ccc(-c2nn[n-]n2)cn1)C(=O)c1ccc(=O)n(C)n1 ZINC001579043022 1075497191 /nfs/dbraw/zinc/49/71/91/1075497191.db2.gz NAAFBKQIJAECJS-LLVKDONJSA-N -1 3 385.388 -1.100 20 0 GAADHM CN(C[C@H](O)CNc1ccc(-c2nnn[n-]2)cn1)C(=O)c1ccc(=O)n(C)n1 ZINC001579043022 1075497189 /nfs/dbraw/zinc/49/71/89/1075497189.db2.gz NAAFBKQIJAECJS-LLVKDONJSA-N 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ZINC001579043232 1075497138 /nfs/dbraw/zinc/49/71/38/1075497138.db2.gz PAFNZQPUNUIHHZ-GFCCVEGCSA-N -1 3 389.420 -1.092 20 0 GAADHM CN(C[C@H](O)CNc1ccc(-c2nnn[n-]2)cn1)C(=O)CN1CCCNC1=O ZINC001579043232 1075497136 /nfs/dbraw/zinc/49/71/36/1075497136.db2.gz PAFNZQPUNUIHHZ-GFCCVEGCSA-N -1 3 389.420 -1.092 20 0 GAADHM CN(C[C@@H](O)CNc1ccc(-c2nn[n-]n2)cn1)C(=O)CN1CCCNC1=O ZINC001579043234 1075497059 /nfs/dbraw/zinc/49/70/59/1075497059.db2.gz PAFNZQPUNUIHHZ-LBPRGKRZSA-N -1 3 389.420 -1.092 20 0 GAADHM CN(C[C@@H](O)CNc1ccc(-c2nnn[n-]2)cn1)C(=O)CN1CCCNC1=O ZINC001579043234 1075497055 /nfs/dbraw/zinc/49/70/55/1075497055.db2.gz PAFNZQPUNUIHHZ-LBPRGKRZSA-N -1 3 389.420 -1.092 20 0 GAADHM CN(C[C@H](O)CNc1ccc(-c2nn[n-]n2)nc1)C(=O)CN1CCOCC1 ZINC001579043277 1075497537 /nfs/dbraw/zinc/49/75/37/1075497537.db2.gz PNPSNTSLXORXBS-CYBMUJFWSA-N -1 3 376.421 -1.175 20 0 GAADHM CN(C[C@H](O)CNc1ccc(-c2nnn[n-]2)nc1)C(=O)CN1CCOCC1 ZINC001579043277 1075497534 /nfs/dbraw/zinc/49/75/34/1075497534.db2.gz PNPSNTSLXORXBS-CYBMUJFWSA-N -1 3 376.421 -1.175 20 0 GAADHM CN(C[C@@H](O)CNc1ccc(-c2nn[n-]n2)nc1)C(=O)CN1CCOCC1 ZINC001579043279 1075497619 /nfs/dbraw/zinc/49/76/19/1075497619.db2.gz PNPSNTSLXORXBS-ZDUSSCGKSA-N -1 3 376.421 -1.175 20 0 GAADHM CN(C[C@@H](O)CNc1ccc(-c2nnn[n-]2)nc1)C(=O)CN1CCOCC1 ZINC001579043279 1075497616 /nfs/dbraw/zinc/49/76/16/1075497616.db2.gz PNPSNTSLXORXBS-ZDUSSCGKSA-N -1 3 376.421 -1.175 20 0 GAADHM CN(C[C@H](O)CNc1ccc(-c2nn[n-]n2)nc1)C(=O)CN1CCOCC1=O ZINC001579043592 1075497545 /nfs/dbraw/zinc/49/75/45/1075497545.db2.gz SSQQBRSBFGSUCY-GFCCVEGCSA-N -1 3 390.404 -1.648 20 0 GAADHM CN(C[C@H](O)CNc1ccc(-c2nnn[n-]2)nc1)C(=O)CN1CCOCC1=O ZINC001579043592 1075497542 /nfs/dbraw/zinc/49/75/42/1075497542.db2.gz SSQQBRSBFGSUCY-GFCCVEGCSA-N -1 3 390.404 -1.648 20 0 GAADHM CN(C[C@@H](O)CNc1ccc(-c2nn[n-]n2)nc1)C(=O)CN1CCOCC1=O ZINC001579043593 1075497470 /nfs/dbraw/zinc/49/74/70/1075497470.db2.gz SSQQBRSBFGSUCY-LBPRGKRZSA-N -1 3 390.404 -1.648 20 0 GAADHM 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CN(C[C@@H](O)CNc1ncc(-c2nnn[n-]2)cc1F)C(=O)[C@H]1COC(=O)N1 ZINC001579057283 1075507775 /nfs/dbraw/zinc/50/77/75/1075507775.db2.gz IFMIBYAOFKQSPV-WCBMZHEXSA-N -1 3 380.340 -1.260 20 0 GAADHM CN(C[C@@H](O)CNc1ncc(-c2nn[n-]n2)cc1F)C(=O)[C@@H]1COC(=O)N1 ZINC001579057284 1075507735 /nfs/dbraw/zinc/50/77/35/1075507735.db2.gz IFMIBYAOFKQSPV-WPRPVWTQSA-N -1 3 380.340 -1.260 20 0 GAADHM CN(C[C@@H](O)CNc1ncc(-c2nnn[n-]2)cc1F)C(=O)[C@@H]1COC(=O)N1 ZINC001579057284 1075507732 /nfs/dbraw/zinc/50/77/32/1075507732.db2.gz IFMIBYAOFKQSPV-WPRPVWTQSA-N -1 3 380.340 -1.260 20 0 GAADHM CN(C[C@@H](O)CNc1ncccc1-c1nn[n-]n1)C(=O)C1CS(=O)(=O)C1 ZINC001579057523 1075507745 /nfs/dbraw/zinc/50/77/45/1075507745.db2.gz KCDKKPQHVFABOE-JTQLQIEISA-N -1 3 381.418 -1.463 20 0 GAADHM CN(C[C@@H](O)CNc1ncccc1-c1nnn[n-]1)C(=O)C1CS(=O)(=O)C1 ZINC001579057523 1075507741 /nfs/dbraw/zinc/50/77/41/1075507741.db2.gz KCDKKPQHVFABOE-JTQLQIEISA-N -1 3 381.418 -1.463 20 0 GAADHM CN(C[C@H](O)CNc1ncccc1-c1nn[n-]n1)C(=O)C1CS(=O)(=O)C1 ZINC001579057527 1075508352 /nfs/dbraw/zinc/50/83/52/1075508352.db2.gz KCDKKPQHVFABOE-SNVBAGLBSA-N -1 3 381.418 -1.463 20 0 GAADHM CN(C[C@H](O)CNc1ncccc1-c1nnn[n-]1)C(=O)C1CS(=O)(=O)C1 ZINC001579057527 1075508349 /nfs/dbraw/zinc/50/83/49/1075508349.db2.gz KCDKKPQHVFABOE-SNVBAGLBSA-N -1 3 381.418 -1.463 20 0 GAADHM CN(C[C@H](O)CNc1ncccc1-c1nn[n-]n1)C(=O)CN1CCNC(=O)C1 ZINC001579057677 1075508144 /nfs/dbraw/zinc/50/81/44/1075508144.db2.gz LEIFOLIVUJXYSH-LLVKDONJSA-N -1 3 389.420 -2.075 20 0 GAADHM CN(C[C@H](O)CNc1ncccc1-c1nnn[n-]1)C(=O)CN1CCNC(=O)C1 ZINC001579057677 1075508140 /nfs/dbraw/zinc/50/81/40/1075508140.db2.gz LEIFOLIVUJXYSH-LLVKDONJSA-N -1 3 389.420 -2.075 20 0 GAADHM CN(C[C@@H](O)CNc1ncccc1-c1nn[n-]n1)C(=O)CN1CCNC(=O)C1 ZINC001579057678 1075508160 /nfs/dbraw/zinc/50/81/60/1075508160.db2.gz LEIFOLIVUJXYSH-NSHDSACASA-N -1 3 389.420 -2.075 20 0 GAADHM CN(C[C@@H](O)CNc1ncccc1-c1nnn[n-]1)C(=O)CN1CCNC(=O)C1 ZINC001579057678 1075508154 /nfs/dbraw/zinc/50/81/54/1075508154.db2.gz 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ZINC001579057758 1075508201 /nfs/dbraw/zinc/50/82/01/1075508201.db2.gz MLVMPWJSWXTBBD-NSHDSACASA-N -1 3 389.420 -1.092 20 0 GAADHM CN(C[C@@H](O)CNc1ncccc1-c1nnn[n-]1)C(=O)CN1CCCNC1=O ZINC001579057758 1075508193 /nfs/dbraw/zinc/50/81/93/1075508193.db2.gz MLVMPWJSWXTBBD-NSHDSACASA-N -1 3 389.420 -1.092 20 0 GAADHM CN(C[C@@H](O)CNc1ncc(-c2nn[n-]n2)cc1F)C(=O)[C@H]1C[C@H]1C(N)=O ZINC001579057885 1075508220 /nfs/dbraw/zinc/50/82/20/1075508220.db2.gz OZJTVGPGYIFKIK-AEJSXWLSSA-N -1 3 378.368 -1.247 20 0 GAADHM CN(C[C@@H](O)CNc1ncc(-c2nnn[n-]2)cc1F)C(=O)[C@H]1C[C@H]1C(N)=O ZINC001579057885 1075508214 /nfs/dbraw/zinc/50/82/14/1075508214.db2.gz OZJTVGPGYIFKIK-AEJSXWLSSA-N -1 3 378.368 -1.247 20 0 GAADHM CN(C[C@H](O)CNc1ncc(-c2nn[n-]n2)cc1F)C(=O)[C@H]1C[C@H]1C(N)=O ZINC001579057886 1075508131 /nfs/dbraw/zinc/50/81/31/1075508131.db2.gz OZJTVGPGYIFKIK-BBBLOLIVSA-N -1 3 378.368 -1.247 20 0 GAADHM CN(C[C@H](O)CNc1ncc(-c2nnn[n-]2)cc1F)C(=O)[C@H]1C[C@H]1C(N)=O ZINC001579057886 1075508127 /nfs/dbraw/zinc/50/81/27/1075508127.db2.gz OZJTVGPGYIFKIK-BBBLOLIVSA-N -1 3 378.368 -1.247 20 0 GAADHM CN(C[C@@H](O)CNc1ncccc1-c1nn[n-]n1)C(=O)CN1C(=O)CCC1=O ZINC001579057959 1075508325 /nfs/dbraw/zinc/50/83/25/1075508325.db2.gz QDMKTDQJTYARRL-JTQLQIEISA-N -1 3 388.388 -1.358 20 0 GAADHM CN(C[C@@H](O)CNc1ncccc1-c1nnn[n-]1)C(=O)CN1C(=O)CCC1=O ZINC001579057959 1075508320 /nfs/dbraw/zinc/50/83/20/1075508320.db2.gz QDMKTDQJTYARRL-JTQLQIEISA-N -1 3 388.388 -1.358 20 0 GAADHM CN(C[C@H](O)CNc1ncccc1-c1nn[n-]n1)C(=O)CN1C(=O)CCC1=O ZINC001579057960 1075508178 /nfs/dbraw/zinc/50/81/78/1075508178.db2.gz QDMKTDQJTYARRL-SNVBAGLBSA-N -1 3 388.388 -1.358 20 0 GAADHM CN(C[C@H](O)CNc1ncccc1-c1nnn[n-]1)C(=O)CN1C(=O)CCC1=O ZINC001579057960 1075508172 /nfs/dbraw/zinc/50/81/72/1075508172.db2.gz QDMKTDQJTYARRL-SNVBAGLBSA-N -1 3 388.388 -1.358 20 0 GAADHM CN(C[C@H](O)CNc1ncc(-c2nn[n-]n2)cc1F)C(=O)Cn1cnnn1 ZINC001579057981 1075508280 /nfs/dbraw/zinc/50/82/80/1075508280.db2.gz QPTGWKMEOSZJBW-SECBINFHSA-N -1 3 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ZINC001579058072 1075508339 /nfs/dbraw/zinc/50/83/39/1075508339.db2.gz STAMCJUVOSWNRT-SNVBAGLBSA-N -1 3 383.434 -1.072 20 0 GAADHM CN(C[C@H](O)CNc1ncccc1-c1nnn[n-]1)C(=O)CCS(C)(=O)=O ZINC001579058072 1075508334 /nfs/dbraw/zinc/50/83/34/1075508334.db2.gz STAMCJUVOSWNRT-SNVBAGLBSA-N -1 3 383.434 -1.072 20 0 GAADHM CN(C[C@@H](O)CNc1ncc(-c2nn[n-]n2)cc1F)C(=O)Cn1cncn1 ZINC001579058089 1075508367 /nfs/dbraw/zinc/50/83/67/1075508367.db2.gz SWJLOSPIOZCWEZ-JTQLQIEISA-N -1 3 376.356 -1.076 20 0 GAADHM CN(C[C@@H](O)CNc1ncc(-c2nnn[n-]2)cc1F)C(=O)Cn1cncn1 ZINC001579058089 1075508363 /nfs/dbraw/zinc/50/83/63/1075508363.db2.gz SWJLOSPIOZCWEZ-JTQLQIEISA-N -1 3 376.356 -1.076 20 0 GAADHM CN(C[C@H](O)CNc1ncc(-c2nn[n-]n2)cc1F)C(=O)Cn1cncn1 ZINC001579058090 1075508304 /nfs/dbraw/zinc/50/83/04/1075508304.db2.gz SWJLOSPIOZCWEZ-SNVBAGLBSA-N -1 3 376.356 -1.076 20 0 GAADHM CN(C[C@H](O)CNc1ncc(-c2nnn[n-]2)cc1F)C(=O)Cn1cncn1 ZINC001579058090 1075508297 /nfs/dbraw/zinc/50/82/97/1075508297.db2.gz SWJLOSPIOZCWEZ-SNVBAGLBSA-N -1 3 376.356 -1.076 20 0 GAADHM CN(C[C@@H](O)CNc1ncc(-c2nn[n-]n2)cc1F)C(=O)[C@H]1CCC(=O)N1 ZINC001579058323 1075508239 /nfs/dbraw/zinc/50/82/39/1075508239.db2.gz YNJYVLXPWBMIRF-GXSJLCMTSA-N -1 3 378.368 -1.089 20 0 GAADHM CN(C[C@@H](O)CNc1ncc(-c2nnn[n-]2)cc1F)C(=O)[C@H]1CCC(=O)N1 ZINC001579058323 1075508233 /nfs/dbraw/zinc/50/82/33/1075508233.db2.gz YNJYVLXPWBMIRF-GXSJLCMTSA-N -1 3 378.368 -1.089 20 0 GAADHM CN(C[C@H](O)CNc1ncc(-c2nn[n-]n2)cc1F)C(=O)[C@@H]1CCC(=O)N1 ZINC001579058324 1075508732 /nfs/dbraw/zinc/50/87/32/1075508732.db2.gz YNJYVLXPWBMIRF-KOLCDFICSA-N -1 3 378.368 -1.089 20 0 GAADHM CN(C[C@H](O)CNc1ncc(-c2nnn[n-]2)cc1F)C(=O)[C@@H]1CCC(=O)N1 ZINC001579058324 1075508727 /nfs/dbraw/zinc/50/87/27/1075508727.db2.gz YNJYVLXPWBMIRF-KOLCDFICSA-N -1 3 378.368 -1.089 20 0 GAADHM CN(C[C@H](O)CNc1ncc(-c2nn[n-]n2)cc1F)C(=O)[C@H]1CCC(=O)N1 ZINC001579058325 1075508621 /nfs/dbraw/zinc/50/86/21/1075508621.db2.gz YNJYVLXPWBMIRF-MWLCHTKSSA-N -1 3 378.368 -1.089 20 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CN(C[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)C(=O)Cn1ncnn1 ZINC001579088844 1075513428 /nfs/dbraw/zinc/51/34/28/1075513428.db2.gz RCWDOBFDZPGCCR-JTQLQIEISA-N -1 3 385.392 -1.198 20 0 GAADHM CN(C[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)C(=O)Cn1ncnn1 ZINC001579088844 1075513426 /nfs/dbraw/zinc/51/34/26/1075513426.db2.gz RCWDOBFDZPGCCR-JTQLQIEISA-N -1 3 385.392 -1.198 20 0 GAADHM CN(C[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)C(=O)Cn1ncnn1 ZINC001579088846 1075513397 /nfs/dbraw/zinc/51/33/97/1075513397.db2.gz RCWDOBFDZPGCCR-SNVBAGLBSA-N -1 3 385.392 -1.198 20 0 GAADHM CN(C[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)C(=O)Cn1ncnn1 ZINC001579088846 1075513396 /nfs/dbraw/zinc/51/33/96/1075513396.db2.gz RCWDOBFDZPGCCR-SNVBAGLBSA-N -1 3 385.392 -1.198 20 0 GAADHM CN(C[C@@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)C(=O)Cn1ncnn1 ZINC001579088961 1075513340 /nfs/dbraw/zinc/51/33/40/1075513340.db2.gz VITLSXJRHKHMLM-JTQLQIEISA-N -1 3 385.392 -1.198 20 0 GAADHM 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CN(C[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)C(=O)CNC(N)=O ZINC001579089259 1075513384 /nfs/dbraw/zinc/51/33/84/1075513384.db2.gz QLKGNUWXNUCLTG-VIFPVBQESA-N -1 3 375.393 -1.216 20 0 GAADHM CN(C[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)C(=O)CNC(N)=O ZINC001579089259 1075513381 /nfs/dbraw/zinc/51/33/81/1075513381.db2.gz QLKGNUWXNUCLTG-VIFPVBQESA-N -1 3 375.393 -1.216 20 0 GAADHM CN(C[C@@H]1CCN(C(=O)Cn2ncnn2)C1)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579089385 1075513408 /nfs/dbraw/zinc/51/34/08/1075513408.db2.gz UQWKMOOUDWSWFW-JTQLQIEISA-N -1 3 385.392 -1.198 20 0 GAADHM CN(C[C@@H]1CCN(C(=O)Cn2ncnn2)C1)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579089385 1075513406 /nfs/dbraw/zinc/51/34/06/1075513406.db2.gz UQWKMOOUDWSWFW-JTQLQIEISA-N -1 3 385.392 -1.198 20 0 GAADHM CN(C[C@H]1CCN(C(=O)Cn2ncnn2)C1)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579089386 1075513242 /nfs/dbraw/zinc/51/32/42/1075513242.db2.gz UQWKMOOUDWSWFW-SNVBAGLBSA-N -1 3 385.392 -1.198 20 0 GAADHM CN(C[C@H]1CCN(C(=O)Cn2ncnn2)C1)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579089386 1075513237 /nfs/dbraw/zinc/51/32/37/1075513237.db2.gz UQWKMOOUDWSWFW-SNVBAGLBSA-N -1 3 385.392 -1.198 20 0 GAADHM CN(C[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)C(=O)Cn1ncnn1 ZINC001579089393 1075513265 /nfs/dbraw/zinc/51/32/65/1075513265.db2.gz UUWYAFXPWKAFPQ-JTQLQIEISA-N -1 3 385.392 -1.198 20 0 GAADHM CN(C[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)C(=O)Cn1ncnn1 ZINC001579089393 1075513257 /nfs/dbraw/zinc/51/32/57/1075513257.db2.gz UUWYAFXPWKAFPQ-JTQLQIEISA-N -1 3 385.392 -1.198 20 0 GAADHM CN(C[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)C(=O)Cn1ncnn1 ZINC001579089394 1075513307 /nfs/dbraw/zinc/51/33/07/1075513307.db2.gz UUWYAFXPWKAFPQ-SNVBAGLBSA-N -1 3 385.392 -1.198 20 0 GAADHM CN(C[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)C(=O)Cn1ncnn1 ZINC001579089394 1075513299 /nfs/dbraw/zinc/51/32/99/1075513299.db2.gz UUWYAFXPWKAFPQ-SNVBAGLBSA-N -1 3 385.392 -1.198 20 0 GAADHM CN(C[C@@H]1CCN(C(=O)Cn2ncnn2)C1)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579089454 1075513351 /nfs/dbraw/zinc/51/33/51/1075513351.db2.gz XCHPSFUYAPWFFK-JTQLQIEISA-N -1 3 385.392 -1.198 20 0 GAADHM CN(C[C@@H]1CCN(C(=O)Cn2ncnn2)C1)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579089454 1075513348 /nfs/dbraw/zinc/51/33/48/1075513348.db2.gz XCHPSFUYAPWFFK-JTQLQIEISA-N -1 3 385.392 -1.198 20 0 GAADHM CN(C[C@H]1CCN(C(=O)Cn2ncnn2)C1)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579089455 1075513751 /nfs/dbraw/zinc/51/37/51/1075513751.db2.gz XCHPSFUYAPWFFK-SNVBAGLBSA-N -1 3 385.392 -1.198 20 0 GAADHM CN(C[C@H]1CCN(C(=O)Cn2ncnn2)C1)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579089455 1075513747 /nfs/dbraw/zinc/51/37/47/1075513747.db2.gz XCHPSFUYAPWFFK-SNVBAGLBSA-N -1 3 385.392 -1.198 20 0 GAADHM CN(C[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)C(=O)c1nnn(C)n1 ZINC001579090222 1075513689 /nfs/dbraw/zinc/51/36/89/1075513689.db2.gz RVZGPTCUTOGYHC-SECBINFHSA-N -1 3 385.392 -1.047 20 0 GAADHM CN(C[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)C(=O)c1nnn(C)n1 ZINC001579090222 1075513688 /nfs/dbraw/zinc/51/36/88/1075513688.db2.gz RVZGPTCUTOGYHC-SECBINFHSA-N -1 3 385.392 -1.047 20 0 GAADHM CN(C[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)C(=O)c1nnn(C)n1 ZINC001579090223 1075513664 /nfs/dbraw/zinc/51/36/64/1075513664.db2.gz RVZGPTCUTOGYHC-VIFPVBQESA-N -1 3 385.392 -1.047 20 0 GAADHM CN(C[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)C(=O)c1nnn(C)n1 ZINC001579090223 1075513659 /nfs/dbraw/zinc/51/36/59/1075513659.db2.gz RVZGPTCUTOGYHC-VIFPVBQESA-N -1 3 385.392 -1.047 20 0 GAADHM CN(C[C@H]1CCN1C(=O)CCNC(N)=O)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579092300 1075513741 /nfs/dbraw/zinc/51/37/41/1075513741.db2.gz CIGKMAZWCZOWGV-SECBINFHSA-N -1 3 375.393 -1.074 20 0 GAADHM CN(C[C@H]1CCN1C(=O)CCNC(N)=O)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579092300 1075513740 /nfs/dbraw/zinc/51/37/40/1075513740.db2.gz CIGKMAZWCZOWGV-SECBINFHSA-N -1 3 375.393 -1.074 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)CCNC(N)=O)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579092301 1075513727 /nfs/dbraw/zinc/51/37/27/1075513727.db2.gz CIGKMAZWCZOWGV-VIFPVBQESA-N -1 3 375.393 -1.074 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)CCNC(N)=O)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579092301 1075513723 /nfs/dbraw/zinc/51/37/23/1075513723.db2.gz CIGKMAZWCZOWGV-VIFPVBQESA-N -1 3 375.393 -1.074 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)CN1CN=NC1=O)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579092340 1075513763 /nfs/dbraw/zinc/51/37/63/1075513763.db2.gz CVXWVFUTWQQLKH-JTQLQIEISA-N -1 3 386.376 -1.135 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)CN1CN=NC1=O)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579092340 1075513759 /nfs/dbraw/zinc/51/37/59/1075513759.db2.gz CVXWVFUTWQQLKH-JTQLQIEISA-N -1 3 386.376 -1.135 20 0 GAADHM CN(C[C@H]1CCN1C(=O)CN1CN=NC1=O)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579092341 1075513782 /nfs/dbraw/zinc/51/37/82/1075513782.db2.gz CVXWVFUTWQQLKH-SNVBAGLBSA-N -1 3 386.376 -1.135 20 0 GAADHM CN(C[C@H]1CCN1C(=O)CN1CN=NC1=O)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579092341 1075513779 /nfs/dbraw/zinc/51/37/79/1075513779.db2.gz CVXWVFUTWQQLKH-SNVBAGLBSA-N -1 3 386.376 -1.135 20 0 GAADHM CN(C[C@H]1CCN1C(=O)CCn1cnnn1)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579092521 1075513697 /nfs/dbraw/zinc/51/36/97/1075513697.db2.gz FIQYKNQQCQGTKY-LLVKDONJSA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C[C@H]1CCN1C(=O)CCn1cnnn1)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579092521 1075513695 /nfs/dbraw/zinc/51/36/95/1075513695.db2.gz FIQYKNQQCQGTKY-LLVKDONJSA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)CCn1cnnn1)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579092522 1075513790 /nfs/dbraw/zinc/51/37/90/1075513790.db2.gz FIQYKNQQCQGTKY-NSHDSACASA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)CCn1cnnn1)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579092522 1075513787 /nfs/dbraw/zinc/51/37/87/1075513787.db2.gz FIQYKNQQCQGTKY-NSHDSACASA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C[C@H]1CCN1C(=O)CCn1cnnn1)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579092523 1075513772 /nfs/dbraw/zinc/51/37/72/1075513772.db2.gz FJILLVILTDCMKL-LLVKDONJSA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C[C@H]1CCN1C(=O)CCn1cnnn1)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579092523 1075513770 /nfs/dbraw/zinc/51/37/70/1075513770.db2.gz FJILLVILTDCMKL-LLVKDONJSA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)CCn1cnnn1)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579092524 1075513719 /nfs/dbraw/zinc/51/37/19/1075513719.db2.gz FJILLVILTDCMKL-NSHDSACASA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)CCn1cnnn1)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579092524 1075513716 /nfs/dbraw/zinc/51/37/16/1075513716.db2.gz FJILLVILTDCMKL-NSHDSACASA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)CCNC(N)=O)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579092794 1075513633 /nfs/dbraw/zinc/51/36/33/1075513633.db2.gz IQULTXYSKHPPPJ-JTQLQIEISA-N -1 3 375.393 -1.074 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)CCNC(N)=O)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579092794 1075513627 /nfs/dbraw/zinc/51/36/27/1075513627.db2.gz IQULTXYSKHPPPJ-JTQLQIEISA-N -1 3 375.393 -1.074 20 0 GAADHM CN(C[C@H]1CCN1C(=O)CCNC(N)=O)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579092795 1075513705 /nfs/dbraw/zinc/51/37/05/1075513705.db2.gz IQULTXYSKHPPPJ-SNVBAGLBSA-N -1 3 375.393 -1.074 20 0 GAADHM CN(C[C@H]1CCN1C(=O)CCNC(N)=O)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579092795 1075513703 /nfs/dbraw/zinc/51/37/03/1075513703.db2.gz IQULTXYSKHPPPJ-SNVBAGLBSA-N -1 3 375.393 -1.074 20 0 GAADHM CN(C[C@H]1CCN(C(=O)c2nnn(C)n2)C1)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579092852 1075513647 /nfs/dbraw/zinc/51/36/47/1075513647.db2.gz KBFOXLJIBFEZEP-SECBINFHSA-N -1 3 385.392 -1.047 20 0 GAADHM CN(C[C@H]1CCN(C(=O)c2nnn(C)n2)C1)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579092852 1075513643 /nfs/dbraw/zinc/51/36/43/1075513643.db2.gz KBFOXLJIBFEZEP-SECBINFHSA-N -1 3 385.392 -1.047 20 0 GAADHM CN(C[C@@H]1CCN(C(=O)c2nnn(C)n2)C1)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579092853 1075513733 /nfs/dbraw/zinc/51/37/33/1075513733.db2.gz KBFOXLJIBFEZEP-VIFPVBQESA-N -1 3 385.392 -1.047 20 0 GAADHM CN(C[C@@H]1CCN(C(=O)c2nnn(C)n2)C1)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579092853 1075513732 /nfs/dbraw/zinc/51/37/32/1075513732.db2.gz KBFOXLJIBFEZEP-VIFPVBQESA-N -1 3 385.392 -1.047 20 0 GAADHM CN(C[C@H]1CCN(C(=O)c2nnn(C)n2)C1)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579092898 1075513673 /nfs/dbraw/zinc/51/36/73/1075513673.db2.gz LINFPGAAKJILOR-SECBINFHSA-N -1 3 385.392 -1.047 20 0 GAADHM CN(C[C@H]1CCN(C(=O)c2nnn(C)n2)C1)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579092898 1075513670 /nfs/dbraw/zinc/51/36/70/1075513670.db2.gz LINFPGAAKJILOR-SECBINFHSA-N -1 3 385.392 -1.047 20 0 GAADHM CN(C[C@@H]1CCN(C(=O)c2nnn(C)n2)C1)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579092899 1075513711 /nfs/dbraw/zinc/51/37/11/1075513711.db2.gz LINFPGAAKJILOR-VIFPVBQESA-N -1 3 385.392 -1.047 20 0 GAADHM CN(C[C@@H]1CCN(C(=O)c2nnn(C)n2)C1)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579092899 1075513709 /nfs/dbraw/zinc/51/37/09/1075513709.db2.gz LINFPGAAKJILOR-VIFPVBQESA-N -1 3 385.392 -1.047 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)CS(C)(=O)=O)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579092968 1075513682 /nfs/dbraw/zinc/51/36/82/1075513682.db2.gz NDJGRLCFZYMDTI-JTQLQIEISA-N -1 3 381.418 -1.088 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)CS(C)(=O)=O)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579092968 1075513680 /nfs/dbraw/zinc/51/36/80/1075513680.db2.gz NDJGRLCFZYMDTI-JTQLQIEISA-N -1 3 381.418 -1.088 20 0 GAADHM CN(C[C@H]1CCN1C(=O)CS(C)(=O)=O)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579092969 1075514199 /nfs/dbraw/zinc/51/41/99/1075514199.db2.gz NDJGRLCFZYMDTI-SNVBAGLBSA-N -1 3 381.418 -1.088 20 0 GAADHM CN(C[C@H]1CCN1C(=O)CS(C)(=O)=O)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579092969 1075514196 /nfs/dbraw/zinc/51/41/96/1075514196.db2.gz NDJGRLCFZYMDTI-SNVBAGLBSA-N -1 3 381.418 -1.088 20 0 GAADHM CN(C[C@H]1CCN1C(=O)CN1CN=NC1=O)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579092974 1075514154 /nfs/dbraw/zinc/51/41/54/1075514154.db2.gz NKOGFQGGLRLRFK-SECBINFHSA-N -1 3 386.376 -1.135 20 0 GAADHM CN(C[C@H]1CCN1C(=O)CN1CN=NC1=O)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579092974 1075514150 /nfs/dbraw/zinc/51/41/50/1075514150.db2.gz NKOGFQGGLRLRFK-SECBINFHSA-N -1 3 386.376 -1.135 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)CN1CN=NC1=O)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579092975 1075514117 /nfs/dbraw/zinc/51/41/17/1075514117.db2.gz NKOGFQGGLRLRFK-VIFPVBQESA-N -1 3 386.376 -1.135 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)CN1CN=NC1=O)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579092975 1075514113 /nfs/dbraw/zinc/51/41/13/1075514113.db2.gz NKOGFQGGLRLRFK-VIFPVBQESA-N -1 3 386.376 -1.135 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)CCn1cnnn1)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579093047 1075514082 /nfs/dbraw/zinc/51/40/82/1075514082.db2.gz ORKJCCMUAWSGDY-JTQLQIEISA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)CCn1cnnn1)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579093047 1075514080 /nfs/dbraw/zinc/51/40/80/1075514080.db2.gz ORKJCCMUAWSGDY-JTQLQIEISA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C[C@H]1CCN1C(=O)CCn1cnnn1)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579093048 1075514186 /nfs/dbraw/zinc/51/41/86/1075514186.db2.gz ORKJCCMUAWSGDY-SNVBAGLBSA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C[C@H]1CCN1C(=O)CCn1cnnn1)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579093048 1075514182 /nfs/dbraw/zinc/51/41/82/1075514182.db2.gz ORKJCCMUAWSGDY-SNVBAGLBSA-N -1 3 385.392 -1.056 20 0 GAADHM CN(C[C@H]1CCN1C(=O)CS(C)(=O)=O)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579093167 1075514133 /nfs/dbraw/zinc/51/41/33/1075514133.db2.gz RJKAFWNIHURSIS-SECBINFHSA-N -1 3 381.418 -1.088 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)CS(C)(=O)=O)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579093168 1075514123 /nfs/dbraw/zinc/51/41/23/1075514123.db2.gz RJKAFWNIHURSIS-VIFPVBQESA-N -1 3 381.418 -1.088 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)CN1CN=NC1=O)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579093211 1075514091 /nfs/dbraw/zinc/51/40/91/1075514091.db2.gz SHLIDRSKDKHIKW-JTQLQIEISA-N -1 3 386.376 -1.135 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)CN1CN=NC1=O)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579093211 1075514088 /nfs/dbraw/zinc/51/40/88/1075514088.db2.gz SHLIDRSKDKHIKW-JTQLQIEISA-N -1 3 386.376 -1.135 20 0 GAADHM CN(C[C@H]1CCN1C(=O)CN1CN=NC1=O)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579093212 1075514024 /nfs/dbraw/zinc/51/40/24/1075514024.db2.gz SHLIDRSKDKHIKW-SNVBAGLBSA-N -1 3 386.376 -1.135 20 0 GAADHM CN(C[C@H]1CCN1C(=O)CN1CN=NC1=O)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579093212 1075514020 /nfs/dbraw/zinc/51/40/20/1075514020.db2.gz SHLIDRSKDKHIKW-SNVBAGLBSA-N -1 3 386.376 -1.135 20 0 GAADHM CN(C[C@H]1CCN(C(=O)c2nnn(C)n2)C1)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579093263 1075514012 /nfs/dbraw/zinc/51/40/12/1075514012.db2.gz UCIWZNVCFZLGFA-SECBINFHSA-N -1 3 385.392 -1.047 20 0 GAADHM CN(C[C@H]1CCN(C(=O)c2nnn(C)n2)C1)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579093263 1075514009 /nfs/dbraw/zinc/51/40/09/1075514009.db2.gz UCIWZNVCFZLGFA-SECBINFHSA-N -1 3 385.392 -1.047 20 0 GAADHM CN(C[C@@H]1CCN(C(=O)c2nnn(C)n2)C1)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579093264 1075514104 /nfs/dbraw/zinc/51/41/04/1075514104.db2.gz UCIWZNVCFZLGFA-VIFPVBQESA-N -1 3 385.392 -1.047 20 0 GAADHM CN(C[C@@H]1CCN(C(=O)c2nnn(C)n2)C1)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579093264 1075514101 /nfs/dbraw/zinc/51/41/01/1075514101.db2.gz UCIWZNVCFZLGFA-VIFPVBQESA-N -1 3 385.392 -1.047 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1)C(=O)CS(C)(=O)=O ZINC001579094548 1075514064 /nfs/dbraw/zinc/51/40/64/1075514064.db2.gz AKBMGXDTWGZPKJ-JTQLQIEISA-N -1 3 381.418 -1.088 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1)C(=O)CS(C)(=O)=O ZINC001579094548 1075514061 /nfs/dbraw/zinc/51/40/61/1075514061.db2.gz AKBMGXDTWGZPKJ-JTQLQIEISA-N -1 3 381.418 -1.088 20 0 GAADHM CN(C[C@H]1CCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1)C(=O)CS(C)(=O)=O ZINC001579094549 1075514036 /nfs/dbraw/zinc/51/40/36/1075514036.db2.gz AKBMGXDTWGZPKJ-SNVBAGLBSA-N -1 3 381.418 -1.088 20 0 GAADHM CN(C[C@H]1CCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1)C(=O)CS(C)(=O)=O ZINC001579094549 1075514032 /nfs/dbraw/zinc/51/40/32/1075514032.db2.gz AKBMGXDTWGZPKJ-SNVBAGLBSA-N -1 3 381.418 -1.088 20 0 GAADHM CN(C[C@H]1CCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1)C(=O)CCNC(N)=O ZINC001579096274 1075514209 /nfs/dbraw/zinc/51/42/09/1075514209.db2.gz DFLBETCBCVDUBB-SECBINFHSA-N -1 3 375.393 -1.074 20 0 GAADHM CN(C[C@H]1CCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1)C(=O)CCNC(N)=O ZINC001579096274 1075514205 /nfs/dbraw/zinc/51/42/05/1075514205.db2.gz DFLBETCBCVDUBB-SECBINFHSA-N -1 3 375.393 -1.074 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1)C(=O)CCNC(N)=O ZINC001579096275 1075514076 /nfs/dbraw/zinc/51/40/76/1075514076.db2.gz DFLBETCBCVDUBB-VIFPVBQESA-N -1 3 375.393 -1.074 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1)C(=O)CCNC(N)=O ZINC001579096275 1075514072 /nfs/dbraw/zinc/51/40/72/1075514072.db2.gz DFLBETCBCVDUBB-VIFPVBQESA-N -1 3 375.393 -1.074 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1)C(=O)CCNC(N)=O ZINC001579097012 1075514145 /nfs/dbraw/zinc/51/41/45/1075514145.db2.gz XQJUJWRQLCXDPE-JTQLQIEISA-N -1 3 375.393 -1.074 20 0 GAADHM CN(C[C@@H]1CCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1)C(=O)CCNC(N)=O ZINC001579097012 1075514140 /nfs/dbraw/zinc/51/41/40/1075514140.db2.gz XQJUJWRQLCXDPE-JTQLQIEISA-N -1 3 375.393 -1.074 20 0 GAADHM CN(C[C@H]1CCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1)C(=O)CCNC(N)=O ZINC001579097013 1075514164 /nfs/dbraw/zinc/51/41/64/1075514164.db2.gz XQJUJWRQLCXDPE-SNVBAGLBSA-N -1 3 375.393 -1.074 20 0 GAADHM CN(C[C@H]1CCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1)C(=O)CCNC(N)=O ZINC001579097013 1075514162 /nfs/dbraw/zinc/51/41/62/1075514162.db2.gz XQJUJWRQLCXDPE-SNVBAGLBSA-N -1 3 375.393 -1.074 20 0 GAADHM 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CN(c1ccc(-c2nn[n-]n2)cn1)[C@@H]1CCN(C(=O)[C@H]2CCS(=O)(=O)N2)C1 ZINC001579271126 1075528348 /nfs/dbraw/zinc/52/83/48/1075528348.db2.gz JTNXUTYOQDBJSG-VXGBXAGGSA-N -1 3 392.445 -1.010 20 0 GAADHM CN(c1ccc(-c2nnn[n-]2)cn1)[C@@H]1CCN(C(=O)[C@H]2CCS(=O)(=O)N2)C1 ZINC001579271126 1075528346 /nfs/dbraw/zinc/52/83/46/1075528346.db2.gz JTNXUTYOQDBJSG-VXGBXAGGSA-N -1 3 392.445 -1.010 20 0 GAADHM CN(c1ccc(-c2nn[n-]n2)nc1)[C@H]1CCN(C(=O)[C@@H]2CCS(=O)(=O)N2)C1 ZINC001579271151 1075528275 /nfs/dbraw/zinc/52/82/75/1075528275.db2.gz ACSILXGFNCCMRS-AAEUAGOBSA-N -1 3 392.445 -1.010 20 0 GAADHM CN(c1ccc(-c2nnn[n-]2)nc1)[C@H]1CCN(C(=O)[C@@H]2CCS(=O)(=O)N2)C1 ZINC001579271151 1075528273 /nfs/dbraw/zinc/52/82/73/1075528273.db2.gz ACSILXGFNCCMRS-AAEUAGOBSA-N -1 3 392.445 -1.010 20 0 GAADHM CN(c1ccc(-c2nn[n-]n2)nc1)[C@@H]1CCN(C(=O)[C@H]2CCS(=O)(=O)N2)C1 ZINC001579271154 1075528249 /nfs/dbraw/zinc/52/82/49/1075528249.db2.gz ACSILXGFNCCMRS-DGCLKSJQSA-N -1 3 392.445 -1.010 20 0 GAADHM CN(c1ccc(-c2nnn[n-]2)nc1)[C@@H]1CCN(C(=O)[C@H]2CCS(=O)(=O)N2)C1 ZINC001579271154 1075528247 /nfs/dbraw/zinc/52/82/47/1075528247.db2.gz ACSILXGFNCCMRS-DGCLKSJQSA-N -1 3 392.445 -1.010 20 0 GAADHM CN(c1ccc(-c2nn[n-]n2)nc1)[C@H]1CCN(C(=O)[C@H]2CCS(=O)(=O)N2)C1 ZINC001579271156 1075528264 /nfs/dbraw/zinc/52/82/64/1075528264.db2.gz ACSILXGFNCCMRS-WCQYABFASA-N -1 3 392.445 -1.010 20 0 GAADHM CN(c1ccc(-c2nnn[n-]2)nc1)[C@H]1CCN(C(=O)[C@H]2CCS(=O)(=O)N2)C1 ZINC001579271156 1075528263 /nfs/dbraw/zinc/52/82/63/1075528263.db2.gz ACSILXGFNCCMRS-WCQYABFASA-N -1 3 392.445 -1.010 20 0 GAADHM CN(c1ccc(-c2nn[n-]n2)nc1)[C@@H]1CCN(C(=O)[C@@H]2CCS(=O)(=O)N2)C1 ZINC001579271158 1075528588 /nfs/dbraw/zinc/52/85/88/1075528588.db2.gz ACSILXGFNCCMRS-YPMHNXCESA-N -1 3 392.445 -1.010 20 0 GAADHM CN(c1ccc(-c2nnn[n-]2)nc1)[C@@H]1CCN(C(=O)[C@@H]2CCS(=O)(=O)N2)C1 ZINC001579271158 1075528585 /nfs/dbraw/zinc/52/85/85/1075528585.db2.gz ACSILXGFNCCMRS-YPMHNXCESA-N -1 3 392.445 -1.010 20 0 GAADHM CN(c1ccc(-c2nn[n-]n2)cn1)[C@@H]1CCN(C(=O)CN2CCNC(=O)C2)C1 ZINC001579271225 1075528615 /nfs/dbraw/zinc/52/86/15/1075528615.db2.gz KUWZMLIZLCTFGR-CYBMUJFWSA-N -1 3 385.432 -1.269 20 0 GAADHM CN(c1ccc(-c2nnn[n-]2)cn1)[C@@H]1CCN(C(=O)CN2CCNC(=O)C2)C1 ZINC001579271225 1075528611 /nfs/dbraw/zinc/52/86/11/1075528611.db2.gz KUWZMLIZLCTFGR-CYBMUJFWSA-N -1 3 385.432 -1.269 20 0 GAADHM CN(c1ccc(-c2nn[n-]n2)nc1)[C@@H]1CCN(C(=O)Cn2ncn(C)c2=O)C1 ZINC001579271360 1075528575 /nfs/dbraw/zinc/52/85/75/1075528575.db2.gz DHASDUDIWIVVIM-GFCCVEGCSA-N -1 3 384.404 -1.106 20 0 GAADHM CN(c1ccc(-c2nnn[n-]2)nc1)[C@@H]1CCN(C(=O)Cn2ncn(C)c2=O)C1 ZINC001579271360 1075528572 /nfs/dbraw/zinc/52/85/72/1075528572.db2.gz DHASDUDIWIVVIM-GFCCVEGCSA-N -1 3 384.404 -1.106 20 0 GAADHM CN(c1ccc(-c2nn[n-]n2)nc1)[C@H]1CCN(C(=O)Cn2ncn(C)c2=O)C1 ZINC001579271362 1075528860 /nfs/dbraw/zinc/52/88/60/1075528860.db2.gz DHASDUDIWIVVIM-LBPRGKRZSA-N -1 3 384.404 -1.106 20 0 GAADHM CN(c1ccc(-c2nnn[n-]2)nc1)[C@H]1CCN(C(=O)Cn2ncn(C)c2=O)C1 ZINC001579271362 1075528857 /nfs/dbraw/zinc/52/88/57/1075528857.db2.gz DHASDUDIWIVVIM-LBPRGKRZSA-N -1 3 384.404 -1.106 20 0 GAADHM CN(c1ccc(-c2nn[n-]n2)cn1)[C@H]1CCN(C(=O)CN2CCNC(=O)C2)C1 ZINC001579271488 1075528845 /nfs/dbraw/zinc/52/88/45/1075528845.db2.gz KUWZMLIZLCTFGR-ZDUSSCGKSA-N -1 3 385.432 -1.269 20 0 GAADHM CN(c1ccc(-c2nnn[n-]2)cn1)[C@H]1CCN(C(=O)CN2CCNC(=O)C2)C1 ZINC001579271488 1075528837 /nfs/dbraw/zinc/52/88/37/1075528837.db2.gz KUWZMLIZLCTFGR-ZDUSSCGKSA-N -1 3 385.432 -1.269 20 0 GAADHM CN(c1ccc(-c2nn[n-]n2)nc1)[C@@H]1CCN(C(=O)CN2CCNC(=O)C2)C1 ZINC001579272724 1075528737 /nfs/dbraw/zinc/52/87/37/1075528737.db2.gz SUAQDNCBTOJDDW-CYBMUJFWSA-N -1 3 385.432 -1.269 20 0 GAADHM CN(c1ccc(-c2nnn[n-]2)nc1)[C@@H]1CCN(C(=O)CN2CCNC(=O)C2)C1 ZINC001579272724 1075528730 /nfs/dbraw/zinc/52/87/30/1075528730.db2.gz SUAQDNCBTOJDDW-CYBMUJFWSA-N -1 3 385.432 -1.269 20 0 GAADHM CN(c1ccc(-c2nn[n-]n2)nc1)[C@H]1CCN(C(=O)CN2CCNC(=O)C2)C1 ZINC001579272725 1075528780 /nfs/dbraw/zinc/52/87/80/1075528780.db2.gz SUAQDNCBTOJDDW-ZDUSSCGKSA-N -1 3 385.432 -1.269 20 0 GAADHM CN(c1ccc(-c2nnn[n-]2)nc1)[C@H]1CCN(C(=O)CN2CCNC(=O)C2)C1 ZINC001579272725 1075528775 /nfs/dbraw/zinc/52/87/75/1075528775.db2.gz SUAQDNCBTOJDDW-ZDUSSCGKSA-N -1 3 385.432 -1.269 20 0 GAADHM CN(c1ccc(-c2nn[n-]n2)cn1)[C@@H]1CCN(C(=O)Cn2ncn(C)c2=O)C1 ZINC001579273211 1075528799 /nfs/dbraw/zinc/52/87/99/1075528799.db2.gz WNFYCCFLJPSZMC-GFCCVEGCSA-N -1 3 384.404 -1.106 20 0 GAADHM CN(c1ccc(-c2nnn[n-]2)cn1)[C@@H]1CCN(C(=O)Cn2ncn(C)c2=O)C1 ZINC001579273211 1075528794 /nfs/dbraw/zinc/52/87/94/1075528794.db2.gz WNFYCCFLJPSZMC-GFCCVEGCSA-N -1 3 384.404 -1.106 20 0 GAADHM CN(c1ccc(-c2nn[n-]n2)cn1)[C@H]1CCN(C(=O)Cn2ncn(C)c2=O)C1 ZINC001579273213 1075528688 /nfs/dbraw/zinc/52/86/88/1075528688.db2.gz WNFYCCFLJPSZMC-LBPRGKRZSA-N -1 3 384.404 -1.106 20 0 GAADHM CN(c1ccc(-c2nnn[n-]2)cn1)[C@H]1CCN(C(=O)Cn2ncn(C)c2=O)C1 ZINC001579273213 1075528683 /nfs/dbraw/zinc/52/86/83/1075528683.db2.gz WNFYCCFLJPSZMC-LBPRGKRZSA-N -1 3 384.404 -1.106 20 0 GAADHM CN(c1ncccc1-c1nn[n-]n1)[C@H]1CCN(C(=O)[C@H]2CCS(=O)(=O)N2)C1 ZINC001579292488 1075529504 /nfs/dbraw/zinc/52/95/04/1075529504.db2.gz ITFQBLALTYWYLC-CMPLNLGQSA-N -1 3 392.445 -1.010 20 0 GAADHM CN(c1ncccc1-c1nnn[n-]1)[C@H]1CCN(C(=O)[C@H]2CCS(=O)(=O)N2)C1 ZINC001579292488 1075529501 /nfs/dbraw/zinc/52/95/01/1075529501.db2.gz ITFQBLALTYWYLC-CMPLNLGQSA-N -1 3 392.445 -1.010 20 0 GAADHM CN(c1ncccc1-c1nn[n-]n1)[C@H]1CCN(C(=O)[C@@H]2CCS(=O)(=O)N2)C1 ZINC001579292489 1075529655 /nfs/dbraw/zinc/52/96/55/1075529655.db2.gz ITFQBLALTYWYLC-JQWIXIFHSA-N -1 3 392.445 -1.010 20 0 GAADHM CN(c1ncccc1-c1nnn[n-]1)[C@H]1CCN(C(=O)[C@@H]2CCS(=O)(=O)N2)C1 ZINC001579292489 1075529653 /nfs/dbraw/zinc/52/96/53/1075529653.db2.gz ITFQBLALTYWYLC-JQWIXIFHSA-N -1 3 392.445 -1.010 20 0 GAADHM CN(c1ncccc1-c1nn[n-]n1)[C@@H]1CCN(C(=O)[C@@H]2CCS(=O)(=O)N2)C1 ZINC001579292490 1075529473 /nfs/dbraw/zinc/52/94/73/1075529473.db2.gz ITFQBLALTYWYLC-PWSUYJOCSA-N -1 3 392.445 -1.010 20 0 GAADHM CN(c1ncccc1-c1nnn[n-]1)[C@@H]1CCN(C(=O)[C@@H]2CCS(=O)(=O)N2)C1 ZINC001579292490 1075529469 /nfs/dbraw/zinc/52/94/69/1075529469.db2.gz ITFQBLALTYWYLC-PWSUYJOCSA-N -1 3 392.445 -1.010 20 0 GAADHM CN(c1ncccc1-c1nn[n-]n1)[C@@H]1CCN(C(=O)[C@H]2CCS(=O)(=O)N2)C1 ZINC001579292491 1075529550 /nfs/dbraw/zinc/52/95/50/1075529550.db2.gz ITFQBLALTYWYLC-ZYHUDNBSSA-N -1 3 392.445 -1.010 20 0 GAADHM CN(c1ncccc1-c1nnn[n-]1)[C@@H]1CCN(C(=O)[C@H]2CCS(=O)(=O)N2)C1 ZINC001579292491 1075529547 /nfs/dbraw/zinc/52/95/47/1075529547.db2.gz ITFQBLALTYWYLC-ZYHUDNBSSA-N -1 3 392.445 -1.010 20 0 GAADHM CN(c1ncccc1-c1nn[n-]n1)[C@@H]1CCN(C(=O)CN2CCNC(=O)C2)C1 ZINC001579292641 1075529665 /nfs/dbraw/zinc/52/96/65/1075529665.db2.gz BEAZDYDHYKBHIV-GFCCVEGCSA-N -1 3 385.432 -1.269 20 0 GAADHM CN(c1ncccc1-c1nnn[n-]1)[C@@H]1CCN(C(=O)CN2CCNC(=O)C2)C1 ZINC001579292641 1075529662 /nfs/dbraw/zinc/52/96/62/1075529662.db2.gz BEAZDYDHYKBHIV-GFCCVEGCSA-N -1 3 385.432 -1.269 20 0 GAADHM CN(c1ncccc1-c1nn[n-]n1)[C@H]1CCN(C(=O)CN2CCNC(=O)C2)C1 ZINC001579292642 1075529603 /nfs/dbraw/zinc/52/96/03/1075529603.db2.gz BEAZDYDHYKBHIV-LBPRGKRZSA-N -1 3 385.432 -1.269 20 0 GAADHM CN(c1ncccc1-c1nnn[n-]1)[C@H]1CCN(C(=O)CN2CCNC(=O)C2)C1 ZINC001579292642 1075529599 /nfs/dbraw/zinc/52/95/99/1075529599.db2.gz BEAZDYDHYKBHIV-LBPRGKRZSA-N -1 3 385.432 -1.269 20 0 GAADHM CN(c1ncccc1-c1nn[n-]n1)[C@@H]1CCN(C(=O)[C@@H]2CC(=O)NC(=O)N2)C1 ZINC001579294622 1075529632 /nfs/dbraw/zinc/52/96/32/1075529632.db2.gz QIZVSTKDFGPFHC-KOLCDFICSA-N -1 3 385.388 -1.103 20 0 GAADHM CN(c1ncccc1-c1nnn[n-]1)[C@@H]1CCN(C(=O)[C@@H]2CC(=O)NC(=O)N2)C1 ZINC001579294622 1075529630 /nfs/dbraw/zinc/52/96/30/1075529630.db2.gz QIZVSTKDFGPFHC-KOLCDFICSA-N -1 3 385.388 -1.103 20 0 GAADHM CN(c1ncccc1-c1nn[n-]n1)[C@H]1CCN(C(=O)[C@@H]2CC(=O)NC(=O)N2)C1 ZINC001579294623 1075529590 /nfs/dbraw/zinc/52/95/90/1075529590.db2.gz QIZVSTKDFGPFHC-ONGXEEELSA-N -1 3 385.388 -1.103 20 0 GAADHM CN(c1ncccc1-c1nnn[n-]1)[C@H]1CCN(C(=O)[C@@H]2CC(=O)NC(=O)N2)C1 ZINC001579294623 1075529588 /nfs/dbraw/zinc/52/95/88/1075529588.db2.gz QIZVSTKDFGPFHC-ONGXEEELSA-N -1 3 385.388 -1.103 20 0 GAADHM CN1C(=O)CC[C@@H]1CC(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579299203 1075529945 /nfs/dbraw/zinc/52/99/45/1075529945.db2.gz BCVMHGSYAHYEBJ-GHMZBOCLSA-N -1 3 390.404 -1.587 20 0 GAADHM CN1C(=O)CC[C@@H]1CC(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579299203 1075529942 /nfs/dbraw/zinc/52/99/42/1075529942.db2.gz BCVMHGSYAHYEBJ-GHMZBOCLSA-N -1 3 390.404 -1.587 20 0 GAADHM CN1C(=O)CC[C@@H]1CC(=O)NC[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579299204 1075530091 /nfs/dbraw/zinc/53/00/91/1075530091.db2.gz BCVMHGSYAHYEBJ-MNOVXSKESA-N -1 3 390.404 -1.587 20 0 GAADHM CN1C(=O)CC[C@@H]1CC(=O)NC[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579299204 1075530089 /nfs/dbraw/zinc/53/00/89/1075530089.db2.gz BCVMHGSYAHYEBJ-MNOVXSKESA-N -1 3 390.404 -1.587 20 0 GAADHM CN1C(=O)CC[C@H]1CC(=O)NC[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579299205 1075529889 /nfs/dbraw/zinc/52/98/89/1075529889.db2.gz BCVMHGSYAHYEBJ-QWRGUYRKSA-N -1 3 390.404 -1.587 20 0 GAADHM CN1C(=O)CC[C@H]1CC(=O)NC[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579299205 1075529885 /nfs/dbraw/zinc/52/98/85/1075529885.db2.gz BCVMHGSYAHYEBJ-QWRGUYRKSA-N -1 3 390.404 -1.587 20 0 GAADHM CN1C(=O)CC[C@H]1CC(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579299206 1075529872 /nfs/dbraw/zinc/52/98/72/1075529872.db2.gz BCVMHGSYAHYEBJ-WDEREUQCSA-N -1 3 390.404 -1.587 20 0 GAADHM CN1C(=O)CC[C@H]1CC(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579299206 1075529867 /nfs/dbraw/zinc/52/98/67/1075529867.db2.gz BCVMHGSYAHYEBJ-WDEREUQCSA-N -1 3 390.404 -1.587 20 0 GAADHM CN1C(=O)CC[C@@H]1C(=O)N(CCO)CCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579299211 1075530007 /nfs/dbraw/zinc/53/00/07/1075530007.db2.gz BELKJXFIZKUYCY-GFCCVEGCSA-N -1 3 390.404 -1.634 20 0 GAADHM CN1C(=O)CC[C@@H]1C(=O)N(CCO)CCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579299211 1075530001 /nfs/dbraw/zinc/53/00/01/1075530001.db2.gz BELKJXFIZKUYCY-GFCCVEGCSA-N -1 3 390.404 -1.634 20 0 GAADHM CN1C(=O)CCC[C@@H]1C(=O)NC[C@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579299255 1075529932 /nfs/dbraw/zinc/52/99/32/1075529932.db2.gz CPOAQOOSQYTRHV-BXKDBHETSA-N -1 3 390.404 -1.587 20 0 GAADHM CN1C(=O)CCC[C@@H]1C(=O)NC[C@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579299255 1075529927 /nfs/dbraw/zinc/52/99/27/1075529927.db2.gz CPOAQOOSQYTRHV-BXKDBHETSA-N -1 3 390.404 -1.587 20 0 GAADHM CN1C(=O)CCC[C@H]1C(=O)NC[C@@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579299256 1075530111 /nfs/dbraw/zinc/53/01/11/1075530111.db2.gz CPOAQOOSQYTRHV-CABZTGNLSA-N -1 3 390.404 -1.587 20 0 GAADHM CN1C(=O)CCC[C@H]1C(=O)NC[C@@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579299256 1075530108 /nfs/dbraw/zinc/53/01/08/1075530108.db2.gz CPOAQOOSQYTRHV-CABZTGNLSA-N -1 3 390.404 -1.587 20 0 GAADHM 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CNC(=O)[C@H](C)N1CCN(CCNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001579382740 1075582554 /nfs/dbraw/zinc/58/25/54/1075582554.db2.gz JCZXAJWVJJVUDS-NSHDSACASA-N -1 3 375.437 -1.323 20 0 GAADHM CNC(=O)[C@H](C)N1CCN(CCNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001579382740 1075582550 /nfs/dbraw/zinc/58/25/50/1075582550.db2.gz JCZXAJWVJJVUDS-NSHDSACASA-N -1 3 375.437 -1.323 20 0 GAADHM CNC(=O)[C@@H](C)N1CC(N2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)C1 ZINC001579383101 1075582654 /nfs/dbraw/zinc/58/26/54/1075582654.db2.gz NTZLOASLEPKEKC-LLVKDONJSA-N -1 3 387.448 -1.229 20 0 GAADHM CNC(=O)[C@@H](C)N1CC(N2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)C1 ZINC001579383101 1075582645 /nfs/dbraw/zinc/58/26/45/1075582645.db2.gz NTZLOASLEPKEKC-LLVKDONJSA-N -1 3 387.448 -1.229 20 0 GAADHM CNC(=O)[C@H](C)N1CC(N2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)C1 ZINC001579383102 1075582635 /nfs/dbraw/zinc/58/26/35/1075582635.db2.gz NTZLOASLEPKEKC-NSHDSACASA-N -1 3 387.448 -1.229 20 0 GAADHM CNC(=O)[C@H](C)N1CC(N2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)C1 ZINC001579383102 1075582627 /nfs/dbraw/zinc/58/26/27/1075582627.db2.gz NTZLOASLEPKEKC-NSHDSACASA-N -1 3 387.448 -1.229 20 0 GAADHM CNC(=O)[C@H](C)N1CCC(CO)(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001579383321 1075582458 /nfs/dbraw/zinc/58/24/58/1075582458.db2.gz QKYFGXWOESJGGQ-JTQLQIEISA-N -1 3 376.421 -1.114 20 0 GAADHM CNC(=O)[C@@H](C)N1CCC(CO)(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001579383322 1075582715 /nfs/dbraw/zinc/58/27/15/1075582715.db2.gz QKYFGXWOESJGGQ-SNVBAGLBSA-N -1 3 376.421 -1.114 20 0 GAADHM CNC(=O)[C@@H](C)N1CC(N2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2)C1 ZINC001579383379 1075582416 /nfs/dbraw/zinc/58/24/16/1075582416.db2.gz QWTYBIYLGJRCKN-LLVKDONJSA-N -1 3 387.448 -1.229 20 0 GAADHM CNC(=O)[C@@H](C)N1CC(N2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2)C1 ZINC001579383379 1075582413 /nfs/dbraw/zinc/58/24/13/1075582413.db2.gz QWTYBIYLGJRCKN-LLVKDONJSA-N -1 3 387.448 -1.229 20 0 GAADHM CNC(=O)[C@H](C)N1CC(N2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2)C1 ZINC001579383380 1075582933 /nfs/dbraw/zinc/58/29/33/1075582933.db2.gz QWTYBIYLGJRCKN-NSHDSACASA-N -1 3 387.448 -1.229 20 0 GAADHM CNC(=O)[C@H](C)N1CC(N2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2)C1 ZINC001579383380 1075582927 /nfs/dbraw/zinc/58/29/27/1075582927.db2.gz QWTYBIYLGJRCKN-NSHDSACASA-N -1 3 387.448 -1.229 20 0 GAADHM CNC(=O)[C@H](C)N1CCC(CO)(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001579383971 1075583050 /nfs/dbraw/zinc/58/30/50/1075583050.db2.gz YOKQFKYZOFCMPK-JTQLQIEISA-N -1 3 376.421 -1.114 20 0 GAADHM CNC(=O)[C@H](C)N1CCC(CO)(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001579383971 1075583047 /nfs/dbraw/zinc/58/30/47/1075583047.db2.gz YOKQFKYZOFCMPK-JTQLQIEISA-N -1 3 376.421 -1.114 20 0 GAADHM CNC(=O)[C@@H](C)N1CCC(CO)(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001579383972 1075583072 /nfs/dbraw/zinc/58/30/72/1075583072.db2.gz YOKQFKYZOFCMPK-SNVBAGLBSA-N -1 3 376.421 -1.114 20 0 GAADHM CNC(=O)[C@@H](C)N1CCC(CO)(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001579383972 1075583068 /nfs/dbraw/zinc/58/30/68/1075583068.db2.gz YOKQFKYZOFCMPK-SNVBAGLBSA-N -1 3 376.421 -1.114 20 0 GAADHM CNC(=O)C1(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)CC1 ZINC001579386290 1075582910 /nfs/dbraw/zinc/58/29/10/1075582910.db2.gz GXLYQESOVLPRLL-GHMZBOCLSA-N -1 3 388.388 -1.978 20 0 GAADHM CNC(=O)C1(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)CC1 ZINC001579386290 1075582903 /nfs/dbraw/zinc/58/29/03/1075582903.db2.gz GXLYQESOVLPRLL-GHMZBOCLSA-N -1 3 388.388 -1.978 20 0 GAADHM CNC(=O)C1(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)CC1 ZINC001579386632 1075583392 /nfs/dbraw/zinc/58/33/92/1075583392.db2.gz LSSBSNMZZBNINF-GHMZBOCLSA-N -1 3 388.388 -1.978 20 0 GAADHM CNC(=O)C1(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)CC1 ZINC001579386632 1075583389 /nfs/dbraw/zinc/58/33/89/1075583389.db2.gz LSSBSNMZZBNINF-GHMZBOCLSA-N -1 3 388.388 -1.978 20 0 GAADHM CNC(=O)CCCC(=O)N(C)C[C@@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579388190 1075583368 /nfs/dbraw/zinc/58/33/68/1075583368.db2.gz AMYMPLLSWAMGAC-JTQLQIEISA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)N(C)C[C@@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579388190 1075583365 /nfs/dbraw/zinc/58/33/65/1075583365.db2.gz AMYMPLLSWAMGAC-JTQLQIEISA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)N(C)C[C@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579388192 1075583336 /nfs/dbraw/zinc/58/33/36/1075583336.db2.gz AMYMPLLSWAMGAC-SNVBAGLBSA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)N(C)C[C@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579388192 1075583330 /nfs/dbraw/zinc/58/33/30/1075583330.db2.gz AMYMPLLSWAMGAC-SNVBAGLBSA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CC(=O)N1CCC(CO)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001579388465 1075583469 /nfs/dbraw/zinc/58/34/69/1075583469.db2.gz CHHUWCLYBAAVCK-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CNC(=O)CC(=O)N1CCC(CO)(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001579388465 1075583464 /nfs/dbraw/zinc/58/34/64/1075583464.db2.gz CHHUWCLYBAAVCK-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CNC(=O)CCCC(=O)N(C)C[C@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579388544 1075583688 /nfs/dbraw/zinc/58/36/88/1075583688.db2.gz FGJOODPTEOLOQL-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)N(C)C[C@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579388544 1075583682 /nfs/dbraw/zinc/58/36/82/1075583682.db2.gz FGJOODPTEOLOQL-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)N(C)C[C@@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579388546 1075583706 /nfs/dbraw/zinc/58/37/06/1075583706.db2.gz FGJOODPTEOLOQL-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)N(C)C[C@@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579388546 1075583703 /nfs/dbraw/zinc/58/37/03/1075583703.db2.gz FGJOODPTEOLOQL-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CC(=O)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1 ZINC001579388711 1075583845 /nfs/dbraw/zinc/58/38/45/1075583845.db2.gz IBDCRXKNVZRDMI-GZMMTYOYSA-N -1 3 376.377 -1.978 20 0 GAADHM CNC(=O)CC(=O)N1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H](O)C1 ZINC001579388711 1075583844 /nfs/dbraw/zinc/58/38/44/1075583844.db2.gz IBDCRXKNVZRDMI-GZMMTYOYSA-N -1 3 376.377 -1.978 20 0 GAADHM CNC(=O)CC(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001579388712 1075583617 /nfs/dbraw/zinc/58/36/17/1075583617.db2.gz IBDCRXKNVZRDMI-KCJUWKMLSA-N -1 3 376.377 -1.978 20 0 GAADHM CNC(=O)CC(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001579388712 1075583613 /nfs/dbraw/zinc/58/36/13/1075583613.db2.gz IBDCRXKNVZRDMI-KCJUWKMLSA-N -1 3 376.377 -1.978 20 0 GAADHM CNC(=O)CC(=O)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001579388713 1075583667 /nfs/dbraw/zinc/58/36/67/1075583667.db2.gz IBDCRXKNVZRDMI-KWQFWETISA-N -1 3 376.377 -1.978 20 0 GAADHM CNC(=O)CC(=O)N1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001579388713 1075583663 /nfs/dbraw/zinc/58/36/63/1075583663.db2.gz IBDCRXKNVZRDMI-KWQFWETISA-N -1 3 376.377 -1.978 20 0 GAADHM CNC(=O)CC(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1 ZINC001579388714 1075583743 /nfs/dbraw/zinc/58/37/43/1075583743.db2.gz IBDCRXKNVZRDMI-LDYMZIIASA-N -1 3 376.377 -1.978 20 0 GAADHM CNC(=O)CC(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H](O)C1 ZINC001579388714 1075583737 /nfs/dbraw/zinc/58/37/37/1075583737.db2.gz IBDCRXKNVZRDMI-LDYMZIIASA-N -1 3 376.377 -1.978 20 0 GAADHM CNC(=O)CCCC(=O)N1CC(O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579388759 1075583835 /nfs/dbraw/zinc/58/38/35/1075583835.db2.gz IWBCGPUVXUWFMN-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CNC(=O)CCCC(=O)N1CC(O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579388759 1075583832 /nfs/dbraw/zinc/58/38/32/1075583832.db2.gz IWBCGPUVXUWFMN-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CNC(=O)CCCC(=O)N(C)C[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579388944 1075583727 /nfs/dbraw/zinc/58/37/27/1075583727.db2.gz NLHFGHOSEDUBMW-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)N(C)C[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579388944 1075583724 /nfs/dbraw/zinc/58/37/24/1075583724.db2.gz NLHFGHOSEDUBMW-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)N(C)C[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579388945 1075583826 /nfs/dbraw/zinc/58/38/26/1075583826.db2.gz NLHFGHOSEDUBMW-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)N(C)C[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579388945 1075583823 /nfs/dbraw/zinc/58/38/23/1075583823.db2.gz NLHFGHOSEDUBMW-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)N1CC(O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579389134 1075584263 /nfs/dbraw/zinc/58/42/63/1075584263.db2.gz SRRNPGDOORKWTP-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CNC(=O)CCCC(=O)N1CC(O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579389134 1075584259 /nfs/dbraw/zinc/58/42/59/1075584259.db2.gz SRRNPGDOORKWTP-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CNC(=O)CCCC(=O)N1CC(O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579389154 1075584305 /nfs/dbraw/zinc/58/43/05/1075584305.db2.gz UEPKWQRPCHYFHU-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CNC(=O)CCCC(=O)N1CC(O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579389154 1075584304 /nfs/dbraw/zinc/58/43/04/1075584304.db2.gz UEPKWQRPCHYFHU-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CNC(=O)CCCC(=O)N1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001579389964 1075584087 /nfs/dbraw/zinc/58/40/87/1075584087.db2.gz RJQNEOKTFRHRKA-NEPJUHHUSA-N -1 3 390.404 -1.587 20 0 GAADHM CNC(=O)CCCC(=O)N1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001579389964 1075584082 /nfs/dbraw/zinc/58/40/82/1075584082.db2.gz RJQNEOKTFRHRKA-NEPJUHHUSA-N -1 3 390.404 -1.587 20 0 GAADHM CNC(=O)CCCC(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579389965 1075584280 /nfs/dbraw/zinc/58/42/80/1075584280.db2.gz RJQNEOKTFRHRKA-VXGBXAGGSA-N -1 3 390.404 -1.587 20 0 GAADHM CNC(=O)CCCC(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579389965 1075584278 /nfs/dbraw/zinc/58/42/78/1075584278.db2.gz RJQNEOKTFRHRKA-VXGBXAGGSA-N -1 3 390.404 -1.587 20 0 GAADHM CNC(=O)CCCC(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579390175 1075584109 /nfs/dbraw/zinc/58/41/09/1075584109.db2.gz YKYMFDPLTCOKGD-VXGBXAGGSA-N -1 3 390.404 -1.587 20 0 GAADHM CNC(=O)CCCC(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579390175 1075584101 /nfs/dbraw/zinc/58/41/01/1075584101.db2.gz YKYMFDPLTCOKGD-VXGBXAGGSA-N -1 3 390.404 -1.587 20 0 GAADHM CNC(=O)CCCC(=O)NC[C@H](O)CN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579392304 1075584700 /nfs/dbraw/zinc/58/47/00/1075584700.db2.gz REKSDWWQQCRFIC-JTQLQIEISA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)NC[C@H](O)CN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579392304 1075584695 /nfs/dbraw/zinc/58/46/95/1075584695.db2.gz REKSDWWQQCRFIC-JTQLQIEISA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)NC[C@@H](O)CN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579392305 1075584452 /nfs/dbraw/zinc/58/44/52/1075584452.db2.gz REKSDWWQQCRFIC-SNVBAGLBSA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)NC[C@@H](O)CN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579392305 1075584445 /nfs/dbraw/zinc/58/44/45/1075584445.db2.gz REKSDWWQQCRFIC-SNVBAGLBSA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)NC[C@@H](O)CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579392485 1075584599 /nfs/dbraw/zinc/58/45/99/1075584599.db2.gz TYBYGUASCMVFRG-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)NC[C@@H](O)CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579392485 1075584595 /nfs/dbraw/zinc/58/45/95/1075584595.db2.gz TYBYGUASCMVFRG-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)NC[C@H](O)CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579392487 1075584536 /nfs/dbraw/zinc/58/45/36/1075584536.db2.gz TYBYGUASCMVFRG-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)NC[C@H](O)CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579392487 1075584529 /nfs/dbraw/zinc/58/45/29/1075584529.db2.gz TYBYGUASCMVFRG-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)NC[C@@H](O)CN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579392853 1075584495 /nfs/dbraw/zinc/58/44/95/1075584495.db2.gz WWJKSEGOVYKLHS-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)NC[C@@H](O)CN(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579392853 1075584486 /nfs/dbraw/zinc/58/44/86/1075584486.db2.gz WWJKSEGOVYKLHS-LLVKDONJSA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)NC[C@H](O)CN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579392854 1075584687 /nfs/dbraw/zinc/58/46/87/1075584687.db2.gz WWJKSEGOVYKLHS-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CCCC(=O)NC[C@H](O)CN(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579392854 1075584684 /nfs/dbraw/zinc/58/46/84/1075584684.db2.gz WWJKSEGOVYKLHS-NSHDSACASA-N -1 3 392.420 -1.340 20 0 GAADHM CNC(=O)CN(CC(=O)NC)C(=O)CNC(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001579393832 1075584946 /nfs/dbraw/zinc/58/49/46/1075584946.db2.gz DQGDGXBABCFGCC-UHFFFAOYSA-N -1 3 388.388 -2.083 20 0 GAADHM CNC(=O)CN(CC(=O)NC)C(=O)CNC(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001579393832 1075584944 /nfs/dbraw/zinc/58/49/44/1075584944.db2.gz DQGDGXBABCFGCC-UHFFFAOYSA-N -1 3 388.388 -2.083 20 0 GAADHM CNC(=O)CCCC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O ZINC001579394020 1075585014 /nfs/dbraw/zinc/58/50/14/1075585014.db2.gz KRJKWFIPAHMVKK-NEPJUHHUSA-N -1 3 390.404 -1.587 20 0 GAADHM CNC(=O)CCCC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O ZINC001579394020 1075585009 /nfs/dbraw/zinc/58/50/09/1075585009.db2.gz KRJKWFIPAHMVKK-NEPJUHHUSA-N -1 3 390.404 -1.587 20 0 GAADHM CNC(=O)CCCC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1O ZINC001579394021 1075584938 /nfs/dbraw/zinc/58/49/38/1075584938.db2.gz KRJKWFIPAHMVKK-VXGBXAGGSA-N -1 3 390.404 -1.587 20 0 GAADHM CNC(=O)CCCC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1O ZINC001579394021 1075584936 /nfs/dbraw/zinc/58/49/36/1075584936.db2.gz KRJKWFIPAHMVKK-VXGBXAGGSA-N -1 3 390.404 -1.587 20 0 GAADHM CNC(=O)CCCC(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001579394067 1075585474 /nfs/dbraw/zinc/58/54/74/1075585474.db2.gz LWMZXLGABIQABQ-NEPJUHHUSA-N -1 3 392.395 -1.017 20 0 GAADHM CNC(=O)CCCC(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001579394067 1075585471 /nfs/dbraw/zinc/58/54/71/1075585471.db2.gz LWMZXLGABIQABQ-NEPJUHHUSA-N -1 3 392.395 -1.017 20 0 GAADHM CNC(=O)CCCC(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001579394069 1075585417 /nfs/dbraw/zinc/58/54/17/1075585417.db2.gz LWMZXLGABIQABQ-VXGBXAGGSA-N -1 3 392.395 -1.017 20 0 GAADHM CNC(=O)CCCC(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001579394069 1075585413 /nfs/dbraw/zinc/58/54/13/1075585413.db2.gz LWMZXLGABIQABQ-VXGBXAGGSA-N -1 3 392.395 -1.017 20 0 GAADHM CNC(=O)CN(CC(=O)NC)C[C@@H](O)COc1ccccc1-c1nn[n-]n1 ZINC001579394102 1075585377 /nfs/dbraw/zinc/58/53/77/1075585377.db2.gz MZMRLPHTOUDPNH-LLVKDONJSA-N -1 3 377.405 -1.600 20 0 GAADHM CNC(=O)CN(CC(=O)NC)C[C@@H](O)COc1ccccc1-c1nnn[n-]1 ZINC001579394102 1075585372 /nfs/dbraw/zinc/58/53/72/1075585372.db2.gz MZMRLPHTOUDPNH-LLVKDONJSA-N -1 3 377.405 -1.600 20 0 GAADHM CNC(=O)CN(CC(=O)NC)C[C@H](O)COc1ccccc1-c1nn[n-]n1 ZINC001579394106 1075585481 /nfs/dbraw/zinc/58/54/81/1075585481.db2.gz MZMRLPHTOUDPNH-NSHDSACASA-N -1 3 377.405 -1.600 20 0 GAADHM CNC(=O)CN(CC(=O)NC)C[C@H](O)COc1ccccc1-c1nnn[n-]1 ZINC001579394106 1075585478 /nfs/dbraw/zinc/58/54/78/1075585478.db2.gz MZMRLPHTOUDPNH-NSHDSACASA-N -1 3 377.405 -1.600 20 0 GAADHM CNC(=O)CN(CC(=O)NC)Cc1cccc(C(=O)OC)c1-c1nn[n-]n1 ZINC001579394307 1075585467 /nfs/dbraw/zinc/58/54/67/1075585467.db2.gz RYVXXAKPZOSTGI-UHFFFAOYSA-N -1 3 375.389 -1.053 20 0 GAADHM CNC(=O)CN(CC(=O)NC)Cc1cccc(C(=O)OC)c1-c1nnn[n-]1 ZINC001579394307 1075585465 /nfs/dbraw/zinc/58/54/65/1075585465.db2.gz RYVXXAKPZOSTGI-UHFFFAOYSA-N -1 3 375.389 -1.053 20 0 GAADHM CNC(=O)CCCC(=O)NCC1(O)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579394352 1075585853 /nfs/dbraw/zinc/58/58/53/1075585853.db2.gz UERFJISTJHKFTJ-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CNC(=O)CCCC(=O)NCC1(O)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579394352 1075585850 /nfs/dbraw/zinc/58/58/50/1075585850.db2.gz UERFJISTJHKFTJ-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CNC(=O)CN(CC(=O)NC)CC(=O)Nc1oc(C)c(C)c1-c1nnn[n-]1 ZINC001579394381 1075585667 /nfs/dbraw/zinc/58/56/67/1075585667.db2.gz SWRBIISYTFVXAA-UHFFFAOYSA-N -1 3 378.393 -1.191 20 0 GAADHM CNC(=O)CN(CCO)[C@@H]1CCCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579394446 1075585783 /nfs/dbraw/zinc/58/57/83/1075585783.db2.gz XWTJVDGRPPEPRC-GFCCVEGCSA-N -1 3 376.421 -1.160 20 0 GAADHM CNC(=O)CN(CCO)[C@H]1CCCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579394447 1075585716 /nfs/dbraw/zinc/58/57/16/1075585716.db2.gz XWTJVDGRPPEPRC-LBPRGKRZSA-N -1 3 376.421 -1.160 20 0 GAADHM CNC(=O)CCCC(=O)NCC1(O)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579394472 1075585843 /nfs/dbraw/zinc/58/58/43/1075585843.db2.gz VGVRSMZGQYPOJH-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CNC(=O)CCCC(=O)NCC1(O)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579394472 1075585840 /nfs/dbraw/zinc/58/58/40/1075585840.db2.gz VGVRSMZGQYPOJH-UHFFFAOYSA-N -1 3 390.404 -1.586 20 0 GAADHM CNC(=O)CCCC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O ZINC001579394505 1075585807 /nfs/dbraw/zinc/58/58/07/1075585807.db2.gz WKQCHACUTLSKKX-VXGBXAGGSA-N -1 3 390.404 -1.587 20 0 GAADHM CNC(=O)CCCC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O ZINC001579394505 1075585804 /nfs/dbraw/zinc/58/58/04/1075585804.db2.gz WKQCHACUTLSKKX-VXGBXAGGSA-N -1 3 390.404 -1.587 20 0 GAADHM CNC(=O)CCCC(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O ZINC001579394541 1075585834 /nfs/dbraw/zinc/58/58/34/1075585834.db2.gz YMHRMVBNULQQHE-VXGBXAGGSA-N -1 3 390.404 -1.587 20 0 GAADHM CNC(=O)CCCC(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O ZINC001579394541 1075585831 /nfs/dbraw/zinc/58/58/31/1075585831.db2.gz YMHRMVBNULQQHE-VXGBXAGGSA-N -1 3 390.404 -1.587 20 0 GAADHM CNC(=O)CN(CCO)[C@@H]1CCCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579394566 1075585737 /nfs/dbraw/zinc/58/57/37/1075585737.db2.gz YWLLGQILXFEGOC-GFCCVEGCSA-N -1 3 376.421 -1.160 20 0 GAADHM CNC(=O)CN(CCO)[C@@H]1CCCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579394566 1075585731 /nfs/dbraw/zinc/58/57/31/1075585731.db2.gz YWLLGQILXFEGOC-GFCCVEGCSA-N -1 3 376.421 -1.160 20 0 GAADHM CNC(=O)CN(CCO)[C@H]1CCCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579394567 1075585756 /nfs/dbraw/zinc/58/57/56/1075585756.db2.gz YWLLGQILXFEGOC-LBPRGKRZSA-N -1 3 376.421 -1.160 20 0 GAADHM CNC(=O)CN(CCO)[C@H]1CCCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579394567 1075585754 /nfs/dbraw/zinc/58/57/54/1075585754.db2.gz YWLLGQILXFEGOC-LBPRGKRZSA-N -1 3 376.421 -1.160 20 0 GAADHM CNC(=O)CN1CC(N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2=O)C1 ZINC001579396222 1075585773 /nfs/dbraw/zinc/58/57/73/1075585773.db2.gz ADHGAMTZDSNUJU-JTQLQIEISA-N -1 3 387.404 -2.044 20 0 GAADHM CNC(=O)CN1CC(N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2=O)C1 ZINC001579396222 1075585771 /nfs/dbraw/zinc/58/57/71/1075585771.db2.gz ADHGAMTZDSNUJU-JTQLQIEISA-N -1 3 387.404 -2.044 20 0 GAADHM CNC(=O)CN1CC(N2C[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2=O)C1 ZINC001579396223 1075585687 /nfs/dbraw/zinc/58/56/87/1075585687.db2.gz ADHGAMTZDSNUJU-SNVBAGLBSA-N -1 3 387.404 -2.044 20 0 GAADHM CNC(=O)CN1CC(N2C[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2=O)C1 ZINC001579396223 1075585681 /nfs/dbraw/zinc/58/56/81/1075585681.db2.gz ADHGAMTZDSNUJU-SNVBAGLBSA-N -1 3 387.404 -2.044 20 0 GAADHM CNC(=O)CN1CCC(NC(=O)NCCn2cnc(-c3nn[n-]n3)n2)CC1 ZINC001579396390 1075585653 /nfs/dbraw/zinc/58/56/53/1075585653.db2.gz COJWAPNFACNSBK-UHFFFAOYSA-N -1 3 377.413 -2.032 20 0 GAADHM CNC(=O)CN1CCN(CCN(C)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001579396409 1075585902 /nfs/dbraw/zinc/58/59/02/1075585902.db2.gz CZTKUBDCPLBPKU-UHFFFAOYSA-N -1 3 375.437 -1.370 20 0 GAADHM CNC(=O)CN1CCN(CCN(C)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001579396409 1075585901 /nfs/dbraw/zinc/58/59/01/1075585901.db2.gz CZTKUBDCPLBPKU-UHFFFAOYSA-N -1 3 375.437 -1.370 20 0 GAADHM CNC(=O)CN1CCN(CCCNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001579396442 1075586146 /nfs/dbraw/zinc/58/61/46/1075586146.db2.gz FMDIVIXKANLCQT-UHFFFAOYSA-N -1 3 375.437 -1.322 20 0 GAADHM CNC(=O)CN1CC(n2cc(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)nn2)C1 ZINC001579396514 1075586201 /nfs/dbraw/zinc/58/62/01/1075586201.db2.gz IHQAXASEHJXOJF-UHFFFAOYSA-N -1 3 385.392 -1.681 20 0 GAADHM CNC(=O)CN1CC(n2cc(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)nn2)C1 ZINC001579396514 1075586197 /nfs/dbraw/zinc/58/61/97/1075586197.db2.gz IHQAXASEHJXOJF-UHFFFAOYSA-N -1 3 385.392 -1.681 20 0 GAADHM CNC(=O)CN1CCN(CCN(C)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001579396528 1075586272 /nfs/dbraw/zinc/58/62/72/1075586272.db2.gz JAMJDEAXSRCYNT-UHFFFAOYSA-N -1 3 375.437 -1.370 20 0 GAADHM CNC(=O)CN1CCN(CCN(C)C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001579396528 1075586270 /nfs/dbraw/zinc/58/62/70/1075586270.db2.gz JAMJDEAXSRCYNT-UHFFFAOYSA-N -1 3 375.437 -1.370 20 0 GAADHM CNC(=O)CN1CCN([C@@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)CC1 ZINC001579396652 1075586251 /nfs/dbraw/zinc/58/62/51/1075586251.db2.gz NMAKSTAJDFCIBS-CYBMUJFWSA-N -1 3 387.448 -1.227 20 0 GAADHM CNC(=O)CN1CCN([C@@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)CC1 ZINC001579396652 1075586250 /nfs/dbraw/zinc/58/62/50/1075586250.db2.gz NMAKSTAJDFCIBS-CYBMUJFWSA-N -1 3 387.448 -1.227 20 0 GAADHM CNC(=O)CN1CCN([C@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)CC1 ZINC001579396653 1075586313 /nfs/dbraw/zinc/58/63/13/1075586313.db2.gz 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CNC(=O)NC(=O)CN1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@H](OC)C1 ZINC001579398840 1075590443 /nfs/dbraw/zinc/59/04/43/1075590443.db2.gz XMSAIOPKIKLFCD-GHMZBOCLSA-N -1 3 391.392 -1.921 20 0 GAADHM CNC(=O)NC(=O)CN1C[C@H]2CC[C@@H](C1)N2C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579398842 1075590321 /nfs/dbraw/zinc/59/03/21/1075590321.db2.gz XNGVTKFQLDKSQT-PHIMTYICSA-N -1 3 387.404 -1.061 20 0 GAADHM CNC(=O)NC(=O)CN1C[C@H]2CC[C@@H](C1)N2C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579398842 1075590313 /nfs/dbraw/zinc/59/03/13/1075590313.db2.gz XNGVTKFQLDKSQT-PHIMTYICSA-N -1 3 387.404 -1.061 20 0 GAADHM CNC(=O)NC(=O)CN(C)[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579398856 1075590161 /nfs/dbraw/zinc/59/01/61/1075590161.db2.gz XPIAWTDXGQZXBF-SECBINFHSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NC(=O)CN(C)[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579398858 1075590273 /nfs/dbraw/zinc/59/02/73/1075590273.db2.gz XPIAWTDXGQZXBF-VIFPVBQESA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NC(=O)CN1CCC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579398915 1075590412 /nfs/dbraw/zinc/59/04/12/1075590412.db2.gz YBBSMSQOUNLSOI-JTQLQIEISA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NC(=O)CN1CCC[C@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579398915 1075590406 /nfs/dbraw/zinc/59/04/06/1075590406.db2.gz YBBSMSQOUNLSOI-JTQLQIEISA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NC(=O)CN1CCC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579398917 1075590683 /nfs/dbraw/zinc/59/06/83/1075590683.db2.gz YBBSMSQOUNLSOI-SNVBAGLBSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NC(=O)CN1CCC[C@@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579398917 1075590680 /nfs/dbraw/zinc/59/06/80/1075590680.db2.gz YBBSMSQOUNLSOI-SNVBAGLBSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)Cc1noc(CN(C)CCNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001579399255 1075590775 /nfs/dbraw/zinc/59/07/75/1075590775.db2.gz UVDHSMASDUAYLT-UHFFFAOYSA-N -1 3 388.392 -1.272 20 0 GAADHM CNC(=O)Cc1noc(CN(C)CCNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001579399255 1075590769 /nfs/dbraw/zinc/59/07/69/1075590769.db2.gz UVDHSMASDUAYLT-UHFFFAOYSA-N -1 3 388.392 -1.272 20 0 GAADHM CNC(=O)NC(=O)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(-c3nn[n-]n3)c[nH]1)C2 ZINC001579400828 1075591126 /nfs/dbraw/zinc/59/11/26/1075591126.db2.gz HBXJQRLSJYNOAD-FOGDFJRCSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NC(=O)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(-c3nnn[n-]3)c[nH]1)C2 ZINC001579400828 1075591121 /nfs/dbraw/zinc/59/11/21/1075591121.db2.gz HBXJQRLSJYNOAD-FOGDFJRCSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NC(C)(C)C(=O)N1CC(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579400902 1075591065 /nfs/dbraw/zinc/59/10/65/1075591065.db2.gz IVRMBIPOQUJRBE-UHFFFAOYSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NC(C)(C)C(=O)N1CC(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579400902 1075591062 /nfs/dbraw/zinc/59/10/62/1075591062.db2.gz IVRMBIPOQUJRBE-UHFFFAOYSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NC(=O)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c[nH]c(-c3nn[n-]n3)c1)C2 ZINC001579401383 1075591338 /nfs/dbraw/zinc/59/13/38/1075591338.db2.gz OFYSJYOWIBDGAC-FOGDFJRCSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NC(=O)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c[nH]c(-c3nnn[n-]3)c1)C2 ZINC001579401383 1075591332 /nfs/dbraw/zinc/59/13/32/1075591332.db2.gz OFYSJYOWIBDGAC-FOGDFJRCSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NC(=O)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(-c3nn[n-]n3)[nH]1)C2 ZINC001579401706 1075592156 /nfs/dbraw/zinc/59/21/56/1075592156.db2.gz WSMZPBMXLMESSC-FXAINCCUSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NC(=O)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(-c3nnn[n-]3)[nH]1)C2 ZINC001579401706 1075592151 /nfs/dbraw/zinc/59/21/51/1075592151.db2.gz WSMZPBMXLMESSC-FXAINCCUSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NC(=O)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(-c3nn[n-]n3)[nH]1)C2 ZINC001579401707 1075592097 /nfs/dbraw/zinc/59/20/97/1075592097.db2.gz WSMZPBMXLMESSC-ZHAHWJHGSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NC(=O)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(-c3nnn[n-]3)[nH]1)C2 ZINC001579401707 1075592092 /nfs/dbraw/zinc/59/20/92/1075592092.db2.gz WSMZPBMXLMESSC-ZHAHWJHGSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NC(C)(C)C(=O)N1CC(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579401789 1075592413 /nfs/dbraw/zinc/59/24/13/1075592413.db2.gz YTBJBWMQQUHKAH-UHFFFAOYSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NC(C)(C)C(=O)N1CC(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579401789 1075592409 /nfs/dbraw/zinc/59/24/09/1075592409.db2.gz YTBJBWMQQUHKAH-UHFFFAOYSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@@H]1CCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579402156 1075592947 /nfs/dbraw/zinc/59/29/47/1075592947.db2.gz DZEXYYLZAZQESM-JTQLQIEISA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@@H]1CCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579402156 1075592945 /nfs/dbraw/zinc/59/29/45/1075592945.db2.gz DZEXYYLZAZQESM-JTQLQIEISA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@H]1CCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579402157 1075592955 /nfs/dbraw/zinc/59/29/55/1075592955.db2.gz DZEXYYLZAZQESM-SNVBAGLBSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@H]1CCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579402157 1075592953 /nfs/dbraw/zinc/59/29/53/1075592953.db2.gz DZEXYYLZAZQESM-SNVBAGLBSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@@H](O)CNc1nc(C)ccc1-c1nn[n-]n1 ZINC001579402210 1075592848 /nfs/dbraw/zinc/59/28/48/1075592848.db2.gz GWYMJIVAXGGPCA-JTQLQIEISA-N -1 3 377.409 -1.270 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@@H](O)CNc1nc(C)ccc1-c1nnn[n-]1 ZINC001579402210 1075592843 /nfs/dbraw/zinc/59/28/43/1075592843.db2.gz GWYMJIVAXGGPCA-JTQLQIEISA-N -1 3 377.409 -1.270 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@H](O)CNc1nc(C)ccc1-c1nn[n-]n1 ZINC001579402212 1075592832 /nfs/dbraw/zinc/59/28/32/1075592832.db2.gz GWYMJIVAXGGPCA-SNVBAGLBSA-N -1 3 377.409 -1.270 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@H](O)CNc1nc(C)ccc1-c1nnn[n-]1 ZINC001579402212 1075592829 /nfs/dbraw/zinc/59/28/29/1075592829.db2.gz GWYMJIVAXGGPCA-SNVBAGLBSA-N -1 3 377.409 -1.270 20 0 GAADHM CNC(=O)NCC(=O)N(C)[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579402350 1075592929 /nfs/dbraw/zinc/59/29/29/1075592929.db2.gz IKDXWPGYLQBIHO-SECBINFHSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N(C)[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579402350 1075592926 /nfs/dbraw/zinc/59/29/26/1075592926.db2.gz IKDXWPGYLQBIHO-SECBINFHSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N(C)[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579402351 1075592862 /nfs/dbraw/zinc/59/28/62/1075592862.db2.gz IKDXWPGYLQBIHO-VIFPVBQESA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N(C)[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579402351 1075592857 /nfs/dbraw/zinc/59/28/57/1075592857.db2.gz IKDXWPGYLQBIHO-VIFPVBQESA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@H](O)CN(C)c1ccc(-c2nn[n-]n2)c(C)n1 ZINC001579402539 1075592913 /nfs/dbraw/zinc/59/29/13/1075592913.db2.gz LJANZXMXJFDEIB-LLVKDONJSA-N -1 3 391.436 -1.245 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@H](O)CN(C)c1ccc(-c2nnn[n-]2)c(C)n1 ZINC001579402539 1075592910 /nfs/dbraw/zinc/59/29/10/1075592910.db2.gz LJANZXMXJFDEIB-LLVKDONJSA-N -1 3 391.436 -1.245 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@@H](O)CN(C)c1ccc(-c2nn[n-]n2)c(C)n1 ZINC001579402540 1075592901 /nfs/dbraw/zinc/59/29/01/1075592901.db2.gz LJANZXMXJFDEIB-NSHDSACASA-N -1 3 391.436 -1.245 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@@H](O)CN(C)c1ccc(-c2nnn[n-]2)c(C)n1 ZINC001579402540 1075592898 /nfs/dbraw/zinc/59/28/98/1075592898.db2.gz LJANZXMXJFDEIB-NSHDSACASA-N -1 3 391.436 -1.245 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@H](O)CNc1snc(C)c1-c1nnn[n-]1 ZINC001579402560 1075592750 /nfs/dbraw/zinc/59/27/50/1075592750.db2.gz LUVWSKXNIMPEQS-MRVPVSSYSA-N -1 3 383.438 -1.208 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@@H](O)CNc1snc(C)c1-c1nnn[n-]1 ZINC001579402561 1075592893 /nfs/dbraw/zinc/59/28/93/1075592893.db2.gz LUVWSKXNIMPEQS-QMMMGPOBSA-N -1 3 383.438 -1.208 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@@H](O)CNc1ccc(-c2nn[n-]n2)c(C)n1 ZINC001579402564 1075592937 /nfs/dbraw/zinc/59/29/37/1075592937.db2.gz LVGFQVWAIWFXAS-JTQLQIEISA-N -1 3 377.409 -1.270 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@@H](O)CNc1ccc(-c2nnn[n-]2)c(C)n1 ZINC001579402564 1075592935 /nfs/dbraw/zinc/59/29/35/1075592935.db2.gz LVGFQVWAIWFXAS-JTQLQIEISA-N -1 3 377.409 -1.270 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@H](O)CNc1ccc(-c2nn[n-]n2)c(C)n1 ZINC001579402565 1075592875 /nfs/dbraw/zinc/59/28/75/1075592875.db2.gz LVGFQVWAIWFXAS-SNVBAGLBSA-N -1 3 377.409 -1.270 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@H](O)CNc1ccc(-c2nnn[n-]2)c(C)n1 ZINC001579402565 1075592871 /nfs/dbraw/zinc/59/28/71/1075592871.db2.gz LVGFQVWAIWFXAS-SNVBAGLBSA-N -1 3 377.409 -1.270 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@@H]1CCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579402569 1075592885 /nfs/dbraw/zinc/59/28/85/1075592885.db2.gz LXNQHBKMUDCWCB-JTQLQIEISA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@@H]1CCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579402569 1075592883 /nfs/dbraw/zinc/59/28/83/1075592883.db2.gz LXNQHBKMUDCWCB-JTQLQIEISA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@H]1CCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579402570 1075593160 /nfs/dbraw/zinc/59/31/60/1075593160.db2.gz LXNQHBKMUDCWCB-SNVBAGLBSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@H]1CCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579402570 1075593158 /nfs/dbraw/zinc/59/31/58/1075593158.db2.gz LXNQHBKMUDCWCB-SNVBAGLBSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@H](O)CN(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001579402646 1075593230 /nfs/dbraw/zinc/59/32/30/1075593230.db2.gz NIZAVEKSVDJOBT-LLVKDONJSA-N -1 3 377.409 -1.554 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@H](O)CN(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001579402646 1075593226 /nfs/dbraw/zinc/59/32/26/1075593226.db2.gz NIZAVEKSVDJOBT-LLVKDONJSA-N -1 3 377.409 -1.554 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@@H](O)CN(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001579402648 1075593141 /nfs/dbraw/zinc/59/31/41/1075593141.db2.gz NIZAVEKSVDJOBT-NSHDSACASA-N -1 3 377.409 -1.554 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@@H](O)CN(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001579402648 1075593136 /nfs/dbraw/zinc/59/31/36/1075593136.db2.gz NIZAVEKSVDJOBT-NSHDSACASA-N -1 3 377.409 -1.554 20 0 GAADHM CNC(=O)NCC(=O)N(C)C1CC(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579402757 1075593273 /nfs/dbraw/zinc/59/32/73/1075593273.db2.gz ONHAJJAOMOPOOJ-UHFFFAOYSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N(C)C1CC(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579402757 1075593268 /nfs/dbraw/zinc/59/32/68/1075593268.db2.gz ONHAJJAOMOPOOJ-UHFFFAOYSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@H](O)CN(C)c1ncccc1-c1nn[n-]n1 ZINC001579402789 1075593242 /nfs/dbraw/zinc/59/32/42/1075593242.db2.gz QCFFJLPMELDCRT-JTQLQIEISA-N -1 3 377.409 -1.554 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@H](O)CN(C)c1ncccc1-c1nnn[n-]1 ZINC001579402789 1075593238 /nfs/dbraw/zinc/59/32/38/1075593238.db2.gz QCFFJLPMELDCRT-JTQLQIEISA-N -1 3 377.409 -1.554 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@@H](O)CN(C)c1ncccc1-c1nn[n-]n1 ZINC001579402790 1075593219 /nfs/dbraw/zinc/59/32/19/1075593219.db2.gz QCFFJLPMELDCRT-SNVBAGLBSA-N -1 3 377.409 -1.554 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@@H](O)CN(C)c1ncccc1-c1nnn[n-]1 ZINC001579402790 1075593217 /nfs/dbraw/zinc/59/32/17/1075593217.db2.gz QCFFJLPMELDCRT-SNVBAGLBSA-N -1 3 377.409 -1.554 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@](C)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579402820 1075593150 /nfs/dbraw/zinc/59/31/50/1075593150.db2.gz ADYXRNLYIZSLRG-HNNXBMFYSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@](C)(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579402820 1075593147 /nfs/dbraw/zinc/59/31/47/1075593147.db2.gz ADYXRNLYIZSLRG-HNNXBMFYSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@](C)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579402821 1075593101 /nfs/dbraw/zinc/59/31/01/1075593101.db2.gz ADYXRNLYIZSLRG-OAHLLOKOSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@](C)(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579402821 1075593098 /nfs/dbraw/zinc/59/30/98/1075593098.db2.gz ADYXRNLYIZSLRG-OAHLLOKOSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@H]1C ZINC001579402871 1075593128 /nfs/dbraw/zinc/59/31/28/1075593128.db2.gz BSFJLSWZPOTXMW-PSASIEDQSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@H]1C ZINC001579402871 1075593123 /nfs/dbraw/zinc/59/31/23/1075593123.db2.gz BSFJLSWZPOTXMW-PSASIEDQSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@H]1C ZINC001579402872 1075593202 /nfs/dbraw/zinc/59/32/02/1075593202.db2.gz BSFJLSWZPOTXMW-SCZZXKLOSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@H]1C ZINC001579402872 1075593199 /nfs/dbraw/zinc/59/31/99/1075593199.db2.gz BSFJLSWZPOTXMW-SCZZXKLOSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H]1C ZINC001579402873 1075593283 /nfs/dbraw/zinc/59/32/83/1075593283.db2.gz BSFJLSWZPOTXMW-WCBMZHEXSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H]1C ZINC001579402873 1075593280 /nfs/dbraw/zinc/59/32/80/1075593280.db2.gz BSFJLSWZPOTXMW-WCBMZHEXSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H]1C ZINC001579402874 1075593550 /nfs/dbraw/zinc/59/35/50/1075593550.db2.gz BSFJLSWZPOTXMW-WPRPVWTQSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H]1C ZINC001579402874 1075593548 /nfs/dbraw/zinc/59/35/48/1075593548.db2.gz BSFJLSWZPOTXMW-WPRPVWTQSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579402884 1075593637 /nfs/dbraw/zinc/59/36/37/1075593637.db2.gz BXLIOMXFEIGQDI-SECBINFHSA-N -1 3 375.393 -1.298 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579402884 1075593636 /nfs/dbraw/zinc/59/36/36/1075593636.db2.gz BXLIOMXFEIGQDI-SECBINFHSA-N -1 3 375.393 -1.298 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579402885 1075593597 /nfs/dbraw/zinc/59/35/97/1075593597.db2.gz BXLIOMXFEIGQDI-VIFPVBQESA-N -1 3 375.393 -1.298 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579402885 1075593596 /nfs/dbraw/zinc/59/35/96/1075593596.db2.gz BXLIOMXFEIGQDI-VIFPVBQESA-N -1 3 375.393 -1.298 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](C)C1 ZINC001579403074 1075593566 /nfs/dbraw/zinc/59/35/66/1075593566.db2.gz FFMRADMJCJUDMZ-NXEZZACHSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H](C)C1 ZINC001579403074 1075593564 /nfs/dbraw/zinc/59/35/64/1075593564.db2.gz FFMRADMJCJUDMZ-NXEZZACHSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@H](C)[C@@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579403075 1075593532 /nfs/dbraw/zinc/59/35/32/1075593532.db2.gz FFMRADMJCJUDMZ-UWVGGRQHSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@H](C)[C@@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579403075 1075593529 /nfs/dbraw/zinc/59/35/29/1075593529.db2.gz FFMRADMJCJUDMZ-UWVGGRQHSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@H](C)[C@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579403076 1075593562 /nfs/dbraw/zinc/59/35/62/1075593562.db2.gz FFMRADMJCJUDMZ-VHSXEESVSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@H](C)[C@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579403076 1075593560 /nfs/dbraw/zinc/59/35/60/1075593560.db2.gz FFMRADMJCJUDMZ-VHSXEESVSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H](C)[C@@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579403077 1075593583 /nfs/dbraw/zinc/59/35/83/1075593583.db2.gz FFMRADMJCJUDMZ-ZJUUUORDSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H](C)[C@@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579403077 1075593580 /nfs/dbraw/zinc/59/35/80/1075593580.db2.gz FFMRADMJCJUDMZ-ZJUUUORDSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@H](O)CNc1ncc(-c2nn[n-]n2)cc1F ZINC001579403165 1075593541 /nfs/dbraw/zinc/59/35/41/1075593541.db2.gz XDPONIGDHKYLBL-SECBINFHSA-N -1 3 381.372 -1.439 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@H](O)CNc1ncc(-c2nnn[n-]2)cc1F ZINC001579403165 1075593537 /nfs/dbraw/zinc/59/35/37/1075593537.db2.gz XDPONIGDHKYLBL-SECBINFHSA-N -1 3 381.372 -1.439 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@@H](O)CNc1ncc(-c2nn[n-]n2)cc1F ZINC001579403166 1075593576 /nfs/dbraw/zinc/59/35/76/1075593576.db2.gz XDPONIGDHKYLBL-VIFPVBQESA-N -1 3 381.372 -1.439 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@@H](O)CNc1ncc(-c2nnn[n-]2)cc1F ZINC001579403166 1075593574 /nfs/dbraw/zinc/59/35/74/1075593574.db2.gz XDPONIGDHKYLBL-VIFPVBQESA-N -1 3 381.372 -1.439 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@H]1CCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579403206 1075593607 /nfs/dbraw/zinc/59/36/07/1075593607.db2.gz YJEFKLQFFLLTGD-SECBINFHSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@H]1CCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579403206 1075593605 /nfs/dbraw/zinc/59/36/05/1075593605.db2.gz YJEFKLQFFLLTGD-SECBINFHSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@@H]1CCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579403207 1075593591 /nfs/dbraw/zinc/59/35/91/1075593591.db2.gz YJEFKLQFFLLTGD-VIFPVBQESA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N(C)C[C@@H]1CCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579403207 1075593588 /nfs/dbraw/zinc/59/35/88/1075593588.db2.gz YJEFKLQFFLLTGD-VIFPVBQESA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1CC([C@@H](C)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579403246 1075593621 /nfs/dbraw/zinc/59/36/21/1075593621.db2.gz HNKMLKTZHMHHQL-MRVPVSSYSA-N -1 3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N1CC([C@@H](C)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579403246 1075593617 /nfs/dbraw/zinc/59/36/17/1075593617.db2.gz HNKMLKTZHMHHQL-MRVPVSSYSA-N -1 3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N1CC([C@H](C)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579403247 1075593557 /nfs/dbraw/zinc/59/35/57/1075593557.db2.gz HNKMLKTZHMHHQL-QMMMGPOBSA-N -1 3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N1CC([C@H](C)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579403247 1075593555 /nfs/dbraw/zinc/59/35/55/1075593555.db2.gz HNKMLKTZHMHHQL-QMMMGPOBSA-N -1 3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N1CCC(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001579403266 1075593931 /nfs/dbraw/zinc/59/39/31/1075593931.db2.gz HYJYBEDFFKNILO-UHFFFAOYSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001579403266 1075593926 /nfs/dbraw/zinc/59/39/26/1075593926.db2.gz HYJYBEDFFKNILO-UHFFFAOYSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N(C)[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579403292 1075593940 /nfs/dbraw/zinc/59/39/40/1075593940.db2.gz ZBAOYDBDLCKLHL-JTQLQIEISA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N(C)[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579403292 1075593938 /nfs/dbraw/zinc/59/39/38/1075593938.db2.gz ZBAOYDBDLCKLHL-JTQLQIEISA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H]2[C@@H](CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H]2C1 ZINC001579403293 1075593916 /nfs/dbraw/zinc/59/39/16/1075593916.db2.gz IGHHBEBWCHRJIQ-OWUUHHOZSA-N -1 3 387.404 -1.442 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H]2[C@@H](CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H]2C1 ZINC001579403293 1075593914 /nfs/dbraw/zinc/59/39/14/1075593914.db2.gz IGHHBEBWCHRJIQ-OWUUHHOZSA-N -1 3 387.404 -1.442 20 0 GAADHM CNC(=O)NCC(=O)N(C)[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579403294 1075593902 /nfs/dbraw/zinc/59/39/02/1075593902.db2.gz ZBAOYDBDLCKLHL-SNVBAGLBSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N(C)[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579403294 1075593897 /nfs/dbraw/zinc/59/38/97/1075593897.db2.gz ZBAOYDBDLCKLHL-SNVBAGLBSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H]2[C@@H](CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H]2C1 ZINC001579403302 1075593993 /nfs/dbraw/zinc/59/39/93/1075593993.db2.gz IKWNOZSMQAATCP-RTCCRHLQSA-N -1 3 387.404 -1.442 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H]2[C@@H](CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H]2C1 ZINC001579403302 1075593991 /nfs/dbraw/zinc/59/39/91/1075593991.db2.gz IKWNOZSMQAATCP-RTCCRHLQSA-N -1 3 387.404 -1.442 20 0 GAADHM CNC(=O)NCC(=O)N(CCO)CCNc1ncc(-c2nn[n-]n2)cc1F ZINC001579403332 1075594011 /nfs/dbraw/zinc/59/40/11/1075594011.db2.gz JFHKHPNMLOBNAP-UHFFFAOYSA-N -1 3 381.372 -1.437 20 0 GAADHM CNC(=O)NCC(=O)N(CCO)CCNc1ncc(-c2nnn[n-]2)cc1F ZINC001579403332 1075594008 /nfs/dbraw/zinc/59/40/08/1075594008.db2.gz JFHKHPNMLOBNAP-UHFFFAOYSA-N -1 3 381.372 -1.437 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@H](C)[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579403372 1075594002 /nfs/dbraw/zinc/59/40/02/1075594002.db2.gz JNZLGZZEYIDMFP-GZMMTYOYSA-N -1 3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@H](C)[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579403372 1075593999 /nfs/dbraw/zinc/59/39/99/1075593999.db2.gz JNZLGZZEYIDMFP-GZMMTYOYSA-N -1 3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H](C)[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579403373 1075593984 /nfs/dbraw/zinc/59/39/84/1075593984.db2.gz JNZLGZZEYIDMFP-KCJUWKMLSA-N -1 3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H](C)[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579403373 1075593981 /nfs/dbraw/zinc/59/39/81/1075593981.db2.gz JNZLGZZEYIDMFP-KCJUWKMLSA-N -1 3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](C)C1 ZINC001579403374 1075593960 /nfs/dbraw/zinc/59/39/60/1075593960.db2.gz JNZLGZZEYIDMFP-KWQFWETISA-N -1 3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](C)C1 ZINC001579403374 1075593957 /nfs/dbraw/zinc/59/39/57/1075593957.db2.gz JNZLGZZEYIDMFP-KWQFWETISA-N -1 3 375.393 -1.300 20 0 GAADHM 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CNC(=O)NCC(=O)N1CC[C@H]1CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579404961 1075595277 /nfs/dbraw/zinc/59/52/77/1075595277.db2.gz CTRVTYYYPJWFFA-JTQLQIEISA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@H]1CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579404962 1075595241 /nfs/dbraw/zinc/59/52/41/1075595241.db2.gz CTRVTYYYPJWFFA-SNVBAGLBSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@H]1CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579404962 1075595238 /nfs/dbraw/zinc/59/52/38/1075595238.db2.gz CTRVTYYYPJWFFA-SNVBAGLBSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1CCOC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579404986 1075595440 /nfs/dbraw/zinc/59/54/40/1075595440.db2.gz DTXQMEAKOBFGMG-JTQLQIEISA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)N1CCOC[C@@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579404986 1075595437 /nfs/dbraw/zinc/59/54/37/1075595437.db2.gz DTXQMEAKOBFGMG-JTQLQIEISA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)N1CCOC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579404987 1075595291 /nfs/dbraw/zinc/59/52/91/1075595291.db2.gz DTXQMEAKOBFGMG-SNVBAGLBSA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)N1CCOC[C@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579404987 1075595288 /nfs/dbraw/zinc/59/52/88/1075595288.db2.gz DTXQMEAKOBFGMG-SNVBAGLBSA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)N1CCC2(CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)C1 ZINC001579405070 1075595397 /nfs/dbraw/zinc/59/53/97/1075595397.db2.gz HAVCWLBDQQGZRS-UHFFFAOYSA-N -1 3 387.404 -1.202 20 0 GAADHM CNC(=O)NCC(=O)N1CCC2(CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)C1 ZINC001579405070 1075595393 /nfs/dbraw/zinc/59/53/93/1075595393.db2.gz HAVCWLBDQQGZRS-UHFFFAOYSA-N -1 3 387.404 -1.202 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@H]1CN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579405082 1075595687 /nfs/dbraw/zinc/59/56/87/1075595687.db2.gz HGTBJXAIFYGENK-SECBINFHSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@H]1CN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579405082 1075595681 /nfs/dbraw/zinc/59/56/81/1075595681.db2.gz HGTBJXAIFYGENK-SECBINFHSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@H]1CN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579405083 1075595855 /nfs/dbraw/zinc/59/58/55/1075595855.db2.gz HGTBJXAIFYGENK-VIFPVBQESA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@H]1CN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579405083 1075595851 /nfs/dbraw/zinc/59/58/51/1075595851.db2.gz HGTBJXAIFYGENK-VIFPVBQESA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1CCC2(CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)C1 ZINC001579405088 1075595747 /nfs/dbraw/zinc/59/57/47/1075595747.db2.gz HNEKKLNFDLHKES-UHFFFAOYSA-N -1 3 387.404 -1.202 20 0 GAADHM CNC(=O)NCC(=O)N1CCC2(CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)C1 ZINC001579405088 1075595745 /nfs/dbraw/zinc/59/57/45/1075595745.db2.gz HNEKKLNFDLHKES-UHFFFAOYSA-N -1 3 387.404 -1.202 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579405104 1075595865 /nfs/dbraw/zinc/59/58/65/1075595865.db2.gz HQNYNBNEWKOTOA-JTQLQIEISA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579405104 1075595863 /nfs/dbraw/zinc/59/58/63/1075595863.db2.gz HQNYNBNEWKOTOA-JTQLQIEISA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579405105 1075595812 /nfs/dbraw/zinc/59/58/12/1075595812.db2.gz HQNYNBNEWKOTOA-SNVBAGLBSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579405105 1075595809 /nfs/dbraw/zinc/59/58/09/1075595809.db2.gz HQNYNBNEWKOTOA-SNVBAGLBSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@](CO)(Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001579405107 1075595767 /nfs/dbraw/zinc/59/57/67/1075595767.db2.gz HTXFCJSFQNQVHT-INIZCTEOSA-N -1 3 389.420 -1.044 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@](CO)(Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579405107 1075595765 /nfs/dbraw/zinc/59/57/65/1075595765.db2.gz HTXFCJSFQNQVHT-INIZCTEOSA-N -1 3 389.420 -1.044 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@@](CO)(Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001579405108 1075595831 /nfs/dbraw/zinc/59/58/31/1075595831.db2.gz HTXFCJSFQNQVHT-MRXNPFEDSA-N -1 3 389.420 -1.044 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@@](CO)(Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579405108 1075595829 /nfs/dbraw/zinc/59/58/29/1075595829.db2.gz HTXFCJSFQNQVHT-MRXNPFEDSA-N -1 3 389.420 -1.044 20 0 GAADHM CNC(=O)NCC(=O)N1CCO[C@@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579405172 1075595777 /nfs/dbraw/zinc/59/57/77/1075595777.db2.gz JLNHTLFPUUVBPT-JTQLQIEISA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)N1CCO[C@@H](CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579405172 1075595773 /nfs/dbraw/zinc/59/57/73/1075595773.db2.gz JLNHTLFPUUVBPT-JTQLQIEISA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)N1CCO[C@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579405173 1075595702 /nfs/dbraw/zinc/59/57/02/1075595702.db2.gz JLNHTLFPUUVBPT-SNVBAGLBSA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)N1CCO[C@H](CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579405173 1075595696 /nfs/dbraw/zinc/59/56/96/1075595696.db2.gz JLNHTLFPUUVBPT-SNVBAGLBSA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)N1CCOC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579405204 1075595712 /nfs/dbraw/zinc/59/57/12/1075595712.db2.gz KPTBYTHNAZRYHO-SECBINFHSA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)N1CCOC[C@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579405204 1075595711 /nfs/dbraw/zinc/59/57/11/1075595711.db2.gz KPTBYTHNAZRYHO-SECBINFHSA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)N1CCOC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579405205 1075595670 /nfs/dbraw/zinc/59/56/70/1075595670.db2.gz KPTBYTHNAZRYHO-VIFPVBQESA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)N1CCOC[C@@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579405205 1075595666 /nfs/dbraw/zinc/59/56/66/1075595666.db2.gz KPTBYTHNAZRYHO-VIFPVBQESA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)N1CCC(O)(CNc2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001579405219 1075595803 /nfs/dbraw/zinc/59/58/03/1075595803.db2.gz LGGFJVABLCDGKW-UHFFFAOYSA-N -1 3 389.420 -1.044 20 0 GAADHM CNC(=O)NCC(=O)N1CCC(O)(CNc2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001579405219 1075595801 /nfs/dbraw/zinc/59/58/01/1075595801.db2.gz LGGFJVABLCDGKW-UHFFFAOYSA-N -1 3 389.420 -1.044 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579405243 1075596225 /nfs/dbraw/zinc/59/62/25/1075596225.db2.gz MASXBTCVAKUAPU-SECBINFHSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579405243 1075596223 /nfs/dbraw/zinc/59/62/23/1075596223.db2.gz MASXBTCVAKUAPU-SECBINFHSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579405244 1075596164 /nfs/dbraw/zinc/59/61/64/1075596164.db2.gz MASXBTCVAKUAPU-VIFPVBQESA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579405244 1075596161 /nfs/dbraw/zinc/59/61/61/1075596161.db2.gz MASXBTCVAKUAPU-VIFPVBQESA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCO[C@@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579405262 1075596118 /nfs/dbraw/zinc/59/61/18/1075596118.db2.gz MQYDMSJDMZPYIZ-JTQLQIEISA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)N1CCO[C@@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579405262 1075596114 /nfs/dbraw/zinc/59/61/14/1075596114.db2.gz MQYDMSJDMZPYIZ-JTQLQIEISA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)N1CCO[C@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579405263 1075596096 /nfs/dbraw/zinc/59/60/96/1075596096.db2.gz MQYDMSJDMZPYIZ-SNVBAGLBSA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)N1CCO[C@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579405263 1075596091 /nfs/dbraw/zinc/59/60/91/1075596091.db2.gz MQYDMSJDMZPYIZ-SNVBAGLBSA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@](CO)(Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579405484 1075596206 /nfs/dbraw/zinc/59/62/06/1075596206.db2.gz QQQRRXFBGMGDRR-INIZCTEOSA-N -1 3 389.420 -1.044 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@](CO)(Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579405484 1075596202 /nfs/dbraw/zinc/59/62/02/1075596202.db2.gz QQQRRXFBGMGDRR-INIZCTEOSA-N -1 3 389.420 -1.044 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@@](CO)(Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579405487 1075596522 /nfs/dbraw/zinc/59/65/22/1075596522.db2.gz QQQRRXFBGMGDRR-MRXNPFEDSA-N -1 3 389.420 -1.044 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@@](CO)(Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579405487 1075596518 /nfs/dbraw/zinc/59/65/18/1075596518.db2.gz QQQRRXFBGMGDRR-MRXNPFEDSA-N -1 3 389.420 -1.044 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579405678 1075596547 /nfs/dbraw/zinc/59/65/47/1075596547.db2.gz SUUICIOFPKCLDI-SNVBAGLBSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579405678 1075596543 /nfs/dbraw/zinc/59/65/43/1075596543.db2.gz SUUICIOFPKCLDI-SNVBAGLBSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@](CO)(Nc2ncccc2-c2nn[n-]n2)C1 ZINC001579405705 1075596626 /nfs/dbraw/zinc/59/66/26/1075596626.db2.gz ULULCDXFCDTWFZ-INIZCTEOSA-N -1 3 389.420 -1.044 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@](CO)(Nc2ncccc2-c2nnn[n-]2)C1 ZINC001579405705 1075596622 /nfs/dbraw/zinc/59/66/22/1075596622.db2.gz ULULCDXFCDTWFZ-INIZCTEOSA-N -1 3 389.420 -1.044 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@@](CO)(Nc2ncccc2-c2nn[n-]n2)C1 ZINC001579405706 1075596579 /nfs/dbraw/zinc/59/65/79/1075596579.db2.gz ULULCDXFCDTWFZ-MRXNPFEDSA-N -1 3 389.420 -1.044 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@@](CO)(Nc2ncccc2-c2nnn[n-]2)C1 ZINC001579405706 1075596575 /nfs/dbraw/zinc/59/65/75/1075596575.db2.gz ULULCDXFCDTWFZ-MRXNPFEDSA-N -1 3 389.420 -1.044 20 0 GAADHM CNC(=O)NCC(=O)N1CCO[C@H](CNc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579405734 1075596447 /nfs/dbraw/zinc/59/64/47/1075596447.db2.gz VADFVKOSVKGLMD-LLVKDONJSA-N -1 3 375.393 -1.170 20 0 GAADHM CNC(=O)NCC(=O)N1CCO[C@H](CNc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579405734 1075596445 /nfs/dbraw/zinc/59/64/45/1075596445.db2.gz VADFVKOSVKGLMD-LLVKDONJSA-N -1 3 375.393 -1.170 20 0 GAADHM CNC(=O)NCC(=O)N1CCO[C@@H](CNc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579405737 1075596468 /nfs/dbraw/zinc/59/64/68/1075596468.db2.gz VADFVKOSVKGLMD-NSHDSACASA-N -1 3 375.393 -1.170 20 0 GAADHM CNC(=O)NCC(=O)N1CCO[C@@H](CNc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579405737 1075596466 /nfs/dbraw/zinc/59/64/66/1075596466.db2.gz VADFVKOSVKGLMD-NSHDSACASA-N -1 3 375.393 -1.170 20 0 GAADHM CNC(=O)NCC(=O)N1CCC(O)(CNc2ncccc2-c2nn[n-]n2)CC1 ZINC001579405786 1075596536 /nfs/dbraw/zinc/59/65/36/1075596536.db2.gz VPZQHTUBHBMOTC-UHFFFAOYSA-N -1 3 389.420 -1.044 20 0 GAADHM CNC(=O)NCC(=O)N1CCC(O)(CNc2ncccc2-c2nnn[n-]2)CC1 ZINC001579405786 1075596530 /nfs/dbraw/zinc/59/65/30/1075596530.db2.gz VPZQHTUBHBMOTC-UHFFFAOYSA-N -1 3 389.420 -1.044 20 0 GAADHM CNC(=O)NCC(=O)N1CCO[C@@H](CNc2ncccc2-c2nn[n-]n2)C1 ZINC001579405810 1075596511 /nfs/dbraw/zinc/59/65/11/1075596511.db2.gz VTMGWNYDMKXQKS-JTQLQIEISA-N -1 3 375.393 -1.170 20 0 GAADHM CNC(=O)NCC(=O)N1CCO[C@@H](CNc2ncccc2-c2nnn[n-]2)C1 ZINC001579405810 1075596508 /nfs/dbraw/zinc/59/65/08/1075596508.db2.gz VTMGWNYDMKXQKS-JTQLQIEISA-N -1 3 375.393 -1.170 20 0 GAADHM CNC(=O)NCC(=O)N1CCO[C@H](CNc2ncccc2-c2nn[n-]n2)C1 ZINC001579405811 1075596502 /nfs/dbraw/zinc/59/65/02/1075596502.db2.gz VTMGWNYDMKXQKS-SNVBAGLBSA-N -1 3 375.393 -1.170 20 0 GAADHM CNC(=O)NCC(=O)N1CCO[C@H](CNc2ncccc2-c2nnn[n-]2)C1 ZINC001579405811 1075596499 /nfs/dbraw/zinc/59/64/99/1075596499.db2.gz VTMGWNYDMKXQKS-SNVBAGLBSA-N -1 3 375.393 -1.170 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@H]1CN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579405971 1075596486 /nfs/dbraw/zinc/59/64/86/1075596486.db2.gz WBLVCFFWEGXRIB-JTQLQIEISA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@H]1CN(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579405971 1075596482 /nfs/dbraw/zinc/59/64/82/1075596482.db2.gz WBLVCFFWEGXRIB-JTQLQIEISA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@H]1CN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579405972 1075596478 /nfs/dbraw/zinc/59/64/78/1075596478.db2.gz WBLVCFFWEGXRIB-SNVBAGLBSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@H]1CN(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579405972 1075596475 /nfs/dbraw/zinc/59/64/75/1075596475.db2.gz WBLVCFFWEGXRIB-SNVBAGLBSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579406003 1075596559 /nfs/dbraw/zinc/59/65/59/1075596559.db2.gz WPLNKZDLPMLXDT-JTQLQIEISA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579406003 1075596555 /nfs/dbraw/zinc/59/65/55/1075596555.db2.gz WPLNKZDLPMLXDT-JTQLQIEISA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579406004 1075596908 /nfs/dbraw/zinc/59/69/08/1075596908.db2.gz WPLNKZDLPMLXDT-SNVBAGLBSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579406004 1075596903 /nfs/dbraw/zinc/59/69/03/1075596903.db2.gz WPLNKZDLPMLXDT-SNVBAGLBSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579406119 1075597049 /nfs/dbraw/zinc/59/70/49/1075597049.db2.gz YCVZZGSKTIPQGB-SECBINFHSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579406119 1075597046 /nfs/dbraw/zinc/59/70/46/1075597046.db2.gz YCVZZGSKTIPQGB-SECBINFHSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579406121 1075597035 /nfs/dbraw/zinc/59/70/35/1075597035.db2.gz YCVZZGSKTIPQGB-VIFPVBQESA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579406121 1075597028 /nfs/dbraw/zinc/59/70/28/1075597028.db2.gz YCVZZGSKTIPQGB-VIFPVBQESA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579406122 1075596862 /nfs/dbraw/zinc/59/68/62/1075596862.db2.gz YGLGJDIKVNCSOS-JTQLQIEISA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579406122 1075596857 /nfs/dbraw/zinc/59/68/57/1075596857.db2.gz YGLGJDIKVNCSOS-JTQLQIEISA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579406124 1075597067 /nfs/dbraw/zinc/59/70/67/1075597067.db2.gz YGLGJDIKVNCSOS-SNVBAGLBSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCC[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579406124 1075597062 /nfs/dbraw/zinc/59/70/62/1075597062.db2.gz YGLGJDIKVNCSOS-SNVBAGLBSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1CCCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001579406125 1075596893 /nfs/dbraw/zinc/59/68/93/1075596893.db2.gz YGWHYXMIBSECKM-UHFFFAOYSA-N -1 3 375.393 -1.202 20 0 GAADHM CNC(=O)NCC(=O)N1CCCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001579406125 1075596888 /nfs/dbraw/zinc/59/68/88/1075596888.db2.gz YGWHYXMIBSECKM-UHFFFAOYSA-N -1 3 375.393 -1.202 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H]2C1 ZINC001579406417 1075596997 /nfs/dbraw/zinc/59/69/97/1075596997.db2.gz BPSCMWLCGLMJLR-BXKDBHETSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H]2C1 ZINC001579406417 1075596990 /nfs/dbraw/zinc/59/69/90/1075596990.db2.gz BPSCMWLCGLMJLR-BXKDBHETSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H]2C1 ZINC001579406430 1075597081 /nfs/dbraw/zinc/59/70/81/1075597081.db2.gz BUHZYLZXXBIAKH-JOYOIKCWSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H]2C1 ZINC001579406430 1075597078 /nfs/dbraw/zinc/59/70/78/1075597078.db2.gz BUHZYLZXXBIAKH-JOYOIKCWSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N[C@H](CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)C(C)C ZINC001579406433 1075597415 /nfs/dbraw/zinc/59/74/15/1075597415.db2.gz BUOQZAAVZAAIDY-LLVKDONJSA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)N[C@H](CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)C(C)C ZINC001579406433 1075597410 /nfs/dbraw/zinc/59/74/10/1075597410.db2.gz BUOQZAAVZAAIDY-LLVKDONJSA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H](CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)C(C)C ZINC001579406437 1075597475 /nfs/dbraw/zinc/59/74/75/1075597475.db2.gz BUOQZAAVZAAIDY-NSHDSACASA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H](CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)C(C)C ZINC001579406437 1075597472 /nfs/dbraw/zinc/59/74/72/1075597472.db2.gz BUOQZAAVZAAIDY-NSHDSACASA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@H](OC)C1 ZINC001579406506 1075597240 /nfs/dbraw/zinc/59/72/40/1075597240.db2.gz DCUAOYYBDLOTKX-GHMZBOCLSA-N -1 3 391.392 -1.921 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@H](OC)C1 ZINC001579406506 1075597236 /nfs/dbraw/zinc/59/72/36/1075597236.db2.gz DCUAOYYBDLOTKX-GHMZBOCLSA-N -1 3 391.392 -1.921 20 0 GAADHM CNC(=O)NCC(=O)NC1(CCO)CN(Cc2ccccc2-c2nn[n-]n2)C1 ZINC001579406842 1075597489 /nfs/dbraw/zinc/59/74/89/1075597489.db2.gz DVJOKADBDFBCCK-UHFFFAOYSA-N -1 3 388.432 -1.151 20 0 GAADHM CNC(=O)NCC(=O)NC1(CCO)CN(Cc2ccccc2-c2nnn[n-]2)C1 ZINC001579406842 1075597487 /nfs/dbraw/zinc/59/74/87/1075597487.db2.gz DVJOKADBDFBCCK-UHFFFAOYSA-N -1 3 388.432 -1.151 20 0 GAADHM CNC(=O)NCC(=O)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(-c3nn[n-]n3)c[nH]1)C2 ZINC001579406885 1075597375 /nfs/dbraw/zinc/59/73/75/1075597375.db2.gz FBKBLKJSYHEAMS-FOGDFJRCSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NCC(=O)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(-c3nnn[n-]3)c[nH]1)C2 ZINC001579406885 1075597371 /nfs/dbraw/zinc/59/73/71/1075597371.db2.gz FBKBLKJSYHEAMS-FOGDFJRCSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NCC(=O)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(-c3nn[n-]n3)c[nH]1)C2 ZINC001579406889 1075597226 /nfs/dbraw/zinc/59/72/26/1075597226.db2.gz FBKBLKJSYHEAMS-SCVCMEIPSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NCC(=O)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(-c3nnn[n-]3)c[nH]1)C2 ZINC001579406889 1075597223 /nfs/dbraw/zinc/59/72/23/1075597223.db2.gz FBKBLKJSYHEAMS-SCVCMEIPSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NCC(=O)N[C@H](C)C1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579406967 1075597273 /nfs/dbraw/zinc/59/72/73/1075597273.db2.gz FSDUEQZLGCEDHM-MRVPVSSYSA-N -1 3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N[C@H](C)C1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579406967 1075597269 /nfs/dbraw/zinc/59/72/69/1075597269.db2.gz FSDUEQZLGCEDHM-MRVPVSSYSA-N -1 3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H](C)C1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579406969 1075597307 /nfs/dbraw/zinc/59/73/07/1075597307.db2.gz FSDUEQZLGCEDHM-QMMMGPOBSA-N -1 3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H](C)C1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579406969 1075597302 /nfs/dbraw/zinc/59/73/02/1075597302.db2.gz FSDUEQZLGCEDHM-QMMMGPOBSA-N -1 3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N[C@H](CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)C1CC1 ZINC001579406999 1075597199 /nfs/dbraw/zinc/59/71/99/1075597199.db2.gz GHSSXQNZJKOGJY-LLVKDONJSA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)N[C@H](CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)C1CC1 ZINC001579406999 1075597197 /nfs/dbraw/zinc/59/71/97/1075597197.db2.gz GHSSXQNZJKOGJY-LLVKDONJSA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H](CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)C1CC1 ZINC001579407000 1075597262 /nfs/dbraw/zinc/59/72/62/1075597262.db2.gz GHSSXQNZJKOGJY-NSHDSACASA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H](CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)C1CC1 ZINC001579407000 1075597257 /nfs/dbraw/zinc/59/72/57/1075597257.db2.gz GHSSXQNZJKOGJY-NSHDSACASA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)NC1(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCC1 ZINC001579407197 1075597464 /nfs/dbraw/zinc/59/74/64/1075597464.db2.gz HDVAXOAZWVLIKX-UHFFFAOYSA-N -1 3 375.393 -1.108 20 0 GAADHM CNC(=O)NCC(=O)NC1(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCC1 ZINC001579407197 1075597460 /nfs/dbraw/zinc/59/74/60/1075597460.db2.gz HDVAXOAZWVLIKX-UHFFFAOYSA-N -1 3 375.393 -1.108 20 0 GAADHM CNC(=O)NCC(=O)NC1(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCC1 ZINC001579407200 1075597442 /nfs/dbraw/zinc/59/74/42/1075597442.db2.gz HEXQPLZDMROHRF-UHFFFAOYSA-N -1 3 375.393 -1.108 20 0 GAADHM CNC(=O)NCC(=O)NC1(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCC1 ZINC001579407200 1075597438 /nfs/dbraw/zinc/59/74/38/1075597438.db2.gz HEXQPLZDMROHRF-UHFFFAOYSA-N -1 3 375.393 -1.108 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]21 ZINC001579407207 1075597289 /nfs/dbraw/zinc/59/72/89/1075597289.db2.gz HQMBDBHSWBAZHS-BXKDBHETSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]21 ZINC001579407207 1075597286 /nfs/dbraw/zinc/59/72/86/1075597286.db2.gz HQMBDBHSWBAZHS-BXKDBHETSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N[C@H](CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)C1CC1 ZINC001579407218 1075597431 /nfs/dbraw/zinc/59/74/31/1075597431.db2.gz HXWLRNIZDXASNW-LLVKDONJSA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)N[C@H](CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)C1CC1 ZINC001579407218 1075597426 /nfs/dbraw/zinc/59/74/26/1075597426.db2.gz HXWLRNIZDXASNW-LLVKDONJSA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H](CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)C1CC1 ZINC001579407219 1075597327 /nfs/dbraw/zinc/59/73/27/1075597327.db2.gz HXWLRNIZDXASNW-NSHDSACASA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H](CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)C1CC1 ZINC001579407219 1075597321 /nfs/dbraw/zinc/59/73/21/1075597321.db2.gz HXWLRNIZDXASNW-NSHDSACASA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@H](OC)C1 ZINC001579407253 1075597838 /nfs/dbraw/zinc/59/78/38/1075597838.db2.gz IMEMKNOYIMIZNX-GHMZBOCLSA-N -1 3 391.392 -1.921 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@H](OC)C1 ZINC001579407253 1075597837 /nfs/dbraw/zinc/59/78/37/1075597837.db2.gz IMEMKNOYIMIZNX-GHMZBOCLSA-N -1 3 391.392 -1.921 20 0 GAADHM CNC(=O)NCC(=O)N[C@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)C(C)C ZINC001579407254 1075597818 /nfs/dbraw/zinc/59/78/18/1075597818.db2.gz INEHFXGCHSABFP-LLVKDONJSA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)N[C@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)C(C)C ZINC001579407254 1075597817 /nfs/dbraw/zinc/59/78/17/1075597817.db2.gz INEHFXGCHSABFP-LLVKDONJSA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)C(C)C ZINC001579407255 1075597832 /nfs/dbraw/zinc/59/78/32/1075597832.db2.gz INEHFXGCHSABFP-NSHDSACASA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)C(C)C ZINC001579407255 1075597830 /nfs/dbraw/zinc/59/78/30/1075597830.db2.gz INEHFXGCHSABFP-NSHDSACASA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)N[C@H](CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)C(C)C ZINC001579407278 1075597826 /nfs/dbraw/zinc/59/78/26/1075597826.db2.gz JCPPQTGUYMJHKH-LLVKDONJSA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)N[C@H](CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)C(C)C ZINC001579407278 1075597824 /nfs/dbraw/zinc/59/78/24/1075597824.db2.gz JCPPQTGUYMJHKH-LLVKDONJSA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H](CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)C(C)C ZINC001579407446 1075597742 /nfs/dbraw/zinc/59/77/42/1075597742.db2.gz JCPPQTGUYMJHKH-NSHDSACASA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H](CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)C(C)C ZINC001579407446 1075597738 /nfs/dbraw/zinc/59/77/38/1075597738.db2.gz JCPPQTGUYMJHKH-NSHDSACASA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2C1 ZINC001579407489 1075597728 /nfs/dbraw/zinc/59/77/28/1075597728.db2.gz JROMNPWPEGASER-AOOOYVTPSA-N -1 3 387.404 -1.346 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2C1 ZINC001579407489 1075597724 /nfs/dbraw/zinc/59/77/24/1075597724.db2.gz JROMNPWPEGASER-AOOOYVTPSA-N -1 3 387.404 -1.346 20 0 GAADHM CNC(=O)NCC(=O)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c[nH]c(-c3nn[n-]n3)c1)C2 ZINC001579407544 1075597751 /nfs/dbraw/zinc/59/77/51/1075597751.db2.gz KIIRDTAGGIONTC-FOGDFJRCSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NCC(=O)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c[nH]c(-c3nnn[n-]3)c1)C2 ZINC001579407544 1075597750 /nfs/dbraw/zinc/59/77/50/1075597750.db2.gz KIIRDTAGGIONTC-FOGDFJRCSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NCC(=O)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c[nH]c(-c3nn[n-]n3)c1)C2 ZINC001579407545 1075597794 /nfs/dbraw/zinc/59/77/94/1075597794.db2.gz KIIRDTAGGIONTC-SCVCMEIPSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NCC(=O)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c[nH]c(-c3nnn[n-]3)c1)C2 ZINC001579407545 1075597792 /nfs/dbraw/zinc/59/77/92/1075597792.db2.gz KIIRDTAGGIONTC-SCVCMEIPSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H]2C1 ZINC001579407553 1075597698 /nfs/dbraw/zinc/59/76/98/1075597698.db2.gz KQDXYOVRCDEYKI-BXKDBHETSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H]2C1 ZINC001579407553 1075597693 /nfs/dbraw/zinc/59/76/93/1075597693.db2.gz KQDXYOVRCDEYKI-BXKDBHETSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)NC1(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCC1 ZINC001579407576 1075597805 /nfs/dbraw/zinc/59/78/05/1075597805.db2.gz LFEAGRLMUMRVDQ-UHFFFAOYSA-N -1 3 375.393 -1.108 20 0 GAADHM CNC(=O)NCC(=O)NC1(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCC1 ZINC001579407576 1075597804 /nfs/dbraw/zinc/59/78/04/1075597804.db2.gz LFEAGRLMUMRVDQ-UHFFFAOYSA-N -1 3 375.393 -1.108 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2C1 ZINC001579407586 1075597682 /nfs/dbraw/zinc/59/76/82/1075597682.db2.gz LMTADTWCSXABHL-PHIMTYICSA-N -1 3 387.404 -1.346 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2C1 ZINC001579407586 1075597678 /nfs/dbraw/zinc/59/76/78/1075597678.db2.gz LMTADTWCSXABHL-PHIMTYICSA-N -1 3 387.404 -1.346 20 0 GAADHM CNC(=O)NCC(=O)NC1(CCO)CN(Cc2cccc(-c3nn[n-]n3)c2)C1 ZINC001579407595 1075597761 /nfs/dbraw/zinc/59/77/61/1075597761.db2.gz LVXBRZZVQYWXHJ-UHFFFAOYSA-N -1 3 388.432 -1.151 20 0 GAADHM CNC(=O)NCC(=O)NC1(CCO)CN(Cc2cccc(-c3nnn[n-]3)c2)C1 ZINC001579407595 1075597759 /nfs/dbraw/zinc/59/77/59/1075597759.db2.gz LVXBRZZVQYWXHJ-UHFFFAOYSA-N -1 3 388.432 -1.151 20 0 GAADHM CNC(=O)NCC(=O)N[C@@]1(C)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579407888 1075597770 /nfs/dbraw/zinc/59/77/70/1075597770.db2.gz NCLHXPSLGMBLGR-HNNXBMFYSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N[C@@]1(C)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579407888 1075597767 /nfs/dbraw/zinc/59/77/67/1075597767.db2.gz NCLHXPSLGMBLGR-HNNXBMFYSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N[C@]1(C)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579407891 1075597777 /nfs/dbraw/zinc/59/77/77/1075597777.db2.gz NCLHXPSLGMBLGR-OAHLLOKOSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N[C@]1(C)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579407891 1075597774 /nfs/dbraw/zinc/59/77/74/1075597774.db2.gz NCLHXPSLGMBLGR-OAHLLOKOSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](OC)C1 ZINC001579408014 1075597811 /nfs/dbraw/zinc/59/78/11/1075597811.db2.gz OUDNNDKUTQHDOG-GHMZBOCLSA-N -1 3 391.392 -1.921 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H](OC)C1 ZINC001579408014 1075597809 /nfs/dbraw/zinc/59/78/09/1075597809.db2.gz OUDNNDKUTQHDOG-GHMZBOCLSA-N -1 3 391.392 -1.921 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]21 ZINC001579408292 1075597801 /nfs/dbraw/zinc/59/78/01/1075597801.db2.gz RAFBFKDAYLTRJS-JOYOIKCWSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]21 ZINC001579408292 1075597800 /nfs/dbraw/zinc/59/78/00/1075597800.db2.gz RAFBFKDAYLTRJS-JOYOIKCWSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]21 ZINC001579408443 1075597788 /nfs/dbraw/zinc/59/77/88/1075597788.db2.gz SCTPCSOBOJPZOT-BXKDBHETSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]21 ZINC001579408443 1075597786 /nfs/dbraw/zinc/59/77/86/1075597786.db2.gz SCTPCSOBOJPZOT-BXKDBHETSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]21 ZINC001579408445 1075598070 /nfs/dbraw/zinc/59/80/70/1075598070.db2.gz SEWVRRRAXVSGFU-JOYOIKCWSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]21 ZINC001579408445 1075598064 /nfs/dbraw/zinc/59/80/64/1075598064.db2.gz SEWVRRRAXVSGFU-JOYOIKCWSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(-c3nn[n-]n3)[nH]1)C2 ZINC001579408450 1075598092 /nfs/dbraw/zinc/59/80/92/1075598092.db2.gz SNNPDOUZCDALFM-FXAINCCUSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NCC(=O)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(-c3nnn[n-]3)[nH]1)C2 ZINC001579408450 1075598089 /nfs/dbraw/zinc/59/80/89/1075598089.db2.gz SNNPDOUZCDALFM-FXAINCCUSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H]2C1 ZINC001579408569 1075598205 /nfs/dbraw/zinc/59/82/05/1075598205.db2.gz UXCZIBLALCKGJC-BXKDBHETSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1CC[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H]2C1 ZINC001579408569 1075598204 /nfs/dbraw/zinc/59/82/04/1075598204.db2.gz UXCZIBLALCKGJC-BXKDBHETSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H]2C1 ZINC001579408588 1075598240 /nfs/dbraw/zinc/59/82/40/1075598240.db2.gz UYZXIGAEDGOSMT-JOYOIKCWSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H]2C1 ZINC001579408588 1075598235 /nfs/dbraw/zinc/59/82/35/1075598235.db2.gz UYZXIGAEDGOSMT-JOYOIKCWSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N[C@@]1(C)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579408795 1075598052 /nfs/dbraw/zinc/59/80/52/1075598052.db2.gz WYEOGMUIUHHQHG-HNNXBMFYSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N[C@@]1(C)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579408795 1075598047 /nfs/dbraw/zinc/59/80/47/1075598047.db2.gz WYEOGMUIUHHQHG-HNNXBMFYSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N[C@]1(C)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579408796 1075598131 /nfs/dbraw/zinc/59/81/31/1075598131.db2.gz WYEOGMUIUHHQHG-OAHLLOKOSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N[C@]1(C)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579408796 1075598128 /nfs/dbraw/zinc/59/81/28/1075598128.db2.gz WYEOGMUIUHHQHG-OAHLLOKOSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)N[C@H](C)C1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579408809 1075598080 /nfs/dbraw/zinc/59/80/80/1075598080.db2.gz XIQQCSCMWCCBEK-MRVPVSSYSA-N -1 3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N[C@H](C)C1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579408809 1075598077 /nfs/dbraw/zinc/59/80/77/1075598077.db2.gz XIQQCSCMWCCBEK-MRVPVSSYSA-N -1 3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H](C)C1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579408810 1075598145 /nfs/dbraw/zinc/59/81/45/1075598145.db2.gz XIQQCSCMWCCBEK-QMMMGPOBSA-N -1 3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H](C)C1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579408810 1075598141 /nfs/dbraw/zinc/59/81/41/1075598141.db2.gz XIQQCSCMWCCBEK-QMMMGPOBSA-N -1 3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H]2C1 ZINC001579408839 1075598226 /nfs/dbraw/zinc/59/82/26/1075598226.db2.gz YJRNAASZAVSKMB-JOYOIKCWSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H]2C1 ZINC001579408839 1075598225 /nfs/dbraw/zinc/59/82/25/1075598225.db2.gz YJRNAASZAVSKMB-JOYOIKCWSA-N 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CNC(=O)NCC(=O)N[C@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)C1CC1 ZINC001579408848 1075598162 /nfs/dbraw/zinc/59/81/62/1075598162.db2.gz YSKVSOHPAKGTSF-LLVKDONJSA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)C1CC1 ZINC001579408849 1075598191 /nfs/dbraw/zinc/59/81/91/1075598191.db2.gz YSKVSOHPAKGTSF-NSHDSACASA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)C1CC1 ZINC001579408849 1075598185 /nfs/dbraw/zinc/59/81/85/1075598185.db2.gz YSKVSOHPAKGTSF-NSHDSACASA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]21 ZINC001579408850 1075598156 /nfs/dbraw/zinc/59/81/56/1075598156.db2.gz YWOKGJJQZQTRMR-BXKDBHETSA-N -1 3 387.404 -1.203 20 0 GAADHM CNC(=O)NCC(=O)N1C[C@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]21 ZINC001579408850 1075598153 /nfs/dbraw/zinc/59/81/53/1075598153.db2.gz YWOKGJJQZQTRMR-BXKDBHETSA-N -1 3 387.404 -1.203 20 0 GAADHM 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3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1C ZINC001579409333 1075599234 /nfs/dbraw/zinc/59/92/34/1075599234.db2.gz HUBPOWRMCWGYIY-LDYMZIIASA-N -1 3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1C ZINC001579409333 1075599232 /nfs/dbraw/zinc/59/92/32/1075599232.db2.gz HUBPOWRMCWGYIY-LDYMZIIASA-N -1 3 375.393 -1.300 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1C[C@@H](C)N(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579409361 1075599255 /nfs/dbraw/zinc/59/92/55/1075599255.db2.gz ILPCHZAJRMWKBH-BDAKNGLRSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1C[C@@H](C)N(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579409361 1075599253 /nfs/dbraw/zinc/59/92/53/1075599253.db2.gz ILPCHZAJRMWKBH-BDAKNGLRSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H]1C[C@H](C)N(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579409362 1075599195 /nfs/dbraw/zinc/59/91/95/1075599195.db2.gz ILPCHZAJRMWKBH-DTWKUNHWSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H]1C[C@H](C)N(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579409362 1075599191 /nfs/dbraw/zinc/59/91/91/1075599191.db2.gz ILPCHZAJRMWKBH-DTWKUNHWSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1C[C@H](C)N(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579409363 1075599222 /nfs/dbraw/zinc/59/92/22/1075599222.db2.gz ILPCHZAJRMWKBH-IUCAKERBSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1C[C@H](C)N(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579409363 1075599219 /nfs/dbraw/zinc/59/92/19/1075599219.db2.gz ILPCHZAJRMWKBH-IUCAKERBSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H]1C[C@@H](C)N(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579409364 1075599337 /nfs/dbraw/zinc/59/93/37/1075599337.db2.gz ILPCHZAJRMWKBH-RKDXNWHRSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H]1C[C@@H](C)N(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579409364 1075599333 /nfs/dbraw/zinc/59/93/33/1075599333.db2.gz ILPCHZAJRMWKBH-RKDXNWHRSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H]1C ZINC001579409372 1075599249 /nfs/dbraw/zinc/59/92/49/1075599249.db2.gz IRIACMGRONPRNI-BDAKNGLRSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H]1C ZINC001579409372 1075599247 /nfs/dbraw/zinc/59/92/47/1075599247.db2.gz IRIACMGRONPRNI-BDAKNGLRSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H]1C ZINC001579409373 1075599185 /nfs/dbraw/zinc/59/91/85/1075599185.db2.gz IRIACMGRONPRNI-DTWKUNHWSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H]1C ZINC001579409373 1075599180 /nfs/dbraw/zinc/59/91/80/1075599180.db2.gz IRIACMGRONPRNI-DTWKUNHWSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H]1C ZINC001579409374 1075599313 /nfs/dbraw/zinc/59/93/13/1075599313.db2.gz IRIACMGRONPRNI-IUCAKERBSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H]1C ZINC001579409374 1075599310 /nfs/dbraw/zinc/59/93/10/1075599310.db2.gz IRIACMGRONPRNI-IUCAKERBSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H]1C ZINC001579409375 1075599278 /nfs/dbraw/zinc/59/92/78/1075599278.db2.gz IRIACMGRONPRNI-RKDXNWHRSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H]1C ZINC001579409375 1075599275 /nfs/dbraw/zinc/59/92/75/1075599275.db2.gz IRIACMGRONPRNI-RKDXNWHRSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H](NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)C(C)C ZINC001579409483 1075599206 /nfs/dbraw/zinc/59/92/06/1075599206.db2.gz LBJJCHCYVYZMMB-LLVKDONJSA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H](NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)C(C)C ZINC001579409483 1075599203 /nfs/dbraw/zinc/59/92/03/1075599203.db2.gz LBJJCHCYVYZMMB-LLVKDONJSA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H](NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)C(C)C ZINC001579409484 1075599608 /nfs/dbraw/zinc/59/96/08/1075599608.db2.gz LBJJCHCYVYZMMB-NSHDSACASA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H](NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)C(C)C ZINC001579409484 1075599603 /nfs/dbraw/zinc/59/96/03/1075599603.db2.gz LBJJCHCYVYZMMB-NSHDSACASA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1O ZINC001579409485 1075599517 /nfs/dbraw/zinc/59/95/17/1075599517.db2.gz LDKQIJZUKFEWQK-GHMZBOCLSA-N -1 3 375.393 -1.754 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C[C@H]1O ZINC001579409485 1075599515 /nfs/dbraw/zinc/59/95/15/1075599515.db2.gz LDKQIJZUKFEWQK-GHMZBOCLSA-N -1 3 375.393 -1.754 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001579409486 1075599744 /nfs/dbraw/zinc/59/97/44/1075599744.db2.gz LDKQIJZUKFEWQK-MNOVXSKESA-N -1 3 375.393 -1.754 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O 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GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(c2ccc(-c3nn[n-]n3)nc2)CCCO1 ZINC001579411589 1075601553 /nfs/dbraw/zinc/60/15/53/1075601553.db2.gz IMWAWHHVYOUAHD-LBPRGKRZSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(c2ccc(-c3nnn[n-]3)nc2)CCCO1 ZINC001579411589 1075601551 /nfs/dbraw/zinc/60/15/51/1075601551.db2.gz IMWAWHHVYOUAHD-LBPRGKRZSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1[C@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]21 ZINC001579411615 1075601468 /nfs/dbraw/zinc/60/14/68/1075601468.db2.gz JASXAPGCRWOCLA-RTCCRHLQSA-N -1 3 387.404 -1.442 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1[C@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]21 ZINC001579411615 1075601466 /nfs/dbraw/zinc/60/14/66/1075601466.db2.gz JASXAPGCRWOCLA-RTCCRHLQSA-N -1 3 387.404 -1.442 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H](NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)C1CC1 ZINC001579411674 1075601902 /nfs/dbraw/zinc/60/19/02/1075601902.db2.gz KAGMMYXCXFSWLZ-LLVKDONJSA-N -1 3 375.393 -1.252 20 0 GAADHM 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ZINC001579411689 1075601833 /nfs/dbraw/zinc/60/18/33/1075601833.db2.gz KJTOKQWFPHLYCK-OAHLLOKOSA-N -1 3 375.393 -1.752 20 0 GAADHM CNC(=O)NCC(=O)NC[C@]1(O)CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579411689 1075601828 /nfs/dbraw/zinc/60/18/28/1075601828.db2.gz KJTOKQWFPHLYCK-OAHLLOKOSA-N -1 3 375.393 -1.752 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@]1(O)CCN(c2ccc(-c3nn[n-]n3)c(C)n2)C1 ZINC001579411712 1075601889 /nfs/dbraw/zinc/60/18/89/1075601889.db2.gz KXTHKIVUDRMWFU-INIZCTEOSA-N -1 3 389.420 -1.443 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@]1(O)CCN(c2ccc(-c3nnn[n-]3)c(C)n2)C1 ZINC001579411712 1075601887 /nfs/dbraw/zinc/60/18/87/1075601887.db2.gz KXTHKIVUDRMWFU-INIZCTEOSA-N -1 3 389.420 -1.443 20 0 GAADHM CNC(=O)NCC(=O)NC[C@]1(O)CCN(c2ccc(-c3nn[n-]n3)c(C)n2)C1 ZINC001579411713 1075601862 /nfs/dbraw/zinc/60/18/62/1075601862.db2.gz KXTHKIVUDRMWFU-MRXNPFEDSA-N -1 3 389.420 -1.443 20 0 GAADHM CNC(=O)NCC(=O)NC[C@]1(O)CCN(c2ccc(-c3nnn[n-]3)c(C)n2)C1 ZINC001579411713 1075601860 /nfs/dbraw/zinc/60/18/60/1075601860.db2.gz KXTHKIVUDRMWFU-MRXNPFEDSA-N -1 3 389.420 -1.443 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H](NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)C(C)C ZINC001579411715 1075601894 /nfs/dbraw/zinc/60/18/94/1075601894.db2.gz KZQZDWOBWPNYPU-LLVKDONJSA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H](NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)C(C)C ZINC001579411715 1075601893 /nfs/dbraw/zinc/60/18/93/1075601893.db2.gz KZQZDWOBWPNYPU-LLVKDONJSA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H](NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)C(C)C ZINC001579411716 1075601933 /nfs/dbraw/zinc/60/19/33/1075601933.db2.gz KZQZDWOBWPNYPU-NSHDSACASA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H](NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)C(C)C ZINC001579411716 1075601931 /nfs/dbraw/zinc/60/19/31/1075601931.db2.gz KZQZDWOBWPNYPU-NSHDSACASA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)CCO1 ZINC001579411729 1075601915 /nfs/dbraw/zinc/60/19/15/1075601915.db2.gz 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CNC(=O)NCC(=O)NC[C@@H]1CN(c2ncccc2-c2nn[n-]n2)CCCO1 ZINC001579411738 1075601852 /nfs/dbraw/zinc/60/18/52/1075601852.db2.gz LNXNEAATWCSVKF-LLVKDONJSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(c2ncccc2-c2nnn[n-]2)CCCO1 ZINC001579411738 1075601850 /nfs/dbraw/zinc/60/18/50/1075601850.db2.gz LNXNEAATWCSVKF-LLVKDONJSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(c2ncccc2-c2nn[n-]n2)CCCO1 ZINC001579411739 1075601908 /nfs/dbraw/zinc/60/19/08/1075601908.db2.gz LNXNEAATWCSVKF-NSHDSACASA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(c2ncccc2-c2nnn[n-]2)CCCO1 ZINC001579411739 1075601906 /nfs/dbraw/zinc/60/19/06/1075601906.db2.gz LNXNEAATWCSVKF-NSHDSACASA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579411750 1075601873 /nfs/dbraw/zinc/60/18/73/1075601873.db2.gz LZTHAXCWQNHWGK-SECBINFHSA-N -1 3 375.393 -1.298 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579411750 1075601871 /nfs/dbraw/zinc/60/18/71/1075601871.db2.gz LZTHAXCWQNHWGK-SECBINFHSA-N -1 3 375.393 -1.298 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579411751 1075601803 /nfs/dbraw/zinc/60/18/03/1075601803.db2.gz LZTHAXCWQNHWGK-VIFPVBQESA-N -1 3 375.393 -1.298 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579411751 1075601798 /nfs/dbraw/zinc/60/17/98/1075601798.db2.gz LZTHAXCWQNHWGK-VIFPVBQESA-N -1 3 375.393 -1.298 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@]1(C)CN(c2ncccc2-c2nn[n-]n2)CCO1 ZINC001579411795 1075602268 /nfs/dbraw/zinc/60/22/68/1075602268.db2.gz NBCKNUYLKVBDIB-INIZCTEOSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@]1(C)CN(c2ncccc2-c2nnn[n-]2)CCO1 ZINC001579411795 1075602266 /nfs/dbraw/zinc/60/22/66/1075602266.db2.gz NBCKNUYLKVBDIB-INIZCTEOSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@]1(C)CN(c2ncccc2-c2nn[n-]n2)CCO1 ZINC001579411796 1075602236 /nfs/dbraw/zinc/60/22/36/1075602236.db2.gz NBCKNUYLKVBDIB-MRXNPFEDSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@]1(C)CN(c2ncccc2-c2nnn[n-]2)CCO1 ZINC001579411796 1075602233 /nfs/dbraw/zinc/60/22/33/1075602233.db2.gz NBCKNUYLKVBDIB-MRXNPFEDSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@]1(O)CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579411802 1075602157 /nfs/dbraw/zinc/60/21/57/1075602157.db2.gz NGGJAQGOVSZFOT-HNNXBMFYSA-N -1 3 375.393 -1.752 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@]1(O)CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579411802 1075602154 /nfs/dbraw/zinc/60/21/54/1075602154.db2.gz NGGJAQGOVSZFOT-HNNXBMFYSA-N -1 3 375.393 -1.752 20 0 GAADHM CNC(=O)NCC(=O)NC[C@]1(O)CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579411803 1075602285 /nfs/dbraw/zinc/60/22/85/1075602285.db2.gz NGGJAQGOVSZFOT-OAHLLOKOSA-N -1 3 375.393 -1.752 20 0 GAADHM CNC(=O)NCC(=O)NC[C@]1(O)CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579411803 1075602283 /nfs/dbraw/zinc/60/22/83/1075602283.db2.gz NGGJAQGOVSZFOT-OAHLLOKOSA-N -1 3 375.393 -1.752 20 0 GAADHM CNC(=O)NCC(=O)NCC1(O)CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C1 ZINC001579411817 1075602245 /nfs/dbraw/zinc/60/22/45/1075602245.db2.gz NPJGNMLXPJXIHM-UHFFFAOYSA-N -1 3 392.395 -1.402 20 0 GAADHM CNC(=O)NCC(=O)NCC1(O)CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C1 ZINC001579411817 1075602242 /nfs/dbraw/zinc/60/22/42/1075602242.db2.gz NPJGNMLXPJXIHM-UHFFFAOYSA-N -1 3 392.395 -1.402 20 0 GAADHM CNC(=O)NCC(=O)NCC1CC(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579411830 1075602197 /nfs/dbraw/zinc/60/21/97/1075602197.db2.gz NXCXKRKYJYQIHW-UHFFFAOYSA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)NCC1CC(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579411830 1075602194 /nfs/dbraw/zinc/60/21/94/1075602194.db2.gz NXCXKRKYJYQIHW-UHFFFAOYSA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H](NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)C(C)C ZINC001579411853 1075602214 /nfs/dbraw/zinc/60/22/14/1075602214.db2.gz OSDPOVREQXJVJT-LLVKDONJSA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H](NC(=O)c1ccc(-c2nnn[n-]2)[nH]1)C(C)C ZINC001579411853 1075602212 /nfs/dbraw/zinc/60/22/12/1075602212.db2.gz OSDPOVREQXJVJT-LLVKDONJSA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H](NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)C(C)C ZINC001579411854 1075602206 /nfs/dbraw/zinc/60/22/06/1075602206.db2.gz OSDPOVREQXJVJT-NSHDSACASA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H](NC(=O)c1ccc(-c2nnn[n-]2)[nH]1)C(C)C ZINC001579411854 1075602202 /nfs/dbraw/zinc/60/22/02/1075602202.db2.gz OSDPOVREQXJVJT-NSHDSACASA-N -1 3 377.409 -1.006 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579411905 1075602638 /nfs/dbraw/zinc/60/26/38/1075602638.db2.gz QOUIGNAYVRUWJP-JTQLQIEISA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579411905 1075602636 /nfs/dbraw/zinc/60/26/36/1075602636.db2.gz QOUIGNAYVRUWJP-JTQLQIEISA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579411906 1075602585 /nfs/dbraw/zinc/60/25/85/1075602585.db2.gz QOUIGNAYVRUWJP-SNVBAGLBSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579411906 1075602581 /nfs/dbraw/zinc/60/25/81/1075602581.db2.gz QOUIGNAYVRUWJP-SNVBAGLBSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1COCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579411912 1075602649 /nfs/dbraw/zinc/60/26/49/1075602649.db2.gz QSCIMEWTTMTSHK-JTQLQIEISA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1COCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579411912 1075602648 /nfs/dbraw/zinc/60/26/48/1075602648.db2.gz QSCIMEWTTMTSHK-JTQLQIEISA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1COCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579411913 1075602544 /nfs/dbraw/zinc/60/25/44/1075602544.db2.gz QSCIMEWTTMTSHK-SNVBAGLBSA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1COCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579411913 1075602541 /nfs/dbraw/zinc/60/25/41/1075602541.db2.gz QSCIMEWTTMTSHK-SNVBAGLBSA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H](NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)C1CC1 ZINC001579411914 1075602593 /nfs/dbraw/zinc/60/25/93/1075602593.db2.gz QWPPTBGMQBBDKD-LLVKDONJSA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H](NC(=O)c1ccc(-c2nnn[n-]2)[nH]1)C1CC1 ZINC001579411914 1075602590 /nfs/dbraw/zinc/60/25/90/1075602590.db2.gz QWPPTBGMQBBDKD-LLVKDONJSA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H](NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)C1CC1 ZINC001579411915 1075602522 /nfs/dbraw/zinc/60/25/22/1075602522.db2.gz QWPPTBGMQBBDKD-NSHDSACASA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H](NC(=O)c1ccc(-c2nnn[n-]2)[nH]1)C1CC1 ZINC001579411915 1075602520 /nfs/dbraw/zinc/60/25/20/1075602520.db2.gz QWPPTBGMQBBDKD-NSHDSACASA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCO1 ZINC001579411917 1075602646 /nfs/dbraw/zinc/60/26/46/1075602646.db2.gz RAARIQUBHMZZTR-SECBINFHSA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCO1 ZINC001579411917 1075602645 /nfs/dbraw/zinc/60/26/45/1075602645.db2.gz RAARIQUBHMZZTR-SECBINFHSA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCO1 ZINC001579411918 1075602643 /nfs/dbraw/zinc/60/26/43/1075602643.db2.gz RAARIQUBHMZZTR-VIFPVBQESA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCO1 ZINC001579411918 1075602642 /nfs/dbraw/zinc/60/26/42/1075602642.db2.gz RAARIQUBHMZZTR-VIFPVBQESA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@]1(C)CN(c2ccc(-c3nn[n-]n3)cn2)CCO1 ZINC001579411938 1075602575 /nfs/dbraw/zinc/60/25/75/1075602575.db2.gz RPBMHTOGZCCSPH-INIZCTEOSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@]1(C)CN(c2ccc(-c3nnn[n-]3)cn2)CCO1 ZINC001579411938 1075602572 /nfs/dbraw/zinc/60/25/72/1075602572.db2.gz RPBMHTOGZCCSPH-INIZCTEOSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@]1(C)CN(c2ccc(-c3nn[n-]n3)cn2)CCO1 ZINC001579411939 1075602602 /nfs/dbraw/zinc/60/26/02/1075602602.db2.gz RPBMHTOGZCCSPH-MRXNPFEDSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@]1(C)CN(c2ccc(-c3nnn[n-]3)cn2)CCO1 ZINC001579411939 1075602599 /nfs/dbraw/zinc/60/25/99/1075602599.db2.gz RPBMHTOGZCCSPH-MRXNPFEDSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NCC1(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCC1 ZINC001579411944 1075602628 /nfs/dbraw/zinc/60/26/28/1075602628.db2.gz RQYDEPQESDVUBH-UHFFFAOYSA-N -1 3 375.393 -1.108 20 0 GAADHM CNC(=O)NCC(=O)NCC1(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCC1 ZINC001579411944 1075602627 /nfs/dbraw/zinc/60/26/27/1075602627.db2.gz RQYDEPQESDVUBH-UHFFFAOYSA-N -1 3 375.393 -1.108 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1C ZINC001579411956 1075602623 /nfs/dbraw/zinc/60/26/23/1075602623.db2.gz SCRLWBQWBXFKNW-GXSJLCMTSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1C ZINC001579411956 1075602622 /nfs/dbraw/zinc/60/26/22/1075602622.db2.gz SCRLWBQWBXFKNW-GXSJLCMTSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1C ZINC001579411957 1075602618 /nfs/dbraw/zinc/60/26/18/1075602618.db2.gz SCRLWBQWBXFKNW-KOLCDFICSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1C ZINC001579411957 1075602617 /nfs/dbraw/zinc/60/26/17/1075602617.db2.gz SCRLWBQWBXFKNW-KOLCDFICSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1C ZINC001579411958 1075602549 /nfs/dbraw/zinc/60/25/49/1075602549.db2.gz SCRLWBQWBXFKNW-MWLCHTKSSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1C ZINC001579411958 1075602548 /nfs/dbraw/zinc/60/25/48/1075602548.db2.gz SCRLWBQWBXFKNW-MWLCHTKSSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1C ZINC001579411959 1075602567 /nfs/dbraw/zinc/60/25/67/1075602567.db2.gz SCRLWBQWBXFKNW-ONGXEEELSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1C ZINC001579411959 1075602564 /nfs/dbraw/zinc/60/25/64/1075602564.db2.gz SCRLWBQWBXFKNW-ONGXEEELSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)NCC1CC(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579411963 1075602632 /nfs/dbraw/zinc/60/26/32/1075602632.db2.gz SMAYIUHBEYDAKV-UHFFFAOYSA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)NCC1CC(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579411963 1075602631 /nfs/dbraw/zinc/60/26/31/1075602631.db2.gz SMAYIUHBEYDAKV-UHFFFAOYSA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCO1 ZINC001579411976 1075602559 /nfs/dbraw/zinc/60/25/59/1075602559.db2.gz SSHPGVRHGUAQTA-JTQLQIEISA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCO1 ZINC001579411976 1075602556 /nfs/dbraw/zinc/60/25/56/1075602556.db2.gz SSHPGVRHGUAQTA-JTQLQIEISA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCO1 ZINC001579411977 1075602610 /nfs/dbraw/zinc/60/26/10/1075602610.db2.gz SSHPGVRHGUAQTA-SNVBAGLBSA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCO1 ZINC001579411977 1075602607 /nfs/dbraw/zinc/60/26/07/1075602607.db2.gz SSHPGVRHGUAQTA-SNVBAGLBSA-N -1 3 391.392 -1.919 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1[C@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]21 ZINC001579411989 1075602996 /nfs/dbraw/zinc/60/29/96/1075602996.db2.gz TVJRNMDSCAMXIC-OWUUHHOZSA-N -1 3 387.404 -1.442 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1[C@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]21 ZINC001579411989 1075602994 /nfs/dbraw/zinc/60/29/94/1075602994.db2.gz TVJRNMDSCAMXIC-OWUUHHOZSA-N -1 3 387.404 -1.442 20 0 GAADHM CNC(=O)NCC(=O)NCC1(O)CN(Cc2cc(F)ccc2-c2nn[n-]n2)C1 ZINC001579411999 1075602986 /nfs/dbraw/zinc/60/29/86/1075602986.db2.gz UCJKGVFXCGAZCP-UHFFFAOYSA-N -1 3 392.395 -1.402 20 0 GAADHM CNC(=O)NCC(=O)NCC1(O)CN(Cc2cc(F)ccc2-c2nnn[n-]2)C1 ZINC001579411999 1075602985 /nfs/dbraw/zinc/60/29/85/1075602985.db2.gz UCJKGVFXCGAZCP-UHFFFAOYSA-N -1 3 392.395 -1.402 20 0 GAADHM CNC(=O)NCC(=O)NCC1(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCC1 ZINC001579412003 1075603014 /nfs/dbraw/zinc/60/30/14/1075603014.db2.gz UFUCMZRGCRIVLL-UHFFFAOYSA-N -1 3 375.393 -1.108 20 0 GAADHM CNC(=O)NCC(=O)NCC1(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCC1 ZINC001579412003 1075603012 /nfs/dbraw/zinc/60/30/12/1075603012.db2.gz UFUCMZRGCRIVLL-UHFFFAOYSA-N -1 3 375.393 -1.108 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(c2ncccc2-c2nn[n-]n2)CCO1 ZINC001579412027 1075602911 /nfs/dbraw/zinc/60/29/11/1075602911.db2.gz VBCOZYAUCCGUOF-JTQLQIEISA-N -1 3 375.393 -1.488 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(c2ncccc2-c2nnn[n-]2)CCO1 ZINC001579412027 1075602909 /nfs/dbraw/zinc/60/29/09/1075602909.db2.gz VBCOZYAUCCGUOF-JTQLQIEISA-N -1 3 375.393 -1.488 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(c2ncccc2-c2nn[n-]n2)CCO1 ZINC001579412028 1075603022 /nfs/dbraw/zinc/60/30/22/1075603022.db2.gz VBCOZYAUCCGUOF-SNVBAGLBSA-N -1 3 375.393 -1.488 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(c2ncccc2-c2nnn[n-]2)CCO1 ZINC001579412028 1075603019 /nfs/dbraw/zinc/60/30/19/1075603019.db2.gz VBCOZYAUCCGUOF-SNVBAGLBSA-N -1 3 375.393 -1.488 20 0 GAADHM CNC(=O)NCC(=O)NCC1(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCC1 ZINC001579412061 1075603003 /nfs/dbraw/zinc/60/30/03/1075603003.db2.gz VWADXFACIALRKR-UHFFFAOYSA-N -1 3 375.393 -1.108 20 0 GAADHM CNC(=O)NCC(=O)NCC1(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCC1 ZINC001579412061 1075603001 /nfs/dbraw/zinc/60/30/01/1075603001.db2.gz VWADXFACIALRKR-UHFFFAOYSA-N -1 3 375.393 -1.108 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@]1(C)CN(c2ccc(-c3nn[n-]n3)nc2)CCO1 ZINC001579412064 1075603029 /nfs/dbraw/zinc/60/30/29/1075603029.db2.gz VWOUKRKSNCJSQE-INIZCTEOSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@]1(C)CN(c2ccc(-c3nnn[n-]3)nc2)CCO1 ZINC001579412064 1075603027 /nfs/dbraw/zinc/60/30/27/1075603027.db2.gz VWOUKRKSNCJSQE-INIZCTEOSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@]1(C)CN(c2ccc(-c3nn[n-]n3)nc2)CCO1 ZINC001579412065 1075602900 /nfs/dbraw/zinc/60/29/00/1075602900.db2.gz VWOUKRKSNCJSQE-MRXNPFEDSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@]1(C)CN(c2ccc(-c3nnn[n-]3)nc2)CCO1 ZINC001579412065 1075602898 /nfs/dbraw/zinc/60/28/98/1075602898.db2.gz VWOUKRKSNCJSQE-MRXNPFEDSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1C ZINC001579412070 1075602964 /nfs/dbraw/zinc/60/29/64/1075602964.db2.gz WCPJNXNHHWUOGO-GXSJLCMTSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1C ZINC001579412070 1075602961 /nfs/dbraw/zinc/60/29/61/1075602961.db2.gz WCPJNXNHHWUOGO-GXSJLCMTSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1C ZINC001579412071 1075602920 /nfs/dbraw/zinc/60/29/20/1075602920.db2.gz WCPJNXNHHWUOGO-KOLCDFICSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1C ZINC001579412071 1075602919 /nfs/dbraw/zinc/60/29/19/1075602919.db2.gz WCPJNXNHHWUOGO-KOLCDFICSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1C ZINC001579412072 1075602981 /nfs/dbraw/zinc/60/29/81/1075602981.db2.gz WCPJNXNHHWUOGO-MWLCHTKSSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1C ZINC001579412072 1075602979 /nfs/dbraw/zinc/60/29/79/1075602979.db2.gz WCPJNXNHHWUOGO-MWLCHTKSSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1C ZINC001579412073 1075602952 /nfs/dbraw/zinc/60/29/52/1075602952.db2.gz WCPJNXNHHWUOGO-ONGXEEELSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1C ZINC001579412073 1075602948 /nfs/dbraw/zinc/60/29/48/1075602948.db2.gz WCPJNXNHHWUOGO-ONGXEEELSA-N -1 3 389.420 -1.052 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579412085 1075603251 /nfs/dbraw/zinc/60/32/51/1075603251.db2.gz WMPOQTTZZUVIHT-SECBINFHSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579412085 1075603248 /nfs/dbraw/zinc/60/32/48/1075603248.db2.gz WMPOQTTZZUVIHT-SECBINFHSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579412086 1075603219 /nfs/dbraw/zinc/60/32/19/1075603219.db2.gz WMPOQTTZZUVIHT-VIFPVBQESA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579412086 1075603217 /nfs/dbraw/zinc/60/32/17/1075603217.db2.gz WMPOQTTZZUVIHT-VIFPVBQESA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)CCCO1 ZINC001579412087 1075603377 /nfs/dbraw/zinc/60/33/77/1075603377.db2.gz WPDJSGYYUJVVBS-GFCCVEGCSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)CCCO1 ZINC001579412087 1075603374 /nfs/dbraw/zinc/60/33/74/1075603374.db2.gz WPDJSGYYUJVVBS-GFCCVEGCSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(c2ccc(-c3nn[n-]n3)cn2)CCCO1 ZINC001579412088 1075603208 /nfs/dbraw/zinc/60/32/08/1075603208.db2.gz WPDJSGYYUJVVBS-LBPRGKRZSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(c2ccc(-c3nnn[n-]3)cn2)CCCO1 ZINC001579412088 1075603206 /nfs/dbraw/zinc/60/32/06/1075603206.db2.gz WPDJSGYYUJVVBS-LBPRGKRZSA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1COCCN1c1nc(C)ccc1-c1nn[n-]n1 ZINC001579412093 1075603305 /nfs/dbraw/zinc/60/33/05/1075603305.db2.gz WVILDGNAVBFYKF-LLVKDONJSA-N -1 3 389.420 -1.179 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1COCCN1c1nc(C)ccc1-c1nnn[n-]1 ZINC001579412093 1075603302 /nfs/dbraw/zinc/60/33/02/1075603302.db2.gz WVILDGNAVBFYKF-LLVKDONJSA-N -1 3 389.420 -1.179 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1COCCN1c1nc(C)ccc1-c1nn[n-]n1 ZINC001579412094 1075603358 /nfs/dbraw/zinc/60/33/58/1075603358.db2.gz WVILDGNAVBFYKF-NSHDSACASA-N -1 3 389.420 -1.179 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1COCCN1c1nc(C)ccc1-c1nnn[n-]1 ZINC001579412094 1075603356 /nfs/dbraw/zinc/60/33/56/1075603356.db2.gz WVILDGNAVBFYKF-NSHDSACASA-N -1 3 389.420 -1.179 20 0 GAADHM CNC(=O)NCC(=O)NCC1(O)CN(Cc2ccc(-c3nnn[n-]3)s2)C1 ZINC001579412118 1075603286 /nfs/dbraw/zinc/60/32/86/1075603286.db2.gz XJLLYKWLJNIJDU-UHFFFAOYSA-N -1 3 380.434 -1.480 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]21 ZINC001579412133 1075603340 /nfs/dbraw/zinc/60/33/40/1075603340.db2.gz XTAPRWGBFAGMAL-RTCCRHLQSA-N -1 3 387.404 -1.442 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]21 ZINC001579412133 1075603336 /nfs/dbraw/zinc/60/33/36/1075603336.db2.gz XTAPRWGBFAGMAL-RTCCRHLQSA-N -1 3 387.404 -1.442 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1COCCN1c1ncccc1-c1nn[n-]n1 ZINC001579412135 1075603350 /nfs/dbraw/zinc/60/33/50/1075603350.db2.gz XTTSJJCVGFXDAZ-JTQLQIEISA-N -1 3 375.393 -1.488 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1COCCN1c1ncccc1-c1nnn[n-]1 ZINC001579412135 1075603347 /nfs/dbraw/zinc/60/33/47/1075603347.db2.gz XTTSJJCVGFXDAZ-JTQLQIEISA-N -1 3 375.393 -1.488 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1COCCN1c1ncccc1-c1nn[n-]n1 ZINC001579412136 1075603295 /nfs/dbraw/zinc/60/32/95/1075603295.db2.gz XTTSJJCVGFXDAZ-SNVBAGLBSA-N -1 3 375.393 -1.488 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1COCCN1c1ncccc1-c1nnn[n-]1 ZINC001579412136 1075603291 /nfs/dbraw/zinc/60/32/91/1075603291.db2.gz XTTSJJCVGFXDAZ-SNVBAGLBSA-N -1 3 375.393 -1.488 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)CCO1 ZINC001579412146 1075603240 /nfs/dbraw/zinc/60/32/40/1075603240.db2.gz YLAZPFFLNVPEBT-LLVKDONJSA-N -1 3 375.393 -1.488 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)CCO1 ZINC001579412146 1075603238 /nfs/dbraw/zinc/60/32/38/1075603238.db2.gz YLAZPFFLNVPEBT-LLVKDONJSA-N -1 3 375.393 -1.488 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(c2ccc(-c3nn[n-]n3)nc2)CCO1 ZINC001579412147 1075603276 /nfs/dbraw/zinc/60/32/76/1075603276.db2.gz YLAZPFFLNVPEBT-NSHDSACASA-N -1 3 375.393 -1.488 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(c2ccc(-c3nnn[n-]3)nc2)CCO1 ZINC001579412147 1075603273 /nfs/dbraw/zinc/60/32/73/1075603273.db2.gz YLAZPFFLNVPEBT-NSHDSACASA-N -1 3 375.393 -1.488 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@]1(O)CCN(c2nc(C)ccc2-c2nn[n-]n2)C1 ZINC001579412148 1075603367 /nfs/dbraw/zinc/60/33/67/1075603367.db2.gz YQWUNBXYYIVMGP-INIZCTEOSA-N -1 3 389.420 -1.443 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@]1(O)CCN(c2nc(C)ccc2-c2nnn[n-]2)C1 ZINC001579412148 1075603365 /nfs/dbraw/zinc/60/33/65/1075603365.db2.gz YQWUNBXYYIVMGP-INIZCTEOSA-N -1 3 389.420 -1.443 20 0 GAADHM CNC(=O)NCC(=O)NC[C@]1(O)CCN(c2nc(C)ccc2-c2nn[n-]n2)C1 ZINC001579412149 1075603265 /nfs/dbraw/zinc/60/32/65/1075603265.db2.gz YQWUNBXYYIVMGP-MRXNPFEDSA-N -1 3 389.420 -1.443 20 0 GAADHM CNC(=O)NCC(=O)NC[C@]1(O)CCN(c2nc(C)ccc2-c2nnn[n-]2)C1 ZINC001579412149 1075603261 /nfs/dbraw/zinc/60/32/61/1075603261.db2.gz YQWUNBXYYIVMGP-MRXNPFEDSA-N -1 3 389.420 -1.443 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(c2ccc(-c3nn[n-]n3)c(C)n2)CCO1 ZINC001579412168 1075603802 /nfs/dbraw/zinc/60/38/02/1075603802.db2.gz ZGPBURCLNRWJLR-LLVKDONJSA-N -1 3 389.420 -1.179 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1CN(c2ccc(-c3nnn[n-]3)c(C)n2)CCO1 ZINC001579412168 1075603799 /nfs/dbraw/zinc/60/37/99/1075603799.db2.gz ZGPBURCLNRWJLR-LLVKDONJSA-N -1 3 389.420 -1.179 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(c2ccc(-c3nn[n-]n3)c(C)n2)CCO1 ZINC001579412169 1075603704 /nfs/dbraw/zinc/60/37/04/1075603704.db2.gz ZGPBURCLNRWJLR-NSHDSACASA-N -1 3 389.420 -1.179 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1CN(c2ccc(-c3nnn[n-]3)c(C)n2)CCO1 ZINC001579412169 1075603702 /nfs/dbraw/zinc/60/37/02/1075603702.db2.gz ZGPBURCLNRWJLR-NSHDSACASA-N -1 3 389.420 -1.179 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H](O)CNc1ncc(-c2nn[n-]n2)cc1Cl ZINC001579412175 1075603712 /nfs/dbraw/zinc/60/37/12/1075603712.db2.gz ZIGDISLPECCZJY-MRVPVSSYSA-N -1 3 383.800 -1.267 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H](O)CNc1ncc(-c2nnn[n-]2)cc1Cl ZINC001579412175 1075603711 /nfs/dbraw/zinc/60/37/11/1075603711.db2.gz ZIGDISLPECCZJY-MRVPVSSYSA-N -1 3 383.800 -1.267 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H](O)CNc1ncc(-c2nn[n-]n2)cc1Cl ZINC001579412176 1075603717 /nfs/dbraw/zinc/60/37/17/1075603717.db2.gz ZIGDISLPECCZJY-QMMMGPOBSA-N -1 3 383.800 -1.267 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H](O)CNc1ncc(-c2nnn[n-]2)cc1Cl ZINC001579412176 1075603715 /nfs/dbraw/zinc/60/37/15/1075603715.db2.gz ZIGDISLPECCZJY-QMMMGPOBSA-N -1 3 383.800 -1.267 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1COCCN1c1ccc(-c2nn[n-]n2)c(C)n1 ZINC001579412191 1075603744 /nfs/dbraw/zinc/60/37/44/1075603744.db2.gz ZSBQNOSWHVLMDI-LLVKDONJSA-N -1 3 389.420 -1.179 20 0 GAADHM CNC(=O)NCC(=O)NC[C@@H]1COCCN1c1ccc(-c2nnn[n-]2)c(C)n1 ZINC001579412191 1075603743 /nfs/dbraw/zinc/60/37/43/1075603743.db2.gz ZSBQNOSWHVLMDI-LLVKDONJSA-N -1 3 389.420 -1.179 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1COCCN1c1ccc(-c2nn[n-]n2)c(C)n1 ZINC001579412192 1075603723 /nfs/dbraw/zinc/60/37/23/1075603723.db2.gz ZSBQNOSWHVLMDI-NSHDSACASA-N -1 3 389.420 -1.179 20 0 GAADHM CNC(=O)NCC(=O)NC[C@H]1COCCN1c1ccc(-c2nnn[n-]2)c(C)n1 ZINC001579412192 1075603721 /nfs/dbraw/zinc/60/37/21/1075603721.db2.gz ZSBQNOSWHVLMDI-NSHDSACASA-N -1 3 389.420 -1.179 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@@H](O)CNc1ncccc1-c1nn[n-]n1 ZINC001579412259 1075603774 /nfs/dbraw/zinc/60/37/74/1075603774.db2.gz BPOPCKSSWQTFIV-JTQLQIEISA-N -1 3 377.409 -1.188 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@@H](O)CNc1ncccc1-c1nnn[n-]1 ZINC001579412259 1075603771 /nfs/dbraw/zinc/60/37/71/1075603771.db2.gz BPOPCKSSWQTFIV-JTQLQIEISA-N -1 3 377.409 -1.188 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@H](O)CNc1ncccc1-c1nn[n-]n1 ZINC001579412260 1075603809 /nfs/dbraw/zinc/60/38/09/1075603809.db2.gz BPOPCKSSWQTFIV-SNVBAGLBSA-N -1 3 377.409 -1.188 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@H](O)CNc1ncccc1-c1nnn[n-]1 ZINC001579412260 1075603806 /nfs/dbraw/zinc/60/38/06/1075603806.db2.gz BPOPCKSSWQTFIV-SNVBAGLBSA-N -1 3 377.409 -1.188 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@@H](O)CN(C)c1ncccc1-c1nn[n-]n1 ZINC001579412277 1075603762 /nfs/dbraw/zinc/60/37/62/1075603762.db2.gz CICRYYSGESEGQD-LLVKDONJSA-N -1 3 391.436 -1.164 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@@H](O)CN(C)c1ncccc1-c1nnn[n-]1 ZINC001579412277 1075603760 /nfs/dbraw/zinc/60/37/60/1075603760.db2.gz CICRYYSGESEGQD-LLVKDONJSA-N -1 3 391.436 -1.164 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@H](O)CN(C)c1ncccc1-c1nn[n-]n1 ZINC001579412278 1075603693 /nfs/dbraw/zinc/60/36/93/1075603693.db2.gz CICRYYSGESEGQD-NSHDSACASA-N -1 3 391.436 -1.164 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@H](O)CN(C)c1ncccc1-c1nnn[n-]1 ZINC001579412278 1075603692 /nfs/dbraw/zinc/60/36/92/1075603692.db2.gz CICRYYSGESEGQD-NSHDSACASA-N -1 3 391.436 -1.164 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H]1[C@H]2CN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]21 ZINC001579412295 1075603825 /nfs/dbraw/zinc/60/38/25/1075603825.db2.gz CUVMNUFSBWLHEP-GDGBQDQQSA-N -1 3 375.368 -1.119 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H]1[C@H]2CN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]21 ZINC001579412295 1075603821 /nfs/dbraw/zinc/60/38/21/1075603821.db2.gz CUVMNUFSBWLHEP-GDGBQDQQSA-N -1 3 375.368 -1.119 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@H](O)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001579412305 1075603700 /nfs/dbraw/zinc/60/37/00/1075603700.db2.gz CZMJCFTVQBTSDH-LLVKDONJSA-N -1 3 377.409 -1.188 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@H](O)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001579412305 1075603699 /nfs/dbraw/zinc/60/36/99/1075603699.db2.gz CZMJCFTVQBTSDH-LLVKDONJSA-N -1 3 377.409 -1.188 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@@H](O)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001579412306 1075603738 /nfs/dbraw/zinc/60/37/38/1075603738.db2.gz CZMJCFTVQBTSDH-NSHDSACASA-N -1 3 377.409 -1.188 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@@H](O)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001579412306 1075603737 /nfs/dbraw/zinc/60/37/37/1075603737.db2.gz CZMJCFTVQBTSDH-NSHDSACASA-N -1 3 377.409 -1.188 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1C[C@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579412361 1075604151 /nfs/dbraw/zinc/60/41/51/1075604151.db2.gz FPQPPIGSOUJWKL-CZMCAQCFSA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1C[C@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579412361 1075604149 /nfs/dbraw/zinc/60/41/49/1075604149.db2.gz FPQPPIGSOUJWKL-CZMCAQCFSA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1C[C@@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579412362 1075604203 /nfs/dbraw/zinc/60/42/03/1075604203.db2.gz FPQPPIGSOUJWKL-WAAGHKOSSA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1C[C@@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579412362 1075604201 /nfs/dbraw/zinc/60/42/01/1075604201.db2.gz FPQPPIGSOUJWKL-WAAGHKOSSA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H]1C ZINC001579412365 1075604161 /nfs/dbraw/zinc/60/41/61/1075604161.db2.gz FTNBBOVGPIQFKY-SCZZXKLOSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H]1C ZINC001579412365 1075604160 /nfs/dbraw/zinc/60/41/60/1075604160.db2.gz FTNBBOVGPIQFKY-SCZZXKLOSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H]1C ZINC001579412375 1075604178 /nfs/dbraw/zinc/60/41/78/1075604178.db2.gz FZTCEFIYYFTELV-SCZZXKLOSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H]1C ZINC001579412375 1075604177 /nfs/dbraw/zinc/60/41/77/1075604177.db2.gz FZTCEFIYYFTELV-SCZZXKLOSA-N -1 3 375.393 -1.157 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579412447 1075604185 /nfs/dbraw/zinc/60/41/85/1075604185.db2.gz INIRIECRQCARJO-SCVCMEIPSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579412447 1075604184 /nfs/dbraw/zinc/60/41/84/1075604184.db2.gz INIRIECRQCARJO-SCVCMEIPSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579412453 1075604196 /nfs/dbraw/zinc/60/41/96/1075604196.db2.gz IRHGYIUVFIJPTO-UHFFFAOYSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579412453 1075604195 /nfs/dbraw/zinc/60/41/95/1075604195.db2.gz IRHGYIUVFIJPTO-UHFFFAOYSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@H](O)CN(C)c1ccc(-c2nn[n-]n2)nc1 ZINC001579412460 1075604215 /nfs/dbraw/zinc/60/42/15/1075604215.db2.gz IZKJXUJNPBRAJB-GFCCVEGCSA-N -1 3 391.436 -1.164 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@H](O)CN(C)c1ccc(-c2nnn[n-]2)nc1 ZINC001579412460 1075604213 /nfs/dbraw/zinc/60/42/13/1075604213.db2.gz IZKJXUJNPBRAJB-GFCCVEGCSA-N -1 3 391.436 -1.164 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@@H](O)CN(C)c1ccc(-c2nn[n-]n2)nc1 ZINC001579412461 1075604173 /nfs/dbraw/zinc/60/41/73/1075604173.db2.gz IZKJXUJNPBRAJB-LBPRGKRZSA-N -1 3 391.436 -1.164 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@@H](O)CN(C)c1ccc(-c2nnn[n-]2)nc1 ZINC001579412461 1075604171 /nfs/dbraw/zinc/60/41/71/1075604171.db2.gz IZKJXUJNPBRAJB-LBPRGKRZSA-N -1 3 391.436 -1.164 20 0 GAADHM CNC(=O)NC[C@H]1COCCN1S(=O)(=O)c1cncc(-c2nn[n-]n2)c1 ZINC001579412505 1075604192 /nfs/dbraw/zinc/60/41/92/1075604192.db2.gz KHZKFAWDTPVZHA-JTQLQIEISA-N -1 3 382.406 -1.420 20 0 GAADHM CNC(=O)NC[C@H]1COCCN1S(=O)(=O)c1cncc(-c2nnn[n-]2)c1 ZINC001579412505 1075604191 /nfs/dbraw/zinc/60/41/91/1075604191.db2.gz KHZKFAWDTPVZHA-JTQLQIEISA-N -1 3 382.406 -1.420 20 0 GAADHM CNC(=O)NC[C@@H]1COCCN1S(=O)(=O)c1cncc(-c2nn[n-]n2)c1 ZINC001579412506 1075604210 /nfs/dbraw/zinc/60/42/10/1075604210.db2.gz KHZKFAWDTPVZHA-SNVBAGLBSA-N -1 3 382.406 -1.420 20 0 GAADHM CNC(=O)NC[C@@H]1COCCN1S(=O)(=O)c1cncc(-c2nnn[n-]2)c1 ZINC001579412506 1075604209 /nfs/dbraw/zinc/60/42/09/1075604209.db2.gz KHZKFAWDTPVZHA-SNVBAGLBSA-N -1 3 382.406 -1.420 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579412681 1075604232 /nfs/dbraw/zinc/60/42/32/1075604232.db2.gz RLNGLGPCOCHVMP-ZHAHWJHGSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579412681 1075604230 /nfs/dbraw/zinc/60/42/30/1075604230.db2.gz RLNGLGPCOCHVMP-ZHAHWJHGSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@H](O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001579412727 1075604643 /nfs/dbraw/zinc/60/46/43/1075604643.db2.gz TTZHUCUINUUXTJ-LLVKDONJSA-N -1 3 377.409 -1.188 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@H](O)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001579412727 1075604642 /nfs/dbraw/zinc/60/46/42/1075604642.db2.gz TTZHUCUINUUXTJ-LLVKDONJSA-N -1 3 377.409 -1.188 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@@H](O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001579412728 1075604573 /nfs/dbraw/zinc/60/45/73/1075604573.db2.gz TTZHUCUINUUXTJ-NSHDSACASA-N -1 3 377.409 -1.188 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C[C@@H](O)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001579412728 1075604570 /nfs/dbraw/zinc/60/45/70/1075604570.db2.gz TTZHUCUINUUXTJ-NSHDSACASA-N -1 3 377.409 -1.188 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579412733 1075604584 /nfs/dbraw/zinc/60/45/84/1075604584.db2.gz TXRLYTWANZRMCX-SCVCMEIPSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579412733 1075604580 /nfs/dbraw/zinc/60/45/80/1075604580.db2.gz TXRLYTWANZRMCX-SCVCMEIPSA-N -1 3 387.404 -1.015 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1C[C@@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579412735 1075604563 /nfs/dbraw/zinc/60/45/63/1075604563.db2.gz UBVYUUJXVHAWPB-DTORHVGOSA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1C[C@@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579412735 1075604560 /nfs/dbraw/zinc/60/45/60/1075604560.db2.gz UBVYUUJXVHAWPB-DTORHVGOSA-N -1 3 375.393 -1.252 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579412767 1075604621 /nfs/dbraw/zinc/60/46/21/1075604621.db2.gz VXTMYOQQIOOTIJ-UHFFFAOYSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCCC(=O)N(C)C1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579412767 1075604619 /nfs/dbraw/zinc/60/46/19/1075604619.db2.gz VXTMYOQQIOOTIJ-UHFFFAOYSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NC[C@H]1CN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)CCO1 ZINC001579412777 1075604639 /nfs/dbraw/zinc/60/46/39/1075604639.db2.gz WHNYFEOZGFNQMZ-JTQLQIEISA-N -1 3 382.406 -1.420 20 0 GAADHM CNC(=O)NC[C@H]1CN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)CCO1 ZINC001579412777 1075604638 /nfs/dbraw/zinc/60/46/38/1075604638.db2.gz WHNYFEOZGFNQMZ-JTQLQIEISA-N -1 3 382.406 -1.420 20 0 GAADHM CNC(=O)NC[C@@H]1CN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)CCO1 ZINC001579412778 1075604647 /nfs/dbraw/zinc/60/46/47/1075604647.db2.gz WHNYFEOZGFNQMZ-SNVBAGLBSA-N -1 3 382.406 -1.420 20 0 GAADHM CNC(=O)NC[C@@H]1CN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)CCO1 ZINC001579412778 1075604645 /nfs/dbraw/zinc/60/46/45/1075604645.db2.gz WHNYFEOZGFNQMZ-SNVBAGLBSA-N -1 3 382.406 -1.420 20 0 GAADHM CNC(=O)NCC(=O)N[C@H]1C[C@@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579412822 1075604555 /nfs/dbraw/zinc/60/45/55/1075604555.db2.gz 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ZINC001579415626 1075606484 /nfs/dbraw/zinc/60/64/84/1075606484.db2.gz OCEDKPJFQIFZPH-VIFPVBQESA-N -1 3 377.409 -1.004 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579415645 1075606505 /nfs/dbraw/zinc/60/65/05/1075606505.db2.gz OOIRHIDTCAEBQQ-SECBINFHSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579415645 1075606503 /nfs/dbraw/zinc/60/65/03/1075606503.db2.gz OOIRHIDTCAEBQQ-SECBINFHSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579415646 1075606439 /nfs/dbraw/zinc/60/64/39/1075606439.db2.gz OOIRHIDTCAEBQQ-VIFPVBQESA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579415646 1075606436 /nfs/dbraw/zinc/60/64/36/1075606436.db2.gz OOIRHIDTCAEBQQ-VIFPVBQESA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001579415701 1075606451 /nfs/dbraw/zinc/60/64/51/1075606451.db2.gz PUVDLGYJBZJFPX-NEPJUHHUSA-N -1 3 389.420 -1.363 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001579415701 1075606446 /nfs/dbraw/zinc/60/64/46/1075606446.db2.gz PUVDLGYJBZJFPX-NEPJUHHUSA-N -1 3 389.420 -1.363 20 0 GAADHM CNC(=O)NCCC(=O)N[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C[C@H]1O ZINC001579415702 1075606510 /nfs/dbraw/zinc/60/65/10/1075606510.db2.gz PUVDLGYJBZJFPX-NWDGAFQWSA-N -1 3 389.420 -1.363 20 0 GAADHM CNC(=O)NCCC(=O)N[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C[C@H]1O ZINC001579415702 1075606509 /nfs/dbraw/zinc/60/65/09/1075606509.db2.gz PUVDLGYJBZJFPX-NWDGAFQWSA-N -1 3 389.420 -1.363 20 0 GAADHM CNC(=O)NCCC(=O)N[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001579415703 1075606411 /nfs/dbraw/zinc/60/64/11/1075606411.db2.gz PUVDLGYJBZJFPX-RYUDHWBXSA-N -1 3 389.420 -1.363 20 0 GAADHM CNC(=O)NCCC(=O)N[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001579415703 1075606405 /nfs/dbraw/zinc/60/64/05/1075606405.db2.gz PUVDLGYJBZJFPX-RYUDHWBXSA-N -1 3 389.420 -1.363 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C[C@H]1O ZINC001579415704 1075606541 /nfs/dbraw/zinc/60/65/41/1075606541.db2.gz PUVDLGYJBZJFPX-VXGBXAGGSA-N -1 3 389.420 -1.363 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C[C@H]1O ZINC001579415704 1075606540 /nfs/dbraw/zinc/60/65/40/1075606540.db2.gz PUVDLGYJBZJFPX-VXGBXAGGSA-N -1 3 389.420 -1.363 20 0 GAADHM CNC(=O)NCCC(=O)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579415785 1075606516 /nfs/dbraw/zinc/60/65/16/1075606516.db2.gz RTWFIALGAIHVOO-JTQLQIEISA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579415785 1075606513 /nfs/dbraw/zinc/60/65/13/1075606513.db2.gz RTWFIALGAIHVOO-JTQLQIEISA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579415786 1075606804 /nfs/dbraw/zinc/60/68/04/1075606804.db2.gz RTWFIALGAIHVOO-SNVBAGLBSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579415786 1075606801 /nfs/dbraw/zinc/60/68/01/1075606801.db2.gz RTWFIALGAIHVOO-SNVBAGLBSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N[C@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579415799 1075606779 /nfs/dbraw/zinc/60/67/79/1075606779.db2.gz SCTFLFHVKIZKJU-JTQLQIEISA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N[C@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579415799 1075606775 /nfs/dbraw/zinc/60/67/75/1075606775.db2.gz SCTFLFHVKIZKJU-JTQLQIEISA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579415800 1075606812 /nfs/dbraw/zinc/60/68/12/1075606812.db2.gz SCTFLFHVKIZKJU-SNVBAGLBSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579415800 1075606810 /nfs/dbraw/zinc/60/68/10/1075606810.db2.gz SCTFLFHVKIZKJU-SNVBAGLBSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N1C[C@@H]2C[C@H]1CN2C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579415851 1075606851 /nfs/dbraw/zinc/60/68/51/1075606851.db2.gz UNYSSOODMLQDQG-QWRGUYRKSA-N -1 3 387.404 -1.061 20 0 GAADHM CNC(=O)NCCC(=O)N1C[C@@H]2C[C@H]1CN2C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579415851 1075606849 /nfs/dbraw/zinc/60/68/49/1075606849.db2.gz UNYSSOODMLQDQG-QWRGUYRKSA-N -1 3 387.404 -1.061 20 0 GAADHM CNC(=O)NCCC(=O)NC[C@@H](C)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579415950 1075606822 /nfs/dbraw/zinc/60/68/22/1075606822.db2.gz WTTVAOTUVXZDPE-SECBINFHSA-N -1 3 377.409 -1.004 20 0 GAADHM CNC(=O)NCCC(=O)NC[C@@H](C)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579415950 1075606820 /nfs/dbraw/zinc/60/68/20/1075606820.db2.gz WTTVAOTUVXZDPE-SECBINFHSA-N -1 3 377.409 -1.004 20 0 GAADHM CNC(=O)NCCC(=O)NC[C@H](C)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579415951 1075606882 /nfs/dbraw/zinc/60/68/82/1075606882.db2.gz WTTVAOTUVXZDPE-VIFPVBQESA-N -1 3 377.409 -1.004 20 0 GAADHM CNC(=O)NCCC(=O)NC[C@H](C)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579415951 1075606878 /nfs/dbraw/zinc/60/68/78/1075606878.db2.gz WTTVAOTUVXZDPE-VIFPVBQESA-N -1 3 377.409 -1.004 20 0 GAADHM CNC(=O)NCCC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579415980 1075606743 /nfs/dbraw/zinc/60/67/43/1075606743.db2.gz XEMQCOUFJQNUQF-WOFXILAISA-N -1 3 387.404 -1.300 20 0 GAADHM CNC(=O)NCCC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579415980 1075606737 /nfs/dbraw/zinc/60/67/37/1075606737.db2.gz XEMQCOUFJQNUQF-WOFXILAISA-N -1 3 387.404 -1.300 20 0 GAADHM CNC(=O)NCCC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001579416027 1075606890 /nfs/dbraw/zinc/60/68/90/1075606890.db2.gz YWPRCVMVNHVGGO-AAEUAGOBSA-N -1 3 389.420 -1.363 20 0 GAADHM CNC(=O)NCCC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001579416027 1075606886 /nfs/dbraw/zinc/60/68/86/1075606886.db2.gz YWPRCVMVNHVGGO-AAEUAGOBSA-N -1 3 389.420 -1.363 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O ZINC001579416028 1075606842 /nfs/dbraw/zinc/60/68/42/1075606842.db2.gz YWPRCVMVNHVGGO-DGCLKSJQSA-N -1 3 389.420 -1.363 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O ZINC001579416028 1075606839 /nfs/dbraw/zinc/60/68/39/1075606839.db2.gz YWPRCVMVNHVGGO-DGCLKSJQSA-N -1 3 389.420 -1.363 20 0 GAADHM CNC(=O)NCCC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O ZINC001579416029 1075606794 /nfs/dbraw/zinc/60/67/94/1075606794.db2.gz YWPRCVMVNHVGGO-WCQYABFASA-N -1 3 389.420 -1.363 20 0 GAADHM CNC(=O)NCCC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O ZINC001579416029 1075606792 /nfs/dbraw/zinc/60/67/92/1075606792.db2.gz YWPRCVMVNHVGGO-WCQYABFASA-N -1 3 389.420 -1.363 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001579416030 1075606832 /nfs/dbraw/zinc/60/68/32/1075606832.db2.gz YWPRCVMVNHVGGO-YPMHNXCESA-N -1 3 389.420 -1.363 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001579416030 1075606830 /nfs/dbraw/zinc/60/68/30/1075606830.db2.gz YWPRCVMVNHVGGO-YPMHNXCESA-N -1 3 389.420 -1.363 20 0 GAADHM CNC(=O)NCCC(=O)N(CCO)CCNc1ccc(-c2nn[n-]n2)nc1 ZINC001579416127 1075606762 /nfs/dbraw/zinc/60/67/62/1075606762.db2.gz BRWAPNXJCAURJK-UHFFFAOYSA-N -1 3 377.409 -1.186 20 0 GAADHM CNC(=O)NCCC(=O)N(CCO)CCNc1ccc(-c2nnn[n-]2)nc1 ZINC001579416127 1075606756 /nfs/dbraw/zinc/60/67/56/1075606756.db2.gz BRWAPNXJCAURJK-UHFFFAOYSA-N -1 3 377.409 -1.186 20 0 GAADHM CNC(=O)NCCC(=O)N1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001579416151 1075607071 /nfs/dbraw/zinc/60/70/71/1075607071.db2.gz CNJDDGAGNNARGN-UHFFFAOYSA-N -1 3 375.393 -1.202 20 0 GAADHM CNC(=O)NCCC(=O)N1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001579416151 1075607067 /nfs/dbraw/zinc/60/70/67/1075607067.db2.gz CNJDDGAGNNARGN-UHFFFAOYSA-N -1 3 375.393 -1.202 20 0 GAADHM CNC(=O)NCCC(=O)N1CC(N(C)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579416192 1075607046 /nfs/dbraw/zinc/60/70/46/1075607046.db2.gz DOPPVNGAQLOSCT-UHFFFAOYSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCCC(=O)N1CC(N(C)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579416192 1075607044 /nfs/dbraw/zinc/60/70/44/1075607044.db2.gz DOPPVNGAQLOSCT-UHFFFAOYSA-N -1 3 375.393 -1.203 20 0 GAADHM CNC(=O)NCCC(=O)N1CC(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579416208 1075607180 /nfs/dbraw/zinc/60/71/80/1075607180.db2.gz FMWBWBWHNNLMIL-UHFFFAOYSA-N -1 3 375.393 -1.298 20 0 GAADHM CNC(=O)NCCC(=O)N1CC(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579416208 1075607177 /nfs/dbraw/zinc/60/71/77/1075607177.db2.gz FMWBWBWHNNLMIL-UHFFFAOYSA-N -1 3 375.393 -1.298 20 0 GAADHM CNC(=O)NCCC(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579416250 1075607156 /nfs/dbraw/zinc/60/71/56/1075607156.db2.gz GJLWCDKQFTUARU-SECBINFHSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579416250 1075607150 /nfs/dbraw/zinc/60/71/50/1075607150.db2.gz GJLWCDKQFTUARU-SECBINFHSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579416251 1075607086 /nfs/dbraw/zinc/60/70/86/1075607086.db2.gz GJLWCDKQFTUARU-VIFPVBQESA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579416251 1075607084 /nfs/dbraw/zinc/60/70/84/1075607084.db2.gz GJLWCDKQFTUARU-VIFPVBQESA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N1CC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579416407 1075607249 /nfs/dbraw/zinc/60/72/49/1075607249.db2.gz HVAHDTUZKGIAEI-SECBINFHSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N1CC[C@@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579416407 1075607245 /nfs/dbraw/zinc/60/72/45/1075607245.db2.gz HVAHDTUZKGIAEI-SECBINFHSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N1CC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579416408 1075607192 /nfs/dbraw/zinc/60/71/92/1075607192.db2.gz HVAHDTUZKGIAEI-VIFPVBQESA-N -1 3 375.393 -1.155 20 0 GAADHM 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CNC(=O)NCCC(=O)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579417233 1075607168 /nfs/dbraw/zinc/60/71/68/1075607168.db2.gz QUSQBBNBCVIVMA-JTQLQIEISA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579417233 1075607166 /nfs/dbraw/zinc/60/71/66/1075607166.db2.gz QUSQBBNBCVIVMA-JTQLQIEISA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579417234 1075607214 /nfs/dbraw/zinc/60/72/14/1075607214.db2.gz QUSQBBNBCVIVMA-SNVBAGLBSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579417234 1075607210 /nfs/dbraw/zinc/60/72/10/1075607210.db2.gz QUSQBBNBCVIVMA-SNVBAGLBSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N1CC[C@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579417513 1075607240 /nfs/dbraw/zinc/60/72/40/1075607240.db2.gz TVBBAWVUWIQBSH-JTQLQIEISA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)N1CC[C@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 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1075608653 /nfs/dbraw/zinc/60/86/53/1075608653.db2.gz SSUNNIIGUQFVSI-NSHDSACASA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCCC(=O)NC[C@H]1COCCN1c1ncccc1-c1nnn[n-]1 ZINC001579418371 1075608650 /nfs/dbraw/zinc/60/86/50/1075608650.db2.gz SSUNNIIGUQFVSI-NSHDSACASA-N -1 3 389.420 -1.098 20 0 GAADHM CNC(=O)NCCC(=O)NC[C@@H]1CCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579418375 1075608725 /nfs/dbraw/zinc/60/87/25/1075608725.db2.gz TUZJPNRDWDFLOB-JTQLQIEISA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)NC[C@@H]1CCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579418375 1075608722 /nfs/dbraw/zinc/60/87/22/1075608722.db2.gz TUZJPNRDWDFLOB-JTQLQIEISA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)NC[C@H]1CCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579418376 1075608635 /nfs/dbraw/zinc/60/86/35/1075608635.db2.gz TUZJPNRDWDFLOB-SNVBAGLBSA-N -1 3 375.393 -1.155 20 0 GAADHM CNC(=O)NCCC(=O)NC[C@H]1CCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579418376 1075608631 /nfs/dbraw/zinc/60/86/31/1075608631.db2.gz 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ZINC001579419540 1075609831 /nfs/dbraw/zinc/60/98/31/1075609831.db2.gz KSPJHMNPAUJMGE-MNOVXSKESA-N -1 3 375.393 -1.754 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001579419540 1075609827 /nfs/dbraw/zinc/60/98/27/1075609827.db2.gz KSPJHMNPAUJMGE-MNOVXSKESA-N -1 3 375.393 -1.754 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001579419554 1075609814 /nfs/dbraw/zinc/60/98/14/1075609814.db2.gz LVWIGCZTQOUSRY-MNOVXSKESA-N -1 3 375.393 -1.754 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001579419554 1075609813 /nfs/dbraw/zinc/60/98/13/1075609813.db2.gz LVWIGCZTQOUSRY-MNOVXSKESA-N -1 3 375.393 -1.754 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1[C@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]21 ZINC001579419679 1075609743 /nfs/dbraw/zinc/60/97/43/1075609743.db2.gz NFSZONLMUBFIHJ-WOFXILAISA-N -1 3 387.404 -1.300 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1[C@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]21 ZINC001579419679 1075609741 /nfs/dbraw/zinc/60/97/41/1075609741.db2.gz NFSZONLMUBFIHJ-WOFXILAISA-N -1 3 387.404 -1.300 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1[C@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]21 ZINC001579419723 1075609762 /nfs/dbraw/zinc/60/97/62/1075609762.db2.gz PBHHXMVFOIJGNS-IWIIMEHWSA-N -1 3 387.404 -1.300 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1[C@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]21 ZINC001579419723 1075609760 /nfs/dbraw/zinc/60/97/60/1075609760.db2.gz PBHHXMVFOIJGNS-IWIIMEHWSA-N -1 3 387.404 -1.300 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)c(C)n2)C[C@@H]1O ZINC001579419763 1075609854 /nfs/dbraw/zinc/60/98/54/1075609854.db2.gz RDIFMHAOTRCDDL-NEPJUHHUSA-N -1 3 389.420 -1.445 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)c(C)n2)C[C@@H]1O ZINC001579419763 1075609851 /nfs/dbraw/zinc/60/98/51/1075609851.db2.gz RDIFMHAOTRCDDL-NEPJUHHUSA-N -1 3 389.420 -1.445 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)c(C)n2)C[C@H]1O ZINC001579419764 1075609748 /nfs/dbraw/zinc/60/97/48/1075609748.db2.gz RDIFMHAOTRCDDL-VXGBXAGGSA-N -1 3 389.420 -1.445 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)c(C)n2)C[C@H]1O ZINC001579419764 1075609746 /nfs/dbraw/zinc/60/97/46/1075609746.db2.gz RDIFMHAOTRCDDL-VXGBXAGGSA-N -1 3 389.420 -1.445 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001579419771 1075609770 /nfs/dbraw/zinc/60/97/70/1075609770.db2.gz RHSSBXUCSWDZES-NEPJUHHUSA-N -1 3 375.393 -1.754 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001579419771 1075609767 /nfs/dbraw/zinc/60/97/67/1075609767.db2.gz RHSSBXUCSWDZES-NEPJUHHUSA-N -1 3 375.393 -1.754 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O ZINC001579419773 1075609841 /nfs/dbraw/zinc/60/98/41/1075609841.db2.gz RHSSBXUCSWDZES-VXGBXAGGSA-N -1 3 375.393 -1.754 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O ZINC001579419773 1075609838 /nfs/dbraw/zinc/60/98/38/1075609838.db2.gz RHSSBXUCSWDZES-VXGBXAGGSA-N -1 3 375.393 -1.754 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@H]1OC ZINC001579419778 1075609878 /nfs/dbraw/zinc/60/98/78/1075609878.db2.gz ROMOVENKJIHXIS-VXGBXAGGSA-N -1 3 389.420 -1.099 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@H]1OC ZINC001579419778 1075609875 /nfs/dbraw/zinc/60/98/75/1075609875.db2.gz ROMOVENKJIHXIS-VXGBXAGGSA-N -1 3 389.420 -1.099 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CN(c2nc(C)ccc2-c2nn[n-]n2)C[C@@H]1O ZINC001579419974 1075609785 /nfs/dbraw/zinc/60/97/85/1075609785.db2.gz UPFBSJJPZBXLTI-NEPJUHHUSA-N -1 3 389.420 -1.445 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CN(c2nc(C)ccc2-c2nnn[n-]2)C[C@@H]1O ZINC001579419974 1075609783 /nfs/dbraw/zinc/60/97/83/1075609783.db2.gz UPFBSJJPZBXLTI-NEPJUHHUSA-N -1 3 389.420 -1.445 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CN(c2nc(C)ccc2-c2nn[n-]n2)C[C@H]1O ZINC001579419976 1075609883 /nfs/dbraw/zinc/60/98/83/1075609883.db2.gz UPFBSJJPZBXLTI-VXGBXAGGSA-N -1 3 389.420 -1.445 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CN(c2nc(C)ccc2-c2nnn[n-]2)C[C@H]1O ZINC001579419976 1075609880 /nfs/dbraw/zinc/60/98/80/1075609880.db2.gz UPFBSJJPZBXLTI-VXGBXAGGSA-N -1 3 389.420 -1.445 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]21 ZINC001579419993 1075610206 /nfs/dbraw/zinc/61/02/06/1075610206.db2.gz UWQDIGVZGGEIRB-IWIIMEHWSA-N -1 3 387.404 -1.300 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]21 ZINC001579419993 1075610203 /nfs/dbraw/zinc/61/02/03/1075610203.db2.gz UWQDIGVZGGEIRB-IWIIMEHWSA-N -1 3 387.404 -1.300 20 0 GAADHM CNC(=O)NCCC(=O)N[C@H]1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579420032 1075610183 /nfs/dbraw/zinc/61/01/83/1075610183.db2.gz XFTOWKZFJPYIKW-AOOOYVTPSA-N -1 3 375.393 -1.109 20 0 GAADHM CNC(=O)NCCC(=O)N[C@H]1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579420032 1075610178 /nfs/dbraw/zinc/61/01/78/1075610178.db2.gz XFTOWKZFJPYIKW-AOOOYVTPSA-N -1 3 375.393 -1.109 20 0 GAADHM 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ZINC001579424360 1075610254 /nfs/dbraw/zinc/61/02/54/1075610254.db2.gz AHNUSNPCGUSNEK-PHIMTYICSA-N -1 3 392.445 -1.010 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@H](C)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579424368 1075610196 /nfs/dbraw/zinc/61/01/96/1075610196.db2.gz ASEKMVWYZYDLFA-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@H](C)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579424368 1075610191 /nfs/dbraw/zinc/61/01/91/1075610191.db2.gz ASEKMVWYZYDLFA-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@@H](C)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579424369 1075610146 /nfs/dbraw/zinc/61/01/46/1075610146.db2.gz ASEKMVWYZYDLFA-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@@H](C)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579424369 1075610144 /nfs/dbraw/zinc/61/01/44/1075610144.db2.gz ASEKMVWYZYDLFA-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N(CCO)CCNc1ncccc1-c1nn[n-]n1 ZINC001579424408 1075610530 /nfs/dbraw/zinc/61/05/30/1075610530.db2.gz CELFLOSLDYKEQG-UHFFFAOYSA-N -1 3 384.422 -1.956 20 0 GAADHM CNS(=O)(=O)CC(=O)N(CCO)CCNc1ncccc1-c1nnn[n-]1 ZINC001579424408 1075610529 /nfs/dbraw/zinc/61/05/29/1075610529.db2.gz CELFLOSLDYKEQG-UHFFFAOYSA-N -1 3 384.422 -1.956 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@H]2CC[C@@H](C1)N2c1ccc(-c2nn[n-]n2)cn1 ZINC001579424428 1075610600 /nfs/dbraw/zinc/61/06/00/1075610600.db2.gz DCQFQLWXXDSCKK-TXEJJXNPSA-N -1 3 392.445 -1.010 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@H]2CC[C@@H](C1)N2c1ccc(-c2nnn[n-]2)cn1 ZINC001579424428 1075610598 /nfs/dbraw/zinc/61/05/98/1075610598.db2.gz DCQFQLWXXDSCKK-TXEJJXNPSA-N -1 3 392.445 -1.010 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579424457 1075610623 /nfs/dbraw/zinc/61/06/23/1075610623.db2.gz DTKTXPNDBWPBNN-SECBINFHSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579424457 1075610621 /nfs/dbraw/zinc/61/06/21/1075610621.db2.gz DTKTXPNDBWPBNN-SECBINFHSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579424458 1075610540 /nfs/dbraw/zinc/61/05/40/1075610540.db2.gz DTKTXPNDBWPBNN-VIFPVBQESA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579424458 1075610538 /nfs/dbraw/zinc/61/05/38/1075610538.db2.gz DTKTXPNDBWPBNN-VIFPVBQESA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CCCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001579424471 1075610509 /nfs/dbraw/zinc/61/05/09/1075610509.db2.gz FIQWUMUYNVQNCD-UHFFFAOYSA-N -1 3 380.434 -1.150 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CCCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001579424471 1075610506 /nfs/dbraw/zinc/61/05/06/1075610506.db2.gz FIQWUMUYNVQNCD-UHFFFAOYSA-N -1 3 380.434 -1.150 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@@H](O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001579424480 1075610491 /nfs/dbraw/zinc/61/04/91/1075610491.db2.gz FURDLGLQERCRCH-JTQLQIEISA-N -1 3 384.422 -1.958 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@@H](O)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001579424480 1075610486 /nfs/dbraw/zinc/61/04/86/1075610486.db2.gz FURDLGLQERCRCH-JTQLQIEISA-N -1 3 384.422 -1.958 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@H](O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001579424481 1075610550 /nfs/dbraw/zinc/61/05/50/1075610550.db2.gz FURDLGLQERCRCH-SNVBAGLBSA-N -1 3 384.422 -1.958 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@H](O)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001579424481 1075610548 /nfs/dbraw/zinc/61/05/48/1075610548.db2.gz FURDLGLQERCRCH-SNVBAGLBSA-N -1 3 384.422 -1.958 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@@H](N(C)c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579424501 1075610981 /nfs/dbraw/zinc/61/09/81/1075610981.db2.gz GMHYQRRLLZFCOZ-LLVKDONJSA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@@H](N(C)c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579424501 1075610979 /nfs/dbraw/zinc/61/09/79/1075610979.db2.gz GMHYQRRLLZFCOZ-LLVKDONJSA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H](N(C)c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579424502 1075610949 /nfs/dbraw/zinc/61/09/49/1075610949.db2.gz GMHYQRRLLZFCOZ-NSHDSACASA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H](N(C)c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579424502 1075610947 /nfs/dbraw/zinc/61/09/47/1075610947.db2.gz GMHYQRRLLZFCOZ-NSHDSACASA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)CCN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579424535 1075611327 /nfs/dbraw/zinc/61/13/27/1075611327.db2.gz HYPAGFMWSALXAG-UHFFFAOYSA-N -1 3 384.422 -1.726 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)CCN(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579424535 1075611326 /nfs/dbraw/zinc/61/13/26/1075611326.db2.gz HYPAGFMWSALXAG-UHFFFAOYSA-N -1 3 384.422 -1.726 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CCN(c2ccc(-c3nn[n-]n3)c(C)n2)CC1 ZINC001579424536 1075611266 /nfs/dbraw/zinc/61/12/66/1075611266.db2.gz IBZDFGQSNWYQCP-UHFFFAOYSA-N -1 3 380.434 -1.232 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CCN(c2ccc(-c3nnn[n-]3)c(C)n2)CC1 ZINC001579424536 1075611264 /nfs/dbraw/zinc/61/12/64/1075611264.db2.gz IBZDFGQSNWYQCP-UHFFFAOYSA-N -1 3 380.434 -1.232 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001579424543 1075611354 /nfs/dbraw/zinc/61/13/54/1075611354.db2.gz IERZDWQYUHXGIV-UHFFFAOYSA-N -1 3 382.406 -1.972 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001579424543 1075611350 /nfs/dbraw/zinc/61/13/50/1075611350.db2.gz IERZDWQYUHXGIV-UHFFFAOYSA-N -1 3 382.406 -1.972 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@H](O)CNc1ncccc1-c1nn[n-]n1 ZINC001579424572 1075611337 /nfs/dbraw/zinc/61/13/37/1075611337.db2.gz JAYDGHHWRHONPL-SECBINFHSA-N -1 3 384.422 -1.958 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@H](O)CNc1ncccc1-c1nnn[n-]1 ZINC001579424572 1075611336 /nfs/dbraw/zinc/61/13/36/1075611336.db2.gz JAYDGHHWRHONPL-SECBINFHSA-N -1 3 384.422 -1.958 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@@H](O)CNc1ncccc1-c1nn[n-]n1 ZINC001579424573 1075611311 /nfs/dbraw/zinc/61/13/11/1075611311.db2.gz JAYDGHHWRHONPL-VIFPVBQESA-N -1 3 384.422 -1.958 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@@H](O)CNc1ncccc1-c1nnn[n-]1 ZINC001579424573 1075611309 /nfs/dbraw/zinc/61/13/09/1075611309.db2.gz JAYDGHHWRHONPL-VIFPVBQESA-N -1 3 384.422 -1.958 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@@H](C)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579424575 1075611702 /nfs/dbraw/zinc/61/17/02/1075611702.db2.gz JESADCCXNYFMMG-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@@H](C)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579424575 1075611699 /nfs/dbraw/zinc/61/16/99/1075611699.db2.gz JESADCCXNYFMMG-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@H](C)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579424576 1075611606 /nfs/dbraw/zinc/61/16/06/1075611606.db2.gz JESADCCXNYFMMG-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@H](C)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579424576 1075611604 /nfs/dbraw/zinc/61/16/04/1075611604.db2.gz JESADCCXNYFMMG-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579424581 1075611678 /nfs/dbraw/zinc/61/16/78/1075611678.db2.gz JJNBAXYVCIHDEE-JTQLQIEISA-N -1 3 387.447 -1.036 20 0 GAADHM CNS(=O)(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579424581 1075611676 /nfs/dbraw/zinc/61/16/76/1075611676.db2.gz JJNBAXYVCIHDEE-JTQLQIEISA-N -1 3 387.447 -1.036 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579424582 1075611716 /nfs/dbraw/zinc/61/17/16/1075611716.db2.gz JJNBAXYVCIHDEE-SNVBAGLBSA-N -1 3 387.447 -1.036 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579424582 1075611712 /nfs/dbraw/zinc/61/17/12/1075611712.db2.gz JJNBAXYVCIHDEE-SNVBAGLBSA-N -1 3 387.447 -1.036 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)CCCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579424589 1075611581 /nfs/dbraw/zinc/61/15/81/1075611581.db2.gz JMAZZGLXTBLEDX-UHFFFAOYSA-N -1 3 384.422 -1.678 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)CCCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579424589 1075611578 /nfs/dbraw/zinc/61/15/78/1075611578.db2.gz JMAZZGLXTBLEDX-UHFFFAOYSA-N -1 3 384.422 -1.678 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579424594 1075611616 /nfs/dbraw/zinc/61/16/16/1075611616.db2.gz JSCPDCHONSNSBK-UHFFFAOYSA-N -1 3 382.406 -2.068 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579424594 1075611613 /nfs/dbraw/zinc/61/16/13/1075611613.db2.gz JSCPDCHONSNSBK-UHFFFAOYSA-N -1 3 382.406 -2.068 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@@H](Nc2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001579424610 1075611597 /nfs/dbraw/zinc/61/15/97/1075611597.db2.gz KGLGTKYIISMRRR-SECBINFHSA-N -1 3 384.397 -1.037 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@@H](Nc2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001579424610 1075611595 /nfs/dbraw/zinc/61/15/95/1075611595.db2.gz KGLGTKYIISMRRR-SECBINFHSA-N -1 3 384.397 -1.037 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579424611 1075611632 /nfs/dbraw/zinc/61/16/32/1075611632.db2.gz KHIZOZUNQLAQNY-UHFFFAOYSA-N -1 3 382.406 -1.973 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579424611 1075611629 /nfs/dbraw/zinc/61/16/29/1075611629.db2.gz KHIZOZUNQLAQNY-UHFFFAOYSA-N -1 3 382.406 -1.973 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579424613 1075611573 /nfs/dbraw/zinc/61/15/73/1075611573.db2.gz KMORUZPYFUTDKF-LLVKDONJSA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579424613 1075611572 /nfs/dbraw/zinc/61/15/72/1075611572.db2.gz KMORUZPYFUTDKF-LLVKDONJSA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579424614 1075611656 /nfs/dbraw/zinc/61/16/56/1075611656.db2.gz KMORUZPYFUTDKF-NSHDSACASA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579424614 1075611655 /nfs/dbraw/zinc/61/16/55/1075611655.db2.gz KMORUZPYFUTDKF-NSHDSACASA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N(CCO)CCNc1ccc(-c2nn[n-]n2)nc1 ZINC001579424619 1075612035 /nfs/dbraw/zinc/61/20/35/1075612035.db2.gz KUMWIWWTQVSZEU-UHFFFAOYSA-N -1 3 384.422 -1.956 20 0 GAADHM CNS(=O)(=O)CC(=O)N(CCO)CCNc1ccc(-c2nnn[n-]2)nc1 ZINC001579424619 1075612034 /nfs/dbraw/zinc/61/20/34/1075612034.db2.gz KUMWIWWTQVSZEU-UHFFFAOYSA-N -1 3 384.422 -1.956 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001579424648 1075612030 /nfs/dbraw/zinc/61/20/30/1075612030.db2.gz MBNWQYRECUQQCA-JTQLQIEISA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001579424648 1075612029 /nfs/dbraw/zinc/61/20/29/1075612029.db2.gz MBNWQYRECUQQCA-JTQLQIEISA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001579424649 1075612007 /nfs/dbraw/zinc/61/20/07/1075612007.db2.gz MBNWQYRECUQQCA-SNVBAGLBSA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001579424649 1075612005 /nfs/dbraw/zinc/61/20/05/1075612005.db2.gz MBNWQYRECUQQCA-SNVBAGLBSA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N(CCO)CCNc1ccc(-c2nn[n-]n2)cn1 ZINC001579424650 1075611978 /nfs/dbraw/zinc/61/19/78/1075611978.db2.gz MDCCROYAWNIKLF-UHFFFAOYSA-N -1 3 384.422 -1.956 20 0 GAADHM CNS(=O)(=O)CC(=O)N(CCO)CCNc1ccc(-c2nnn[n-]2)cn1 ZINC001579424650 1075611976 /nfs/dbraw/zinc/61/19/76/1075611976.db2.gz MDCCROYAWNIKLF-UHFFFAOYSA-N -1 3 384.422 -1.956 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001579424654 1075612370 /nfs/dbraw/zinc/61/23/70/1075612370.db2.gz MIKHCPXTSVMPOG-UHFFFAOYSA-N -1 3 382.406 -1.972 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001579424654 1075612368 /nfs/dbraw/zinc/61/23/68/1075612368.db2.gz MIKHCPXTSVMPOG-UHFFFAOYSA-N -1 3 382.406 -1.972 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579424656 1075612317 /nfs/dbraw/zinc/61/23/17/1075612317.db2.gz MMXIIGYIOAQZNV-SECBINFHSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579424656 1075612312 /nfs/dbraw/zinc/61/23/12/1075612312.db2.gz MMXIIGYIOAQZNV-SECBINFHSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579424657 1075612429 /nfs/dbraw/zinc/61/24/29/1075612429.db2.gz MMXIIGYIOAQZNV-VIFPVBQESA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579424657 1075612426 /nfs/dbraw/zinc/61/24/26/1075612426.db2.gz MMXIIGYIOAQZNV-VIFPVBQESA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CCN(c2nc(C)ccc2-c2nn[n-]n2)CC1 ZINC001579424667 1075612388 /nfs/dbraw/zinc/61/23/88/1075612388.db2.gz MVVZQWFHTSRDCN-UHFFFAOYSA-N -1 3 380.434 -1.232 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CCN(c2nc(C)ccc2-c2nnn[n-]2)CC1 ZINC001579424667 1075612385 /nfs/dbraw/zinc/61/23/85/1075612385.db2.gz MVVZQWFHTSRDCN-UHFFFAOYSA-N -1 3 380.434 -1.232 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H](N(C)c2ncccc2-c2nn[n-]n2)C1 ZINC001579424686 1075612461 /nfs/dbraw/zinc/61/24/61/1075612461.db2.gz NLTHJBGGASCSNG-JTQLQIEISA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H](N(C)c2ncccc2-c2nnn[n-]2)C1 ZINC001579424686 1075612458 /nfs/dbraw/zinc/61/24/58/1075612458.db2.gz NLTHJBGGASCSNG-JTQLQIEISA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@@H](N(C)c2ncccc2-c2nn[n-]n2)C1 ZINC001579424687 1075612379 /nfs/dbraw/zinc/61/23/79/1075612379.db2.gz NLTHJBGGASCSNG-SNVBAGLBSA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@@H](N(C)c2ncccc2-c2nnn[n-]2)C1 ZINC001579424687 1075612376 /nfs/dbraw/zinc/61/23/76/1075612376.db2.gz NLTHJBGGASCSNG-SNVBAGLBSA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@H]2CC[C@@H](C1)N2c1ccc(-c2nn[n-]n2)nc1 ZINC001579424699 1075612695 /nfs/dbraw/zinc/61/26/95/1075612695.db2.gz NXOYEKUFHDGEFL-TXEJJXNPSA-N -1 3 392.445 -1.010 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@H]2CC[C@@H](C1)N2c1ccc(-c2nnn[n-]2)nc1 ZINC001579424699 1075612691 /nfs/dbraw/zinc/61/26/91/1075612691.db2.gz NXOYEKUFHDGEFL-TXEJJXNPSA-N -1 3 392.445 -1.010 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579424717 1075612612 /nfs/dbraw/zinc/61/26/12/1075612612.db2.gz OJXJWONSLINIST-UHFFFAOYSA-N -1 3 382.406 -2.068 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579424717 1075612609 /nfs/dbraw/zinc/61/26/09/1075612609.db2.gz OJXJWONSLINIST-UHFFFAOYSA-N -1 3 382.406 -2.068 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579424730 1075612756 /nfs/dbraw/zinc/61/27/56/1075612756.db2.gz OUECYJXUNXQGGV-SECBINFHSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579424730 1075612752 /nfs/dbraw/zinc/61/27/52/1075612752.db2.gz OUECYJXUNXQGGV-SECBINFHSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579424731 1075612786 /nfs/dbraw/zinc/61/27/86/1075612786.db2.gz OUECYJXUNXQGGV-VIFPVBQESA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579424731 1075612783 /nfs/dbraw/zinc/61/27/83/1075612783.db2.gz OUECYJXUNXQGGV-VIFPVBQESA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)CCN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579424752 1075612684 /nfs/dbraw/zinc/61/26/84/1075612684.db2.gz POPRYAJANZPCMW-UHFFFAOYSA-N -1 3 384.422 -1.726 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)CCN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579424752 1075612681 /nfs/dbraw/zinc/61/26/81/1075612681.db2.gz POPRYAJANZPCMW-UHFFFAOYSA-N -1 3 384.422 -1.726 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579424755 1075612631 /nfs/dbraw/zinc/61/26/31/1075612631.db2.gz PQZUIFSMIPNSGK-MRVPVSSYSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579424755 1075612630 /nfs/dbraw/zinc/61/26/30/1075612630.db2.gz PQZUIFSMIPNSGK-MRVPVSSYSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579424756 1075613058 /nfs/dbraw/zinc/61/30/58/1075613058.db2.gz PQZUIFSMIPNSGK-QMMMGPOBSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579424756 1075613056 /nfs/dbraw/zinc/61/30/56/1075613056.db2.gz PQZUIFSMIPNSGK-QMMMGPOBSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579424764 1075613052 /nfs/dbraw/zinc/61/30/52/1075613052.db2.gz PTERASWNQMYPHL-SECBINFHSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579424764 1075613050 /nfs/dbraw/zinc/61/30/50/1075613050.db2.gz PTERASWNQMYPHL-SECBINFHSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579424765 1075613068 /nfs/dbraw/zinc/61/30/68/1075613068.db2.gz PTERASWNQMYPHL-VIFPVBQESA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579424765 1075613067 /nfs/dbraw/zinc/61/30/67/1075613067.db2.gz PTERASWNQMYPHL-VIFPVBQESA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@H](C)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579424766 1075613040 /nfs/dbraw/zinc/61/30/40/1075613040.db2.gz PTWVFFCBIJYUPI-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@H](C)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579424766 1075613038 /nfs/dbraw/zinc/61/30/38/1075613038.db2.gz PTWVFFCBIJYUPI-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@@H](C)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579424767 1075613018 /nfs/dbraw/zinc/61/30/18/1075613018.db2.gz PTWVFFCBIJYUPI-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@@H](C)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579424767 1075613017 /nfs/dbraw/zinc/61/30/17/1075613017.db2.gz PTWVFFCBIJYUPI-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579424779 1075613030 /nfs/dbraw/zinc/61/30/30/1075613030.db2.gz QDTNTGCBWCTIKE-UHFFFAOYSA-N -1 3 382.406 -1.973 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579424779 1075613028 /nfs/dbraw/zinc/61/30/28/1075613028.db2.gz QDTNTGCBWCTIKE-UHFFFAOYSA-N -1 3 382.406 -1.973 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@@H](C)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579424784 1075613110 /nfs/dbraw/zinc/61/31/10/1075613110.db2.gz QGRMVRSRULUSPE-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@@H](C)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579424784 1075613108 /nfs/dbraw/zinc/61/31/08/1075613108.db2.gz QGRMVRSRULUSPE-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@H](C)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579424785 1075613022 /nfs/dbraw/zinc/61/30/22/1075613022.db2.gz QGRMVRSRULUSPE-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@H](C)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579424785 1075613020 /nfs/dbraw/zinc/61/30/20/1075613020.db2.gz QGRMVRSRULUSPE-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579424787 1075613063 /nfs/dbraw/zinc/61/30/63/1075613063.db2.gz QHLYHHBJEVMDOD-UHFFFAOYSA-N -1 3 382.406 -2.068 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579424787 1075613062 /nfs/dbraw/zinc/61/30/62/1075613062.db2.gz QHLYHHBJEVMDOD-UHFFFAOYSA-N -1 3 382.406 -2.068 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC(N(C)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579424800 1075613083 /nfs/dbraw/zinc/61/30/83/1075613083.db2.gz QTXGIDRAXYGGPE-UHFFFAOYSA-N -1 3 382.406 -1.973 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC(N(C)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579424800 1075613082 /nfs/dbraw/zinc/61/30/82/1075613082.db2.gz QTXGIDRAXYGGPE-UHFFFAOYSA-N -1 3 382.406 -1.973 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC(N(C)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579424801 1075613074 /nfs/dbraw/zinc/61/30/74/1075613074.db2.gz QVECQFAKUJLFSX-UHFFFAOYSA-N -1 3 382.406 -1.973 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC(N(C)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579424801 1075613072 /nfs/dbraw/zinc/61/30/72/1075613072.db2.gz QVECQFAKUJLFSX-UHFFFAOYSA-N -1 3 382.406 -1.973 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001579424840 1075613364 /nfs/dbraw/zinc/61/33/64/1075613364.db2.gz RYHOMHOWVFUGPW-LLVKDONJSA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579424840 1075613362 /nfs/dbraw/zinc/61/33/62/1075613362.db2.gz RYHOMHOWVFUGPW-LLVKDONJSA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001579424841 1075613482 /nfs/dbraw/zinc/61/34/82/1075613482.db2.gz RYHOMHOWVFUGPW-NSHDSACASA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579424841 1075613478 /nfs/dbraw/zinc/61/34/78/1075613478.db2.gz RYHOMHOWVFUGPW-NSHDSACASA-N -1 3 380.434 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@H]1C ZINC001579424863 1075613414 /nfs/dbraw/zinc/61/34/14/1075613414.db2.gz AGGCHLSTYDYVNU-MWLCHTKSSA-N -1 3 380.434 -1.248 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@H]1C ZINC001579424863 1075613409 /nfs/dbraw/zinc/61/34/09/1075613409.db2.gz AGGCHLSTYDYVNU-MWLCHTKSSA-N -1 3 380.434 -1.248 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O ZINC001579424882 1075613673 /nfs/dbraw/zinc/61/36/73/1075613673.db2.gz AXPCDGXHARKYPE-GHMZBOCLSA-N -1 3 382.406 -2.523 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O ZINC001579424882 1075613671 /nfs/dbraw/zinc/61/36/71/1075613671.db2.gz AXPCDGXHARKYPE-GHMZBOCLSA-N -1 3 382.406 -2.523 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001579424883 1075613713 /nfs/dbraw/zinc/61/37/13/1075613713.db2.gz AXPCDGXHARKYPE-MNOVXSKESA-N -1 3 382.406 -2.523 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001579424883 1075613709 /nfs/dbraw/zinc/61/37/09/1075613709.db2.gz AXPCDGXHARKYPE-MNOVXSKESA-N -1 3 382.406 -2.523 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]2C1 ZINC001579424892 1075613653 /nfs/dbraw/zinc/61/36/53/1075613653.db2.gz AZEXJHWUGLNDOT-PHIMTYICSA-N -1 3 392.445 -1.295 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]2C1 ZINC001579424892 1075613651 /nfs/dbraw/zinc/61/36/51/1075613651.db2.gz AZEXJHWUGLNDOT-PHIMTYICSA-N -1 3 392.445 -1.295 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1[C@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]21 ZINC001579424908 1075613726 /nfs/dbraw/zinc/61/37/26/1075613726.db2.gz BMYSHMGIQZWFKD-CNDDSTCGSA-N -1 3 392.445 -1.391 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1[C@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@H]21 ZINC001579424908 1075613723 /nfs/dbraw/zinc/61/37/23/1075613723.db2.gz BMYSHMGIQZWFKD-CNDDSTCGSA-N -1 3 392.445 -1.391 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H](C)CN(C)c1ncc(-c2nn[n-]n2)cc1F ZINC001579424915 1075614028 /nfs/dbraw/zinc/61/40/28/1075614028.db2.gz BWARCVVYMQIGIB-MRVPVSSYSA-N -1 3 386.413 -1.109 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H](C)CN(C)c1ncc(-c2nnn[n-]2)cc1F ZINC001579424915 1075614024 /nfs/dbraw/zinc/61/40/24/1075614024.db2.gz BWARCVVYMQIGIB-MRVPVSSYSA-N -1 3 386.413 -1.109 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H](C)CN(C)c1ncc(-c2nn[n-]n2)cc1F ZINC001579424916 1075614149 /nfs/dbraw/zinc/61/41/49/1075614149.db2.gz BWARCVVYMQIGIB-QMMMGPOBSA-N -1 3 386.413 -1.109 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H](C)CN(C)c1ncc(-c2nnn[n-]2)cc1F ZINC001579424916 1075614146 /nfs/dbraw/zinc/61/41/46/1075614146.db2.gz BWARCVVYMQIGIB-QMMMGPOBSA-N -1 3 386.413 -1.109 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1O ZINC001579424922 1075614054 /nfs/dbraw/zinc/61/40/54/1075614054.db2.gz CCVJPEWOGXLGOD-NXEZZACHSA-N -1 3 382.406 -2.523 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@H]1O ZINC001579424922 1075614053 /nfs/dbraw/zinc/61/40/53/1075614053.db2.gz CCVJPEWOGXLGOD-NXEZZACHSA-N -1 3 382.406 -2.523 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001579424923 1075614128 /nfs/dbraw/zinc/61/41/28/1075614128.db2.gz CCVJPEWOGXLGOD-ZJUUUORDSA-N -1 3 382.406 -2.523 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001579424923 1075614125 /nfs/dbraw/zinc/61/41/25/1075614125.db2.gz CCVJPEWOGXLGOD-ZJUUUORDSA-N -1 3 382.406 -2.523 20 0 GAADHM CNS(=O)(=O)CC(=O)NCCN(c1ncccc1-c1nn[n-]n1)C1CC1 ZINC001579424937 1075614035 /nfs/dbraw/zinc/61/40/35/1075614035.db2.gz CMVYPKLTYZQLCX-UHFFFAOYSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)NCCN(c1ncccc1-c1nnn[n-]1)C1CC1 ZINC001579424937 1075614032 /nfs/dbraw/zinc/61/40/32/1075614032.db2.gz CMVYPKLTYZQLCX-UHFFFAOYSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@@H](O)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001579424971 1075614062 /nfs/dbraw/zinc/61/40/62/1075614062.db2.gz TVSYUHNFEBCPAR-JTQLQIEISA-N -1 3 384.422 -1.958 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@@H](O)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001579424971 1075614060 /nfs/dbraw/zinc/61/40/60/1075614060.db2.gz TVSYUHNFEBCPAR-JTQLQIEISA-N -1 3 384.422 -1.958 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@H](O)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001579424972 1075614097 /nfs/dbraw/zinc/61/40/97/1075614097.db2.gz TVSYUHNFEBCPAR-SNVBAGLBSA-N -1 3 384.422 -1.958 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C[C@H](O)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001579424972 1075614093 /nfs/dbraw/zinc/61/40/93/1075614093.db2.gz TVSYUHNFEBCPAR-SNVBAGLBSA-N -1 3 384.422 -1.958 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579424982 1075614453 /nfs/dbraw/zinc/61/44/53/1075614453.db2.gz UJUGYLINXXDIQT-UHFFFAOYSA-N -1 3 382.406 -1.973 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)C1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579424982 1075614450 /nfs/dbraw/zinc/61/44/50/1075614450.db2.gz UJUGYLINXXDIQT-UHFFFAOYSA-N -1 3 382.406 -1.973 20 0 GAADHM CNS(=O)(=O)C1CCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001579425033 1075614483 /nfs/dbraw/zinc/61/44/83/1075614483.db2.gz WHJGHXGBRYBBDX-UHFFFAOYSA-N -1 3 387.447 -1.036 20 0 GAADHM CNS(=O)(=O)C1CCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001579425033 1075614482 /nfs/dbraw/zinc/61/44/82/1075614482.db2.gz WHJGHXGBRYBBDX-UHFFFAOYSA-N -1 3 387.447 -1.036 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)CCN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579425040 1075614334 /nfs/dbraw/zinc/61/43/34/1075614334.db2.gz WKHCPSXRBPXFDR-UHFFFAOYSA-N -1 3 384.422 -1.726 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)CCN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579425040 1075614331 /nfs/dbraw/zinc/61/43/31/1075614331.db2.gz WKHCPSXRBPXFDR-UHFFFAOYSA-N -1 3 384.422 -1.726 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CCCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001579425171 1075614757 /nfs/dbraw/zinc/61/47/57/1075614757.db2.gz XYDAQDVQAWDZIY-UHFFFAOYSA-N -1 3 380.434 -1.150 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CCCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001579425171 1075614756 /nfs/dbraw/zinc/61/47/56/1075614756.db2.gz XYDAQDVQAWDZIY-UHFFFAOYSA-N -1 3 380.434 -1.150 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)CCN(C)c1ncc(-c2nn[n-]n2)cc1F ZINC001579425178 1075614712 /nfs/dbraw/zinc/61/47/12/1075614712.db2.gz YBOWLSBWAHMURN-UHFFFAOYSA-N -1 3 386.413 -1.155 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)CCN(C)c1ncc(-c2nnn[n-]2)cc1F ZINC001579425178 1075614709 /nfs/dbraw/zinc/61/47/09/1075614709.db2.gz YBOWLSBWAHMURN-UHFFFAOYSA-N -1 3 386.413 -1.155 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC(N(C)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579425187 1075614780 /nfs/dbraw/zinc/61/47/80/1075614780.db2.gz YFWHOVBQHGRPRV-UHFFFAOYSA-N -1 3 382.406 -1.973 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC(N(C)C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579425187 1075614778 /nfs/dbraw/zinc/61/47/78/1075614778.db2.gz YFWHOVBQHGRPRV-UHFFFAOYSA-N -1 3 382.406 -1.973 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@H](C)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579425281 1075614725 /nfs/dbraw/zinc/61/47/25/1075614725.db2.gz ZUWATZOSMWJKCM-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@H](C)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579425281 1075614722 /nfs/dbraw/zinc/61/47/22/1075614722.db2.gz ZUWATZOSMWJKCM-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@@H](C)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579425283 1075614798 /nfs/dbraw/zinc/61/47/98/1075614798.db2.gz ZUWATZOSMWJKCM-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N(C)[C@@H](C)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579425283 1075614796 /nfs/dbraw/zinc/61/47/96/1075614796.db2.gz ZUWATZOSMWJKCM-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H](C)CN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579425354 1075614749 /nfs/dbraw/zinc/61/47/49/1075614749.db2.gz DSCMAULYKFWWNH-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H](C)CN(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579425354 1075614748 /nfs/dbraw/zinc/61/47/48/1075614748.db2.gz DSCMAULYKFWWNH-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H](C)CN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579425355 1075614793 /nfs/dbraw/zinc/61/47/93/1075614793.db2.gz DSCMAULYKFWWNH-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H](C)CN(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579425355 1075614791 /nfs/dbraw/zinc/61/47/91/1075614791.db2.gz DSCMAULYKFWWNH-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001579425364 1075615225 /nfs/dbraw/zinc/61/52/25/1075615225.db2.gz DXJOIGOJTUXWJV-SNVBAGLBSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001579425364 1075615221 /nfs/dbraw/zinc/61/52/21/1075615221.db2.gz DXJOIGOJTUXWJV-SNVBAGLBSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)NCC1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579425388 1075615195 /nfs/dbraw/zinc/61/51/95/1075615195.db2.gz FCCDISVQXHZFRV-UHFFFAOYSA-N -1 3 382.406 -2.068 20 0 GAADHM CNS(=O)(=O)CC(=O)NCC1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579425388 1075615191 /nfs/dbraw/zinc/61/51/91/1075615191.db2.gz FCCDISVQXHZFRV-UHFFFAOYSA-N -1 3 382.406 -2.068 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579425401 1075615097 /nfs/dbraw/zinc/61/50/97/1075615097.db2.gz FHNMBDLQNOCGDA-SECBINFHSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579425401 1075615094 /nfs/dbraw/zinc/61/50/94/1075615094.db2.gz FHNMBDLQNOCGDA-SECBINFHSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579425407 1075615215 /nfs/dbraw/zinc/61/52/15/1075615215.db2.gz FHNMBDLQNOCGDA-VIFPVBQESA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579425407 1075615212 /nfs/dbraw/zinc/61/52/12/1075615212.db2.gz FHNMBDLQNOCGDA-VIFPVBQESA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]2C1 ZINC001579425494 1075615184 /nfs/dbraw/zinc/61/51/84/1075615184.db2.gz FVDNZBRXMHHLAP-PHIMTYICSA-N -1 3 392.445 -1.295 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]2C1 ZINC001579425494 1075615181 /nfs/dbraw/zinc/61/51/81/1075615181.db2.gz FVDNZBRXMHHLAP-PHIMTYICSA-N -1 3 392.445 -1.295 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]21 ZINC001579425501 1075615125 /nfs/dbraw/zinc/61/51/25/1075615125.db2.gz GFWYJGBAKQOEJW-CMPLNLGQSA-N -1 3 392.445 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]21 ZINC001579425501 1075615122 /nfs/dbraw/zinc/61/51/22/1075615122.db2.gz GFWYJGBAKQOEJW-CMPLNLGQSA-N -1 3 392.445 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H](C)N(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579425505 1075615208 /nfs/dbraw/zinc/61/52/08/1075615208.db2.gz GOTBFKOQKJDMII-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H](C)N(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579425505 1075615205 /nfs/dbraw/zinc/61/52/05/1075615205.db2.gz GOTBFKOQKJDMII-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H](C)N(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579425506 1075615158 /nfs/dbraw/zinc/61/51/58/1075615158.db2.gz GOTBFKOQKJDMII-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H](C)N(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579425506 1075615156 /nfs/dbraw/zinc/61/51/56/1075615156.db2.gz GOTBFKOQKJDMII-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nn[n-]n2)cn1 ZINC001579425507 1075615144 /nfs/dbraw/zinc/61/51/44/1075615144.db2.gz GUIHPFKSYXOUAG-QWRGUYRKSA-N -1 3 378.418 -1.400 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nnn[n-]2)cn1 ZINC001579425507 1075615141 /nfs/dbraw/zinc/61/51/41/1075615141.db2.gz GUIHPFKSYXOUAG-QWRGUYRKSA-N -1 3 378.418 -1.400 20 0 GAADHM CNS(=O)(=O)CC(=O)NC1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001579425528 1075615380 /nfs/dbraw/zinc/61/53/80/1075615380.db2.gz HHBSEGIAFFNITO-UHFFFAOYSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)NC1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001579425528 1075615376 /nfs/dbraw/zinc/61/53/76/1075615376.db2.gz HHBSEGIAFFNITO-UHFFFAOYSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001579425861 1075615740 /nfs/dbraw/zinc/61/57/40/1075615740.db2.gz IJOWBFOWWJVQJJ-JTQLQIEISA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579425861 1075615738 /nfs/dbraw/zinc/61/57/38/1075615738.db2.gz IJOWBFOWWJVQJJ-JTQLQIEISA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001579425866 1075615764 /nfs/dbraw/zinc/61/57/64/1075615764.db2.gz IJOWBFOWWJVQJJ-SNVBAGLBSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579425866 1075615759 /nfs/dbraw/zinc/61/57/59/1075615759.db2.gz IJOWBFOWWJVQJJ-SNVBAGLBSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCN(c2snc(C)c2-c2nnn[n-]2)C1 ZINC001579425872 1075615697 /nfs/dbraw/zinc/61/56/97/1075615697.db2.gz ILBGEVXIZXDVAO-MRVPVSSYSA-N -1 3 386.463 -1.124 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(c2snc(C)c2-c2nnn[n-]2)C1 ZINC001579425876 1075615751 /nfs/dbraw/zinc/61/57/51/1075615751.db2.gz ILBGEVXIZXDVAO-QMMMGPOBSA-N -1 3 386.463 -1.124 20 0 GAADHM CNS(=O)(=O)CC(=O)NCCN(c1ccc(-c2nn[n-]n2)cn1)C1CC1 ZINC001579425884 1075615816 /nfs/dbraw/zinc/61/58/16/1075615816.db2.gz IMOCDBDWOOCWRL-UHFFFAOYSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)NCCN(c1ccc(-c2nnn[n-]2)cn1)C1CC1 ZINC001579425884 1075615814 /nfs/dbraw/zinc/61/58/14/1075615814.db2.gz IMOCDBDWOOCWRL-UHFFFAOYSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1CCCN1c1ccc(-c2nn[n-]n2)nc1 ZINC001579425894 1075615846 /nfs/dbraw/zinc/61/58/46/1075615846.db2.gz IPYANZZHFXDAJB-JTQLQIEISA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1CCCN1c1ccc(-c2nnn[n-]2)nc1 ZINC001579425894 1075615844 /nfs/dbraw/zinc/61/58/44/1075615844.db2.gz IPYANZZHFXDAJB-JTQLQIEISA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H]1CCCN1c1ccc(-c2nn[n-]n2)nc1 ZINC001579425897 1075615799 /nfs/dbraw/zinc/61/57/99/1075615799.db2.gz IPYANZZHFXDAJB-SNVBAGLBSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H]1CCCN1c1ccc(-c2nnn[n-]2)nc1 ZINC001579425897 1075615796 /nfs/dbraw/zinc/61/57/96/1075615796.db2.gz IPYANZZHFXDAJB-SNVBAGLBSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]21 ZINC001579425909 1075615772 /nfs/dbraw/zinc/61/57/72/1075615772.db2.gz JAMUHDVCFNGIHV-GXFFZTMASA-N -1 3 392.445 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]21 ZINC001579425909 1075615769 /nfs/dbraw/zinc/61/57/69/1075615769.db2.gz JAMUHDVCFNGIHV-GXFFZTMASA-N -1 3 392.445 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@]1(C)CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579425925 1075616189 /nfs/dbraw/zinc/61/61/89/1075616189.db2.gz KDOKXIIDEAEUHM-AWEZNQCLSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@]1(C)CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579425925 1075616187 /nfs/dbraw/zinc/61/61/87/1075616187.db2.gz KDOKXIIDEAEUHM-AWEZNQCLSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@]1(C)CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579425926 1075616134 /nfs/dbraw/zinc/61/61/34/1075616134.db2.gz KDOKXIIDEAEUHM-CQSZACIVSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@]1(C)CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579425926 1075616132 /nfs/dbraw/zinc/61/61/32/1075616132.db2.gz KDOKXIIDEAEUHM-CQSZACIVSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)NC1CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C1 ZINC001579425929 1075616119 /nfs/dbraw/zinc/61/61/19/1075616119.db2.gz KEWBQALBFNHXJB-UHFFFAOYSA-N -1 3 383.409 -1.145 20 0 GAADHM CNS(=O)(=O)CC(=O)NC1CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C1 ZINC001579425929 1075616118 /nfs/dbraw/zinc/61/61/18/1075616118.db2.gz KEWBQALBFNHXJB-UHFFFAOYSA-N -1 3 383.409 -1.145 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H](Nc2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001579425932 1075616152 /nfs/dbraw/zinc/61/61/52/1075616152.db2.gz KGLGTKYIISMRRR-VIFPVBQESA-N -1 3 384.397 -1.037 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H](Nc2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001579425932 1075616149 /nfs/dbraw/zinc/61/61/49/1075616149.db2.gz KGLGTKYIISMRRR-VIFPVBQESA-N -1 3 384.397 -1.037 20 0 GAADHM CNS(=O)(=O)CC(=O)NC1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001579425949 1075616393 /nfs/dbraw/zinc/61/63/93/1075616393.db2.gz KTYRMYSDIPOQOO-UHFFFAOYSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)NC1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001579425949 1075616389 /nfs/dbraw/zinc/61/63/89/1075616389.db2.gz KTYRMYSDIPOQOO-UHFFFAOYSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(c2nc(C)ccc2-c2nn[n-]n2)C1 ZINC001579426192 1075616492 /nfs/dbraw/zinc/61/64/92/1075616492.db2.gz KUWBEFCJAJWNPV-JTQLQIEISA-N -1 3 380.434 -1.186 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(c2nc(C)ccc2-c2nnn[n-]2)C1 ZINC001579426192 1075616486 /nfs/dbraw/zinc/61/64/86/1075616486.db2.gz KUWBEFCJAJWNPV-JTQLQIEISA-N -1 3 380.434 -1.186 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCN(c2nc(C)ccc2-c2nn[n-]n2)C1 ZINC001579426198 1075616459 /nfs/dbraw/zinc/61/64/59/1075616459.db2.gz KUWBEFCJAJWNPV-SNVBAGLBSA-N -1 3 380.434 -1.186 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCN(c2nc(C)ccc2-c2nnn[n-]2)C1 ZINC001579426198 1075616455 /nfs/dbraw/zinc/61/64/55/1075616455.db2.gz KUWBEFCJAJWNPV-SNVBAGLBSA-N -1 3 380.434 -1.186 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1[C@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]21 ZINC001579426233 1075616440 /nfs/dbraw/zinc/61/64/40/1075616440.db2.gz LUPPMNFMXBVBRG-CNDDSTCGSA-N -1 3 392.445 -1.391 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1[C@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]21 ZINC001579426233 1075616437 /nfs/dbraw/zinc/61/64/37/1075616437.db2.gz LUPPMNFMXBVBRG-CNDDSTCGSA-N -1 3 392.445 -1.391 20 0 GAADHM CNS(=O)(=O)CC(=O)NC1CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C1 ZINC001579426238 1075616586 /nfs/dbraw/zinc/61/65/86/1075616586.db2.gz LWTAYIFARPMHTD-UHFFFAOYSA-N -1 3 383.409 -1.145 20 0 GAADHM CNS(=O)(=O)CC(=O)NC1CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C1 ZINC001579426238 1075616581 /nfs/dbraw/zinc/61/65/81/1075616581.db2.gz LWTAYIFARPMHTD-UHFFFAOYSA-N -1 3 383.409 -1.145 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579426310 1075616805 /nfs/dbraw/zinc/61/68/05/1075616805.db2.gz MVHCZWQMPDNECT-SECBINFHSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579426310 1075616802 /nfs/dbraw/zinc/61/68/02/1075616802.db2.gz MVHCZWQMPDNECT-SECBINFHSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579426317 1075616739 /nfs/dbraw/zinc/61/67/39/1075616739.db2.gz MVHCZWQMPDNECT-VIFPVBQESA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579426317 1075616737 /nfs/dbraw/zinc/61/67/37/1075616737.db2.gz MVHCZWQMPDNECT-VIFPVBQESA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H](C)CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579426366 1075616880 /nfs/dbraw/zinc/61/68/80/1075616880.db2.gz NMBFQEKKDKPZEI-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H](C)CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579426366 1075616875 /nfs/dbraw/zinc/61/68/75/1075616875.db2.gz NMBFQEKKDKPZEI-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H](C)CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579426367 1075616761 /nfs/dbraw/zinc/61/67/61/1075616761.db2.gz NMBFQEKKDKPZEI-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H](C)CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579426367 1075616758 /nfs/dbraw/zinc/61/67/58/1075616758.db2.gz NMBFQEKKDKPZEI-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nn[n-]n2)nc1 ZINC001579426368 1075616748 /nfs/dbraw/zinc/61/67/48/1075616748.db2.gz NMVOMTWBAJAVFW-QWRGUYRKSA-N -1 3 378.418 -1.400 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nnn[n-]2)nc1 ZINC001579426368 1075616746 /nfs/dbraw/zinc/61/67/46/1075616746.db2.gz NMVOMTWBAJAVFW-QWRGUYRKSA-N -1 3 378.418 -1.400 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nn[n-]n2)c(C)n1 ZINC001579426373 1075616841 /nfs/dbraw/zinc/61/68/41/1075616841.db2.gz NTOUDYDWWFHZNW-QWRGUYRKSA-N -1 3 392.445 -1.091 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nnn[n-]2)c(C)n1 ZINC001579426373 1075616836 /nfs/dbraw/zinc/61/68/36/1075616836.db2.gz NTOUDYDWWFHZNW-QWRGUYRKSA-N -1 3 392.445 -1.091 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@]1(C)CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001579426379 1075616857 /nfs/dbraw/zinc/61/68/57/1075616857.db2.gz NZZKDASIYIMSNY-AWEZNQCLSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@]1(C)CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579426379 1075616849 /nfs/dbraw/zinc/61/68/49/1075616849.db2.gz NZZKDASIYIMSNY-AWEZNQCLSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@]1(C)CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001579426380 1075616903 /nfs/dbraw/zinc/61/69/03/1075616903.db2.gz NZZKDASIYIMSNY-CQSZACIVSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@]1(C)CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579426380 1075616900 /nfs/dbraw/zinc/61/69/00/1075616900.db2.gz NZZKDASIYIMSNY-CQSZACIVSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579426407 1075617186 /nfs/dbraw/zinc/61/71/86/1075617186.db2.gz OWUZJCJQLXJJLW-JTQLQIEISA-N -1 3 380.434 -1.247 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579426407 1075617182 /nfs/dbraw/zinc/61/71/82/1075617182.db2.gz OWUZJCJQLXJJLW-JTQLQIEISA-N -1 3 380.434 -1.247 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579426409 1075617200 /nfs/dbraw/zinc/61/72/00/1075617200.db2.gz OWUZJCJQLXJJLW-SNVBAGLBSA-N -1 3 380.434 -1.247 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579426409 1075617197 /nfs/dbraw/zinc/61/71/97/1075617197.db2.gz OWUZJCJQLXJJLW-SNVBAGLBSA-N -1 3 380.434 -1.247 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1C ZINC001579426454 1075617166 /nfs/dbraw/zinc/61/71/66/1075617166.db2.gz PHZMBDOHOWZUFB-BXKDBHETSA-N -1 3 380.434 -1.248 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1C ZINC001579426454 1075617164 /nfs/dbraw/zinc/61/71/64/1075617164.db2.gz PHZMBDOHOWZUFB-BXKDBHETSA-N -1 3 380.434 -1.248 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]21 ZINC001579426477 1075617271 /nfs/dbraw/zinc/61/72/71/1075617271.db2.gz POGDMVIAUNRGIL-NWDGAFQWSA-N -1 3 392.445 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N1CC[C@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@H]21 ZINC001579426477 1075617270 /nfs/dbraw/zinc/61/72/70/1075617270.db2.gz POGDMVIAUNRGIL-NWDGAFQWSA-N -1 3 392.445 -1.152 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1C ZINC001579426533 1075617175 /nfs/dbraw/zinc/61/71/75/1075617175.db2.gz QCEGHPBQFUDLHZ-MWLCHTKSSA-N -1 3 380.434 -1.248 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@H]1C ZINC001579426533 1075617171 /nfs/dbraw/zinc/61/71/71/1075617171.db2.gz QCEGHPBQFUDLHZ-MWLCHTKSSA-N -1 3 380.434 -1.248 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@@H]2C[C@H]1CN2c1nc(C)ccc1-c1nn[n-]n1 ZINC001579426537 1075617249 /nfs/dbraw/zinc/61/72/49/1075617249.db2.gz QHIYJCJOBXQSLY-QWRGUYRKSA-N -1 3 392.445 -1.091 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@@H]2C[C@H]1CN2c1nc(C)ccc1-c1nnn[n-]1 ZINC001579426537 1075617246 /nfs/dbraw/zinc/61/72/46/1075617246.db2.gz QHIYJCJOBXQSLY-QWRGUYRKSA-N -1 3 392.445 -1.091 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]2C1 ZINC001579426540 1075617277 /nfs/dbraw/zinc/61/72/77/1075617277.db2.gz QLDJCVLBEFKJCK-TXEJJXNPSA-N -1 3 392.445 -1.295 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@H]2C1 ZINC001579426540 1075617276 /nfs/dbraw/zinc/61/72/76/1075617276.db2.gz QLDJCVLBEFKJCK-TXEJJXNPSA-N -1 3 392.445 -1.295 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001579426541 1075617287 /nfs/dbraw/zinc/61/72/87/1075617287.db2.gz QNVKEVDHPXXNNK-JTQLQIEISA-N -1 3 380.434 -1.247 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579426541 1075617286 /nfs/dbraw/zinc/61/72/86/1075617286.db2.gz QNVKEVDHPXXNNK-JTQLQIEISA-N -1 3 380.434 -1.247 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001579426542 1075617665 /nfs/dbraw/zinc/61/76/65/1075617665.db2.gz QNVKEVDHPXXNNK-SNVBAGLBSA-N -1 3 380.434 -1.247 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579426542 1075617661 /nfs/dbraw/zinc/61/76/61/1075617661.db2.gz QNVKEVDHPXXNNK-SNVBAGLBSA-N -1 3 380.434 -1.247 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001579426547 1075617545 /nfs/dbraw/zinc/61/75/45/1075617545.db2.gz QOGBFDFLAMCKHF-JTQLQIEISA-N -1 3 380.434 -1.247 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001579426547 1075617540 /nfs/dbraw/zinc/61/75/40/1075617540.db2.gz QOGBFDFLAMCKHF-JTQLQIEISA-N -1 3 380.434 -1.247 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001579426548 1075617604 /nfs/dbraw/zinc/61/76/04/1075617604.db2.gz QOGBFDFLAMCKHF-SNVBAGLBSA-N -1 3 380.434 -1.247 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001579426548 1075617598 /nfs/dbraw/zinc/61/75/98/1075617598.db2.gz QOGBFDFLAMCKHF-SNVBAGLBSA-N -1 3 380.434 -1.247 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@H]1C ZINC001579426549 1075617589 /nfs/dbraw/zinc/61/75/89/1075617589.db2.gz QPBYUFWBRJECRM-GHMZBOCLSA-N -1 3 394.461 -1.001 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@H]1C ZINC001579426549 1075617584 /nfs/dbraw/zinc/61/75/84/1075617584.db2.gz QPBYUFWBRJECRM-GHMZBOCLSA-N -1 3 394.461 -1.001 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H]1CCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579426565 1075617526 /nfs/dbraw/zinc/61/75/26/1075617526.db2.gz RFYYTVKTYAKQIP-MRVPVSSYSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H]1CCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579426565 1075617522 /nfs/dbraw/zinc/61/75/22/1075617522.db2.gz RFYYTVKTYAKQIP-MRVPVSSYSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1CCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579426566 1075617616 /nfs/dbraw/zinc/61/76/16/1075617616.db2.gz RFYYTVKTYAKQIP-QMMMGPOBSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1CCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579426566 1075617615 /nfs/dbraw/zinc/61/76/15/1075617615.db2.gz RFYYTVKTYAKQIP-QMMMGPOBSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)NC1CN(Cc2cc(-c3nn[n-]n3)ccc2F)C1 ZINC001579426583 1075618020 /nfs/dbraw/zinc/61/80/20/1075618020.db2.gz RSBNOVWNMMYOGL-UHFFFAOYSA-N -1 3 383.409 -1.145 20 0 GAADHM CNS(=O)(=O)CC(=O)NC1CN(Cc2cc(-c3nnn[n-]3)ccc2F)C1 ZINC001579426583 1075618015 /nfs/dbraw/zinc/61/80/15/1075618015.db2.gz RSBNOVWNMMYOGL-UHFFFAOYSA-N -1 3 383.409 -1.145 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@]1(C)CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001579426732 1075618077 /nfs/dbraw/zinc/61/80/77/1075618077.db2.gz SNFHDVBFNXKKCC-AWEZNQCLSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@]1(C)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001579426732 1075618072 /nfs/dbraw/zinc/61/80/72/1075618072.db2.gz SNFHDVBFNXKKCC-AWEZNQCLSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@]1(C)CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001579426733 1075617892 /nfs/dbraw/zinc/61/78/92/1075617892.db2.gz SNFHDVBFNXKKCC-CQSZACIVSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@]1(C)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001579426733 1075617888 /nfs/dbraw/zinc/61/78/88/1075617888.db2.gz SNFHDVBFNXKKCC-CQSZACIVSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@H]1O ZINC001579426747 1075617928 /nfs/dbraw/zinc/61/79/28/1075617928.db2.gz SYCGWKDYHNIXAI-NXEZZACHSA-N -1 3 382.406 -2.523 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@H]1O ZINC001579426747 1075617923 /nfs/dbraw/zinc/61/79/23/1075617923.db2.gz SYCGWKDYHNIXAI-NXEZZACHSA-N -1 3 382.406 -2.523 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001579426748 1075617838 /nfs/dbraw/zinc/61/78/38/1075617838.db2.gz SYCGWKDYHNIXAI-ZJUUUORDSA-N -1 3 382.406 -2.523 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001579426748 1075617833 /nfs/dbraw/zinc/61/78/33/1075617833.db2.gz SYCGWKDYHNIXAI-ZJUUUORDSA-N -1 3 382.406 -2.523 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H]1CCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579426778 1075618438 /nfs/dbraw/zinc/61/84/38/1075618438.db2.gz UCSPYGFVGXZQBI-SECBINFHSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H]1CCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579426778 1075618436 /nfs/dbraw/zinc/61/84/36/1075618436.db2.gz UCSPYGFVGXZQBI-SECBINFHSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1CCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579426783 1075618449 /nfs/dbraw/zinc/61/84/49/1075618449.db2.gz UCSPYGFVGXZQBI-VIFPVBQESA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1CCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579426783 1075618448 /nfs/dbraw/zinc/61/84/48/1075618448.db2.gz UCSPYGFVGXZQBI-VIFPVBQESA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H]1CCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579426833 1075618408 /nfs/dbraw/zinc/61/84/08/1075618408.db2.gz USESANRMMGZIMT-SECBINFHSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H]1CCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579426833 1075618404 /nfs/dbraw/zinc/61/84/04/1075618404.db2.gz USESANRMMGZIMT-SECBINFHSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1CCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579426835 1075618394 /nfs/dbraw/zinc/61/83/94/1075618394.db2.gz USESANRMMGZIMT-VIFPVBQESA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1CCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579426835 1075618391 /nfs/dbraw/zinc/61/83/91/1075618391.db2.gz USESANRMMGZIMT-VIFPVBQESA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H](C)N(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579426841 1075618464 /nfs/dbraw/zinc/61/84/64/1075618464.db2.gz UVWVRXBXHPCAKD-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H](C)N(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579426841 1075618461 /nfs/dbraw/zinc/61/84/61/1075618461.db2.gz UVWVRXBXHPCAKD-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H](C)N(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579426844 1075618310 /nfs/dbraw/zinc/61/83/10/1075618310.db2.gz UVWVRXBXHPCAKD-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H](C)N(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579426844 1075618307 /nfs/dbraw/zinc/61/83/07/1075618307.db2.gz UVWVRXBXHPCAKD-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)c(C)n2)C1 ZINC001579426862 1075618380 /nfs/dbraw/zinc/61/83/80/1075618380.db2.gz VEIHBFYCPGPFSB-JTQLQIEISA-N -1 3 380.434 -1.186 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)c(C)n2)C1 ZINC001579426862 1075618374 /nfs/dbraw/zinc/61/83/74/1075618374.db2.gz VEIHBFYCPGPFSB-JTQLQIEISA-N -1 3 380.434 -1.186 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)c(C)n2)C1 ZINC001579426865 1075618443 /nfs/dbraw/zinc/61/84/43/1075618443.db2.gz VEIHBFYCPGPFSB-SNVBAGLBSA-N -1 3 380.434 -1.186 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)c(C)n2)C1 ZINC001579426865 1075618442 /nfs/dbraw/zinc/61/84/42/1075618442.db2.gz VEIHBFYCPGPFSB-SNVBAGLBSA-N -1 3 380.434 -1.186 20 0 GAADHM CNS(=O)(=O)CC(=O)NCC1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579426887 1075618326 /nfs/dbraw/zinc/61/83/26/1075618326.db2.gz VTKOMNSQAJKVEJ-UHFFFAOYSA-N -1 3 382.406 -2.068 20 0 GAADHM CNS(=O)(=O)CC(=O)NCC1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579426887 1075618323 /nfs/dbraw/zinc/61/83/23/1075618323.db2.gz VTKOMNSQAJKVEJ-UHFFFAOYSA-N -1 3 382.406 -2.068 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1CCCN1c1ncccc1-c1nn[n-]n1 ZINC001579427079 1075618872 /nfs/dbraw/zinc/61/88/72/1075618872.db2.gz WKNPQKGMCHCPOI-JTQLQIEISA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H]1CCCN1c1ncccc1-c1nnn[n-]1 ZINC001579427079 1075618871 /nfs/dbraw/zinc/61/88/71/1075618871.db2.gz WKNPQKGMCHCPOI-JTQLQIEISA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H]1CCCN1c1ncccc1-c1nn[n-]n1 ZINC001579427080 1075618819 /nfs/dbraw/zinc/61/88/19/1075618819.db2.gz WKNPQKGMCHCPOI-SNVBAGLBSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H]1CCCN1c1ncccc1-c1nnn[n-]1 ZINC001579427080 1075618816 /nfs/dbraw/zinc/61/88/16/1075618816.db2.gz WKNPQKGMCHCPOI-SNVBAGLBSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@@H]2C[C@H]1CN2c1ncccc1-c1nn[n-]n1 ZINC001579427089 1075618783 /nfs/dbraw/zinc/61/87/83/1075618783.db2.gz WMTZIAOWUCMTGE-UWVGGRQHSA-N -1 3 378.418 -1.400 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@@H]2C[C@H]1CN2c1ncccc1-c1nnn[n-]1 ZINC001579427089 1075618778 /nfs/dbraw/zinc/61/87/78/1075618778.db2.gz WMTZIAOWUCMTGE-UWVGGRQHSA-N -1 3 378.418 -1.400 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H](C)N(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579427112 1075619200 /nfs/dbraw/zinc/61/92/00/1075619200.db2.gz WXUSVVYDBCSBTM-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H](C)N(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579427112 1075619196 /nfs/dbraw/zinc/61/91/96/1075619196.db2.gz WXUSVVYDBCSBTM-MRVPVSSYSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H](C)N(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579427113 1075619265 /nfs/dbraw/zinc/61/92/65/1075619265.db2.gz WXUSVVYDBCSBTM-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H](C)N(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579427113 1075619262 /nfs/dbraw/zinc/61/92/62/1075619262.db2.gz WXUSVVYDBCSBTM-QMMMGPOBSA-N -1 3 384.422 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579427147 1075619143 /nfs/dbraw/zinc/61/91/43/1075619143.db2.gz XWNLZPFGUGGVMP-MRVPVSSYSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579427147 1075619140 /nfs/dbraw/zinc/61/91/40/1075619140.db2.gz XWNLZPFGUGGVMP-MRVPVSSYSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579427148 1075619223 /nfs/dbraw/zinc/61/92/23/1075619223.db2.gz XWNLZPFGUGGVMP-QMMMGPOBSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579427148 1075619218 /nfs/dbraw/zinc/61/92/18/1075619218.db2.gz XWNLZPFGUGGVMP-QMMMGPOBSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)NCCN(c1ccc(-c2nn[n-]n2)nc1)C1CC1 ZINC001579427155 1075619482 /nfs/dbraw/zinc/61/94/82/1075619482.db2.gz YCOGSGZKYMYDCG-UHFFFAOYSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)NCCN(c1ccc(-c2nnn[n-]2)nc1)C1CC1 ZINC001579427155 1075619480 /nfs/dbraw/zinc/61/94/80/1075619480.db2.gz YCOGSGZKYMYDCG-UHFFFAOYSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579427157 1075619566 /nfs/dbraw/zinc/61/95/66/1075619566.db2.gz YEDUMAKBRDAOPW-LLVKDONJSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579427157 1075619558 /nfs/dbraw/zinc/61/95/58/1075619558.db2.gz YEDUMAKBRDAOPW-LLVKDONJSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579427158 1075619625 /nfs/dbraw/zinc/61/96/25/1075619625.db2.gz YEDUMAKBRDAOPW-NSHDSACASA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579427158 1075619621 /nfs/dbraw/zinc/61/96/21/1075619621.db2.gz YEDUMAKBRDAOPW-NSHDSACASA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001579427288 1075619513 /nfs/dbraw/zinc/61/95/13/1075619513.db2.gz ZDSKUECXOGJVOE-SECBINFHSA-N -1 3 384.397 -1.355 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001579427288 1075619510 /nfs/dbraw/zinc/61/95/10/1075619510.db2.gz ZDSKUECXOGJVOE-SECBINFHSA-N -1 3 384.397 -1.355 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001579427289 1075619593 /nfs/dbraw/zinc/61/95/93/1075619593.db2.gz ZDSKUECXOGJVOE-VIFPVBQESA-N -1 3 384.397 -1.355 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001579427289 1075619592 /nfs/dbraw/zinc/61/95/92/1075619592.db2.gz ZDSKUECXOGJVOE-VIFPVBQESA-N -1 3 384.397 -1.355 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H](C)N(C)c1ncc(-c2nn[n-]n2)cc1F ZINC001579427293 1075619901 /nfs/dbraw/zinc/61/99/01/1075619901.db2.gz ZFBHIWXXVGFWGB-MRVPVSSYSA-N -1 3 386.413 -1.109 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@@H](C)N(C)c1ncc(-c2nnn[n-]2)cc1F ZINC001579427293 1075619899 /nfs/dbraw/zinc/61/98/99/1075619899.db2.gz ZFBHIWXXVGFWGB-MRVPVSSYSA-N -1 3 386.413 -1.109 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H](C)N(C)c1ncc(-c2nn[n-]n2)cc1F ZINC001579427294 1075619933 /nfs/dbraw/zinc/61/99/33/1075619933.db2.gz ZFBHIWXXVGFWGB-QMMMGPOBSA-N -1 3 386.413 -1.109 20 0 GAADHM CNS(=O)(=O)CC(=O)NC[C@H](C)N(C)c1ncc(-c2nnn[n-]2)cc1F ZINC001579427294 1075619931 /nfs/dbraw/zinc/61/99/31/1075619931.db2.gz ZFBHIWXXVGFWGB-QMMMGPOBSA-N -1 3 386.413 -1.109 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001579427389 1075619953 /nfs/dbraw/zinc/61/99/53/1075619953.db2.gz AEWHSMXURKCPTH-JTQLQIEISA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001579427389 1075619951 /nfs/dbraw/zinc/61/99/51/1075619951.db2.gz AEWHSMXURKCPTH-JTQLQIEISA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001579427390 1075619919 /nfs/dbraw/zinc/61/99/19/1075619919.db2.gz AEWHSMXURKCPTH-SNVBAGLBSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001579427390 1075619917 /nfs/dbraw/zinc/61/99/17/1075619917.db2.gz AEWHSMXURKCPTH-SNVBAGLBSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CCC(=O)NCCN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579427421 1075620382 /nfs/dbraw/zinc/62/03/82/1075620382.db2.gz BGFHPZWZBZYVAN-UHFFFAOYSA-N -1 3 384.422 -1.678 20 0 GAADHM CNS(=O)(=O)CCC(=O)NCCN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579427421 1075620381 /nfs/dbraw/zinc/62/03/81/1075620381.db2.gz BGFHPZWZBZYVAN-UHFFFAOYSA-N -1 3 384.422 -1.678 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579427422 1075620416 /nfs/dbraw/zinc/62/04/16/1075620416.db2.gz BHVAKSIDBWNYSX-LLVKDONJSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579427422 1075620413 /nfs/dbraw/zinc/62/04/13/1075620413.db2.gz BHVAKSIDBWNYSX-LLVKDONJSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579427423 1075620373 /nfs/dbraw/zinc/62/03/73/1075620373.db2.gz BHVAKSIDBWNYSX-NSHDSACASA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579427423 1075620372 /nfs/dbraw/zinc/62/03/72/1075620372.db2.gz BHVAKSIDBWNYSX-NSHDSACASA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CCC(=O)NCCN(C)c1ncc(-c2nn[n-]n2)cc1F ZINC001579427426 1075620378 /nfs/dbraw/zinc/62/03/78/1075620378.db2.gz BKHNWCLQFJSKRD-UHFFFAOYSA-N -1 3 386.413 -1.108 20 0 GAADHM CNS(=O)(=O)CCC(=O)NCCN(C)c1ncc(-c2nnn[n-]2)cc1F ZINC001579427426 1075620377 /nfs/dbraw/zinc/62/03/77/1075620377.db2.gz BKHNWCLQFJSKRD-UHFFFAOYSA-N -1 3 386.413 -1.108 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001579427475 1075620878 /nfs/dbraw/zinc/62/08/78/1075620878.db2.gz DXJOIGOJTUXWJV-JTQLQIEISA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001579427475 1075620875 /nfs/dbraw/zinc/62/08/75/1075620875.db2.gz DXJOIGOJTUXWJV-JTQLQIEISA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CCC(=O)N(C)CCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579427494 1075620773 /nfs/dbraw/zinc/62/07/73/1075620773.db2.gz FISGCEQAVMRFSW-UHFFFAOYSA-N -1 3 384.422 -1.678 20 0 GAADHM CNS(=O)(=O)CCC(=O)N(C)CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579427494 1075620771 /nfs/dbraw/zinc/62/07/71/1075620771.db2.gz FISGCEQAVMRFSW-UHFFFAOYSA-N -1 3 384.422 -1.678 20 0 GAADHM CNS(=O)(=O)C[C@@H]1CCCN1S(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001579427495 1075620899 /nfs/dbraw/zinc/62/08/99/1075620899.db2.gz FKKQCMKOOVHJPK-JTQLQIEISA-N -1 3 387.447 -1.036 20 0 GAADHM CNS(=O)(=O)C[C@@H]1CCCN1S(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001579427495 1075620896 /nfs/dbraw/zinc/62/08/96/1075620896.db2.gz FKKQCMKOOVHJPK-JTQLQIEISA-N -1 3 387.447 -1.036 20 0 GAADHM CNS(=O)(=O)C[C@H]1CCCN1S(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001579427496 1075620815 /nfs/dbraw/zinc/62/08/15/1075620815.db2.gz FKKQCMKOOVHJPK-SNVBAGLBSA-N -1 3 387.447 -1.036 20 0 GAADHM CNS(=O)(=O)C[C@H]1CCCN1S(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001579427496 1075620813 /nfs/dbraw/zinc/62/08/13/1075620813.db2.gz FKKQCMKOOVHJPK-SNVBAGLBSA-N -1 3 387.447 -1.036 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nn[n-]n4)c(C)n3)C[C@H]21 ZINC001579427497 1075620752 /nfs/dbraw/zinc/62/07/52/1075620752.db2.gz FNMADBOETYFAQN-YABSGUDNSA-N -1 3 392.445 -1.330 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nnn[n-]4)c(C)n3)C[C@H]21 ZINC001579427497 1075620749 /nfs/dbraw/zinc/62/07/49/1075620749.db2.gz FNMADBOETYFAQN-YABSGUDNSA-N -1 3 392.445 -1.330 20 0 GAADHM CNS(=O)(=O)CCC(=O)N1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001579427560 1075621700 /nfs/dbraw/zinc/62/17/00/1075621700.db2.gz IFDFMZNWVUFRSJ-UHFFFAOYSA-N -1 3 380.434 -1.150 20 0 GAADHM CNS(=O)(=O)CCC(=O)N1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001579427560 1075621696 /nfs/dbraw/zinc/62/16/96/1075621696.db2.gz IFDFMZNWVUFRSJ-UHFFFAOYSA-N -1 3 380.434 -1.150 20 0 GAADHM CNS(=O)(=O)CCNS(=O)(=O)Cc1ccc(F)cc1-c1nn[n-]n1 ZINC001579427586 1075621688 /nfs/dbraw/zinc/62/16/88/1075621688.db2.gz JRZAUGXTGVPPBC-UHFFFAOYSA-N -1 3 378.411 -1.026 20 0 GAADHM CNS(=O)(=O)CCNS(=O)(=O)Cc1ccc(F)cc1-c1nnn[n-]1 ZINC001579427586 1075621686 /nfs/dbraw/zinc/62/16/86/1075621686.db2.gz JRZAUGXTGVPPBC-UHFFFAOYSA-N -1 3 378.411 -1.026 20 0 GAADHM CNS(=O)(=O)CCC(=O)N1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001579427592 1075621662 /nfs/dbraw/zinc/62/16/62/1075621662.db2.gz KAMZZCOIAUDFIE-UHFFFAOYSA-N -1 3 380.434 -1.150 20 0 GAADHM CNS(=O)(=O)CCC(=O)N1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001579427592 1075621660 /nfs/dbraw/zinc/62/16/60/1075621660.db2.gz KAMZZCOIAUDFIE-UHFFFAOYSA-N -1 3 380.434 -1.150 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001579427603 1075621730 /nfs/dbraw/zinc/62/17/30/1075621730.db2.gz KGSNNMPPUXQJFL-JTQLQIEISA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579427603 1075621728 /nfs/dbraw/zinc/62/17/28/1075621728.db2.gz KGSNNMPPUXQJFL-JTQLQIEISA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001579427604 1075621635 /nfs/dbraw/zinc/62/16/35/1075621635.db2.gz KGSNNMPPUXQJFL-SNVBAGLBSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579427604 1075621633 /nfs/dbraw/zinc/62/16/33/1075621633.db2.gz KGSNNMPPUXQJFL-SNVBAGLBSA-N -1 3 380.434 -1.104 20 0 GAADHM CNS(=O)(=O)CCC(=O)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001579427614 1075622173 /nfs/dbraw/zinc/62/21/73/1075622173.db2.gz KTPWQEFPMXDYGR-UHFFFAOYSA-N -1 3 380.434 -1.150 20 0 GAADHM CNS(=O)(=O)CCC(=O)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001579427614 1075622168 /nfs/dbraw/zinc/62/21/68/1075622168.db2.gz KTPWQEFPMXDYGR-UHFFFAOYSA-N -1 3 380.434 -1.150 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]21 ZINC001579427626 1075622251 /nfs/dbraw/zinc/62/22/51/1075622251.db2.gz LFIAKORUVYOKHX-YABSGUDNSA-N -1 3 392.445 -1.248 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]21 ZINC001579427626 1075622247 /nfs/dbraw/zinc/62/22/47/1075622247.db2.gz LFIAKORUVYOKHX-YABSGUDNSA-N -1 3 392.445 -1.248 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(c2ncccc2-c2nn[n-]n2)[C@@H]1C ZINC001579427635 1075622109 /nfs/dbraw/zinc/62/21/09/1075622109.db2.gz LKOOIVZVVHGJFX-KOLCDFICSA-N -1 3 380.434 -1.106 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(c2ncccc2-c2nnn[n-]2)[C@@H]1C ZINC001579427635 1075622106 /nfs/dbraw/zinc/62/21/06/1075622106.db2.gz LKOOIVZVVHGJFX-KOLCDFICSA-N -1 3 380.434 -1.106 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]21 ZINC001579427648 1075622261 /nfs/dbraw/zinc/62/22/61/1075622261.db2.gz MIZWPLQNBGYYNK-IWIIMEHWSA-N -1 3 378.418 -1.638 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]21 ZINC001579427648 1075622258 /nfs/dbraw/zinc/62/22/58/1075622258.db2.gz MIZWPLQNBGYYNK-IWIIMEHWSA-N -1 3 378.418 -1.638 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]21 ZINC001579427660 1075622192 /nfs/dbraw/zinc/62/21/92/1075622192.db2.gz MYLMUVPZUILBIC-YABSGUDNSA-N -1 3 392.445 -1.248 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@H]21 ZINC001579427660 1075622187 /nfs/dbraw/zinc/62/21/87/1075622187.db2.gz MYLMUVPZUILBIC-YABSGUDNSA-N -1 3 392.445 -1.248 20 0 GAADHM CNS(=O)(=O)CCC(=O)NC1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579427737 1075622437 /nfs/dbraw/zinc/62/24/37/1075622437.db2.gz OJGYBYJWGVGXHZ-UHFFFAOYSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CCC(=O)NC1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579427737 1075622435 /nfs/dbraw/zinc/62/24/35/1075622435.db2.gz OJGYBYJWGVGXHZ-UHFFFAOYSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)[C@@H]1C ZINC001579427743 1075622478 /nfs/dbraw/zinc/62/24/78/1075622478.db2.gz ONHQVSNTFKEIGH-KOLCDFICSA-N -1 3 380.434 -1.106 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)[C@@H]1C ZINC001579427743 1075622474 /nfs/dbraw/zinc/62/24/74/1075622474.db2.gz ONHQVSNTFKEIGH-KOLCDFICSA-N -1 3 380.434 -1.106 20 0 GAADHM CNS(=O)(=O)CCC(=O)NC1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579427744 1075622468 /nfs/dbraw/zinc/62/24/68/1075622468.db2.gz OQIXXVXHHRGFKK-UHFFFAOYSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CCC(=O)NC1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579427744 1075622465 /nfs/dbraw/zinc/62/24/65/1075622465.db2.gz OQIXXVXHHRGFKK-UHFFFAOYSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CCC(=O)N(C)CCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579427774 1075622870 /nfs/dbraw/zinc/62/28/70/1075622870.db2.gz PLUIONSZOLFERP-UHFFFAOYSA-N -1 3 384.422 -1.678 20 0 GAADHM CNS(=O)(=O)CCC(=O)N(C)CCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579427774 1075622869 /nfs/dbraw/zinc/62/28/69/1075622869.db2.gz PLUIONSZOLFERP-UHFFFAOYSA-N -1 3 384.422 -1.678 20 0 GAADHM CNS(=O)(=O)CCC(=O)NCCN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579427789 1075622865 /nfs/dbraw/zinc/62/28/65/1075622865.db2.gz QIDAXKUDPBJOEV-UHFFFAOYSA-N -1 3 384.422 -1.678 20 0 GAADHM CNS(=O)(=O)CCC(=O)NCCN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579427789 1075622864 /nfs/dbraw/zinc/62/28/64/1075622864.db2.gz QIDAXKUDPBJOEV-UHFFFAOYSA-N -1 3 384.422 -1.678 20 0 GAADHM CNS(=O)(=O)CCC(=O)N1CC(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579427825 1075623345 /nfs/dbraw/zinc/62/33/45/1075623345.db2.gz RQFSBIIRPBGEKQ-UHFFFAOYSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CCC(=O)N1CC(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579427825 1075623343 /nfs/dbraw/zinc/62/33/43/1075623343.db2.gz RQFSBIIRPBGEKQ-UHFFFAOYSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CCC(=O)N1CC(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579427922 1075623834 /nfs/dbraw/zinc/62/38/34/1075623834.db2.gz VDSMCPOXWMVZKD-UHFFFAOYSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CCC(=O)N1CC(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579427922 1075623831 /nfs/dbraw/zinc/62/38/31/1075623831.db2.gz VDSMCPOXWMVZKD-UHFFFAOYSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]21 ZINC001579427942 1075623725 /nfs/dbraw/zinc/62/37/25/1075623725.db2.gz WIQNCOIVRAJERN-IWIIMEHWSA-N -1 3 378.418 -1.638 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@H]21 ZINC001579427942 1075623721 /nfs/dbraw/zinc/62/37/21/1075623721.db2.gz WIQNCOIVRAJERN-IWIIMEHWSA-N -1 3 378.418 -1.638 20 0 GAADHM CNS(=O)(=O)CCC(=O)N1CC(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579427950 1075623772 /nfs/dbraw/zinc/62/37/72/1075623772.db2.gz WURACKHOLYIGKD-UHFFFAOYSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CCC(=O)N1CC(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579427950 1075623770 /nfs/dbraw/zinc/62/37/70/1075623770.db2.gz WURACKHOLYIGKD-UHFFFAOYSA-N -1 3 382.406 -1.925 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1[C@H]2CN(c3nc(C)ccc3-c3nn[n-]n3)C[C@H]21 ZINC001579427974 1075624050 /nfs/dbraw/zinc/62/40/50/1075624050.db2.gz WYBXFTJAMOYUJA-PJXYFTJBSA-N -1 3 392.445 -1.330 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1[C@H]2CN(c3nc(C)ccc3-c3nnn[n-]3)C[C@H]21 ZINC001579427974 1075624047 /nfs/dbraw/zinc/62/40/47/1075624047.db2.gz WYBXFTJAMOYUJA-PJXYFTJBSA-N -1 3 392.445 -1.330 20 0 GAADHM CNS(=O)(=O)CCC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nn[n-]n2)cn1 ZINC001579427994 1075624041 /nfs/dbraw/zinc/62/40/41/1075624041.db2.gz XMWJCWJOVFODHX-RYUDHWBXSA-N -1 3 392.445 -1.010 20 0 GAADHM CNS(=O)(=O)CCC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nnn[n-]2)cn1 ZINC001579427994 1075624039 /nfs/dbraw/zinc/62/40/39/1075624039.db2.gz XMWJCWJOVFODHX-RYUDHWBXSA-N -1 3 392.445 -1.010 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@@H]1[C@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]21 ZINC001579428003 1075624179 /nfs/dbraw/zinc/62/41/79/1075624179.db2.gz YDEMXTCTRNDEAF-PJXYFTJBSA-N -1 3 392.445 -1.248 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@@H]1[C@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]21 ZINC001579428003 1075624177 /nfs/dbraw/zinc/62/41/77/1075624177.db2.gz YDEMXTCTRNDEAF-PJXYFTJBSA-N -1 3 392.445 -1.248 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1[C@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]21 ZINC001579428037 1075624545 /nfs/dbraw/zinc/62/45/45/1075624545.db2.gz YSWYTQYWHFHIMF-IAZYJMLFSA-N -1 3 378.418 -1.638 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1[C@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]21 ZINC001579428037 1075624544 /nfs/dbraw/zinc/62/45/44/1075624544.db2.gz YSWYTQYWHFHIMF-IAZYJMLFSA-N -1 3 378.418 -1.638 20 0 GAADHM CNS(=O)(=O)CCC(=O)NCCN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579428048 1075624540 /nfs/dbraw/zinc/62/45/40/1075624540.db2.gz ZDSKVAVOVCDTFI-UHFFFAOYSA-N -1 3 384.422 -1.678 20 0 GAADHM CNS(=O)(=O)CCC(=O)NCCN(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579428048 1075624539 /nfs/dbraw/zinc/62/45/39/1075624539.db2.gz ZDSKVAVOVCDTFI-UHFFFAOYSA-N -1 3 384.422 -1.678 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001579428077 1075624526 /nfs/dbraw/zinc/62/45/26/1075624526.db2.gz AQTPPDWTVIETKB-UHFFFAOYSA-N -1 3 381.422 -2.036 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001579428077 1075624524 /nfs/dbraw/zinc/62/45/24/1075624524.db2.gz AQTPPDWTVIETKB-UHFFFAOYSA-N -1 3 381.422 -2.036 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)CCNc1ncc(-c2nn[n-]n2)cc1F ZINC001579428084 1075624561 /nfs/dbraw/zinc/62/45/61/1075624561.db2.gz AWXHJHGGFQXMGW-UHFFFAOYSA-N -1 3 387.401 -1.675 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)CCNc1ncc(-c2nnn[n-]2)cc1F ZINC001579428084 1075624560 /nfs/dbraw/zinc/62/45/60/1075624560.db2.gz AWXHJHGGFQXMGW-UHFFFAOYSA-N -1 3 387.401 -1.675 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@@H](C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001579428086 1075624601 /nfs/dbraw/zinc/62/46/01/1075624601.db2.gz BACBQLUAVHQQEV-BDAKNGLRSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@@H](C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001579428086 1075624598 /nfs/dbraw/zinc/62/45/98/1075624598.db2.gz BACBQLUAVHQQEV-BDAKNGLRSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)[C@H](C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001579428087 1075624582 /nfs/dbraw/zinc/62/45/82/1075624582.db2.gz BACBQLUAVHQQEV-DTWKUNHWSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)[C@H](C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001579428087 1075624580 /nfs/dbraw/zinc/62/45/80/1075624580.db2.gz BACBQLUAVHQQEV-DTWKUNHWSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@H](C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001579428088 1075624566 /nfs/dbraw/zinc/62/45/66/1075624566.db2.gz BACBQLUAVHQQEV-IUCAKERBSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@H](C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001579428088 1075624564 /nfs/dbraw/zinc/62/45/64/1075624564.db2.gz BACBQLUAVHQQEV-IUCAKERBSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)[C@@H](C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001579428089 1075624578 /nfs/dbraw/zinc/62/45/78/1075624578.db2.gz BACBQLUAVHQQEV-RKDXNWHRSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)[C@@H](C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001579428089 1075624576 /nfs/dbraw/zinc/62/45/76/1075624576.db2.gz BACBQLUAVHQQEV-RKDXNWHRSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1C[C@@H](Nc2ncccc2-c2nn[n-]n2)C1 ZINC001579428092 1075624556 /nfs/dbraw/zinc/62/45/56/1075624556.db2.gz BGOPESRRNGIHHU-DTORHVGOSA-N -1 3 381.422 -1.625 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1C[C@@H](Nc2ncccc2-c2nnn[n-]2)C1 ZINC001579428092 1075624553 /nfs/dbraw/zinc/62/45/53/1075624553.db2.gz BGOPESRRNGIHHU-DTORHVGOSA-N -1 3 381.422 -1.625 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1C[C@H](Nc2ncccc2-c2nn[n-]n2)C1 ZINC001579428093 1075624550 /nfs/dbraw/zinc/62/45/50/1075624550.db2.gz BGOPESRRNGIHHU-KYZUINATSA-N -1 3 381.422 -1.625 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1C[C@H](Nc2ncccc2-c2nnn[n-]2)C1 ZINC001579428093 1075624548 /nfs/dbraw/zinc/62/45/48/1075624548.db2.gz BGOPESRRNGIHHU-KYZUINATSA-N -1 3 381.422 -1.625 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)[C@H](C)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001579428099 1075624595 /nfs/dbraw/zinc/62/45/95/1075624595.db2.gz BQACZEFNUSAESH-SECBINFHSA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)[C@H](C)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001579428099 1075624594 /nfs/dbraw/zinc/62/45/94/1075624594.db2.gz BQACZEFNUSAESH-SECBINFHSA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)[C@@H](C)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001579428100 1075624614 /nfs/dbraw/zinc/62/46/14/1075624614.db2.gz BQACZEFNUSAESH-VIFPVBQESA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)[C@@H](C)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001579428100 1075624612 /nfs/dbraw/zinc/62/46/12/1075624612.db2.gz BQACZEFNUSAESH-VIFPVBQESA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)CNc1cccc(F)c1-c1nn[n-]n1 ZINC001579428104 1075624572 /nfs/dbraw/zinc/62/45/72/1075624572.db2.gz BRXARLSZYIUQBF-MRVPVSSYSA-N -1 3 386.413 -1.024 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)CNc1cccc(F)c1-c1nnn[n-]1 ZINC001579428104 1075624570 /nfs/dbraw/zinc/62/45/70/1075624570.db2.gz BRXARLSZYIUQBF-MRVPVSSYSA-N -1 3 386.413 -1.024 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)CNc1cccc(F)c1-c1nn[n-]n1 ZINC001579428105 1075624605 /nfs/dbraw/zinc/62/46/05/1075624605.db2.gz BRXARLSZYIUQBF-QMMMGPOBSA-N -1 3 386.413 -1.024 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)CNc1cccc(F)c1-c1nnn[n-]1 ZINC001579428105 1075624604 /nfs/dbraw/zinc/62/46/04/1075624604.db2.gz BRXARLSZYIUQBF-QMMMGPOBSA-N -1 3 386.413 -1.024 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)CNc1ccc(-c2nn[n-]n2)c(C)n1 ZINC001579428106 1075624989 /nfs/dbraw/zinc/62/49/89/1075624989.db2.gz BRZWHDLXUJXEDQ-MRVPVSSYSA-N -1 3 383.438 -1.459 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)CNc1ccc(-c2nnn[n-]2)c(C)n1 ZINC001579428106 1075624986 /nfs/dbraw/zinc/62/49/86/1075624986.db2.gz BRZWHDLXUJXEDQ-MRVPVSSYSA-N -1 3 383.438 -1.459 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)CNc1ccc(-c2nn[n-]n2)c(C)n1 ZINC001579428107 1075624964 /nfs/dbraw/zinc/62/49/64/1075624964.db2.gz BRZWHDLXUJXEDQ-QMMMGPOBSA-N -1 3 383.438 -1.459 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)CNc1ccc(-c2nnn[n-]2)c(C)n1 ZINC001579428107 1075624961 /nfs/dbraw/zinc/62/49/61/1075624961.db2.gz BRZWHDLXUJXEDQ-QMMMGPOBSA-N -1 3 383.438 -1.459 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)N(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001579428122 1075625075 /nfs/dbraw/zinc/62/50/75/1075625075.db2.gz CJYQDIAAOSRZSH-SECBINFHSA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)N(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001579428122 1075625071 /nfs/dbraw/zinc/62/50/71/1075625071.db2.gz CJYQDIAAOSRZSH-SECBINFHSA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)N(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001579428123 1075625044 /nfs/dbraw/zinc/62/50/44/1075625044.db2.gz CJYQDIAAOSRZSH-VIFPVBQESA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)N(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001579428123 1075625041 /nfs/dbraw/zinc/62/50/41/1075625041.db2.gz CJYQDIAAOSRZSH-VIFPVBQESA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCN(C)Cc1ccc(-c2nnn[n-]2)s1 ZINC001579428124 1075624947 /nfs/dbraw/zinc/62/49/47/1075624947.db2.gz CKAUKSCVDGCZID-UHFFFAOYSA-N -1 3 388.479 -1.470 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579428140 1075624996 /nfs/dbraw/zinc/62/49/96/1075624996.db2.gz DPEBDQZODCHZKP-MGCOHNPYSA-N -1 3 381.422 -1.625 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1C[C@H](Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579428140 1075624994 /nfs/dbraw/zinc/62/49/94/1075624994.db2.gz DPEBDQZODCHZKP-MGCOHNPYSA-N -1 3 381.422 -1.625 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)[C@H](C)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001579428150 1075624937 /nfs/dbraw/zinc/62/49/37/1075624937.db2.gz FFSADZGNIVQWRM-SECBINFHSA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)[C@H](C)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001579428150 1075624933 /nfs/dbraw/zinc/62/49/33/1075624933.db2.gz FFSADZGNIVQWRM-SECBINFHSA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)[C@@H](C)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001579428151 1075625026 /nfs/dbraw/zinc/62/50/26/1075625026.db2.gz FFSADZGNIVQWRM-VIFPVBQESA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)[C@@H](C)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001579428151 1075625024 /nfs/dbraw/zinc/62/50/24/1075625024.db2.gz FFSADZGNIVQWRM-VIFPVBQESA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001579428154 1075624979 /nfs/dbraw/zinc/62/49/79/1075624979.db2.gz FGWHVXHHHKKMLT-UHFFFAOYSA-N -1 3 381.422 -2.036 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001579428154 1075624976 /nfs/dbraw/zinc/62/49/76/1075624976.db2.gz FGWHVXHHHKKMLT-UHFFFAOYSA-N -1 3 381.422 -2.036 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCN(C)c1snc(C)c1-c1nnn[n-]1 ZINC001579428157 1075625038 /nfs/dbraw/zinc/62/50/38/1075625038.db2.gz FKLVHHKQJAUHJC-UHFFFAOYSA-N -1 3 389.467 -1.762 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CC[C@H](Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579428172 1075625012 /nfs/dbraw/zinc/62/50/12/1075625012.db2.gz GCGLBNGKUQGMQC-JTQLQIEISA-N -1 3 381.422 -1.672 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CC[C@H](Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579428172 1075625010 /nfs/dbraw/zinc/62/50/10/1075625010.db2.gz GCGLBNGKUQGMQC-JTQLQIEISA-N -1 3 381.422 -1.672 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CC[C@@H](Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579428173 1075625096 /nfs/dbraw/zinc/62/50/96/1075625096.db2.gz GCGLBNGKUQGMQC-SNVBAGLBSA-N -1 3 381.422 -1.672 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CC[C@@H](Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579428173 1075625093 /nfs/dbraw/zinc/62/50/93/1075625093.db2.gz GCGLBNGKUQGMQC-SNVBAGLBSA-N -1 3 381.422 -1.672 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001579428179 1075625400 /nfs/dbraw/zinc/62/54/00/1075625400.db2.gz GOMXLDIVDOPWDD-SECBINFHSA-N -1 3 381.422 -1.990 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001579428179 1075625397 /nfs/dbraw/zinc/62/53/97/1075625397.db2.gz GOMXLDIVDOPWDD-SECBINFHSA-N -1 3 381.422 -1.990 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001579428180 1075625415 /nfs/dbraw/zinc/62/54/15/1075625415.db2.gz GOMXLDIVDOPWDD-VIFPVBQESA-N -1 3 381.422 -1.990 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001579428180 1075625410 /nfs/dbraw/zinc/62/54/10/1075625410.db2.gz GOMXLDIVDOPWDD-VIFPVBQESA-N -1 3 381.422 -1.990 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)CCNc1ncccc1-c1nn[n-]n1 ZINC001579428183 1075625486 /nfs/dbraw/zinc/62/54/86/1075625486.db2.gz GPSPFWGHAFOAEI-SECBINFHSA-N -1 3 383.438 -1.378 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)CCNc1ncccc1-c1nnn[n-]1 ZINC001579428183 1075625481 /nfs/dbraw/zinc/62/54/81/1075625481.db2.gz GPSPFWGHAFOAEI-SECBINFHSA-N -1 3 383.438 -1.378 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)CCNc1ncccc1-c1nn[n-]n1 ZINC001579428184 1075625265 /nfs/dbraw/zinc/62/52/65/1075625265.db2.gz GPSPFWGHAFOAEI-VIFPVBQESA-N -1 3 383.438 -1.378 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)CCNc1ncccc1-c1nnn[n-]1 ZINC001579428184 1075625260 /nfs/dbraw/zinc/62/52/60/1075625260.db2.gz GPSPFWGHAFOAEI-VIFPVBQESA-N -1 3 383.438 -1.378 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)CN(C)c1ccc(-c2nn[n-]n2)nc1 ZINC001579428189 1075625388 /nfs/dbraw/zinc/62/53/88/1075625388.db2.gz HAPMBMKYUSRMGC-SECBINFHSA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)CN(C)c1ccc(-c2nnn[n-]2)nc1 ZINC001579428189 1075625385 /nfs/dbraw/zinc/62/53/85/1075625385.db2.gz HAPMBMKYUSRMGC-SECBINFHSA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)CN(C)c1ccc(-c2nn[n-]n2)nc1 ZINC001579428190 1075625302 /nfs/dbraw/zinc/62/53/02/1075625302.db2.gz HAPMBMKYUSRMGC-VIFPVBQESA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)CN(C)c1ccc(-c2nnn[n-]2)nc1 ZINC001579428190 1075625299 /nfs/dbraw/zinc/62/52/99/1075625299.db2.gz HAPMBMKYUSRMGC-VIFPVBQESA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)Nc1cc(-c2nn[n-]n2)ccc1OCCOC ZINC001579428204 1075625435 /nfs/dbraw/zinc/62/54/35/1075625435.db2.gz HQQLXIXYKMYECM-UHFFFAOYSA-N -1 3 385.406 -1.116 20 0 GAADHM CNS(=O)(=O)NCC(=O)Nc1cc(-c2nnn[n-]2)ccc1OCCOC ZINC001579428204 1075625431 /nfs/dbraw/zinc/62/54/31/1075625431.db2.gz HQQLXIXYKMYECM-UHFFFAOYSA-N -1 3 385.406 -1.116 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579428209 1075625375 /nfs/dbraw/zinc/62/53/75/1075625375.db2.gz HVMWONPWQYDRSR-JTQLQIEISA-N -1 3 381.422 -1.990 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579428209 1075625370 /nfs/dbraw/zinc/62/53/70/1075625370.db2.gz HVMWONPWQYDRSR-JTQLQIEISA-N -1 3 381.422 -1.990 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579428210 1075625319 /nfs/dbraw/zinc/62/53/19/1075625319.db2.gz HVMWONPWQYDRSR-SNVBAGLBSA-N -1 3 381.422 -1.990 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579428210 1075625314 /nfs/dbraw/zinc/62/53/14/1075625314.db2.gz HVMWONPWQYDRSR-SNVBAGLBSA-N -1 3 381.422 -1.990 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)Nc1nc(C)ccc1-c1nn[n-]n1 ZINC001579428220 1075625450 /nfs/dbraw/zinc/62/54/50/1075625450.db2.gz IGOAXGCAAVOVFW-SECBINFHSA-N -1 3 383.438 -1.459 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)Nc1nc(C)ccc1-c1nnn[n-]1 ZINC001579428220 1075625446 /nfs/dbraw/zinc/62/54/46/1075625446.db2.gz IGOAXGCAAVOVFW-SECBINFHSA-N -1 3 383.438 -1.459 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)Nc1nc(C)ccc1-c1nn[n-]n1 ZINC001579428221 1075625289 /nfs/dbraw/zinc/62/52/89/1075625289.db2.gz IGOAXGCAAVOVFW-VIFPVBQESA-N -1 3 383.438 -1.459 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)Nc1nc(C)ccc1-c1nnn[n-]1 ZINC001579428221 1075625284 /nfs/dbraw/zinc/62/52/84/1075625284.db2.gz IGOAXGCAAVOVFW-VIFPVBQESA-N -1 3 383.438 -1.459 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)CCN(C)c1ccc(-c2nn[n-]n2)nc1 ZINC001579428233 1075623825 /nfs/dbraw/zinc/62/38/25/1075623825.db2.gz IXJMYXNNTGUOSL-UHFFFAOYSA-N -1 3 383.438 -1.790 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)CCN(C)c1ccc(-c2nnn[n-]2)nc1 ZINC001579428233 1075623823 /nfs/dbraw/zinc/62/38/23/1075623823.db2.gz IXJMYXNNTGUOSL-UHFFFAOYSA-N -1 3 383.438 -1.790 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)Nc1cccc(F)c1-c1nn[n-]n1 ZINC001579428234 1075625816 /nfs/dbraw/zinc/62/58/16/1075625816.db2.gz JATPEMJXEKVIPT-MRVPVSSYSA-N -1 3 386.413 -1.024 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)Nc1cccc(F)c1-c1nnn[n-]1 ZINC001579428234 1075625814 /nfs/dbraw/zinc/62/58/14/1075625814.db2.gz JATPEMJXEKVIPT-MRVPVSSYSA-N -1 3 386.413 -1.024 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)Nc1cccc(F)c1-c1nn[n-]n1 ZINC001579428235 1075625730 /nfs/dbraw/zinc/62/57/30/1075625730.db2.gz JATPEMJXEKVIPT-QMMMGPOBSA-N -1 3 386.413 -1.024 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)Nc1cccc(F)c1-c1nnn[n-]1 ZINC001579428235 1075625727 /nfs/dbraw/zinc/62/57/27/1075625727.db2.gz JATPEMJXEKVIPT-QMMMGPOBSA-N -1 3 386.413 -1.024 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)CN(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001579428252 1075625757 /nfs/dbraw/zinc/62/57/57/1075625757.db2.gz JVEPZEHKUUDVJE-SECBINFHSA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)CN(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001579428252 1075625755 /nfs/dbraw/zinc/62/57/55/1075625755.db2.gz JVEPZEHKUUDVJE-SECBINFHSA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)CN(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001579428253 1075625744 /nfs/dbraw/zinc/62/57/44/1075625744.db2.gz JVEPZEHKUUDVJE-VIFPVBQESA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)CN(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001579428253 1075625741 /nfs/dbraw/zinc/62/57/41/1075625741.db2.gz JVEPZEHKUUDVJE-VIFPVBQESA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)CCN(C)c1ncccc1-c1nn[n-]n1 ZINC001579428262 1075625807 /nfs/dbraw/zinc/62/58/07/1075625807.db2.gz KCXFBFBEUVYIEQ-UHFFFAOYSA-N -1 3 383.438 -1.790 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)CCN(C)c1ncccc1-c1nnn[n-]1 ZINC001579428262 1075625805 /nfs/dbraw/zinc/62/58/05/1075625805.db2.gz KCXFBFBEUVYIEQ-UHFFFAOYSA-N -1 3 383.438 -1.790 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)CNc1nc(C)ccc1-c1nn[n-]n1 ZINC001579428264 1075625685 /nfs/dbraw/zinc/62/56/85/1075625685.db2.gz KEYCVSGWZBCOML-SECBINFHSA-N -1 3 383.438 -1.459 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)CNc1nc(C)ccc1-c1nnn[n-]1 ZINC001579428264 1075625684 /nfs/dbraw/zinc/62/56/84/1075625684.db2.gz KEYCVSGWZBCOML-SECBINFHSA-N -1 3 383.438 -1.459 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)CNc1nc(C)ccc1-c1nn[n-]n1 ZINC001579428265 1075625860 /nfs/dbraw/zinc/62/58/60/1075625860.db2.gz KEYCVSGWZBCOML-VIFPVBQESA-N -1 3 383.438 -1.459 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)CNc1nc(C)ccc1-c1nnn[n-]1 ZINC001579428265 1075625857 /nfs/dbraw/zinc/62/58/57/1075625857.db2.gz KEYCVSGWZBCOML-VIFPVBQESA-N -1 3 383.438 -1.459 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CC[C@H](Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001579428268 1075625840 /nfs/dbraw/zinc/62/58/40/1075625840.db2.gz KLSOCFYPNWQZCY-JTQLQIEISA-N -1 3 381.422 -1.672 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CC[C@H](Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579428268 1075625839 /nfs/dbraw/zinc/62/58/39/1075625839.db2.gz KLSOCFYPNWQZCY-JTQLQIEISA-N -1 3 381.422 -1.672 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CC[C@@H](Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001579428269 1075625826 /nfs/dbraw/zinc/62/58/26/1075625826.db2.gz KLSOCFYPNWQZCY-SNVBAGLBSA-N -1 3 381.422 -1.672 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CC[C@@H](Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579428269 1075625824 /nfs/dbraw/zinc/62/58/24/1075625824.db2.gz KLSOCFYPNWQZCY-SNVBAGLBSA-N -1 3 381.422 -1.672 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCN(C)c1ncc(-c2nn[n-]n2)cc1F ZINC001579428270 1075625834 /nfs/dbraw/zinc/62/58/34/1075625834.db2.gz KMXXXXLPBFFJFK-UHFFFAOYSA-N -1 3 387.401 -1.993 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCN(C)c1ncc(-c2nnn[n-]2)cc1F ZINC001579428270 1075625832 /nfs/dbraw/zinc/62/58/32/1075625832.db2.gz KMXXXXLPBFFJFK-UHFFFAOYSA-N -1 3 387.401 -1.993 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)CCN(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001579428376 1075625715 /nfs/dbraw/zinc/62/57/15/1075625715.db2.gz KTMVSAXWINYWQR-UHFFFAOYSA-N -1 3 383.438 -1.790 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)CCN(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001579428376 1075625711 /nfs/dbraw/zinc/62/57/11/1075625711.db2.gz KTMVSAXWINYWQR-UHFFFAOYSA-N -1 3 383.438 -1.790 20 0 GAADHM CNS(=O)(=O)N1CCN([C@@H](C(N)=O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001579428396 1075625779 /nfs/dbraw/zinc/62/57/79/1075625779.db2.gz LLGAPZZMNVRLEL-GFCCVEGCSA-N -1 3 380.434 -1.525 20 0 GAADHM CNS(=O)(=O)N1CCN([C@@H](C(N)=O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001579428396 1075625774 /nfs/dbraw/zinc/62/57/74/1075625774.db2.gz LLGAPZZMNVRLEL-GFCCVEGCSA-N -1 3 380.434 -1.525 20 0 GAADHM CNS(=O)(=O)N1CCN([C@H](C(N)=O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001579428398 1075625799 /nfs/dbraw/zinc/62/57/99/1075625799.db2.gz LLGAPZZMNVRLEL-LBPRGKRZSA-N -1 3 380.434 -1.525 20 0 GAADHM CNS(=O)(=O)N1CCN([C@H](C(N)=O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001579428398 1075625796 /nfs/dbraw/zinc/62/57/96/1075625796.db2.gz LLGAPZZMNVRLEL-LBPRGKRZSA-N -1 3 380.434 -1.525 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC1(Nc2ncccc2-c2nn[n-]n2)CC1 ZINC001579428400 1075625846 /nfs/dbraw/zinc/62/58/46/1075625846.db2.gz LLIMSUCDBNBVRT-UHFFFAOYSA-N -1 3 381.422 -1.624 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC1(Nc2ncccc2-c2nnn[n-]2)CC1 ZINC001579428400 1075625844 /nfs/dbraw/zinc/62/58/44/1075625844.db2.gz LLIMSUCDBNBVRT-UHFFFAOYSA-N -1 3 381.422 -1.624 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001579428416 1075626246 /nfs/dbraw/zinc/62/62/46/1075626246.db2.gz LXQQWRFZKSRRST-SECBINFHSA-N -1 3 381.422 -1.990 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579428416 1075626245 /nfs/dbraw/zinc/62/62/45/1075626245.db2.gz LXQQWRFZKSRRST-SECBINFHSA-N -1 3 381.422 -1.990 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001579428418 1075626214 /nfs/dbraw/zinc/62/62/14/1075626214.db2.gz LXQQWRFZKSRRST-VIFPVBQESA-N -1 3 381.422 -1.990 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579428418 1075626210 /nfs/dbraw/zinc/62/62/10/1075626210.db2.gz LXQQWRFZKSRRST-VIFPVBQESA-N -1 3 381.422 -1.990 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)C[C@@H](C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001579428430 1075626169 /nfs/dbraw/zinc/62/61/69/1075626169.db2.gz MGGYLCOIGKHXAZ-SECBINFHSA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)C[C@@H](C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001579428430 1075626167 /nfs/dbraw/zinc/62/61/67/1075626167.db2.gz MGGYLCOIGKHXAZ-SECBINFHSA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)C[C@H](C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001579428431 1075626264 /nfs/dbraw/zinc/62/62/64/1075626264.db2.gz MGGYLCOIGKHXAZ-VIFPVBQESA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)C[C@H](C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001579428431 1075626262 /nfs/dbraw/zinc/62/62/62/1075626262.db2.gz MGGYLCOIGKHXAZ-VIFPVBQESA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001579428454 1075626256 /nfs/dbraw/zinc/62/62/56/1075626256.db2.gz MPMGYDGUVPUXEO-SECBINFHSA-N -1 3 383.438 -1.520 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001579428454 1075626253 /nfs/dbraw/zinc/62/62/53/1075626253.db2.gz MPMGYDGUVPUXEO-SECBINFHSA-N -1 3 383.438 -1.520 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001579428456 1075626193 /nfs/dbraw/zinc/62/61/93/1075626193.db2.gz MPMGYDGUVPUXEO-VIFPVBQESA-N -1 3 383.438 -1.520 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001579428456 1075626190 /nfs/dbraw/zinc/62/61/90/1075626190.db2.gz MPMGYDGUVPUXEO-VIFPVBQESA-N -1 3 383.438 -1.520 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)CNc1ncc(-c2nn[n-]n2)cc1F ZINC001579428461 1075626083 /nfs/dbraw/zinc/62/60/83/1075626083.db2.gz MSVNKRDNAKRLDR-SSDOTTSWSA-N -1 3 387.401 -1.629 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)CNc1ncc(-c2nnn[n-]2)cc1F ZINC001579428461 1075626079 /nfs/dbraw/zinc/62/60/79/1075626079.db2.gz MSVNKRDNAKRLDR-SSDOTTSWSA-N -1 3 387.401 -1.629 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)CNc1ncc(-c2nn[n-]n2)cc1F ZINC001579428462 1075626279 /nfs/dbraw/zinc/62/62/79/1075626279.db2.gz MSVNKRDNAKRLDR-ZETCQYMHSA-N -1 3 387.401 -1.629 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)CNc1ncc(-c2nnn[n-]2)cc1F ZINC001579428462 1075626276 /nfs/dbraw/zinc/62/62/76/1075626276.db2.gz MSVNKRDNAKRLDR-ZETCQYMHSA-N -1 3 387.401 -1.629 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)CCNc1ccc(-c2nn[n-]n2)c(C)n1 ZINC001579428468 1075626224 /nfs/dbraw/zinc/62/62/24/1075626224.db2.gz MXFAEGSHNBPOSO-UHFFFAOYSA-N -1 3 383.438 -1.506 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)CCNc1ccc(-c2nnn[n-]2)c(C)n1 ZINC001579428468 1075626220 /nfs/dbraw/zinc/62/62/20/1075626220.db2.gz MXFAEGSHNBPOSO-UHFFFAOYSA-N -1 3 383.438 -1.506 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCN(C)c1nc(C)ccc1-c1nn[n-]n1 ZINC001579428523 1075626270 /nfs/dbraw/zinc/62/62/70/1075626270.db2.gz OGVPFHYQNGFJAF-UHFFFAOYSA-N -1 3 383.438 -1.824 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCN(C)c1nc(C)ccc1-c1nnn[n-]1 ZINC001579428523 1075626268 /nfs/dbraw/zinc/62/62/68/1075626268.db2.gz OGVPFHYQNGFJAF-UHFFFAOYSA-N -1 3 383.438 -1.824 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCCNc1snc(C)c1-c1nnn[n-]1 ZINC001579428533 1075626180 /nfs/dbraw/zinc/62/61/80/1075626180.db2.gz OMWIYBIEHZKWTA-UHFFFAOYSA-N -1 3 389.467 -1.396 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC[C@@H](C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001579428579 1075626650 /nfs/dbraw/zinc/62/66/50/1075626650.db2.gz PWKXYTDRFXEGLZ-SECBINFHSA-N -1 3 383.438 -1.378 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC[C@@H](C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001579428579 1075626646 /nfs/dbraw/zinc/62/66/46/1075626646.db2.gz PWKXYTDRFXEGLZ-SECBINFHSA-N -1 3 383.438 -1.378 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC[C@H](C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001579428580 1075626622 /nfs/dbraw/zinc/62/66/22/1075626622.db2.gz PWKXYTDRFXEGLZ-VIFPVBQESA-N -1 3 383.438 -1.378 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC[C@H](C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001579428580 1075626617 /nfs/dbraw/zinc/62/66/17/1075626617.db2.gz PWKXYTDRFXEGLZ-VIFPVBQESA-N -1 3 383.438 -1.378 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)CCNc1snc(C)c1-c1nnn[n-]1 ZINC001579428586 1075626536 /nfs/dbraw/zinc/62/65/36/1075626536.db2.gz QBVWPDGDEVKTAX-UHFFFAOYSA-N -1 3 389.467 -1.444 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CC[C@@H](Nc2ncccc2-c2nn[n-]n2)C1 ZINC001579428587 1075626598 /nfs/dbraw/zinc/62/65/98/1075626598.db2.gz QCOGLVTYUXSNJD-SECBINFHSA-N -1 3 381.422 -1.672 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CC[C@@H](Nc2ncccc2-c2nnn[n-]2)C1 ZINC001579428587 1075626596 /nfs/dbraw/zinc/62/65/96/1075626596.db2.gz QCOGLVTYUXSNJD-SECBINFHSA-N -1 3 381.422 -1.672 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CC[C@H](Nc2ncccc2-c2nn[n-]n2)C1 ZINC001579428588 1075626699 /nfs/dbraw/zinc/62/66/99/1075626699.db2.gz QCOGLVTYUXSNJD-VIFPVBQESA-N -1 3 381.422 -1.672 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CC[C@H](Nc2ncccc2-c2nnn[n-]2)C1 ZINC001579428588 1075626696 /nfs/dbraw/zinc/62/66/96/1075626696.db2.gz QCOGLVTYUXSNJD-VIFPVBQESA-N -1 3 381.422 -1.672 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)[C@H](C)Nc1ncccc1-c1nn[n-]n1 ZINC001579428602 1075626679 /nfs/dbraw/zinc/62/66/79/1075626679.db2.gz QVLCQUGDXKNREI-BDAKNGLRSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)[C@H](C)Nc1ncccc1-c1nnn[n-]1 ZINC001579428602 1075626677 /nfs/dbraw/zinc/62/66/77/1075626677.db2.gz QVLCQUGDXKNREI-BDAKNGLRSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@@H](C)Nc1ncccc1-c1nn[n-]n1 ZINC001579428603 1075626576 /nfs/dbraw/zinc/62/65/76/1075626576.db2.gz QVLCQUGDXKNREI-DTWKUNHWSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@@H](C)Nc1ncccc1-c1nnn[n-]1 ZINC001579428603 1075626572 /nfs/dbraw/zinc/62/65/72/1075626572.db2.gz QVLCQUGDXKNREI-DTWKUNHWSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@H](C)Nc1ncccc1-c1nn[n-]n1 ZINC001579428604 1075626510 /nfs/dbraw/zinc/62/65/10/1075626510.db2.gz QVLCQUGDXKNREI-IUCAKERBSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@H](C)Nc1ncccc1-c1nnn[n-]1 ZINC001579428604 1075626507 /nfs/dbraw/zinc/62/65/07/1075626507.db2.gz QVLCQUGDXKNREI-IUCAKERBSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)[C@@H](C)Nc1ncccc1-c1nn[n-]n1 ZINC001579428605 1075626548 /nfs/dbraw/zinc/62/65/48/1075626548.db2.gz QVLCQUGDXKNREI-RKDXNWHRSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)[C@@H](C)Nc1ncccc1-c1nnn[n-]1 ZINC001579428605 1075626545 /nfs/dbraw/zinc/62/65/45/1075626545.db2.gz QVLCQUGDXKNREI-RKDXNWHRSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC1CN(Cc2ccc(-c3nn[n-]n3)cc2)C1 ZINC001579428614 1075626639 /nfs/dbraw/zinc/62/66/39/1075626639.db2.gz RDVFTKMBMDZGPN-UHFFFAOYSA-N -1 3 380.434 -1.779 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC1CN(Cc2ccc(-c3nnn[n-]3)cc2)C1 ZINC001579428614 1075626635 /nfs/dbraw/zinc/62/66/35/1075626635.db2.gz RDVFTKMBMDZGPN-UHFFFAOYSA-N -1 3 380.434 -1.779 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001579428617 1075626566 /nfs/dbraw/zinc/62/65/66/1075626566.db2.gz RJLVOLOSUKLGSF-SECBINFHSA-N -1 3 383.438 -1.520 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001579428617 1075626563 /nfs/dbraw/zinc/62/65/63/1075626563.db2.gz RJLVOLOSUKLGSF-SECBINFHSA-N -1 3 383.438 -1.520 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001579428618 1075626523 /nfs/dbraw/zinc/62/65/23/1075626523.db2.gz RJLVOLOSUKLGSF-VIFPVBQESA-N -1 3 383.438 -1.520 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001579428618 1075626520 /nfs/dbraw/zinc/62/65/20/1075626520.db2.gz RJLVOLOSUKLGSF-VIFPVBQESA-N -1 3 383.438 -1.520 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC1CN(Cc2ccc(-c3nnn[n-]3)s2)C1 ZINC001579428628 1075626609 /nfs/dbraw/zinc/62/66/09/1075626609.db2.gz RNONXLILKFVIDA-UHFFFAOYSA-N -1 3 386.463 -1.718 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)CNc1snc(C)c1-c1nnn[n-]1 ZINC001579428640 1075626554 /nfs/dbraw/zinc/62/65/54/1075626554.db2.gz RRDKKQVHZNHETN-LURJTMIESA-N -1 3 389.467 -1.398 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@@H](C)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001579428646 1075626588 /nfs/dbraw/zinc/62/65/88/1075626588.db2.gz RWYLJFQTFAHBTQ-BDAKNGLRSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@@H](C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001579428646 1075626584 /nfs/dbraw/zinc/62/65/84/1075626584.db2.gz RWYLJFQTFAHBTQ-BDAKNGLRSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)[C@H](C)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001579428648 1075626716 /nfs/dbraw/zinc/62/67/16/1075626716.db2.gz RWYLJFQTFAHBTQ-DTWKUNHWSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)[C@H](C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001579428648 1075626714 /nfs/dbraw/zinc/62/67/14/1075626714.db2.gz RWYLJFQTFAHBTQ-DTWKUNHWSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@H](C)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001579428649 1075626690 /nfs/dbraw/zinc/62/66/90/1075626690.db2.gz RWYLJFQTFAHBTQ-IUCAKERBSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@H](C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001579428649 1075626687 /nfs/dbraw/zinc/62/66/87/1075626687.db2.gz RWYLJFQTFAHBTQ-IUCAKERBSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)[C@@H](C)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001579428650 1075627088 /nfs/dbraw/zinc/62/70/88/1075627088.db2.gz RWYLJFQTFAHBTQ-RKDXNWHRSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)[C@@H](C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001579428650 1075627086 /nfs/dbraw/zinc/62/70/86/1075627086.db2.gz RWYLJFQTFAHBTQ-RKDXNWHRSA-N -1 3 383.438 -1.379 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCCN(C)c1ncccc1-c1nn[n-]n1 ZINC001579428651 1075627039 /nfs/dbraw/zinc/62/70/39/1075627039.db2.gz SANWYINSIZVIJD-UHFFFAOYSA-N -1 3 383.438 -1.742 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCCN(C)c1ncccc1-c1nnn[n-]1 ZINC001579428651 1075627036 /nfs/dbraw/zinc/62/70/36/1075627036.db2.gz SANWYINSIZVIJD-UHFFFAOYSA-N -1 3 383.438 -1.742 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC[C@H](C)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001579428678 1075627031 /nfs/dbraw/zinc/62/70/31/1075627031.db2.gz STCIFVFJRATHKW-VIFPVBQESA-N -1 3 383.438 -1.378 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC[C@H](C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001579428678 1075627029 /nfs/dbraw/zinc/62/70/29/1075627029.db2.gz STCIFVFJRATHKW-VIFPVBQESA-N -1 3 383.438 -1.378 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC1(Nc2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001579428706 1075627094 /nfs/dbraw/zinc/62/70/94/1075627094.db2.gz UFZODFJKHKUTCW-UHFFFAOYSA-N -1 3 381.422 -1.624 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC1(Nc2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001579428706 1075627092 /nfs/dbraw/zinc/62/70/92/1075627092.db2.gz UFZODFJKHKUTCW-UHFFFAOYSA-N -1 3 381.422 -1.624 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1C ZINC001579428765 1075626960 /nfs/dbraw/zinc/62/69/60/1075626960.db2.gz UQNHPADRODUYGG-BXKDBHETSA-N -1 3 395.449 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1C ZINC001579428765 1075626958 /nfs/dbraw/zinc/62/69/58/1075626958.db2.gz UQNHPADRODUYGG-BXKDBHETSA-N -1 3 395.449 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)N(C)c1ncccc1-c1nn[n-]n1 ZINC001579428874 1075627066 /nfs/dbraw/zinc/62/70/66/1075627066.db2.gz USLCBZBXKLENEE-SECBINFHSA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)N(C)c1ncccc1-c1nnn[n-]1 ZINC001579428874 1075627063 /nfs/dbraw/zinc/62/70/63/1075627063.db2.gz USLCBZBXKLENEE-SECBINFHSA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)N(C)c1ncccc1-c1nn[n-]n1 ZINC001579428875 1075627025 /nfs/dbraw/zinc/62/70/25/1075627025.db2.gz USLCBZBXKLENEE-VIFPVBQESA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)N(C)c1ncccc1-c1nnn[n-]1 ZINC001579428875 1075627023 /nfs/dbraw/zinc/62/70/23/1075627023.db2.gz USLCBZBXKLENEE-VIFPVBQESA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC1(Nc2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001579428876 1075627018 /nfs/dbraw/zinc/62/70/18/1075627018.db2.gz USOTXYKWXCYGRJ-UHFFFAOYSA-N -1 3 381.422 -1.624 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC1(Nc2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001579428876 1075627016 /nfs/dbraw/zinc/62/70/16/1075627016.db2.gz USOTXYKWXCYGRJ-UHFFFAOYSA-N -1 3 381.422 -1.624 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCN(C)c1cccc(F)c1-c1nn[n-]n1 ZINC001579428882 1075627072 /nfs/dbraw/zinc/62/70/72/1075627072.db2.gz VDSKWUSGKNDQBE-UHFFFAOYSA-N -1 3 386.413 -1.388 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCN(C)c1cccc(F)c1-c1nnn[n-]1 ZINC001579428882 1075627069 /nfs/dbraw/zinc/62/70/69/1075627069.db2.gz VDSKWUSGKNDQBE-UHFFFAOYSA-N -1 3 386.413 -1.388 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCN(C)c1ccc(-c2nn[n-]n2)c(C)n1 ZINC001579428883 1075626974 /nfs/dbraw/zinc/62/69/74/1075626974.db2.gz VDTFCUHAUTXZEZ-UHFFFAOYSA-N -1 3 383.438 -1.824 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCN(C)c1ccc(-c2nnn[n-]2)c(C)n1 ZINC001579428883 1075626969 /nfs/dbraw/zinc/62/69/69/1075626969.db2.gz VDTFCUHAUTXZEZ-UHFFFAOYSA-N -1 3 383.438 -1.824 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)N(C)c1ccc(-c2nn[n-]n2)nc1 ZINC001579428891 1075627000 /nfs/dbraw/zinc/62/70/00/1075627000.db2.gz VKNUNMICMQRWGO-SECBINFHSA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)N(C)c1ccc(-c2nnn[n-]2)nc1 ZINC001579428891 1075626995 /nfs/dbraw/zinc/62/69/95/1075626995.db2.gz VKNUNMICMQRWGO-SECBINFHSA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)N(C)c1ccc(-c2nn[n-]n2)nc1 ZINC001579428892 1075626984 /nfs/dbraw/zinc/62/69/84/1075626984.db2.gz VKNUNMICMQRWGO-VIFPVBQESA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)N(C)c1ccc(-c2nnn[n-]2)nc1 ZINC001579428892 1075626981 /nfs/dbraw/zinc/62/69/81/1075626981.db2.gz VKNUNMICMQRWGO-VIFPVBQESA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)CN(C)c1ncccc1-c1nn[n-]n1 ZINC001579428905 1075627010 /nfs/dbraw/zinc/62/70/10/1075627010.db2.gz VZEPDZKBDWCNSV-SECBINFHSA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)CN(C)c1ncccc1-c1nnn[n-]1 ZINC001579428905 1075627008 /nfs/dbraw/zinc/62/70/08/1075627008.db2.gz VZEPDZKBDWCNSV-SECBINFHSA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)CN(C)c1ncccc1-c1nn[n-]n1 ZINC001579428906 1075627404 /nfs/dbraw/zinc/62/74/04/1075627404.db2.gz VZEPDZKBDWCNSV-VIFPVBQESA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)CN(C)c1ncccc1-c1nnn[n-]1 ZINC001579428906 1075627399 /nfs/dbraw/zinc/62/73/99/1075627399.db2.gz VZEPDZKBDWCNSV-VIFPVBQESA-N -1 3 383.438 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC[C@H](C)Nc1ncccc1-c1nn[n-]n1 ZINC001579428924 1075627382 /nfs/dbraw/zinc/62/73/82/1075627382.db2.gz WSVGAEZAENRDLS-VIFPVBQESA-N -1 3 383.438 -1.378 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC[C@H](C)Nc1ncccc1-c1nnn[n-]1 ZINC001579428924 1075627374 /nfs/dbraw/zinc/62/73/74/1075627374.db2.gz WSVGAEZAENRDLS-VIFPVBQESA-N -1 3 383.438 -1.378 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)CCNc1ccc(-c2nn[n-]n2)nc1 ZINC001579428928 1075627433 /nfs/dbraw/zinc/62/74/33/1075627433.db2.gz WWLFUYMCSZCJKR-SECBINFHSA-N -1 3 383.438 -1.378 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)CCNc1ccc(-c2nnn[n-]2)nc1 ZINC001579428928 1075627432 /nfs/dbraw/zinc/62/74/32/1075627432.db2.gz WWLFUYMCSZCJKR-SECBINFHSA-N -1 3 383.438 -1.378 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)CCNc1ccc(-c2nn[n-]n2)nc1 ZINC001579428929 1075627452 /nfs/dbraw/zinc/62/74/52/1075627452.db2.gz WWLFUYMCSZCJKR-VIFPVBQESA-N -1 3 383.438 -1.378 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H](C)CCNc1ccc(-c2nnn[n-]2)nc1 ZINC001579428929 1075627446 /nfs/dbraw/zinc/62/74/46/1075627446.db2.gz WWLFUYMCSZCJKR-VIFPVBQESA-N -1 3 383.438 -1.378 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1C[C@H](Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001579428930 1075627555 /nfs/dbraw/zinc/62/75/55/1075627555.db2.gz WWSMDZVJOMHMRQ-MGCOHNPYSA-N -1 3 381.422 -1.625 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1C[C@H](Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579428930 1075627552 /nfs/dbraw/zinc/62/75/52/1075627552.db2.gz WWSMDZVJOMHMRQ-MGCOHNPYSA-N -1 3 381.422 -1.625 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC1CN(Cc2ccccc2-c2nn[n-]n2)C1 ZINC001579428960 1075627484 /nfs/dbraw/zinc/62/74/84/1075627484.db2.gz XSEVYHWQPRMUSI-UHFFFAOYSA-N -1 3 380.434 -1.779 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC1CN(Cc2ccccc2-c2nnn[n-]2)C1 ZINC001579428960 1075627481 /nfs/dbraw/zinc/62/74/81/1075627481.db2.gz XSEVYHWQPRMUSI-UHFFFAOYSA-N -1 3 380.434 -1.779 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)Nc1ncc(-c2nn[n-]n2)cc1F ZINC001579428965 1075627524 /nfs/dbraw/zinc/62/75/24/1075627524.db2.gz XTEPJEKCBRDDLP-SSDOTTSWSA-N -1 3 387.401 -1.629 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)Nc1ncc(-c2nnn[n-]2)cc1F ZINC001579428965 1075627521 /nfs/dbraw/zinc/62/75/21/1075627521.db2.gz XTEPJEKCBRDDLP-SSDOTTSWSA-N -1 3 387.401 -1.629 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)Nc1ncc(-c2nn[n-]n2)cc1F ZINC001579428966 1075627508 /nfs/dbraw/zinc/62/75/08/1075627508.db2.gz XTEPJEKCBRDDLP-ZETCQYMHSA-N -1 3 387.401 -1.629 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)Nc1ncc(-c2nnn[n-]2)cc1F ZINC001579428966 1075627505 /nfs/dbraw/zinc/62/75/05/1075627505.db2.gz XTEPJEKCBRDDLP-ZETCQYMHSA-N -1 3 387.401 -1.629 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCO[C@@H](c2ccc(-c3nn[n-]n3)cc2)C1 ZINC001579429072 1075627544 /nfs/dbraw/zinc/62/75/44/1075627544.db2.gz YOHCLAIWSIFJNH-GFCCVEGCSA-N -1 3 381.418 -1.180 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCO[C@@H](c2ccc(-c3nnn[n-]3)cc2)C1 ZINC001579429072 1075627541 /nfs/dbraw/zinc/62/75/41/1075627541.db2.gz YOHCLAIWSIFJNH-GFCCVEGCSA-N -1 3 381.418 -1.180 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCO[C@H](c2ccc(-c3nn[n-]n3)cc2)C1 ZINC001579429074 1075627491 /nfs/dbraw/zinc/62/74/91/1075627491.db2.gz YOHCLAIWSIFJNH-LBPRGKRZSA-N -1 3 381.418 -1.180 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCO[C@H](c2ccc(-c3nnn[n-]3)cc2)C1 ZINC001579429074 1075627488 /nfs/dbraw/zinc/62/74/88/1075627488.db2.gz YOHCLAIWSIFJNH-LBPRGKRZSA-N -1 3 381.418 -1.180 20 0 GAADHM COC(=O)[C@@H](CC1OCCO1)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001579434402 1075627829 /nfs/dbraw/zinc/62/78/29/1075627829.db2.gz WJZKXVZNRHLMQA-SECBINFHSA-N -1 3 384.374 -1.155 20 0 GAADHM COC(=O)[C@@H](CC1OCCO1)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001579434402 1075627827 /nfs/dbraw/zinc/62/78/27/1075627827.db2.gz WJZKXVZNRHLMQA-SECBINFHSA-N -1 3 384.374 -1.155 20 0 GAADHM COC(=O)[C@H](CC1OCCO1)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001579434403 1075627782 /nfs/dbraw/zinc/62/77/82/1075627782.db2.gz WJZKXVZNRHLMQA-VIFPVBQESA-N -1 3 384.374 -1.155 20 0 GAADHM COC(=O)[C@H](CC1OCCO1)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001579434403 1075627780 /nfs/dbraw/zinc/62/77/80/1075627780.db2.gz WJZKXVZNRHLMQA-VIFPVBQESA-N -1 3 384.374 -1.155 20 0 GAADHM COC(=O)[C@]1(O)CCN(CCS(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579439224 1075628220 /nfs/dbraw/zinc/62/82/20/1075628220.db2.gz IJTHUXVIPJARCU-AWEZNQCLSA-N -1 3 382.402 -1.355 20 0 GAADHM COC(=O)[C@]1(O)CCN(CCS(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579439224 1075628218 /nfs/dbraw/zinc/62/82/18/1075628218.db2.gz IJTHUXVIPJARCU-AWEZNQCLSA-N -1 3 382.402 -1.355 20 0 GAADHM COC(=O)[C@@]1(O)CCN(CCS(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001579439225 1075628254 /nfs/dbraw/zinc/62/82/54/1075628254.db2.gz IJTHUXVIPJARCU-CQSZACIVSA-N -1 3 382.402 -1.355 20 0 GAADHM COC(=O)[C@@]1(O)CCN(CCS(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001579439225 1075628252 /nfs/dbraw/zinc/62/82/52/1075628252.db2.gz IJTHUXVIPJARCU-CQSZACIVSA-N -1 3 382.402 -1.355 20 0 GAADHM COC(=O)C1(O)CN(C(=O)[C@@H]2CC(=O)N(c3ccc(-c4nn[n-]n4)cc3)C2)C1 ZINC001579439330 1075628278 /nfs/dbraw/zinc/62/82/78/1075628278.db2.gz MCKKZPKZKMOYDG-LLVKDONJSA-N -1 3 386.368 -1.034 20 0 GAADHM COC(=O)C1(O)CN(C(=O)[C@@H]2CC(=O)N(c3ccc(-c4nnn[n-]4)cc3)C2)C1 ZINC001579439330 1075628277 /nfs/dbraw/zinc/62/82/77/1075628277.db2.gz MCKKZPKZKMOYDG-LLVKDONJSA-N -1 3 386.368 -1.034 20 0 GAADHM COC(=O)C1(O)CN(C(=O)[C@H]2CC(=O)N(c3ccc(-c4nn[n-]n4)cc3)C2)C1 ZINC001579439331 1075628249 /nfs/dbraw/zinc/62/82/49/1075628249.db2.gz MCKKZPKZKMOYDG-NSHDSACASA-N -1 3 386.368 -1.034 20 0 GAADHM COC(=O)C1(O)CN(C(=O)[C@H]2CC(=O)N(c3ccc(-c4nnn[n-]4)cc3)C2)C1 ZINC001579439331 1075628248 /nfs/dbraw/zinc/62/82/48/1075628248.db2.gz MCKKZPKZKMOYDG-NSHDSACASA-N -1 3 386.368 -1.034 20 0 GAADHM COC(=O)C1(O)CN(C(=O)CNS(=O)(=O)c2cccc(-c3nn[n-]n3)c2)C1 ZINC001579439420 1075628281 /nfs/dbraw/zinc/62/82/81/1075628281.db2.gz PBGMSODQEZMNKJ-UHFFFAOYSA-N -1 3 396.385 -2.109 20 0 GAADHM COC(=O)C1(O)CN(C(=O)CNS(=O)(=O)c2cccc(-c3nnn[n-]3)c2)C1 ZINC001579439420 1075628280 /nfs/dbraw/zinc/62/82/80/1075628280.db2.gz PBGMSODQEZMNKJ-UHFFFAOYSA-N -1 3 396.385 -2.109 20 0 GAADHM COC(=O)C1(O)CN(C(=O)c2ccc(-n3ncc(-c4nn[n-]n4)c3N)cc2)C1 ZINC001579439503 1075628238 /nfs/dbraw/zinc/62/82/38/1075628238.db2.gz SEGSSRKCKCWTQT-UHFFFAOYSA-N -1 3 384.356 -1.006 20 0 GAADHM COC(=O)C1(O)CN(C(=O)c2ccc(-n3ncc(-c4nnn[n-]4)c3N)cc2)C1 ZINC001579439503 1075628237 /nfs/dbraw/zinc/62/82/37/1075628237.db2.gz SEGSSRKCKCWTQT-UHFFFAOYSA-N -1 3 384.356 -1.006 20 0 GAADHM COC(=O)[C@H]1C[C@H]1C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579439801 1075628258 /nfs/dbraw/zinc/62/82/58/1075628258.db2.gz BHVVSFGJJDEGRE-BDAKNGLRSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@H]1C[C@H]1C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579439801 1075628257 /nfs/dbraw/zinc/62/82/57/1075628257.db2.gz BHVVSFGJJDEGRE-BDAKNGLRSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@@H]1C[C@@H]1C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579439802 1075628296 /nfs/dbraw/zinc/62/82/96/1075628296.db2.gz BHVVSFGJJDEGRE-DTWKUNHWSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@@H]1C[C@@H]1C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579439802 1075628295 /nfs/dbraw/zinc/62/82/95/1075628295.db2.gz BHVVSFGJJDEGRE-DTWKUNHWSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@H]1C[C@@H]1C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579439803 1075628275 /nfs/dbraw/zinc/62/82/75/1075628275.db2.gz BHVVSFGJJDEGRE-IUCAKERBSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@H]1C[C@@H]1C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579439803 1075628274 /nfs/dbraw/zinc/62/82/74/1075628274.db2.gz BHVVSFGJJDEGRE-IUCAKERBSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@@H]1C[C@H]1C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579439804 1075628270 /nfs/dbraw/zinc/62/82/70/1075628270.db2.gz BHVVSFGJJDEGRE-RKDXNWHRSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@@H]1C[C@H]1C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579439804 1075628268 /nfs/dbraw/zinc/62/82/68/1075628268.db2.gz BHVVSFGJJDEGRE-RKDXNWHRSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@@H]1C[C@H]1C(=O)N(CCO)CCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579440192 1075628299 /nfs/dbraw/zinc/62/82/99/1075628299.db2.gz FCFUCAYBISCMDW-NXEZZACHSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@H]1C(=O)N(CCO)CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579440192 1075628298 /nfs/dbraw/zinc/62/82/98/1075628298.db2.gz FCFUCAYBISCMDW-NXEZZACHSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@@H]1C(=O)N(CCO)CCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579440193 1075628302 /nfs/dbraw/zinc/62/83/02/1075628302.db2.gz FCFUCAYBISCMDW-UWVGGRQHSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@@H]1C(=O)N(CCO)CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579440193 1075628301 /nfs/dbraw/zinc/62/83/01/1075628301.db2.gz FCFUCAYBISCMDW-UWVGGRQHSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@@H]1C(=O)N(CCO)CCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579440194 1075628287 /nfs/dbraw/zinc/62/82/87/1075628287.db2.gz FCFUCAYBISCMDW-VHSXEESVSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@@H]1C(=O)N(CCO)CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579440194 1075628286 /nfs/dbraw/zinc/62/82/86/1075628286.db2.gz FCFUCAYBISCMDW-VHSXEESVSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@H]1C(=O)N(CCO)CCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579440195 1075628284 /nfs/dbraw/zinc/62/82/84/1075628284.db2.gz FCFUCAYBISCMDW-ZJUUUORDSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@H]1C(=O)N(CCO)CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579440195 1075628283 /nfs/dbraw/zinc/62/82/83/1075628283.db2.gz FCFUCAYBISCMDW-ZJUUUORDSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@H]1C(=O)NCC1(O)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579440887 1075628733 /nfs/dbraw/zinc/62/87/33/1075628733.db2.gz KNSVNBXRRDMQDR-NXEZZACHSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@@H]1C[C@H]1C(=O)NCC1(O)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579440887 1075628732 /nfs/dbraw/zinc/62/87/32/1075628732.db2.gz KNSVNBXRRDMQDR-NXEZZACHSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@H]1C[C@@H]1C(=O)NCC1(O)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579440888 1075628646 /nfs/dbraw/zinc/62/86/46/1075628646.db2.gz KNSVNBXRRDMQDR-UWVGGRQHSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@H]1C[C@@H]1C(=O)NCC1(O)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579440888 1075628644 /nfs/dbraw/zinc/62/86/44/1075628644.db2.gz KNSVNBXRRDMQDR-UWVGGRQHSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@@H]1C[C@@H]1C(=O)NCC1(O)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579440889 1075628621 /nfs/dbraw/zinc/62/86/21/1075628621.db2.gz KNSVNBXRRDMQDR-VHSXEESVSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@@H]1C[C@@H]1C(=O)NCC1(O)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579440889 1075628619 /nfs/dbraw/zinc/62/86/19/1075628619.db2.gz KNSVNBXRRDMQDR-VHSXEESVSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@H]1C[C@H]1C(=O)NCC1(O)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579440890 1075628720 /nfs/dbraw/zinc/62/87/20/1075628720.db2.gz KNSVNBXRRDMQDR-ZJUUUORDSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@H]1C[C@H]1C(=O)NCC1(O)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579440890 1075628718 /nfs/dbraw/zinc/62/87/18/1075628718.db2.gz KNSVNBXRRDMQDR-ZJUUUORDSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@H]1C[C@H]1C(=O)N1CC(O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579440966 1075628725 /nfs/dbraw/zinc/62/87/25/1075628725.db2.gz LXMCMYSXZQMTSB-BDAKNGLRSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@H]1C[C@H]1C(=O)N1CC(O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579440966 1075628723 /nfs/dbraw/zinc/62/87/23/1075628723.db2.gz LXMCMYSXZQMTSB-BDAKNGLRSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@@H]1C[C@@H]1C(=O)N1CC(O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579440967 1075628706 /nfs/dbraw/zinc/62/87/06/1075628706.db2.gz LXMCMYSXZQMTSB-DTWKUNHWSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@@H]1C[C@@H]1C(=O)N1CC(O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579440967 1075628704 /nfs/dbraw/zinc/62/87/04/1075628704.db2.gz LXMCMYSXZQMTSB-DTWKUNHWSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@H]1C[C@@H]1C(=O)N1CC(O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579440968 1075628671 /nfs/dbraw/zinc/62/86/71/1075628671.db2.gz LXMCMYSXZQMTSB-IUCAKERBSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@H]1C[C@@H]1C(=O)N1CC(O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579440968 1075628669 /nfs/dbraw/zinc/62/86/69/1075628669.db2.gz LXMCMYSXZQMTSB-IUCAKERBSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@@H]1C[C@H]1C(=O)N1CC(O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579440969 1075628739 /nfs/dbraw/zinc/62/87/39/1075628739.db2.gz LXMCMYSXZQMTSB-RKDXNWHRSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@@H]1C[C@H]1C(=O)N1CC(O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579440969 1075628738 /nfs/dbraw/zinc/62/87/38/1075628738.db2.gz LXMCMYSXZQMTSB-RKDXNWHRSA-N -1 3 389.372 -1.693 20 0 GAADHM COC(=O)[C@@H]1C[C@H]1C(=O)N(CCO)CCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579440978 1075628632 /nfs/dbraw/zinc/62/86/32/1075628632.db2.gz LZAGBFSYGODVQC-GHMZBOCLSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@H]1C(=O)N(CCO)CCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579440978 1075628628 /nfs/dbraw/zinc/62/86/28/1075628628.db2.gz LZAGBFSYGODVQC-GHMZBOCLSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@H]1C(=O)N(CCO)CCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579440979 1075628680 /nfs/dbraw/zinc/62/86/80/1075628680.db2.gz LZAGBFSYGODVQC-MNOVXSKESA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@H]1C(=O)N(CCO)CCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579440979 1075628677 /nfs/dbraw/zinc/62/86/77/1075628677.db2.gz LZAGBFSYGODVQC-MNOVXSKESA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@@H]1C(=O)N(CCO)CCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579440980 1075628730 /nfs/dbraw/zinc/62/87/30/1075628730.db2.gz LZAGBFSYGODVQC-QWRGUYRKSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@@H]1C(=O)N(CCO)CCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579440980 1075628729 /nfs/dbraw/zinc/62/87/29/1075628729.db2.gz LZAGBFSYGODVQC-QWRGUYRKSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@@H]1C(=O)N(CCO)CCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579440981 1075628695 /nfs/dbraw/zinc/62/86/95/1075628695.db2.gz LZAGBFSYGODVQC-WDEREUQCSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@@H]1C(=O)N(CCO)CCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579440981 1075628692 /nfs/dbraw/zinc/62/86/92/1075628692.db2.gz LZAGBFSYGODVQC-WDEREUQCSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@H]1C(=O)N(CCO)CCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579441114 1075628638 /nfs/dbraw/zinc/62/86/38/1075628638.db2.gz OFDIGSAACYQGSZ-GHMZBOCLSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@H]1C(=O)N(CCO)CCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579441114 1075628636 /nfs/dbraw/zinc/62/86/36/1075628636.db2.gz OFDIGSAACYQGSZ-GHMZBOCLSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@H]1C(=O)N(CCO)CCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579441115 1075628701 /nfs/dbraw/zinc/62/87/01/1075628701.db2.gz OFDIGSAACYQGSZ-MNOVXSKESA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@H]1C(=O)N(CCO)CCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579441115 1075628700 /nfs/dbraw/zinc/62/87/00/1075628700.db2.gz OFDIGSAACYQGSZ-MNOVXSKESA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@@H]1C(=O)N(CCO)CCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579441116 1075628736 /nfs/dbraw/zinc/62/87/36/1075628736.db2.gz OFDIGSAACYQGSZ-QWRGUYRKSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@@H]1C(=O)N(CCO)CCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579441116 1075628735 /nfs/dbraw/zinc/62/87/35/1075628735.db2.gz OFDIGSAACYQGSZ-QWRGUYRKSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@@H]1C(=O)N(CCO)CCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579441117 1075629004 /nfs/dbraw/zinc/62/90/04/1075629004.db2.gz OFDIGSAACYQGSZ-WDEREUQCSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@@H]1C(=O)N(CCO)CCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579441117 1075629000 /nfs/dbraw/zinc/62/90/00/1075629000.db2.gz OFDIGSAACYQGSZ-WDEREUQCSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)C1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)C1 ZINC001579442208 1075629050 /nfs/dbraw/zinc/62/90/50/1075629050.db2.gz CDPBFXIRUCGKCB-UHFFFAOYSA-N -1 3 380.386 -1.224 20 0 GAADHM COC(=O)C1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)C1 ZINC001579442208 1075629048 /nfs/dbraw/zinc/62/90/48/1075629048.db2.gz CDPBFXIRUCGKCB-UHFFFAOYSA-N -1 3 380.386 -1.224 20 0 GAADHM COC(=O)[C@H]1CCN1C(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001579442321 1075629110 /nfs/dbraw/zinc/62/91/10/1075629110.db2.gz DYZXHGLHLZENEK-LLVKDONJSA-N -1 3 380.386 -1.081 20 0 GAADHM COC(=O)[C@H]1CCN1C(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001579442321 1075629108 /nfs/dbraw/zinc/62/91/08/1075629108.db2.gz DYZXHGLHLZENEK-LLVKDONJSA-N -1 3 380.386 -1.081 20 0 GAADHM COC(=O)[C@@H]1CCN1C(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001579442322 1075629072 /nfs/dbraw/zinc/62/90/72/1075629072.db2.gz DYZXHGLHLZENEK-NSHDSACASA-N -1 3 380.386 -1.081 20 0 GAADHM COC(=O)[C@@H]1CCN1C(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001579442322 1075629070 /nfs/dbraw/zinc/62/90/70/1075629070.db2.gz DYZXHGLHLZENEK-NSHDSACASA-N -1 3 380.386 -1.081 20 0 GAADHM COC(=O)[C@@H]1C[C@H]1C(=O)NCCN(CCO)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579442801 1075629092 /nfs/dbraw/zinc/62/90/92/1075629092.db2.gz LHZCRZSGCDFISX-GHMZBOCLSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@H]1C(=O)NCCN(CCO)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579442801 1075629091 /nfs/dbraw/zinc/62/90/91/1075629091.db2.gz LHZCRZSGCDFISX-GHMZBOCLSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@H]1C(=O)NCCN(CCO)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579442802 1075629082 /nfs/dbraw/zinc/62/90/82/1075629082.db2.gz LHZCRZSGCDFISX-MNOVXSKESA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@H]1C(=O)NCCN(CCO)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579442802 1075629080 /nfs/dbraw/zinc/62/90/80/1075629080.db2.gz LHZCRZSGCDFISX-MNOVXSKESA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@@H]1C(=O)NCCN(CCO)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579442803 1075629437 /nfs/dbraw/zinc/62/94/37/1075629437.db2.gz LHZCRZSGCDFISX-QWRGUYRKSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@@H]1C(=O)NCCN(CCO)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579442803 1075629435 /nfs/dbraw/zinc/62/94/35/1075629435.db2.gz LHZCRZSGCDFISX-QWRGUYRKSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@@H]1C(=O)NCCN(CCO)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579442804 1075629504 /nfs/dbraw/zinc/62/95/04/1075629504.db2.gz LHZCRZSGCDFISX-WDEREUQCSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@@H]1C(=O)NCCN(CCO)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579442804 1075629503 /nfs/dbraw/zinc/62/95/03/1075629503.db2.gz LHZCRZSGCDFISX-WDEREUQCSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@H]1C(=O)NCCN(CCO)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579443415 1075629375 /nfs/dbraw/zinc/62/93/75/1075629375.db2.gz QRBFDGYSBRQABN-NXEZZACHSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@H]1C(=O)NCCN(CCO)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579443415 1075629373 /nfs/dbraw/zinc/62/93/73/1075629373.db2.gz QRBFDGYSBRQABN-NXEZZACHSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@@H]1C(=O)NCCN(CCO)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579443416 1075629500 /nfs/dbraw/zinc/62/95/00/1075629500.db2.gz QRBFDGYSBRQABN-UWVGGRQHSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@@H]1C(=O)NCCN(CCO)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579443416 1075629499 /nfs/dbraw/zinc/62/94/99/1075629499.db2.gz QRBFDGYSBRQABN-UWVGGRQHSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@@H]1C(=O)NCCN(CCO)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579443417 1075629400 /nfs/dbraw/zinc/62/94/00/1075629400.db2.gz QRBFDGYSBRQABN-VHSXEESVSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@@H]1C(=O)NCCN(CCO)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579443417 1075629398 /nfs/dbraw/zinc/62/93/98/1075629398.db2.gz QRBFDGYSBRQABN-VHSXEESVSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@H]1C(=O)NCCN(CCO)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579443418 1075629482 /nfs/dbraw/zinc/62/94/82/1075629482.db2.gz QRBFDGYSBRQABN-ZJUUUORDSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@H]1C(=O)NCCN(CCO)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579443418 1075629479 /nfs/dbraw/zinc/62/94/79/1075629479.db2.gz QRBFDGYSBRQABN-ZJUUUORDSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@H]1C(=O)NCCN(CCO)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579443669 1075629394 /nfs/dbraw/zinc/62/93/94/1075629394.db2.gz SHOAZECUIVWMRM-GHMZBOCLSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@H]1C(=O)NCCN(CCO)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579443669 1075629392 /nfs/dbraw/zinc/62/93/92/1075629392.db2.gz SHOAZECUIVWMRM-GHMZBOCLSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@H]1C(=O)NCCN(CCO)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579443671 1075629368 /nfs/dbraw/zinc/62/93/68/1075629368.db2.gz SHOAZECUIVWMRM-MNOVXSKESA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@H]1C(=O)NCCN(CCO)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579443671 1075629365 /nfs/dbraw/zinc/62/93/65/1075629365.db2.gz SHOAZECUIVWMRM-MNOVXSKESA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@@H]1C(=O)NCCN(CCO)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579443673 1075629429 /nfs/dbraw/zinc/62/94/29/1075629429.db2.gz SHOAZECUIVWMRM-QWRGUYRKSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@H]1C[C@@H]1C(=O)NCCN(CCO)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579443673 1075629427 /nfs/dbraw/zinc/62/94/27/1075629427.db2.gz SHOAZECUIVWMRM-QWRGUYRKSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@@H]1C(=O)NCCN(CCO)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579443675 1075629493 /nfs/dbraw/zinc/62/94/93/1075629493.db2.gz SHOAZECUIVWMRM-WDEREUQCSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1C[C@@H]1C(=O)NCCN(CCO)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579443675 1075629490 /nfs/dbraw/zinc/62/94/90/1075629490.db2.gz SHOAZECUIVWMRM-WDEREUQCSA-N -1 3 391.388 -1.445 20 0 GAADHM COC(=O)[C@@H]1CN(C)C(=O)CN1C[C@H](O)COc1ccccc1-c1nn[n-]n1 ZINC001579446052 1075629456 /nfs/dbraw/zinc/62/94/56/1075629456.db2.gz GULRERLBHBKQJZ-AAEUAGOBSA-N -1 3 390.400 -1.078 20 0 GAADHM COC(=O)[C@@H]1CN(C)C(=O)CN1C[C@H](O)COc1ccccc1-c1nnn[n-]1 ZINC001579446052 1075629453 /nfs/dbraw/zinc/62/94/53/1075629453.db2.gz GULRERLBHBKQJZ-AAEUAGOBSA-N -1 3 390.400 -1.078 20 0 GAADHM COC(=O)[C@H]1CN(C)C(=O)CN1C[C@@H](O)COc1ccccc1-c1nn[n-]n1 ZINC001579446053 1075629381 /nfs/dbraw/zinc/62/93/81/1075629381.db2.gz GULRERLBHBKQJZ-DGCLKSJQSA-N -1 3 390.400 -1.078 20 0 GAADHM COC(=O)[C@H]1CN(C)C(=O)CN1C[C@@H](O)COc1ccccc1-c1nnn[n-]1 ZINC001579446053 1075629379 /nfs/dbraw/zinc/62/93/79/1075629379.db2.gz GULRERLBHBKQJZ-DGCLKSJQSA-N -1 3 390.400 -1.078 20 0 GAADHM COC(=O)[C@H]1CN(C)C(=O)CN1C[C@H](O)COc1ccccc1-c1nn[n-]n1 ZINC001579446054 1075629388 /nfs/dbraw/zinc/62/93/88/1075629388.db2.gz GULRERLBHBKQJZ-WCQYABFASA-N -1 3 390.400 -1.078 20 0 GAADHM COC(=O)[C@H]1CN(C)C(=O)CN1C[C@H](O)COc1ccccc1-c1nnn[n-]1 ZINC001579446054 1075629386 /nfs/dbraw/zinc/62/93/86/1075629386.db2.gz GULRERLBHBKQJZ-WCQYABFASA-N -1 3 390.400 -1.078 20 0 GAADHM COC(=O)[C@@H]1CN(C)C(=O)CN1C[C@@H](O)COc1ccccc1-c1nn[n-]n1 ZINC001579446055 1075629462 /nfs/dbraw/zinc/62/94/62/1075629462.db2.gz GULRERLBHBKQJZ-YPMHNXCESA-N -1 3 390.400 -1.078 20 0 GAADHM COC(=O)[C@@H]1CN(C)C(=O)CN1C[C@@H](O)COc1ccccc1-c1nnn[n-]1 ZINC001579446055 1075629460 /nfs/dbraw/zinc/62/94/60/1075629460.db2.gz GULRERLBHBKQJZ-YPMHNXCESA-N -1 3 390.400 -1.078 20 0 GAADHM COC(=O)[C@H]1CN(C)C(=O)CN1CC(=O)NCc1ccc(-c2nn[n-]n2)cc1 ZINC001579446692 1075629921 /nfs/dbraw/zinc/62/99/21/1075629921.db2.gz NSAPXJOBUYPCNC-CYBMUJFWSA-N -1 3 387.400 -1.202 20 0 GAADHM COC(=O)[C@H]1CN(C)C(=O)CN1CC(=O)NCc1ccc(-c2nnn[n-]2)cc1 ZINC001579446692 1075629918 /nfs/dbraw/zinc/62/99/18/1075629918.db2.gz NSAPXJOBUYPCNC-CYBMUJFWSA-N -1 3 387.400 -1.202 20 0 GAADHM COC(=O)[C@@H]1CN(C)C(=O)CN1CC(=O)NCc1ccc(-c2nn[n-]n2)cc1 ZINC001579446693 1075629883 /nfs/dbraw/zinc/62/98/83/1075629883.db2.gz NSAPXJOBUYPCNC-ZDUSSCGKSA-N -1 3 387.400 -1.202 20 0 GAADHM COC(=O)[C@@H]1CN(C)C(=O)CN1CC(=O)NCc1ccc(-c2nnn[n-]2)cc1 ZINC001579446693 1075629880 /nfs/dbraw/zinc/62/98/80/1075629880.db2.gz NSAPXJOBUYPCNC-ZDUSSCGKSA-N -1 3 387.400 -1.202 20 0 GAADHM COC(=O)[C@@H]1CN(C)CCN(S(=O)(=O)c2cncc(-c3nn[n-]n3)c2)C1 ZINC001579446844 1075629912 /nfs/dbraw/zinc/62/99/12/1075629912.db2.gz RINPBSQZSYZVOH-LLVKDONJSA-N -1 3 381.418 -1.013 20 0 GAADHM COC(=O)[C@@H]1CN(C)CCN(S(=O)(=O)c2cncc(-c3nnn[n-]3)c2)C1 ZINC001579446844 1075629910 /nfs/dbraw/zinc/62/99/10/1075629910.db2.gz RINPBSQZSYZVOH-LLVKDONJSA-N -1 3 381.418 -1.013 20 0 GAADHM COC(=O)[C@H]1CN(C)CCN(S(=O)(=O)c2cncc(-c3nn[n-]n3)c2)C1 ZINC001579446845 1075629934 /nfs/dbraw/zinc/62/99/34/1075629934.db2.gz RINPBSQZSYZVOH-NSHDSACASA-N -1 3 381.418 -1.013 20 0 GAADHM COC(=O)[C@H]1CN(C)CCN(S(=O)(=O)c2cncc(-c3nnn[n-]3)c2)C1 ZINC001579446845 1075629931 /nfs/dbraw/zinc/62/99/31/1075629931.db2.gz RINPBSQZSYZVOH-NSHDSACASA-N -1 3 381.418 -1.013 20 0 GAADHM COC(=O)[C@H]1CS(=O)(=O)CCN1C(=O)c1cc(C)c(-c2nn[n-]n2)cn1 ZINC001579446899 1075629863 /nfs/dbraw/zinc/62/98/63/1075629863.db2.gz SRERVEYLAAUYOD-LLVKDONJSA-N -1 3 380.386 -1.018 20 0 GAADHM COC(=O)[C@H]1CS(=O)(=O)CCN1C(=O)c1cc(C)c(-c2nnn[n-]2)cn1 ZINC001579446899 1075629858 /nfs/dbraw/zinc/62/98/58/1075629858.db2.gz SRERVEYLAAUYOD-LLVKDONJSA-N -1 3 380.386 -1.018 20 0 GAADHM COC(=O)[C@@H]1CS(=O)(=O)CCN1C(=O)c1cc(C)c(-c2nn[n-]n2)cn1 ZINC001579446900 1075629788 /nfs/dbraw/zinc/62/97/88/1075629788.db2.gz SRERVEYLAAUYOD-NSHDSACASA-N -1 3 380.386 -1.018 20 0 GAADHM COC(=O)[C@@H]1CS(=O)(=O)CCN1C(=O)c1cc(C)c(-c2nnn[n-]2)cn1 ZINC001579446900 1075629781 /nfs/dbraw/zinc/62/97/81/1075629781.db2.gz SRERVEYLAAUYOD-NSHDSACASA-N -1 3 380.386 -1.018 20 0 GAADHM COC(=O)[C@H]1CN(C)C(=O)CN1S(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001579446940 1075629997 /nfs/dbraw/zinc/62/99/97/1075629997.db2.gz UFHVBMRENLFCET-LLVKDONJSA-N -1 3 380.386 -1.129 20 0 GAADHM COC(=O)[C@H]1CN(C)C(=O)CN1S(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001579446940 1075629993 /nfs/dbraw/zinc/62/99/93/1075629993.db2.gz UFHVBMRENLFCET-LLVKDONJSA-N -1 3 380.386 -1.129 20 0 GAADHM COC(=O)[C@@H]1CN(C)C(=O)CN1S(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001579446941 1075629771 /nfs/dbraw/zinc/62/97/71/1075629771.db2.gz UFHVBMRENLFCET-NSHDSACASA-N -1 3 380.386 -1.129 20 0 GAADHM COC(=O)[C@@H]1CN(C)C(=O)CN1S(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001579446941 1075629768 /nfs/dbraw/zinc/62/97/68/1075629768.db2.gz UFHVBMRENLFCET-NSHDSACASA-N -1 3 380.386 -1.129 20 0 GAADHM COC(=O)[C@@H]1CN(C)C(=O)CN1S(=O)(=O)c1cncc(-c2nn[n-]n2)c1 ZINC001579446978 1075629818 /nfs/dbraw/zinc/62/98/18/1075629818.db2.gz VQYLWKABJSIZNO-JTQLQIEISA-N -1 3 381.374 -1.734 20 0 GAADHM COC(=O)[C@@H]1CN(C)C(=O)CN1S(=O)(=O)c1cncc(-c2nnn[n-]2)c1 ZINC001579446978 1075629813 /nfs/dbraw/zinc/62/98/13/1075629813.db2.gz VQYLWKABJSIZNO-JTQLQIEISA-N -1 3 381.374 -1.734 20 0 GAADHM COC(=O)[C@H]1CN(C)C(=O)CN1S(=O)(=O)c1cncc(-c2nn[n-]n2)c1 ZINC001579446979 1075629961 /nfs/dbraw/zinc/62/99/61/1075629961.db2.gz VQYLWKABJSIZNO-SNVBAGLBSA-N -1 3 381.374 -1.734 20 0 GAADHM COC(=O)[C@H]1CN(C)C(=O)CN1S(=O)(=O)c1cncc(-c2nnn[n-]2)c1 ZINC001579446979 1075629958 /nfs/dbraw/zinc/62/99/58/1075629958.db2.gz VQYLWKABJSIZNO-SNVBAGLBSA-N -1 3 381.374 -1.734 20 0 GAADHM COC(=O)CCN1CCN(c2[nH]c(=O)n(C)c(=O)c2-c2nn[n-]n2)[C@H](C)C1 ZINC001579447323 1075630295 /nfs/dbraw/zinc/63/02/95/1075630295.db2.gz IWCPVEYRDXMVSW-SECBINFHSA-N -1 3 378.393 -1.673 20 0 GAADHM COC(=O)CCN1CCN(c2[nH]c(=O)n(C)c(=O)c2-c2nn[n-]n2)[C@@H](C)C1 ZINC001579447324 1075630353 /nfs/dbraw/zinc/63/03/53/1075630353.db2.gz IWCPVEYRDXMVSW-VIFPVBQESA-N -1 3 378.393 -1.673 20 0 GAADHM COC(=O)CNC(=O)CNS(=O)(=O)c1c(C)cc(F)cc1-c1nnn[n-]1 ZINC001579450394 1075630247 /nfs/dbraw/zinc/63/02/47/1075630247.db2.gz LYZUAAKDCHAWNQ-UHFFFAOYSA-N -1 3 386.365 -1.118 20 0 GAADHM COC(=O)CNC(=O)[C@H]1CCCN1C(=O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001579450449 1075630539 /nfs/dbraw/zinc/63/05/39/1075630539.db2.gz OMMWJTPTEREEJC-LLVKDONJSA-N -1 3 388.388 -1.046 20 0 GAADHM COC(=O)CNC(=O)[C@H]1CCCN1C(=O)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001579450449 1075630536 /nfs/dbraw/zinc/63/05/36/1075630536.db2.gz OMMWJTPTEREEJC-LLVKDONJSA-N -1 3 388.388 -1.046 20 0 GAADHM COC(=O)CNC(=O)[C@@H]1CCCN1C(=O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001579450450 1075630730 /nfs/dbraw/zinc/63/07/30/1075630730.db2.gz OMMWJTPTEREEJC-NSHDSACASA-N -1 3 388.388 -1.046 20 0 GAADHM COC(=O)CNC(=O)[C@@H]1CCCN1C(=O)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001579450450 1075630729 /nfs/dbraw/zinc/63/07/29/1075630729.db2.gz OMMWJTPTEREEJC-NSHDSACASA-N -1 3 388.388 -1.046 20 0 GAADHM COC(=O)NCC(=O)N1C[C@@H]2[C@@H](CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H]2C1 ZINC001579454872 1075630995 /nfs/dbraw/zinc/63/09/95/1075630995.db2.gz CYEGODKJBRDDJV-RTCCRHLQSA-N -1 3 388.388 -1.015 20 0 GAADHM COC(=O)NCC(=O)N1C[C@@H]2[C@@H](CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H]2C1 ZINC001579454872 1075630993 /nfs/dbraw/zinc/63/09/93/1075630993.db2.gz CYEGODKJBRDDJV-RTCCRHLQSA-N -1 3 388.388 -1.015 20 0 GAADHM COC(=O)NCC(=O)N(C)C[C@H](O)CNc1ncc(-c2nn[n-]n2)cc1F ZINC001579454902 1075631017 /nfs/dbraw/zinc/63/10/17/1075631017.db2.gz DQVIKWICIMHFST-SECBINFHSA-N -1 3 382.356 -1.012 20 0 GAADHM COC(=O)NCC(=O)N(C)C[C@H](O)CNc1ncc(-c2nnn[n-]2)cc1F ZINC001579454902 1075631015 /nfs/dbraw/zinc/63/10/15/1075631015.db2.gz DQVIKWICIMHFST-SECBINFHSA-N -1 3 382.356 -1.012 20 0 GAADHM COC(=O)NCC(=O)N(C)C[C@@H](O)CNc1ncc(-c2nn[n-]n2)cc1F ZINC001579454903 1075631090 /nfs/dbraw/zinc/63/10/90/1075631090.db2.gz DQVIKWICIMHFST-VIFPVBQESA-N -1 3 382.356 -1.012 20 0 GAADHM COC(=O)NCC(=O)N(C)C[C@@H](O)CNc1ncc(-c2nnn[n-]2)cc1F ZINC001579454903 1075631089 /nfs/dbraw/zinc/63/10/89/1075631089.db2.gz DQVIKWICIMHFST-VIFPVBQESA-N -1 3 382.356 -1.012 20 0 GAADHM COC(=O)NCC(=O)N(CCO)CCNc1ncc(-c2nn[n-]n2)cc1F ZINC001579455093 1075631002 /nfs/dbraw/zinc/63/10/02/1075631002.db2.gz LSJIJIRVIJIJKV-UHFFFAOYSA-N -1 3 382.356 -1.010 20 0 GAADHM COC(=O)NCC(=O)N(CCO)CCNc1ncc(-c2nnn[n-]2)cc1F ZINC001579455093 1075631001 /nfs/dbraw/zinc/63/10/01/1075631001.db2.gz LSJIJIRVIJIJKV-UHFFFAOYSA-N -1 3 382.356 -1.010 20 0 GAADHM COC(=O)NCC(=O)N(C)C[C@H](O)CN(C)c1ccc(-c2nn[n-]n2)nc1 ZINC001579455178 1075630978 /nfs/dbraw/zinc/63/09/78/1075630978.db2.gz NSIOHLIQEOQYEW-LLVKDONJSA-N -1 3 378.393 -1.127 20 0 GAADHM COC(=O)NCC(=O)N(C)C[C@H](O)CN(C)c1ccc(-c2nnn[n-]2)nc1 ZINC001579455178 1075630977 /nfs/dbraw/zinc/63/09/77/1075630977.db2.gz NSIOHLIQEOQYEW-LLVKDONJSA-N -1 3 378.393 -1.127 20 0 GAADHM COC(=O)NCC(=O)N(C)C[C@@H](O)CN(C)c1ccc(-c2nn[n-]n2)nc1 ZINC001579455179 1075631050 /nfs/dbraw/zinc/63/10/50/1075631050.db2.gz NSIOHLIQEOQYEW-NSHDSACASA-N -1 3 378.393 -1.127 20 0 GAADHM COC(=O)NCC(=O)N(C)C[C@@H](O)CN(C)c1ccc(-c2nnn[n-]2)nc1 ZINC001579455179 1075631047 /nfs/dbraw/zinc/63/10/47/1075631047.db2.gz NSIOHLIQEOQYEW-NSHDSACASA-N -1 3 378.393 -1.127 20 0 GAADHM COC(=O)NCC(=O)N1C[C@@H]2[C@@H](CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H]2C1 ZINC001579455293 1075631032 /nfs/dbraw/zinc/63/10/32/1075631032.db2.gz QRVXGSLIEUZKGP-RTCCRHLQSA-N -1 3 388.388 -1.015 20 0 GAADHM COC(=O)NCC(=O)N1C[C@@H]2[C@@H](CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H]2C1 ZINC001579455293 1075631028 /nfs/dbraw/zinc/63/10/28/1075631028.db2.gz QRVXGSLIEUZKGP-RTCCRHLQSA-N -1 3 388.388 -1.015 20 0 GAADHM COC(=O)NCC(=O)N(C)C[C@H](O)CN(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001579455887 1075631409 /nfs/dbraw/zinc/63/14/09/1075631409.db2.gz WVJIOZDGWWAHJO-LLVKDONJSA-N -1 3 378.393 -1.127 20 0 GAADHM COC(=O)NCC(=O)N(C)C[C@H](O)CN(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001579455887 1075631403 /nfs/dbraw/zinc/63/14/03/1075631403.db2.gz WVJIOZDGWWAHJO-LLVKDONJSA-N -1 3 378.393 -1.127 20 0 GAADHM COC(=O)NCC(=O)N(C)C[C@@H](O)CN(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001579455890 1075631391 /nfs/dbraw/zinc/63/13/91/1075631391.db2.gz WVJIOZDGWWAHJO-NSHDSACASA-N -1 3 378.393 -1.127 20 0 GAADHM COC(=O)NCC(=O)N(C)C[C@@H](O)CN(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001579455890 1075631387 /nfs/dbraw/zinc/63/13/87/1075631387.db2.gz WVJIOZDGWWAHJO-NSHDSACASA-N -1 3 378.393 -1.127 20 0 GAADHM COC(=O)NCC(=O)N(C)C[C@H](O)CN(C)c1ncccc1-c1nn[n-]n1 ZINC001579456060 1075631532 /nfs/dbraw/zinc/63/15/32/1075631532.db2.gz ZBPWJNYWFHZHRL-JTQLQIEISA-N -1 3 378.393 -1.127 20 0 GAADHM COC(=O)NCC(=O)N(C)C[C@H](O)CN(C)c1ncccc1-c1nnn[n-]1 ZINC001579456060 1075631531 /nfs/dbraw/zinc/63/15/31/1075631531.db2.gz ZBPWJNYWFHZHRL-JTQLQIEISA-N -1 3 378.393 -1.127 20 0 GAADHM COC(=O)NCC(=O)N(C)C[C@@H](O)CN(C)c1ncccc1-c1nn[n-]n1 ZINC001579456061 1075631460 /nfs/dbraw/zinc/63/14/60/1075631460.db2.gz ZBPWJNYWFHZHRL-SNVBAGLBSA-N -1 3 378.393 -1.127 20 0 GAADHM COC(=O)NCC(=O)N(C)C[C@@H](O)CN(C)c1ncccc1-c1nnn[n-]1 ZINC001579456061 1075631456 /nfs/dbraw/zinc/63/14/56/1075631456.db2.gz ZBPWJNYWFHZHRL-SNVBAGLBSA-N -1 3 378.393 -1.127 20 0 GAADHM COC(=O)NCC(=O)N1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@H](OC)C1 ZINC001579458322 1075631537 /nfs/dbraw/zinc/63/15/37/1075631537.db2.gz JYLFLQWJFQYVGS-GHMZBOCLSA-N -1 3 392.376 -1.494 20 0 GAADHM COC(=O)NCC(=O)N1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@H](OC)C1 ZINC001579458322 1075631536 /nfs/dbraw/zinc/63/15/36/1075631536.db2.gz JYLFLQWJFQYVGS-GHMZBOCLSA-N -1 3 392.376 -1.494 20 0 GAADHM COC(=O)NCC(=O)N1CCOC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579458354 1075631731 /nfs/dbraw/zinc/63/17/31/1075631731.db2.gz LJZJVRKOVWDRBS-JTQLQIEISA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCOC[C@@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579458354 1075631726 /nfs/dbraw/zinc/63/17/26/1075631726.db2.gz LJZJVRKOVWDRBS-JTQLQIEISA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCOC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579458355 1075631706 /nfs/dbraw/zinc/63/17/06/1075631706.db2.gz LJZJVRKOVWDRBS-SNVBAGLBSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCOC[C@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579458355 1075631702 /nfs/dbraw/zinc/63/17/02/1075631702.db2.gz LJZJVRKOVWDRBS-SNVBAGLBSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCO[C@@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579458610 1075631692 /nfs/dbraw/zinc/63/16/92/1075631692.db2.gz NPINDSMYRSGPET-JTQLQIEISA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCO[C@@H](CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579458610 1075631689 /nfs/dbraw/zinc/63/16/89/1075631689.db2.gz NPINDSMYRSGPET-JTQLQIEISA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCO[C@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001579458611 1075631786 /nfs/dbraw/zinc/63/17/86/1075631786.db2.gz NPINDSMYRSGPET-SNVBAGLBSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCO[C@H](CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001579458611 1075631784 /nfs/dbraw/zinc/63/17/84/1075631784.db2.gz NPINDSMYRSGPET-SNVBAGLBSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCO[C@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579458620 1075631858 /nfs/dbraw/zinc/63/18/58/1075631858.db2.gz NTKXGVQJMUWSQZ-SECBINFHSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCO[C@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579458620 1075631855 /nfs/dbraw/zinc/63/18/55/1075631855.db2.gz NTKXGVQJMUWSQZ-SECBINFHSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCO[C@@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001579458621 1075631684 /nfs/dbraw/zinc/63/16/84/1075631684.db2.gz NTKXGVQJMUWSQZ-VIFPVBQESA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCO[C@@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001579458621 1075631680 /nfs/dbraw/zinc/63/16/80/1075631680.db2.gz NTKXGVQJMUWSQZ-VIFPVBQESA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCOC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579458645 1075631828 /nfs/dbraw/zinc/63/18/28/1075631828.db2.gz PHPZAXOQTQIAEU-SECBINFHSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCOC[C@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579458645 1075631824 /nfs/dbraw/zinc/63/18/24/1075631824.db2.gz PHPZAXOQTQIAEU-SECBINFHSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCOC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579458646 1075631878 /nfs/dbraw/zinc/63/18/78/1075631878.db2.gz PHPZAXOQTQIAEU-VIFPVBQESA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCOC[C@@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579458646 1075631873 /nfs/dbraw/zinc/63/18/73/1075631873.db2.gz PHPZAXOQTQIAEU-VIFPVBQESA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCO[C@@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579458932 1075631720 /nfs/dbraw/zinc/63/17/20/1075631720.db2.gz SMWINLULMIYNCT-JTQLQIEISA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCO[C@@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579458932 1075631714 /nfs/dbraw/zinc/63/17/14/1075631714.db2.gz SMWINLULMIYNCT-JTQLQIEISA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCO[C@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579458933 1075631868 /nfs/dbraw/zinc/63/18/68/1075631868.db2.gz SMWINLULMIYNCT-SNVBAGLBSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCO[C@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579458933 1075631865 /nfs/dbraw/zinc/63/18/65/1075631865.db2.gz SMWINLULMIYNCT-SNVBAGLBSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCOC[C@@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579459009 1075631777 /nfs/dbraw/zinc/63/17/77/1075631777.db2.gz XEYQRKJDLGZWKL-JTQLQIEISA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCOC[C@@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579459009 1075631773 /nfs/dbraw/zinc/63/17/73/1075631773.db2.gz XEYQRKJDLGZWKL-JTQLQIEISA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCOC[C@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579459010 1075631887 /nfs/dbraw/zinc/63/18/87/1075631887.db2.gz XEYQRKJDLGZWKL-SNVBAGLBSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1CCOC[C@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579459010 1075631882 /nfs/dbraw/zinc/63/18/82/1075631882.db2.gz XEYQRKJDLGZWKL-SNVBAGLBSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)N1C[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@H](OC)C1 ZINC001579459163 1075632094 /nfs/dbraw/zinc/63/20/94/1075632094.db2.gz ZUPVBTXPDBEPHN-GHMZBOCLSA-N -1 3 392.376 -1.494 20 0 GAADHM COC(=O)NCC(=O)N1C[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@H](OC)C1 ZINC001579459163 1075632093 /nfs/dbraw/zinc/63/20/93/1075632093.db2.gz ZUPVBTXPDBEPHN-GHMZBOCLSA-N -1 3 392.376 -1.494 20 0 GAADHM COC(=O)NCC(=O)N1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](OC)C1 ZINC001579459166 1075632120 /nfs/dbraw/zinc/63/21/20/1075632120.db2.gz ZXYSFHHBRYUAPS-GHMZBOCLSA-N -1 3 392.376 -1.494 20 0 GAADHM COC(=O)NCC(=O)N1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H](OC)C1 ZINC001579459166 1075632119 /nfs/dbraw/zinc/63/21/19/1075632119.db2.gz ZXYSFHHBRYUAPS-GHMZBOCLSA-N -1 3 392.376 -1.494 20 0 GAADHM COC(=O)NCC(=O)NC[C@@]1(O)CCN(c2ccc(-c3nn[n-]n3)c(C)n2)C1 ZINC001579461040 1075632165 /nfs/dbraw/zinc/63/21/65/1075632165.db2.gz AWMZALNKXZLLAB-INIZCTEOSA-N -1 3 390.404 -1.016 20 0 GAADHM COC(=O)NCC(=O)NC[C@@]1(O)CCN(c2ccc(-c3nnn[n-]3)c(C)n2)C1 ZINC001579461040 1075632164 /nfs/dbraw/zinc/63/21/64/1075632164.db2.gz AWMZALNKXZLLAB-INIZCTEOSA-N -1 3 390.404 -1.016 20 0 GAADHM COC(=O)NCC(=O)NC[C@]1(O)CCN(c2ccc(-c3nn[n-]n3)c(C)n2)C1 ZINC001579461043 1075632172 /nfs/dbraw/zinc/63/21/72/1075632172.db2.gz AWMZALNKXZLLAB-MRXNPFEDSA-N -1 3 390.404 -1.016 20 0 GAADHM COC(=O)NCC(=O)NC[C@]1(O)CCN(c2ccc(-c3nnn[n-]3)c(C)n2)C1 ZINC001579461043 1075632170 /nfs/dbraw/zinc/63/21/70/1075632170.db2.gz AWMZALNKXZLLAB-MRXNPFEDSA-N -1 3 390.404 -1.016 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2nc(C)ccc2-c2nn[n-]n2)C[C@@H]1O ZINC001579461172 1075632207 /nfs/dbraw/zinc/63/22/07/1075632207.db2.gz CJZQNVIPLKKYKE-NEPJUHHUSA-N -1 3 390.404 -1.018 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2nc(C)ccc2-c2nnn[n-]2)C[C@@H]1O ZINC001579461172 1075632206 /nfs/dbraw/zinc/63/22/06/1075632206.db2.gz CJZQNVIPLKKYKE-NEPJUHHUSA-N -1 3 390.404 -1.018 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2nc(C)ccc2-c2nn[n-]n2)C[C@H]1O ZINC001579461174 1075632500 /nfs/dbraw/zinc/63/25/00/1075632500.db2.gz CJZQNVIPLKKYKE-NWDGAFQWSA-N -1 3 390.404 -1.018 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2nc(C)ccc2-c2nnn[n-]2)C[C@H]1O ZINC001579461174 1075632498 /nfs/dbraw/zinc/63/24/98/1075632498.db2.gz CJZQNVIPLKKYKE-NWDGAFQWSA-N -1 3 390.404 -1.018 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2nc(C)ccc2-c2nn[n-]n2)C[C@@H]1O ZINC001579461176 1075632558 /nfs/dbraw/zinc/63/25/58/1075632558.db2.gz CJZQNVIPLKKYKE-RYUDHWBXSA-N -1 3 390.404 -1.018 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2nc(C)ccc2-c2nnn[n-]2)C[C@@H]1O ZINC001579461176 1075632554 /nfs/dbraw/zinc/63/25/54/1075632554.db2.gz CJZQNVIPLKKYKE-RYUDHWBXSA-N -1 3 390.404 -1.018 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2nc(C)ccc2-c2nn[n-]n2)C[C@H]1O ZINC001579461178 1075632629 /nfs/dbraw/zinc/63/26/29/1075632629.db2.gz CJZQNVIPLKKYKE-VXGBXAGGSA-N -1 3 390.404 -1.018 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2nc(C)ccc2-c2nnn[n-]2)C[C@H]1O ZINC001579461178 1075632627 /nfs/dbraw/zinc/63/26/27/1075632627.db2.gz CJZQNVIPLKKYKE-VXGBXAGGSA-N -1 3 390.404 -1.018 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1O ZINC001579461474 1075632623 /nfs/dbraw/zinc/63/26/23/1075632623.db2.gz GTNMTTYACSOFBA-GHMZBOCLSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C[C@H]1O ZINC001579461474 1075632622 /nfs/dbraw/zinc/63/26/22/1075632622.db2.gz GTNMTTYACSOFBA-GHMZBOCLSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001579461475 1075632576 /nfs/dbraw/zinc/63/25/76/1075632576.db2.gz GTNMTTYACSOFBA-MNOVXSKESA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001579461475 1075632574 /nfs/dbraw/zinc/63/25/74/1075632574.db2.gz GTNMTTYACSOFBA-MNOVXSKESA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001579461476 1075632527 /nfs/dbraw/zinc/63/25/27/1075632527.db2.gz GTNMTTYACSOFBA-QWRGUYRKSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001579461476 1075632523 /nfs/dbraw/zinc/63/25/23/1075632523.db2.gz GTNMTTYACSOFBA-QWRGUYRKSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1O ZINC001579461477 1075632635 /nfs/dbraw/zinc/63/26/35/1075632635.db2.gz GTNMTTYACSOFBA-WDEREUQCSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C[C@H]1O ZINC001579461477 1075632633 /nfs/dbraw/zinc/63/26/33/1075632633.db2.gz GTNMTTYACSOFBA-WDEREUQCSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]21 ZINC001579461500 1075632891 /nfs/dbraw/zinc/63/28/91/1075632891.db2.gz HETBCVDOHWPESL-RTCCRHLQSA-N -1 3 388.388 -1.015 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]21 ZINC001579461500 1075632888 /nfs/dbraw/zinc/63/28/88/1075632888.db2.gz HETBCVDOHWPESL-RTCCRHLQSA-N -1 3 388.388 -1.015 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1[C@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]21 ZINC001579461511 1075632839 /nfs/dbraw/zinc/63/28/39/1075632839.db2.gz HGTMQGSEOCTOJH-RTCCRHLQSA-N -1 3 388.388 -1.015 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1[C@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]21 ZINC001579461511 1075632835 /nfs/dbraw/zinc/63/28/35/1075632835.db2.gz HGTMQGSEOCTOJH-RTCCRHLQSA-N -1 3 388.388 -1.015 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C[C@H]1O ZINC001579461555 1075632828 /nfs/dbraw/zinc/63/28/28/1075632828.db2.gz INKIRRLZAGFCHD-GHMZBOCLSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C[C@H]1O ZINC001579461555 1075632827 /nfs/dbraw/zinc/63/28/27/1075632827.db2.gz INKIRRLZAGFCHD-GHMZBOCLSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001579461556 1075632899 /nfs/dbraw/zinc/63/28/99/1075632899.db2.gz INKIRRLZAGFCHD-MNOVXSKESA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001579461556 1075632898 /nfs/dbraw/zinc/63/28/98/1075632898.db2.gz INKIRRLZAGFCHD-MNOVXSKESA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001579461557 1075632928 /nfs/dbraw/zinc/63/29/28/1075632928.db2.gz INKIRRLZAGFCHD-QWRGUYRKSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001579461557 1075632926 /nfs/dbraw/zinc/63/29/26/1075632926.db2.gz INKIRRLZAGFCHD-QWRGUYRKSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C[C@H]1O ZINC001579461558 1075632879 /nfs/dbraw/zinc/63/28/79/1075632879.db2.gz INKIRRLZAGFCHD-WDEREUQCSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C[C@H]1O ZINC001579461558 1075632877 /nfs/dbraw/zinc/63/28/77/1075632877.db2.gz INKIRRLZAGFCHD-WDEREUQCSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)NC[C@@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001579461595 1075632937 /nfs/dbraw/zinc/63/29/37/1075632937.db2.gz JEKGWJFYPDLXLH-HNNXBMFYSA-N -1 3 376.377 -1.325 20 0 GAADHM COC(=O)NCC(=O)NC[C@@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001579461595 1075632934 /nfs/dbraw/zinc/63/29/34/1075632934.db2.gz JEKGWJFYPDLXLH-HNNXBMFYSA-N -1 3 376.377 -1.325 20 0 GAADHM COC(=O)NCC(=O)NC[C@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001579461596 1075632920 /nfs/dbraw/zinc/63/29/20/1075632920.db2.gz JEKGWJFYPDLXLH-OAHLLOKOSA-N -1 3 376.377 -1.325 20 0 GAADHM COC(=O)NCC(=O)NC[C@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001579461596 1075632918 /nfs/dbraw/zinc/63/29/18/1075632918.db2.gz JEKGWJFYPDLXLH-OAHLLOKOSA-N -1 3 376.377 -1.325 20 0 GAADHM COC(=O)NCC(=O)NC[C@@]1(O)CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001579461651 1075632907 /nfs/dbraw/zinc/63/29/07/1075632907.db2.gz KWTZFFXTXQUZGY-HNNXBMFYSA-N -1 3 376.377 -1.325 20 0 GAADHM COC(=O)NCC(=O)NC[C@@]1(O)CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579461651 1075632906 /nfs/dbraw/zinc/63/29/06/1075632906.db2.gz KWTZFFXTXQUZGY-HNNXBMFYSA-N -1 3 376.377 -1.325 20 0 GAADHM COC(=O)NCC(=O)NC[C@]1(O)CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001579461652 1075632914 /nfs/dbraw/zinc/63/29/14/1075632914.db2.gz KWTZFFXTXQUZGY-OAHLLOKOSA-N -1 3 376.377 -1.325 20 0 GAADHM COC(=O)NCC(=O)NC[C@]1(O)CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001579461652 1075632913 /nfs/dbraw/zinc/63/29/13/1075632913.db2.gz KWTZFFXTXQUZGY-OAHLLOKOSA-N -1 3 376.377 -1.325 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1[C@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]21 ZINC001579461667 1075633327 /nfs/dbraw/zinc/63/33/27/1075633327.db2.gz LIHSLLVCTGONNG-OWUUHHOZSA-N -1 3 388.388 -1.015 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1[C@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]21 ZINC001579461667 1075633326 /nfs/dbraw/zinc/63/33/26/1075633326.db2.gz LIHSLLVCTGONNG-OWUUHHOZSA-N -1 3 388.388 -1.015 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)c(C)n2)C[C@@H]1O ZINC001579461733 1075633313 /nfs/dbraw/zinc/63/33/13/1075633313.db2.gz NBCTVUJXFXTEIA-NEPJUHHUSA-N -1 3 390.404 -1.018 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)c(C)n2)C[C@@H]1O ZINC001579461733 1075633311 /nfs/dbraw/zinc/63/33/11/1075633311.db2.gz NBCTVUJXFXTEIA-NEPJUHHUSA-N -1 3 390.404 -1.018 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)c(C)n2)C[C@H]1O ZINC001579461734 1075633308 /nfs/dbraw/zinc/63/33/08/1075633308.db2.gz NBCTVUJXFXTEIA-NWDGAFQWSA-N -1 3 390.404 -1.018 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)c(C)n2)C[C@H]1O ZINC001579461734 1075633306 /nfs/dbraw/zinc/63/33/06/1075633306.db2.gz NBCTVUJXFXTEIA-NWDGAFQWSA-N -1 3 390.404 -1.018 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)c(C)n2)C[C@@H]1O ZINC001579461735 1075633234 /nfs/dbraw/zinc/63/32/34/1075633234.db2.gz NBCTVUJXFXTEIA-RYUDHWBXSA-N -1 3 390.404 -1.018 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)c(C)n2)C[C@@H]1O ZINC001579461735 1075633231 /nfs/dbraw/zinc/63/32/31/1075633231.db2.gz NBCTVUJXFXTEIA-RYUDHWBXSA-N -1 3 390.404 -1.018 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)c(C)n2)C[C@H]1O ZINC001579461736 1075633321 /nfs/dbraw/zinc/63/33/21/1075633321.db2.gz NBCTVUJXFXTEIA-VXGBXAGGSA-N -1 3 390.404 -1.018 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)c(C)n2)C[C@H]1O ZINC001579461736 1075633320 /nfs/dbraw/zinc/63/33/20/1075633320.db2.gz NBCTVUJXFXTEIA-VXGBXAGGSA-N -1 3 390.404 -1.018 20 0 GAADHM COC(=O)NCC(=O)NCC1(O)CN(Cc2cccc(-c3nn[n-]n3)c2)C1 ZINC001579461990 1075633317 /nfs/dbraw/zinc/63/33/17/1075633317.db2.gz SFEIAKOEBRSOMD-UHFFFAOYSA-N -1 3 375.389 -1.114 20 0 GAADHM COC(=O)NCC(=O)NCC1(O)CN(Cc2cccc(-c3nnn[n-]3)c2)C1 ZINC001579461990 1075633315 /nfs/dbraw/zinc/63/33/15/1075633315.db2.gz SFEIAKOEBRSOMD-UHFFFAOYSA-N -1 3 375.389 -1.114 20 0 GAADHM COC(=O)NCC(=O)NC[C@@]1(O)CCN(c2nc(C)ccc2-c2nn[n-]n2)C1 ZINC001579462032 1075633215 /nfs/dbraw/zinc/63/32/15/1075633215.db2.gz UFHMJHJXWULMBB-INIZCTEOSA-N -1 3 390.404 -1.016 20 0 GAADHM COC(=O)NCC(=O)NC[C@@]1(O)CCN(c2nc(C)ccc2-c2nnn[n-]2)C1 ZINC001579462032 1075633213 /nfs/dbraw/zinc/63/32/13/1075633213.db2.gz UFHMJHJXWULMBB-INIZCTEOSA-N -1 3 390.404 -1.016 20 0 GAADHM COC(=O)NCC(=O)NC[C@]1(O)CCN(c2nc(C)ccc2-c2nn[n-]n2)C1 ZINC001579462033 1075633226 /nfs/dbraw/zinc/63/32/26/1075633226.db2.gz UFHMJHJXWULMBB-MRXNPFEDSA-N -1 3 390.404 -1.016 20 0 GAADHM COC(=O)NCC(=O)NC[C@]1(O)CCN(c2nc(C)ccc2-c2nnn[n-]2)C1 ZINC001579462033 1075633222 /nfs/dbraw/zinc/63/32/22/1075633222.db2.gz UFHMJHJXWULMBB-MRXNPFEDSA-N -1 3 390.404 -1.016 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O ZINC001579462113 1075633303 /nfs/dbraw/zinc/63/33/03/1075633303.db2.gz WCHGNMKTGBOIQM-CMPLNLGQSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O ZINC001579462113 1075633300 /nfs/dbraw/zinc/63/33/00/1075633300.db2.gz WCHGNMKTGBOIQM-CMPLNLGQSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001579462114 1075633277 /nfs/dbraw/zinc/63/32/77/1075633277.db2.gz WCHGNMKTGBOIQM-JQWIXIFHSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001579462114 1075633276 /nfs/dbraw/zinc/63/32/76/1075633276.db2.gz WCHGNMKTGBOIQM-JQWIXIFHSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001579462115 1075633295 /nfs/dbraw/zinc/63/32/95/1075633295.db2.gz WCHGNMKTGBOIQM-PWSUYJOCSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001579462115 1075633293 /nfs/dbraw/zinc/63/32/93/1075633293.db2.gz WCHGNMKTGBOIQM-PWSUYJOCSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O ZINC001579462116 1075633506 /nfs/dbraw/zinc/63/35/06/1075633506.db2.gz WCHGNMKTGBOIQM-ZYHUDNBSSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O ZINC001579462116 1075633501 /nfs/dbraw/zinc/63/35/01/1075633501.db2.gz WCHGNMKTGBOIQM-ZYHUDNBSSA-N -1 3 376.377 -1.327 20 0 GAADHM COC(=O)NCC(=O)NCC1(O)CN(Cc2ccc(-c3nn[n-]n3)cc2)C1 ZINC001579462162 1075633636 /nfs/dbraw/zinc/63/36/36/1075633636.db2.gz WYGHBDKXBXYMRR-UHFFFAOYSA-N -1 3 375.389 -1.114 20 0 GAADHM COC(=O)NCC(=O)NCC1(O)CN(Cc2ccc(-c3nnn[n-]3)cc2)C1 ZINC001579462162 1075633633 /nfs/dbraw/zinc/63/36/33/1075633633.db2.gz WYGHBDKXBXYMRR-UHFFFAOYSA-N -1 3 375.389 -1.114 20 0 GAADHM COC(=O)NCC(=O)NCC1(O)CN(Cc2ccc(-c3nnn[n-]3)s2)C1 ZINC001579462203 1075633544 /nfs/dbraw/zinc/63/35/44/1075633544.db2.gz XSRVRSKVOGSLGH-UHFFFAOYSA-N -1 3 381.418 -1.053 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1COCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579462288 1075633271 /nfs/dbraw/zinc/63/32/71/1075633271.db2.gz ABCYBCFABOHHFJ-SECBINFHSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1COCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579462288 1075633269 /nfs/dbraw/zinc/63/32/69/1075633269.db2.gz ABCYBCFABOHHFJ-SECBINFHSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NC[C@H]1COCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579462289 1075633243 /nfs/dbraw/zinc/63/32/43/1075633243.db2.gz ABCYBCFABOHHFJ-VIFPVBQESA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NC[C@H]1COCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579462289 1075633241 /nfs/dbraw/zinc/63/32/41/1075633241.db2.gz ABCYBCFABOHHFJ-VIFPVBQESA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NCCN1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001579462323 1075633740 /nfs/dbraw/zinc/63/37/40/1075633740.db2.gz BADASVNKXHLRGS-UHFFFAOYSA-N -1 3 389.420 -1.144 20 0 GAADHM COC(=O)NCC(=O)NCCN1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001579462323 1075633734 /nfs/dbraw/zinc/63/37/34/1075633734.db2.gz BADASVNKXHLRGS-UHFFFAOYSA-N -1 3 389.420 -1.144 20 0 GAADHM COC(=O)NCC(=O)NC[C@H]1COCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579462346 1075633650 /nfs/dbraw/zinc/63/36/50/1075633650.db2.gz BZUZJWHSQRNKED-JTQLQIEISA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NC[C@H]1COCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579462346 1075633644 /nfs/dbraw/zinc/63/36/44/1075633644.db2.gz BZUZJWHSQRNKED-JTQLQIEISA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1COCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579462347 1075633518 /nfs/dbraw/zinc/63/35/18/1075633518.db2.gz BZUZJWHSQRNKED-SNVBAGLBSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1COCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579462347 1075633514 /nfs/dbraw/zinc/63/35/14/1075633514.db2.gz BZUZJWHSQRNKED-SNVBAGLBSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)CCO1 ZINC001579462425 1075633774 /nfs/dbraw/zinc/63/37/74/1075633774.db2.gz FCNXYIIJWVPXRE-LLVKDONJSA-N -1 3 376.377 -1.061 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)CCO1 ZINC001579462425 1075633771 /nfs/dbraw/zinc/63/37/71/1075633771.db2.gz FCNXYIIJWVPXRE-LLVKDONJSA-N -1 3 376.377 -1.061 20 0 GAADHM COC(=O)NCC(=O)NC[C@H]1CN(c2ccc(-c3nn[n-]n3)nc2)CCO1 ZINC001579462426 1075633606 /nfs/dbraw/zinc/63/36/06/1075633606.db2.gz FCNXYIIJWVPXRE-NSHDSACASA-N -1 3 376.377 -1.061 20 0 GAADHM COC(=O)NCC(=O)NC[C@H]1CN(c2ccc(-c3nnn[n-]3)nc2)CCO1 ZINC001579462426 1075633602 /nfs/dbraw/zinc/63/36/02/1075633602.db2.gz FCNXYIIJWVPXRE-NSHDSACASA-N -1 3 376.377 -1.061 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1COCCN1c1ccc(-c2nn[n-]n2)nc1 ZINC001579462473 1075633858 /nfs/dbraw/zinc/63/38/58/1075633858.db2.gz HBGUGMGULSQOSB-LLVKDONJSA-N -1 3 376.377 -1.061 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1COCCN1c1ccc(-c2nnn[n-]2)nc1 ZINC001579462473 1075633857 /nfs/dbraw/zinc/63/38/57/1075633857.db2.gz HBGUGMGULSQOSB-LLVKDONJSA-N -1 3 376.377 -1.061 20 0 GAADHM COC(=O)NCC(=O)NC[C@H]1COCCN1c1ccc(-c2nn[n-]n2)nc1 ZINC001579462474 1075633897 /nfs/dbraw/zinc/63/38/97/1075633897.db2.gz HBGUGMGULSQOSB-NSHDSACASA-N -1 3 376.377 -1.061 20 0 GAADHM COC(=O)NCC(=O)NC[C@H]1COCCN1c1ccc(-c2nnn[n-]2)nc1 ZINC001579462474 1075633896 /nfs/dbraw/zinc/63/38/96/1075633896.db2.gz HBGUGMGULSQOSB-NSHDSACASA-N -1 3 376.377 -1.061 20 0 GAADHM COC(=O)NCC(=O)NCCN1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001579462562 1075634028 /nfs/dbraw/zinc/63/40/28/1075634028.db2.gz KCNHTTFFADICRZ-UHFFFAOYSA-N -1 3 389.420 -1.144 20 0 GAADHM COC(=O)NCC(=O)NCCN1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001579462562 1075634020 /nfs/dbraw/zinc/63/40/20/1075634020.db2.gz KCNHTTFFADICRZ-UHFFFAOYSA-N -1 3 389.420 -1.144 20 0 GAADHM COC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCO1 ZINC001579462572 1075633884 /nfs/dbraw/zinc/63/38/84/1075633884.db2.gz KGOUDRLAQSBFIJ-JTQLQIEISA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCO1 ZINC001579462572 1075633883 /nfs/dbraw/zinc/63/38/83/1075633883.db2.gz KGOUDRLAQSBFIJ-JTQLQIEISA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCO1 ZINC001579462573 1075633946 /nfs/dbraw/zinc/63/39/46/1075633946.db2.gz KGOUDRLAQSBFIJ-SNVBAGLBSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCO1 ZINC001579462573 1075633939 /nfs/dbraw/zinc/63/39/39/1075633939.db2.gz KGOUDRLAQSBFIJ-SNVBAGLBSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1 ZINC001579462589 1075634081 /nfs/dbraw/zinc/63/40/81/1075634081.db2.gz LBLYOBNTRXKPRV-JTQLQIEISA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NC[C@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1 ZINC001579462589 1075634074 /nfs/dbraw/zinc/63/40/74/1075634074.db2.gz LBLYOBNTRXKPRV-JTQLQIEISA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1 ZINC001579462590 1075634046 /nfs/dbraw/zinc/63/40/46/1075634046.db2.gz LBLYOBNTRXKPRV-SNVBAGLBSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1 ZINC001579462590 1075634038 /nfs/dbraw/zinc/63/40/38/1075634038.db2.gz LBLYOBNTRXKPRV-SNVBAGLBSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NCCN1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001579462790 1075634341 /nfs/dbraw/zinc/63/43/41/1075634341.db2.gz OTEQLINCGZMMOO-UHFFFAOYSA-N -1 3 389.420 -1.144 20 0 GAADHM COC(=O)NCC(=O)NCCN1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001579462790 1075634339 /nfs/dbraw/zinc/63/43/39/1075634339.db2.gz OTEQLINCGZMMOO-UHFFFAOYSA-N -1 3 389.420 -1.144 20 0 GAADHM COC(=O)NCC(=O)NCCN1CCN(c2ccc(-c3nnn[n-]3)nn2)CC1 ZINC001579463054 1075634529 /nfs/dbraw/zinc/63/45/29/1075634529.db2.gz QFZIWROXQRTHLX-UHFFFAOYSA-N -1 3 390.408 -1.749 20 0 GAADHM COC(=O)NCC(=O)NC[C@H]1COCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579463494 1075634399 /nfs/dbraw/zinc/63/43/99/1075634399.db2.gz UEIJYZIREZZZLJ-JTQLQIEISA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NC[C@H]1COCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579463494 1075634398 /nfs/dbraw/zinc/63/43/98/1075634398.db2.gz UEIJYZIREZZZLJ-JTQLQIEISA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1COCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579463495 1075634432 /nfs/dbraw/zinc/63/44/32/1075634432.db2.gz UEIJYZIREZZZLJ-SNVBAGLBSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1COCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579463495 1075634426 /nfs/dbraw/zinc/63/44/26/1075634426.db2.gz UEIJYZIREZZZLJ-SNVBAGLBSA-N -1 3 392.376 -1.492 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1COCCN1c1ccc(-c2nn[n-]n2)cn1 ZINC001579463508 1075634898 /nfs/dbraw/zinc/63/48/98/1075634898.db2.gz UTWOXIWPMPGPIN-LLVKDONJSA-N -1 3 376.377 -1.061 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1COCCN1c1ccc(-c2nnn[n-]2)cn1 ZINC001579463508 1075634896 /nfs/dbraw/zinc/63/48/96/1075634896.db2.gz UTWOXIWPMPGPIN-LLVKDONJSA-N -1 3 376.377 -1.061 20 0 GAADHM COC(=O)NCC(=O)NC[C@H]1COCCN1c1ccc(-c2nn[n-]n2)cn1 ZINC001579463509 1075634777 /nfs/dbraw/zinc/63/47/77/1075634777.db2.gz UTWOXIWPMPGPIN-NSHDSACASA-N -1 3 376.377 -1.061 20 0 GAADHM COC(=O)NCC(=O)NC[C@H]1COCCN1c1ccc(-c2nnn[n-]2)cn1 ZINC001579463509 1075634772 /nfs/dbraw/zinc/63/47/72/1075634772.db2.gz UTWOXIWPMPGPIN-NSHDSACASA-N -1 3 376.377 -1.061 20 0 GAADHM COC(=O)NCC(=O)NC[C@H]1COCCN1c1ncccc1-c1nn[n-]n1 ZINC001579463513 1075634888 /nfs/dbraw/zinc/63/48/88/1075634888.db2.gz UZMONVZZGHZNHV-JTQLQIEISA-N -1 3 376.377 -1.061 20 0 GAADHM COC(=O)NCC(=O)NC[C@H]1COCCN1c1ncccc1-c1nnn[n-]1 ZINC001579463513 1075634883 /nfs/dbraw/zinc/63/48/83/1075634883.db2.gz UZMONVZZGHZNHV-JTQLQIEISA-N -1 3 376.377 -1.061 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1COCCN1c1ncccc1-c1nn[n-]n1 ZINC001579463514 1075634968 /nfs/dbraw/zinc/63/49/68/1075634968.db2.gz UZMONVZZGHZNHV-SNVBAGLBSA-N -1 3 376.377 -1.061 20 0 GAADHM COC(=O)NCC(=O)NC[C@@H]1COCCN1c1ncccc1-c1nnn[n-]1 ZINC001579463514 1075634964 /nfs/dbraw/zinc/63/49/64/1075634964.db2.gz UZMONVZZGHZNHV-SNVBAGLBSA-N -1 3 376.377 -1.061 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)s2)C[C@H]1O ZINC001579464149 1075634933 /nfs/dbraw/zinc/63/49/33/1075634933.db2.gz AXUDSZZKDMLMEF-NXEZZACHSA-N -1 3 381.418 -1.055 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)s2)C[C@H]1O ZINC001579464149 1075634928 /nfs/dbraw/zinc/63/49/28/1075634928.db2.gz AXUDSZZKDMLMEF-NXEZZACHSA-N -1 3 381.418 -1.055 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)s2)C[C@@H]1O ZINC001579464150 1075634741 /nfs/dbraw/zinc/63/47/41/1075634741.db2.gz AXUDSZZKDMLMEF-ZJUUUORDSA-N -1 3 381.418 -1.055 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)s2)C[C@@H]1O ZINC001579464150 1075634737 /nfs/dbraw/zinc/63/47/37/1075634737.db2.gz AXUDSZZKDMLMEF-ZJUUUORDSA-N -1 3 381.418 -1.055 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1OC ZINC001579464205 1075634872 /nfs/dbraw/zinc/63/48/72/1075634872.db2.gz FJQQRAJTUVGNOJ-GHMZBOCLSA-N -1 3 376.377 -1.063 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@H]1OC ZINC001579464205 1075634870 /nfs/dbraw/zinc/63/48/70/1075634870.db2.gz FJQQRAJTUVGNOJ-GHMZBOCLSA-N -1 3 376.377 -1.063 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)c(C)n2)C[C@H]1O ZINC001579464223 1075634842 /nfs/dbraw/zinc/63/48/42/1075634842.db2.gz GJZYDZPBYGFOPA-GHMZBOCLSA-N -1 3 376.377 -1.408 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)c(C)n2)C[C@H]1O ZINC001579464223 1075634839 /nfs/dbraw/zinc/63/48/39/1075634839.db2.gz GJZYDZPBYGFOPA-GHMZBOCLSA-N -1 3 376.377 -1.408 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)c(C)n2)C[C@@H]1O ZINC001579464224 1075634989 /nfs/dbraw/zinc/63/49/89/1075634989.db2.gz GJZYDZPBYGFOPA-MNOVXSKESA-N -1 3 376.377 -1.408 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)c(C)n2)C[C@@H]1O ZINC001579464224 1075634986 /nfs/dbraw/zinc/63/49/86/1075634986.db2.gz GJZYDZPBYGFOPA-MNOVXSKESA-N -1 3 376.377 -1.408 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1OC ZINC001579464395 1075634909 /nfs/dbraw/zinc/63/49/09/1075634909.db2.gz IBMJNCHFNPETON-GHMZBOCLSA-N -1 3 392.376 -1.494 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1OC ZINC001579464395 1075634907 /nfs/dbraw/zinc/63/49/07/1075634907.db2.gz IBMJNCHFNPETON-GHMZBOCLSA-N -1 3 392.376 -1.494 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1OC ZINC001579464418 1075634980 /nfs/dbraw/zinc/63/49/80/1075634980.db2.gz JWMCBJVBQKCDGO-VXGBXAGGSA-N -1 3 376.377 -1.063 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1OC ZINC001579464418 1075634977 /nfs/dbraw/zinc/63/49/77/1075634977.db2.gz JWMCBJVBQKCDGO-VXGBXAGGSA-N -1 3 376.377 -1.063 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(c2nc(C)ccc2-c2nn[n-]n2)C[C@H]1O ZINC001579464436 1075634955 /nfs/dbraw/zinc/63/49/55/1075634955.db2.gz KIJIONQVLAISKS-GHMZBOCLSA-N -1 3 376.377 -1.408 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(c2nc(C)ccc2-c2nnn[n-]2)C[C@H]1O ZINC001579464436 1075634951 /nfs/dbraw/zinc/63/49/51/1075634951.db2.gz KIJIONQVLAISKS-GHMZBOCLSA-N -1 3 376.377 -1.408 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(c2nc(C)ccc2-c2nn[n-]n2)C[C@@H]1O ZINC001579464437 1075635217 /nfs/dbraw/zinc/63/52/17/1075635217.db2.gz KIJIONQVLAISKS-MNOVXSKESA-N -1 3 376.377 -1.408 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(c2nc(C)ccc2-c2nnn[n-]2)C[C@@H]1O ZINC001579464437 1075635216 /nfs/dbraw/zinc/63/52/16/1075635216.db2.gz KIJIONQVLAISKS-MNOVXSKESA-N -1 3 376.377 -1.408 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1OC ZINC001579464504 1075635305 /nfs/dbraw/zinc/63/53/05/1075635305.db2.gz OAIGZOLSKRGKKP-GHMZBOCLSA-N -1 3 392.376 -1.494 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1OC ZINC001579464504 1075635303 /nfs/dbraw/zinc/63/53/03/1075635303.db2.gz OAIGZOLSKRGKKP-GHMZBOCLSA-N -1 3 392.376 -1.494 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(c2snc(C)c2-c2nnn[n-]2)C[C@H]1O ZINC001579464551 1075635325 /nfs/dbraw/zinc/63/53/25/1075635325.db2.gz QXMHJDAJUMGZSY-HTQZYQBOSA-N -1 3 382.406 -1.347 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1OC ZINC001579464565 1075635188 /nfs/dbraw/zinc/63/51/88/1075635188.db2.gz RTKROMHWKQWTHT-GHMZBOCLSA-N -1 3 392.376 -1.494 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1OC ZINC001579464565 1075635187 /nfs/dbraw/zinc/63/51/87/1075635187.db2.gz RTKROMHWKQWTHT-GHMZBOCLSA-N -1 3 392.376 -1.494 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001579464596 1075635237 /nfs/dbraw/zinc/63/52/37/1075635237.db2.gz UNNAJOMYDYYUGV-ZJUUUORDSA-N -1 3 380.340 -1.578 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001579464596 1075635234 /nfs/dbraw/zinc/63/52/34/1075635234.db2.gz UNNAJOMYDYYUGV-ZJUUUORDSA-N -1 3 380.340 -1.578 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@H]1OC ZINC001579464665 1075635150 /nfs/dbraw/zinc/63/51/50/1075635150.db2.gz YZEREXZHNPIUBY-GHMZBOCLSA-N -1 3 376.377 -1.063 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@H]1OC ZINC001579464665 1075635141 /nfs/dbraw/zinc/63/51/41/1075635141.db2.gz YZEREXZHNPIUBY-GHMZBOCLSA-N -1 3 376.377 -1.063 20 0 GAADHM COC(=O)[C@@H](F)CNC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001579466018 1075635228 /nfs/dbraw/zinc/63/52/28/1075635228.db2.gz WPJHAJKWKXFXKE-JTQLQIEISA-N -1 3 386.365 -1.228 20 0 GAADHM COC(=O)[C@@H](F)CNC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001579466018 1075635225 /nfs/dbraw/zinc/63/52/25/1075635225.db2.gz WPJHAJKWKXFXKE-JTQLQIEISA-N -1 3 386.365 -1.228 20 0 GAADHM COC(=O)[C@@]1(CNC(=O)c2ccc(-c3nn[n-]n3)n2C)C[C@@H]1S(C)(=O)=O ZINC001579472649 1075635668 /nfs/dbraw/zinc/63/56/68/1075635668.db2.gz BFMWYEGYRKDIMV-IINYFYTJSA-N -1 3 382.402 -1.089 20 0 GAADHM COC(=O)[C@@]1(CNC(=O)c2ccc(-c3nnn[n-]3)n2C)C[C@@H]1S(C)(=O)=O ZINC001579472649 1075635666 /nfs/dbraw/zinc/63/56/66/1075635666.db2.gz BFMWYEGYRKDIMV-IINYFYTJSA-N -1 3 382.402 -1.089 20 0 GAADHM COC(=O)[C@@]1(CNC(=O)c2cc(-c3nn[n-]n3)ccn2)C[C@@H]1S(C)(=O)=O ZINC001579472813 1075635720 /nfs/dbraw/zinc/63/57/20/1075635720.db2.gz KFAZFDMBEJZLCI-IINYFYTJSA-N -1 3 380.386 -1.032 20 0 GAADHM COC(=O)[C@@]1(CNC(=O)c2cc(-c3nnn[n-]3)ccn2)C[C@@H]1S(C)(=O)=O ZINC001579472813 1075635718 /nfs/dbraw/zinc/63/57/18/1075635718.db2.gz KFAZFDMBEJZLCI-IINYFYTJSA-N -1 3 380.386 -1.032 20 0 GAADHM COC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001579472933 1075635710 /nfs/dbraw/zinc/63/57/10/1075635710.db2.gz QNGNRAKOVGVTFO-IUCAKERBSA-N -1 3 376.377 -1.144 20 0 GAADHM COC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001579472933 1075635706 /nfs/dbraw/zinc/63/57/06/1075635706.db2.gz QNGNRAKOVGVTFO-IUCAKERBSA-N -1 3 376.377 -1.144 20 0 GAADHM COC(=O)[C@H](C)NC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001579472962 1075635624 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COCC(=O)N[C@H](C)C(=O)N[C@H](C)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579634453 1075649718 /nfs/dbraw/zinc/64/97/18/1075649718.db2.gz YYDKWPPEEFYRAS-RKDXNWHRSA-N -1 3 378.393 -1.420 20 0 GAADHM COCC(=O)N[C@H](C)C(=O)N[C@H](C)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579634453 1075649716 /nfs/dbraw/zinc/64/97/16/1075649716.db2.gz YYDKWPPEEFYRAS-RKDXNWHRSA-N -1 3 378.393 -1.420 20 0 GAADHM COCC(=O)N[C@@H](C)C(=O)N1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001579634467 1075649659 /nfs/dbraw/zinc/64/96/59/1075649659.db2.gz ZGKWMIOOLIYACB-JTQLQIEISA-N -1 3 390.404 -1.370 20 0 GAADHM COCC(=O)N[C@@H](C)C(=O)N1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001579634467 1075649657 /nfs/dbraw/zinc/64/96/57/1075649657.db2.gz ZGKWMIOOLIYACB-JTQLQIEISA-N -1 3 390.404 -1.370 20 0 GAADHM COCC(=O)N[C@H](C)C(=O)N1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001579634468 1075649703 /nfs/dbraw/zinc/64/97/03/1075649703.db2.gz ZGKWMIOOLIYACB-SNVBAGLBSA-N -1 3 390.404 -1.370 20 0 GAADHM COCC(=O)N[C@H](C)C(=O)N1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001579634468 1075649701 /nfs/dbraw/zinc/64/97/01/1075649701.db2.gz ZGKWMIOOLIYACB-SNVBAGLBSA-N -1 3 390.404 -1.370 20 0 GAADHM COCC(=O)N[C@@H](C)C(=O)NC[C@@H](C)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579634471 1075649573 /nfs/dbraw/zinc/64/95/73/1075649573.db2.gz ZIKRGVGMDBKKBT-BDAKNGLRSA-N -1 3 378.393 -1.420 20 0 GAADHM COCC(=O)N[C@@H](C)C(=O)NC[C@@H](C)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579634471 1075649571 /nfs/dbraw/zinc/64/95/71/1075649571.db2.gz ZIKRGVGMDBKKBT-BDAKNGLRSA-N -1 3 378.393 -1.420 20 0 GAADHM COCC(=O)N[C@H](C)C(=O)NC[C@H](C)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579634472 1075649600 /nfs/dbraw/zinc/64/96/00/1075649600.db2.gz ZIKRGVGMDBKKBT-DTWKUNHWSA-N -1 3 378.393 -1.420 20 0 GAADHM COCC(=O)N[C@H](C)C(=O)NC[C@H](C)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579634472 1075649597 /nfs/dbraw/zinc/64/95/97/1075649597.db2.gz ZIKRGVGMDBKKBT-DTWKUNHWSA-N -1 3 378.393 -1.420 20 0 GAADHM COCC(=O)N[C@@H](C)C(=O)NC[C@H](C)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579634473 1075649698 /nfs/dbraw/zinc/64/96/98/1075649698.db2.gz ZIKRGVGMDBKKBT-IUCAKERBSA-N -1 3 378.393 -1.420 20 0 GAADHM COCC(=O)N[C@@H](C)C(=O)NC[C@H](C)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579634473 1075649697 /nfs/dbraw/zinc/64/96/97/1075649697.db2.gz ZIKRGVGMDBKKBT-IUCAKERBSA-N -1 3 378.393 -1.420 20 0 GAADHM COCC(=O)N[C@H](C)C(=O)NC[C@@H](C)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579634474 1075649637 /nfs/dbraw/zinc/64/96/37/1075649637.db2.gz ZIKRGVGMDBKKBT-RKDXNWHRSA-N -1 3 378.393 -1.420 20 0 GAADHM COCC(=O)N[C@H](C)C(=O)NC[C@@H](C)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579634474 1075649633 /nfs/dbraw/zinc/64/96/33/1075649633.db2.gz ZIKRGVGMDBKKBT-RKDXNWHRSA-N -1 3 378.393 -1.420 20 0 GAADHM COCC(=O)N[C@@H](C)C(=O)N(C)CCN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579634475 1075649694 /nfs/dbraw/zinc/64/96/94/1075649694.db2.gz ZIWFAAFKMFVABU-JTQLQIEISA-N -1 3 392.420 -1.124 20 0 GAADHM COCC(=O)N[C@@H](C)C(=O)N(C)CCN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579634475 1075649691 /nfs/dbraw/zinc/64/96/91/1075649691.db2.gz ZIWFAAFKMFVABU-JTQLQIEISA-N -1 3 392.420 -1.124 20 0 GAADHM COCC(=O)N[C@H](C)C(=O)N(C)CCN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579634476 1075649712 /nfs/dbraw/zinc/64/97/12/1075649712.db2.gz ZIWFAAFKMFVABU-SNVBAGLBSA-N -1 3 392.420 -1.124 20 0 GAADHM COCC(=O)N[C@H](C)C(=O)N(C)CCN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579634476 1075649711 /nfs/dbraw/zinc/64/97/11/1075649711.db2.gz ZIWFAAFKMFVABU-SNVBAGLBSA-N -1 3 392.420 -1.124 20 0 GAADHM COCC(=O)NCCC(=O)N(C)CCN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579638142 1075649669 /nfs/dbraw/zinc/64/96/69/1075649669.db2.gz ADYDSTLUMXWLTK-UHFFFAOYSA-N -1 3 392.420 -1.122 20 0 GAADHM COCC(=O)NCCC(=O)N(C)CCN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579638142 1075649666 /nfs/dbraw/zinc/64/96/66/1075649666.db2.gz ADYDSTLUMXWLTK-UHFFFAOYSA-N -1 3 392.420 -1.122 20 0 GAADHM 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ZINC001579638560 1075650077 /nfs/dbraw/zinc/65/00/77/1075650077.db2.gz HTJUIVGENXLCBK-UHFFFAOYSA-N -1 3 390.404 -1.464 20 0 GAADHM COCC(=O)NCCC(=O)N1CC(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579638560 1075650073 /nfs/dbraw/zinc/65/00/73/1075650073.db2.gz HTJUIVGENXLCBK-UHFFFAOYSA-N -1 3 390.404 -1.464 20 0 GAADHM COCC(=O)NCCC(=O)N(C)[C@@H](C)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579638563 1075649975 /nfs/dbraw/zinc/64/99/75/1075649975.db2.gz HVLVEGRXKKTHNA-JTQLQIEISA-N -1 3 392.420 -1.076 20 0 GAADHM COCC(=O)NCCC(=O)N(C)[C@@H](C)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579638563 1075649972 /nfs/dbraw/zinc/64/99/72/1075649972.db2.gz HVLVEGRXKKTHNA-JTQLQIEISA-N -1 3 392.420 -1.076 20 0 GAADHM COCC(=O)NCCC(=O)N(C)[C@H](C)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579638564 1075650125 /nfs/dbraw/zinc/65/01/25/1075650125.db2.gz HVLVEGRXKKTHNA-SNVBAGLBSA-N -1 3 392.420 -1.076 20 0 GAADHM COCC(=O)NCCC(=O)N(C)[C@H](C)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579638564 1075650122 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375.389 -1.077 20 0 GAADHM COCC1(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)CC1 ZINC001579736235 1075662935 /nfs/dbraw/zinc/66/29/35/1075662935.db2.gz KFNNFVKRFYPAMQ-NEPJUHHUSA-N -1 3 375.389 -1.077 20 0 GAADHM COCC1(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)CC1 ZINC001579736236 1075662922 /nfs/dbraw/zinc/66/29/22/1075662922.db2.gz KFNNFVKRFYPAMQ-VXGBXAGGSA-N -1 3 375.389 -1.077 20 0 GAADHM COCC1(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)CC1 ZINC001579736236 1075662919 /nfs/dbraw/zinc/66/29/19/1075662919.db2.gz KFNNFVKRFYPAMQ-VXGBXAGGSA-N -1 3 375.389 -1.077 20 0 GAADHM COCC1(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)CC1 ZINC001579736276 1075663021 /nfs/dbraw/zinc/66/30/21/1075663021.db2.gz LFEQAFUQHMBXKB-VXGBXAGGSA-N -1 3 375.389 -1.077 20 0 GAADHM COCC1(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)CC1 ZINC001579736276 1075663020 /nfs/dbraw/zinc/66/30/20/1075663020.db2.gz LFEQAFUQHMBXKB-VXGBXAGGSA-N -1 3 375.389 -1.077 20 0 GAADHM COCCN(C)CCNC(=O)NCCn1cc(-c2nnn[n-]2)c(=O)[nH]c1=O ZINC001579790833 1075663294 /nfs/dbraw/zinc/66/32/94/1075663294.db2.gz FNXMNUBJVHJTHF-UHFFFAOYSA-N -1 3 381.397 -1.994 20 0 GAADHM COCCCOCC(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001579790887 1075663969 /nfs/dbraw/zinc/66/39/69/1075663969.db2.gz HNDRPVHGMSFBAG-CHWSQXEVSA-N -1 3 393.404 -1.451 20 0 GAADHM COCCCOCC(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001579790887 1075663967 /nfs/dbraw/zinc/66/39/67/1075663967.db2.gz HNDRPVHGMSFBAG-CHWSQXEVSA-N -1 3 393.404 -1.451 20 0 GAADHM COCCCOCC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001579790998 1075663960 /nfs/dbraw/zinc/66/39/60/1075663960.db2.gz MHSUMSMVOSBDPP-KGLIPLIRSA-N -1 3 377.405 -1.020 20 0 GAADHM COCCCOCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001579790998 1075663957 /nfs/dbraw/zinc/66/39/57/1075663957.db2.gz MHSUMSMVOSBDPP-KGLIPLIRSA-N -1 3 377.405 -1.020 20 0 GAADHM COCCN(CCNC(=O)[C@H](C)NC(C)=O)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579792256 1075663940 /nfs/dbraw/zinc/66/39/40/1075663940.db2.gz FWZPCDHRSMNLON-JTQLQIEISA-N -1 3 392.420 -1.076 20 0 GAADHM COCCN(CCNC(=O)[C@H](C)NC(C)=O)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579792256 1075663938 /nfs/dbraw/zinc/66/39/38/1075663938.db2.gz FWZPCDHRSMNLON-JTQLQIEISA-N -1 3 392.420 -1.076 20 0 GAADHM COCCN(CCNC(=O)[C@@H](C)NC(C)=O)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579792258 1075663897 /nfs/dbraw/zinc/66/38/97/1075663897.db2.gz FWZPCDHRSMNLON-SNVBAGLBSA-N -1 3 392.420 -1.076 20 0 GAADHM COCCN(CCNC(=O)[C@@H](C)NC(C)=O)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579792258 1075663894 /nfs/dbraw/zinc/66/38/94/1075663894.db2.gz FWZPCDHRSMNLON-SNVBAGLBSA-N -1 3 392.420 -1.076 20 0 GAADHM COCCN(CCNC(=O)[C@H](C)NC(C)=O)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579792818 1075663976 /nfs/dbraw/zinc/66/39/76/1075663976.db2.gz LHBKPUAUCYSRMT-JTQLQIEISA-N -1 3 392.420 -1.076 20 0 GAADHM COCCN(CCNC(=O)[C@H](C)NC(C)=O)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579792818 1075663973 /nfs/dbraw/zinc/66/39/73/1075663973.db2.gz LHBKPUAUCYSRMT-JTQLQIEISA-N -1 3 392.420 -1.076 20 0 GAADHM COCCN(CCNC(=O)[C@@H](C)NC(C)=O)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579792825 1075663840 /nfs/dbraw/zinc/66/38/40/1075663840.db2.gz LHBKPUAUCYSRMT-SNVBAGLBSA-N -1 3 392.420 -1.076 20 0 GAADHM COCCN(CCNC(=O)[C@@H](C)NC(C)=O)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579792825 1075663835 /nfs/dbraw/zinc/66/38/35/1075663835.db2.gz LHBKPUAUCYSRMT-SNVBAGLBSA-N -1 3 392.420 -1.076 20 0 GAADHM COCCN(CCNC(=O)[C@H](C)NC(C)=O)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579793795 1075663734 /nfs/dbraw/zinc/66/37/34/1075663734.db2.gz RKFZYQIWDYHDFZ-JTQLQIEISA-N -1 3 392.420 -1.076 20 0 GAADHM COCCN(CCNC(=O)[C@H](C)NC(C)=O)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579793795 1075663731 /nfs/dbraw/zinc/66/37/31/1075663731.db2.gz RKFZYQIWDYHDFZ-JTQLQIEISA-N -1 3 392.420 -1.076 20 0 GAADHM COCCN(CCNC(=O)[C@@H](C)NC(C)=O)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579793796 1075664398 /nfs/dbraw/zinc/66/43/98/1075664398.db2.gz RKFZYQIWDYHDFZ-SNVBAGLBSA-N -1 3 392.420 -1.076 20 0 GAADHM COCCN(CCNC(=O)[C@@H](C)NC(C)=O)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579793796 1075664396 /nfs/dbraw/zinc/66/43/96/1075664396.db2.gz RKFZYQIWDYHDFZ-SNVBAGLBSA-N -1 3 392.420 -1.076 20 0 GAADHM COCCN(CCNC(=O)CNC(C)=O)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579796998 1075664607 /nfs/dbraw/zinc/66/46/07/1075664607.db2.gz CSUADDDBSRNHEJ-UHFFFAOYSA-N -1 3 378.393 -1.464 20 0 GAADHM COCCN(CCNC(=O)CNC(C)=O)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579796998 1075664606 /nfs/dbraw/zinc/66/46/06/1075664606.db2.gz CSUADDDBSRNHEJ-UHFFFAOYSA-N -1 3 378.393 -1.464 20 0 GAADHM COCCN(CCNC(=O)CS(C)(=O)=O)c1ccc(-c2nn[n-]n2)nc1 ZINC001579798046 1075664838 /nfs/dbraw/zinc/66/48/38/1075664838.db2.gz LBAGLHOBSWINLO-UHFFFAOYSA-N -1 3 383.434 -1.125 20 0 GAADHM COCCN(CCNC(=O)CS(C)(=O)=O)c1ccc(-c2nnn[n-]2)nc1 ZINC001579798046 1075664835 /nfs/dbraw/zinc/66/48/35/1075664835.db2.gz LBAGLHOBSWINLO-UHFFFAOYSA-N -1 3 383.434 -1.125 20 0 GAADHM COCCN(CCNC(=O)CNC(C)=O)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579798089 1075665104 /nfs/dbraw/zinc/66/51/04/1075665104.db2.gz LTGOFQYNAJQVCN-UHFFFAOYSA-N -1 3 378.393 -1.464 20 0 GAADHM COCCN(CCNC(=O)CNC(C)=O)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579798089 1075665099 /nfs/dbraw/zinc/66/50/99/1075665099.db2.gz LTGOFQYNAJQVCN-UHFFFAOYSA-N -1 3 378.393 -1.464 20 0 GAADHM COCCN(CCNC(=O)CS(C)(=O)=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001579798791 1075665548 /nfs/dbraw/zinc/66/55/48/1075665548.db2.gz YECDEKQVKDSWIL-UHFFFAOYSA-N -1 3 383.434 -1.125 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CNC(=O)N1)c1ccc(-c2nn[n-]n2)cn1 ZINC001579798862 1075665577 /nfs/dbraw/zinc/66/55/77/1075665577.db2.gz AIMPBWVKZOBIFA-LLVKDONJSA-N -1 3 375.393 -1.488 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CNC(=O)N1)c1ccc(-c2nnn[n-]2)cn1 ZINC001579798862 1075665572 /nfs/dbraw/zinc/66/55/72/1075665572.db2.gz AIMPBWVKZOBIFA-LLVKDONJSA-N -1 3 375.393 -1.488 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1CNC(=O)N1)c1ccc(-c2nn[n-]n2)cn1 ZINC001579798863 1075665501 /nfs/dbraw/zinc/66/55/01/1075665501.db2.gz AIMPBWVKZOBIFA-NSHDSACASA-N -1 3 375.393 -1.488 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1CNC(=O)N1)c1ccc(-c2nnn[n-]2)cn1 ZINC001579798863 1075665496 /nfs/dbraw/zinc/66/54/96/1075665496.db2.gz AIMPBWVKZOBIFA-NSHDSACASA-N -1 3 375.393 -1.488 20 0 GAADHM COCCN(CCNC(=O)[C@H]1COC(=O)N1)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579798915 1075665540 /nfs/dbraw/zinc/66/55/40/1075665540.db2.gz BZHVIDRLUNSPCG-LLVKDONJSA-N -1 3 392.376 -1.492 20 0 GAADHM COCCN(CCNC(=O)[C@H]1COC(=O)N1)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579798915 1075665537 /nfs/dbraw/zinc/66/55/37/1075665537.db2.gz BZHVIDRLUNSPCG-LLVKDONJSA-N -1 3 392.376 -1.492 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1COC(=O)N1)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579798916 1075665567 /nfs/dbraw/zinc/66/55/67/1075665567.db2.gz BZHVIDRLUNSPCG-NSHDSACASA-N -1 3 392.376 -1.492 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1COC(=O)N1)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579798916 1075665564 /nfs/dbraw/zinc/66/55/64/1075665564.db2.gz BZHVIDRLUNSPCG-NSHDSACASA-N -1 3 392.376 -1.492 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CN(C)CCO1)c1cnc(-c2nn[n-]n2)cn1 ZINC001579798917 1075665612 /nfs/dbraw/zinc/66/56/12/1075665612.db2.gz CADZDXZUYJWGFH-CYBMUJFWSA-N -1 3 391.436 -1.444 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CN(C)CCO1)c1cnc(-c2nnn[n-]2)cn1 ZINC001579798917 1075665609 /nfs/dbraw/zinc/66/56/09/1075665609.db2.gz CADZDXZUYJWGFH-CYBMUJFWSA-N -1 3 391.436 -1.444 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1CN(C)CCO1)c1cnc(-c2nn[n-]n2)cn1 ZINC001579798918 1075666010 /nfs/dbraw/zinc/66/60/10/1075666010.db2.gz CADZDXZUYJWGFH-ZDUSSCGKSA-N -1 3 391.436 -1.444 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1CN(C)CCO1)c1cnc(-c2nnn[n-]2)cn1 ZINC001579798918 1075666006 /nfs/dbraw/zinc/66/60/06/1075666006.db2.gz CADZDXZUYJWGFH-ZDUSSCGKSA-N -1 3 391.436 -1.444 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CNC(=O)N1)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579799005 1075665980 /nfs/dbraw/zinc/66/59/80/1075665980.db2.gz FBQDRBNXBGPDBJ-LLVKDONJSA-N -1 3 391.392 -1.919 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CNC(=O)N1)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579799005 1075665976 /nfs/dbraw/zinc/66/59/76/1075665976.db2.gz FBQDRBNXBGPDBJ-LLVKDONJSA-N -1 3 391.392 -1.919 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1CNC(=O)N1)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579799006 1075666064 /nfs/dbraw/zinc/66/60/64/1075666064.db2.gz FBQDRBNXBGPDBJ-NSHDSACASA-N -1 3 391.392 -1.919 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1CNC(=O)N1)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579799006 1075666061 /nfs/dbraw/zinc/66/60/61/1075666061.db2.gz FBQDRBNXBGPDBJ-NSHDSACASA-N -1 3 391.392 -1.919 20 0 GAADHM COCCN(CCNC(=O)[C@H]1COC(=O)N1)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579799089 1075666047 /nfs/dbraw/zinc/66/60/47/1075666047.db2.gz HPOANCJOWPBWTL-LLVKDONJSA-N -1 3 392.376 -1.492 20 0 GAADHM COCCN(CCNC(=O)[C@H]1COC(=O)N1)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579799089 1075666045 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3 375.393 -1.488 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1CNC(=O)N1)c1ncccc1-c1nnn[n-]1 ZINC001579799143 1075666337 /nfs/dbraw/zinc/66/63/37/1075666337.db2.gz IPKLCRZMFUICKU-NSHDSACASA-N -1 3 375.393 -1.488 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CN(C)C(=O)N1)c1ncccc1-c1nn[n-]n1 ZINC001579799169 1075666342 /nfs/dbraw/zinc/66/63/42/1075666342.db2.gz IZXOPPRQHBTNBN-GFCCVEGCSA-N -1 3 389.420 -1.146 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CN(C)C(=O)N1)c1ncccc1-c1nnn[n-]1 ZINC001579799169 1075666340 /nfs/dbraw/zinc/66/63/40/1075666340.db2.gz IZXOPPRQHBTNBN-GFCCVEGCSA-N -1 3 389.420 -1.146 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1CN(C)C(=O)N1)c1ncccc1-c1nn[n-]n1 ZINC001579799170 1075666374 /nfs/dbraw/zinc/66/63/74/1075666374.db2.gz IZXOPPRQHBTNBN-LBPRGKRZSA-N -1 3 389.420 -1.146 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1CN(C)C(=O)N1)c1ncccc1-c1nnn[n-]1 ZINC001579799170 1075666370 /nfs/dbraw/zinc/66/63/70/1075666370.db2.gz IZXOPPRQHBTNBN-LBPRGKRZSA-N -1 3 389.420 -1.146 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CN(C)CCO1)c1nccnc1-c1nn[n-]n1 ZINC001579799345 1075666938 /nfs/dbraw/zinc/66/69/38/1075666938.db2.gz NWKHFHJZIJIMAU-GFCCVEGCSA-N -1 3 391.436 -1.444 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CN(C)CCO1)c1nccnc1-c1nnn[n-]1 ZINC001579799345 1075666934 /nfs/dbraw/zinc/66/69/34/1075666934.db2.gz NWKHFHJZIJIMAU-GFCCVEGCSA-N -1 3 391.436 -1.444 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1CN(C)CCO1)c1nccnc1-c1nn[n-]n1 ZINC001579799346 1075666870 /nfs/dbraw/zinc/66/68/70/1075666870.db2.gz NWKHFHJZIJIMAU-LBPRGKRZSA-N -1 3 391.436 -1.444 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1CN(C)CCO1)c1nccnc1-c1nnn[n-]1 ZINC001579799346 1075666866 /nfs/dbraw/zinc/66/68/66/1075666866.db2.gz NWKHFHJZIJIMAU-LBPRGKRZSA-N -1 3 391.436 -1.444 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CNC(=O)N1)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579799354 1075666882 /nfs/dbraw/zinc/66/68/82/1075666882.db2.gz OAOITGXCRUAELS-LLVKDONJSA-N -1 3 391.392 -1.919 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CNC(=O)N1)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579799354 1075666877 /nfs/dbraw/zinc/66/68/77/1075666877.db2.gz OAOITGXCRUAELS-LLVKDONJSA-N -1 3 391.392 -1.919 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1CNC(=O)N1)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579799355 1075666893 /nfs/dbraw/zinc/66/68/93/1075666893.db2.gz OAOITGXCRUAELS-NSHDSACASA-N -1 3 391.392 -1.919 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1CNC(=O)N1)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579799355 1075666888 /nfs/dbraw/zinc/66/68/88/1075666888.db2.gz OAOITGXCRUAELS-NSHDSACASA-N -1 3 391.392 -1.919 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CNC(=O)N1)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579799380 1075666810 /nfs/dbraw/zinc/66/68/10/1075666810.db2.gz OSDOVNCRNLOEFX-LLVKDONJSA-N -1 3 391.392 -1.919 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CNC(=O)N1)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579799380 1075666807 /nfs/dbraw/zinc/66/68/07/1075666807.db2.gz OSDOVNCRNLOEFX-LLVKDONJSA-N -1 3 391.392 -1.919 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1CNC(=O)N1)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579799381 1075666850 /nfs/dbraw/zinc/66/68/50/1075666850.db2.gz OSDOVNCRNLOEFX-NSHDSACASA-N -1 3 391.392 -1.919 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1075667326 /nfs/dbraw/zinc/66/73/26/1075667326.db2.gz VGILBYYAUKUUOM-LLVKDONJSA-N -1 3 376.377 -1.061 20 0 GAADHM COCCN(CCNC(=O)[C@H]1COC(=O)N1)c1ccc(-c2nnn[n-]2)cn1 ZINC001579799592 1075667320 /nfs/dbraw/zinc/66/73/20/1075667320.db2.gz VGILBYYAUKUUOM-LLVKDONJSA-N -1 3 376.377 -1.061 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1COC(=O)N1)c1ccc(-c2nn[n-]n2)cn1 ZINC001579799593 1075667380 /nfs/dbraw/zinc/66/73/80/1075667380.db2.gz VGILBYYAUKUUOM-NSHDSACASA-N -1 3 376.377 -1.061 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1COC(=O)N1)c1ccc(-c2nnn[n-]2)cn1 ZINC001579799593 1075667379 /nfs/dbraw/zinc/66/73/79/1075667379.db2.gz VGILBYYAUKUUOM-NSHDSACASA-N -1 3 376.377 -1.061 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CNC(=O)N1)c1nc(C)ccc1-c1nn[n-]n1 ZINC001579799700 1075667308 /nfs/dbraw/zinc/66/73/08/1075667308.db2.gz XQMZMNNEOMXLKE-GFCCVEGCSA-N -1 3 389.420 -1.179 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CNC(=O)N1)c1nc(C)ccc1-c1nnn[n-]1 ZINC001579799700 1075667303 /nfs/dbraw/zinc/66/73/03/1075667303.db2.gz XQMZMNNEOMXLKE-GFCCVEGCSA-N 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ZINC001579799775 1075667709 /nfs/dbraw/zinc/66/77/09/1075667709.db2.gz ZNHNSQKXMZOSQG-GFCCVEGCSA-N -1 3 389.420 -1.146 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CN(C)C(=O)N1)c1ccc(-c2nnn[n-]2)cn1 ZINC001579799775 1075667705 /nfs/dbraw/zinc/66/77/05/1075667705.db2.gz ZNHNSQKXMZOSQG-GFCCVEGCSA-N -1 3 389.420 -1.146 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1CN(C)C(=O)N1)c1ccc(-c2nn[n-]n2)cn1 ZINC001579799776 1075667533 /nfs/dbraw/zinc/66/75/33/1075667533.db2.gz ZNHNSQKXMZOSQG-LBPRGKRZSA-N -1 3 389.420 -1.146 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1CN(C)C(=O)N1)c1ccc(-c2nnn[n-]2)cn1 ZINC001579799776 1075667529 /nfs/dbraw/zinc/66/75/29/1075667529.db2.gz ZNHNSQKXMZOSQG-LBPRGKRZSA-N -1 3 389.420 -1.146 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CN(C)CCO1)c1ccc(-c2nn[n-]n2)nn1 ZINC001579799790 1075667696 /nfs/dbraw/zinc/66/76/96/1075667696.db2.gz ZUQBWZJHHNYUFY-CYBMUJFWSA-N -1 3 391.436 -1.444 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CN(C)CCO1)c1ccc(-c2nnn[n-]2)nn1 ZINC001579799790 1075667690 /nfs/dbraw/zinc/66/76/90/1075667690.db2.gz 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COCCN(CCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)C(=O)[C@H]1COC(=O)N1 ZINC001579800260 1075667744 /nfs/dbraw/zinc/66/77/44/1075667744.db2.gz HJSYQWIYOKXQII-LLVKDONJSA-N -1 3 392.376 -1.492 20 0 GAADHM COCCN(CCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)C(=O)[C@@H]1COC(=O)N1 ZINC001579800261 1075667655 /nfs/dbraw/zinc/66/76/55/1075667655.db2.gz HJSYQWIYOKXQII-NSHDSACASA-N -1 3 392.376 -1.492 20 0 GAADHM COCCN(CCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)C(=O)[C@@H]1COC(=O)N1 ZINC001579800261 1075667653 /nfs/dbraw/zinc/66/76/53/1075667653.db2.gz HJSYQWIYOKXQII-NSHDSACASA-N -1 3 392.376 -1.492 20 0 GAADHM COCCN(CCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)C(=O)[C@H]1CNC(=O)N1 ZINC001579800264 1075667627 /nfs/dbraw/zinc/66/76/27/1075667627.db2.gz HKNROFUABHTFKO-LLVKDONJSA-N -1 3 391.392 -1.919 20 0 GAADHM COCCN(CCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)C(=O)[C@H]1CNC(=O)N1 ZINC001579800264 1075667621 /nfs/dbraw/zinc/66/76/21/1075667621.db2.gz HKNROFUABHTFKO-LLVKDONJSA-N -1 3 391.392 -1.919 20 0 GAADHM 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1075676220 /nfs/dbraw/zinc/67/62/20/1075676220.db2.gz BETAOFVDANLHMP-JHJVBQTASA-N -1 3 391.388 -1.434 20 0 GAADHM CO[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1NC(=O)[C@@H]1COCCO1 ZINC001579850867 1075676208 /nfs/dbraw/zinc/67/62/08/1075676208.db2.gz BETAOFVDANLHMP-UPJWGTAASA-N -1 3 391.388 -1.434 20 0 GAADHM CO[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1NC(=O)[C@@H]1COCCO1 ZINC001579850867 1075676206 /nfs/dbraw/zinc/67/62/06/1075676206.db2.gz BETAOFVDANLHMP-UPJWGTAASA-N -1 3 391.388 -1.434 20 0 GAADHM CO[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1NC(=O)[C@@H](C)NC(C)=O ZINC001579850880 1075676180 /nfs/dbraw/zinc/67/61/80/1075676180.db2.gz BVXZWEGMQOIODU-BZHVJNSISA-N -1 3 390.404 -1.325 20 0 GAADHM CO[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1NC(=O)[C@@H](C)NC(C)=O ZINC001579850880 1075676178 /nfs/dbraw/zinc/67/61/78/1075676178.db2.gz BVXZWEGMQOIODU-BZHVJNSISA-N -1 3 390.404 -1.325 20 0 GAADHM CO[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1NC(=O)[C@H](C)NC(C)=O ZINC001579850881 1075676197 /nfs/dbraw/zinc/67/61/97/1075676197.db2.gz BVXZWEGMQOIODU-ZEGGKSINSA-N -1 3 390.404 -1.325 20 0 GAADHM CO[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1NC(=O)[C@H](C)NC(C)=O ZINC001579850881 1075676196 /nfs/dbraw/zinc/67/61/96/1075676196.db2.gz BVXZWEGMQOIODU-ZEGGKSINSA-N -1 3 390.404 -1.325 20 0 GAADHM CO[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1NC(=O)[C@H]1CCNC1=O ZINC001579850889 1075676217 /nfs/dbraw/zinc/67/62/17/1075676217.db2.gz CAESKRXPCYEKOY-MVWJERBFSA-N -1 3 388.388 -1.714 20 0 GAADHM CO[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1NC(=O)[C@H]1CCNC1=O ZINC001579850889 1075676215 /nfs/dbraw/zinc/67/62/15/1075676215.db2.gz CAESKRXPCYEKOY-MVWJERBFSA-N -1 3 388.388 -1.714 20 0 GAADHM CO[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1NC(=O)[C@@H]1CCNC1=O ZINC001579850890 1075676133 /nfs/dbraw/zinc/67/61/33/1075676133.db2.gz CAESKRXPCYEKOY-YUSALJHKSA-N -1 3 388.388 -1.714 20 0 GAADHM CO[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1NC(=O)[C@@H]1CCNC1=O 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CO[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1NC(=O)[C@@H]1COC(=O)N1 ZINC001579850901 1075676612 /nfs/dbraw/zinc/67/66/12/1075676612.db2.gz CKDZFDAAJQMGJX-OUAUKWLOSA-N -1 3 390.360 -1.741 20 0 GAADHM CO[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1NC(=O)[C@@H]1COC(=O)N1 ZINC001579850901 1075676609 /nfs/dbraw/zinc/67/66/09/1075676609.db2.gz CKDZFDAAJQMGJX-OUAUKWLOSA-N -1 3 390.360 -1.741 20 0 GAADHM CO[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1NC(=O)c1cnnn1C ZINC001579850902 1075676514 /nfs/dbraw/zinc/67/65/14/1075676514.db2.gz CKPBFZHJDLQOPF-ZYHUDNBSSA-N -1 3 386.376 -1.407 20 0 GAADHM CO[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1NC(=O)c1cnnn1C ZINC001579850902 1075676511 /nfs/dbraw/zinc/67/65/11/1075676511.db2.gz CKPBFZHJDLQOPF-ZYHUDNBSSA-N -1 3 386.376 -1.407 20 0 GAADHM CO[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1NC(=O)Cn1cncn1 ZINC001579850921 1075676519 /nfs/dbraw/zinc/67/65/19/1075676519.db2.gz DMZYGCLUFHXGQF-VXGBXAGGSA-N -1 3 386.376 -1.558 20 0 GAADHM CO[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1NC(=O)Cn1cncn1 ZINC001579850921 1075676518 /nfs/dbraw/zinc/67/65/18/1075676518.db2.gz DMZYGCLUFHXGQF-VXGBXAGGSA-N -1 3 386.376 -1.558 20 0 GAADHM CO[C@@H]1CN(C(=O)Cn2cncn2)C[C@H]1NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579850941 1075676557 /nfs/dbraw/zinc/67/65/57/1075676557.db2.gz JPGXAJALIPGNJW-VXGBXAGGSA-N -1 3 386.376 -1.558 20 0 GAADHM CO[C@@H]1CN(C(=O)Cn2cncn2)C[C@H]1NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579850941 1075676554 /nfs/dbraw/zinc/67/65/54/1075676554.db2.gz JPGXAJALIPGNJW-VXGBXAGGSA-N -1 3 386.376 -1.558 20 0 GAADHM CO[C@@H]1CN(C(=O)Cn2cncn2)C[C@H]1NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579850946 1075676617 /nfs/dbraw/zinc/67/66/17/1075676617.db2.gz JWMIXRLSLMMNDH-VXGBXAGGSA-N -1 3 386.376 -1.558 20 0 GAADHM CO[C@@H]1CN(C(=O)Cn2cncn2)C[C@H]1NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579850946 1075676616 /nfs/dbraw/zinc/67/66/16/1075676616.db2.gz JWMIXRLSLMMNDH-VXGBXAGGSA-N -1 3 386.376 -1.558 20 0 GAADHM CO[C@@H]1CN(C(=O)[C@@H]2CCC(=O)N2)C[C@H]1NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579850947 1075676524 /nfs/dbraw/zinc/67/65/24/1075676524.db2.gz JWVHUYGJSXARPJ-MVWJERBFSA-N -1 3 388.388 -1.571 20 0 GAADHM CO[C@@H]1CN(C(=O)[C@@H]2CCC(=O)N2)C[C@H]1NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579850947 1075676522 /nfs/dbraw/zinc/67/65/22/1075676522.db2.gz JWVHUYGJSXARPJ-MVWJERBFSA-N -1 3 388.388 -1.571 20 0 GAADHM CO[C@@H]1CN(C(=O)CNC(C)=O)C[C@H]1NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579850992 1075676571 /nfs/dbraw/zinc/67/65/71/1075676571.db2.gz MAVXMBNNRVDHSJ-VXGBXAGGSA-N -1 3 376.377 -1.714 20 0 GAADHM CO[C@@H]1CN(C(=O)CNC(C)=O)C[C@H]1NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579850992 1075676569 /nfs/dbraw/zinc/67/65/69/1075676569.db2.gz MAVXMBNNRVDHSJ-VXGBXAGGSA-N -1 3 376.377 -1.714 20 0 GAADHM CO[C@@H]1CN(C(=O)[C@H]2CNC(=O)N2)C[C@H]1NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579850994 1075676530 /nfs/dbraw/zinc/67/65/30/1075676530.db2.gz MCDDJPATWWLPGL-GMTAPVOTSA-N -1 3 389.376 -2.168 20 0 GAADHM 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GAADHM CO[C@@H]1CN(C(=O)[C@@H](C)NC(C)=O)C[C@H]1NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579851412 1075677085 /nfs/dbraw/zinc/67/70/85/1075677085.db2.gz WJJIATLAROVCIN-BZHVJNSISA-N -1 3 390.404 -1.325 20 0 GAADHM CO[C@@H]1CN(C(=O)[C@H](C)NC(C)=O)C[C@H]1NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579851413 1075677065 /nfs/dbraw/zinc/67/70/65/1075677065.db2.gz WJJIATLAROVCIN-ZEGGKSINSA-N -1 3 390.404 -1.325 20 0 GAADHM CO[C@@H]1CN(C(=O)[C@H](C)NC(C)=O)C[C@H]1NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579851413 1075677063 /nfs/dbraw/zinc/67/70/63/1075677063.db2.gz WJJIATLAROVCIN-ZEGGKSINSA-N -1 3 390.404 -1.325 20 0 GAADHM CO[C@@H]1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)C[C@H]1O ZINC001579851417 1075677030 /nfs/dbraw/zinc/67/70/30/1075677030.db2.gz WLRUZLYEAUVSPL-VXGBXAGGSA-N -1 3 382.402 -1.637 20 0 GAADHM CO[C@@H]1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)C[C@H]1O ZINC001579851417 1075677026 /nfs/dbraw/zinc/67/70/26/1075677026.db2.gz WLRUZLYEAUVSPL-VXGBXAGGSA-N -1 3 382.402 -1.637 20 0 GAADHM CO[C@@H]1CN(C(=O)[C@H]2CNC(=O)N2)C[C@H]1NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579851427 1075677266 /nfs/dbraw/zinc/67/72/66/1075677266.db2.gz XAAOMCCUMQYFTE-GMTAPVOTSA-N -1 3 389.376 -2.168 20 0 GAADHM CO[C@@H]1CN(C(=O)[C@H]2CNC(=O)N2)C[C@H]1NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579851427 1075677262 /nfs/dbraw/zinc/67/72/62/1075677262.db2.gz XAAOMCCUMQYFTE-GMTAPVOTSA-N -1 3 389.376 -2.168 20 0 GAADHM CO[C@@H]1CN(C(=O)[C@@H]2CNC(=O)N2)C[C@H]1NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579851428 1075677241 /nfs/dbraw/zinc/67/72/41/1075677241.db2.gz XAAOMCCUMQYFTE-HBNTYKKESA-N -1 3 389.376 -2.168 20 0 GAADHM CO[C@@H]1CN(C(=O)[C@@H]2CNC(=O)N2)C[C@H]1NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579851428 1075677233 /nfs/dbraw/zinc/67/72/33/1075677233.db2.gz XAAOMCCUMQYFTE-HBNTYKKESA-N -1 3 389.376 -2.168 20 0 GAADHM CO[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1NC(=O)c1ncn(C)n1 ZINC001579851442 1075677289 /nfs/dbraw/zinc/67/72/89/1075677289.db2.gz OOCAECZRBMXCDD-GHMZBOCLSA-N -1 3 386.376 -1.407 20 0 GAADHM CO[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1NC(=O)c1ncn(C)n1 ZINC001579851442 1075677287 /nfs/dbraw/zinc/67/72/87/1075677287.db2.gz OOCAECZRBMXCDD-GHMZBOCLSA-N -1 3 386.376 -1.407 20 0 GAADHM CO[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1NC(=O)[C@H]1COC(=O)N1 ZINC001579851458 1075677329 /nfs/dbraw/zinc/67/73/29/1075677329.db2.gz PGLHLVFFSWJPCR-GMTAPVOTSA-N -1 3 390.360 -1.741 20 0 GAADHM CO[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1NC(=O)[C@H]1COC(=O)N1 ZINC001579851458 1075677326 /nfs/dbraw/zinc/67/73/26/1075677326.db2.gz PGLHLVFFSWJPCR-GMTAPVOTSA-N -1 3 390.360 -1.741 20 0 GAADHM CO[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1NC(=O)[C@@H]1COC(=O)N1 ZINC001579851459 1075677317 /nfs/dbraw/zinc/67/73/17/1075677317.db2.gz PGLHLVFFSWJPCR-OUAUKWLOSA-N -1 3 390.360 -1.741 20 0 GAADHM CO[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1NC(=O)[C@@H]1COC(=O)N1 ZINC001579851459 1075677315 /nfs/dbraw/zinc/67/73/15/1075677315.db2.gz PGLHLVFFSWJPCR-OUAUKWLOSA-N -1 3 390.360 -1.741 20 0 GAADHM CO[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1NC(=O)[C@H]1COCCO1 ZINC001579851474 1075677359 /nfs/dbraw/zinc/67/73/59/1075677359.db2.gz QHIGXOGAEGESMO-JHJVBQTASA-N -1 3 391.388 -1.434 20 0 GAADHM CO[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1NC(=O)[C@H]1COCCO1 ZINC001579851474 1075677354 /nfs/dbraw/zinc/67/73/54/1075677354.db2.gz QHIGXOGAEGESMO-JHJVBQTASA-N -1 3 391.388 -1.434 20 0 GAADHM CO[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1NC(=O)[C@@H]1COCCO1 ZINC001579851475 1075677307 /nfs/dbraw/zinc/67/73/07/1075677307.db2.gz QHIGXOGAEGESMO-UPJWGTAASA-N -1 3 391.388 -1.434 20 0 GAADHM CO[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1NC(=O)[C@@H]1COCCO1 ZINC001579851475 1075677305 /nfs/dbraw/zinc/67/73/05/1075677305.db2.gz QHIGXOGAEGESMO-UPJWGTAASA-N -1 3 391.388 -1.434 20 0 GAADHM CO[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1NC(=O)CN(C)C(C)=O ZINC001579851478 1075677226 /nfs/dbraw/zinc/67/72/26/1075677226.db2.gz QPKZRWJHNMKURA-CHWSQXEVSA-N -1 3 390.404 -1.371 20 0 GAADHM CO[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1NC(=O)CN(C)C(C)=O ZINC001579851478 1075677222 /nfs/dbraw/zinc/67/72/22/1075677222.db2.gz QPKZRWJHNMKURA-CHWSQXEVSA-N -1 3 390.404 -1.371 20 0 GAADHM CO[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1NC(=O)[C@H]1COCCO1 ZINC001579851522 1075677431 /nfs/dbraw/zinc/67/74/31/1075677431.db2.gz RWBUGHQKBGITDS-JHJVBQTASA-N -1 3 391.388 -1.434 20 0 GAADHM CO[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1NC(=O)[C@H]1COCCO1 ZINC001579851522 1075677427 /nfs/dbraw/zinc/67/74/27/1075677427.db2.gz RWBUGHQKBGITDS-JHJVBQTASA-N -1 3 391.388 -1.434 20 0 GAADHM CO[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1NC(=O)[C@@H]1COCCO1 ZINC001579851524 1075677249 /nfs/dbraw/zinc/67/72/49/1075677249.db2.gz RWBUGHQKBGITDS-UPJWGTAASA-N -1 3 391.388 -1.434 20 0 GAADHM CO[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1NC(=O)[C@@H]1COCCO1 ZINC001579851524 1075677246 /nfs/dbraw/zinc/67/72/46/1075677246.db2.gz RWBUGHQKBGITDS-UPJWGTAASA-N -1 3 391.388 -1.434 20 0 GAADHM CO[C@@H]1CN(C(=O)[C@@H](C)NC(C)=O)C[C@H]1NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579851536 1075677367 /nfs/dbraw/zinc/67/73/67/1075677367.db2.gz YSWPBONBLPOKHH-BZHVJNSISA-N -1 3 390.404 -1.325 20 0 GAADHM CO[C@@H]1CN(C(=O)[C@@H](C)NC(C)=O)C[C@H]1NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579851536 1075677364 /nfs/dbraw/zinc/67/73/64/1075677364.db2.gz YSWPBONBLPOKHH-BZHVJNSISA-N -1 3 390.404 -1.325 20 0 GAADHM CO[C@@H]1CN(C(=O)[C@H](C)NC(C)=O)C[C@H]1NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579851537 1075677406 /nfs/dbraw/zinc/67/74/06/1075677406.db2.gz YSWPBONBLPOKHH-ZEGGKSINSA-N -1 3 390.404 -1.325 20 0 GAADHM CO[C@@H]1CN(C(=O)[C@H](C)NC(C)=O)C[C@H]1NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579851537 1075677403 /nfs/dbraw/zinc/67/74/03/1075677403.db2.gz YSWPBONBLPOKHH-ZEGGKSINSA-N -1 3 390.404 -1.325 20 0 GAADHM CO[C@@H]1CN(C(=O)[C@H]2COCCO2)C[C@H]1NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579851547 1075677419 /nfs/dbraw/zinc/67/74/19/1075677419.db2.gz YZYBZYNWMKRZRL-JHJVBQTASA-N -1 3 391.388 -1.434 20 0 GAADHM CO[C@@H]1CN(C(=O)[C@H]2COCCO2)C[C@H]1NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579851547 1075677415 /nfs/dbraw/zinc/67/74/15/1075677415.db2.gz YZYBZYNWMKRZRL-JHJVBQTASA-N -1 3 391.388 -1.434 20 0 GAADHM CO[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1NC(=O)c1[nH]nnc1C ZINC001579851548 1075677256 /nfs/dbraw/zinc/67/72/56/1075677256.db2.gz RZZPWPQQLBWARH-GHMZBOCLSA-N -1 3 386.376 -1.109 20 0 GAADHM CO[C@@H]1CN(C(=O)[C@@H]2COCCO2)C[C@H]1NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579851549 1075677276 /nfs/dbraw/zinc/67/72/76/1075677276.db2.gz YZYBZYNWMKRZRL-UPJWGTAASA-N -1 3 391.388 -1.434 20 0 GAADHM CO[C@@H]1CN(C(=O)[C@@H]2COCCO2)C[C@H]1NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579851549 1075677272 /nfs/dbraw/zinc/67/72/72/1075677272.db2.gz YZYBZYNWMKRZRL-UPJWGTAASA-N -1 3 391.388 -1.434 20 0 GAADHM CO[C@@H]1CN(C(=O)CNC(C)=O)C[C@H]1NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001579851551 1075677347 /nfs/dbraw/zinc/67/73/47/1075677347.db2.gz ZBMGKZLRBMQCNM-VXGBXAGGSA-N -1 3 376.377 -1.714 20 0 GAADHM CO[C@@H]1CN(C(=O)CNC(C)=O)C[C@H]1NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001579851551 1075677342 /nfs/dbraw/zinc/67/73/42/1075677342.db2.gz ZBMGKZLRBMQCNM-VXGBXAGGSA-N -1 3 376.377 -1.714 20 0 GAADHM CO[C@@H]1CN(C(=O)Cn2nccn2)C[C@H]1NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001579851552 1075677395 /nfs/dbraw/zinc/67/73/95/1075677395.db2.gz ZCWCGQRTUXNDEI-VXGBXAGGSA-N -1 3 386.376 -1.558 20 0 GAADHM CO[C@@H]1CN(C(=O)Cn2nccn2)C[C@H]1NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001579851552 1075677392 /nfs/dbraw/zinc/67/73/92/1075677392.db2.gz ZCWCGQRTUXNDEI-VXGBXAGGSA-N -1 3 386.376 -1.558 20 0 GAADHM CO[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1NC(=O)[C@@H]1CCC(=O)N1 ZINC001579851620 1075677643 /nfs/dbraw/zinc/67/76/43/1075677643.db2.gz VHIVRRZCIGYGKP-MVWJERBFSA-N -1 3 388.388 -1.571 20 0 GAADHM CO[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1NC(=O)[C@@H]1CCC(=O)N1 ZINC001579851620 1075677640 /nfs/dbraw/zinc/67/76/40/1075677640.db2.gz VHIVRRZCIGYGKP-MVWJERBFSA-N -1 3 388.388 -1.571 20 0 GAADHM CO[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1NC(=O)[C@H]1CCC(=O)N1 ZINC001579851621 1075677710 /nfs/dbraw/zinc/67/77/10/1075677710.db2.gz VHIVRRZCIGYGKP-YUSALJHKSA-N -1 3 388.388 -1.571 20 0 GAADHM CO[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1NC(=O)[C@H]1CCC(=O)N1 ZINC001579851621 1075677709 /nfs/dbraw/zinc/67/77/09/1075677709.db2.gz VHIVRRZCIGYGKP-YUSALJHKSA-N -1 3 388.388 -1.571 20 0 GAADHM CO[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1NC(=O)c1cnnn1C ZINC001579851635 1075677597 /nfs/dbraw/zinc/67/75/97/1075677597.db2.gz WHHGATWGSKACNJ-ZYHUDNBSSA-N -1 3 386.376 -1.407 20 0 GAADHM CO[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1NC(=O)c1cnnn1C ZINC001579851635 1075677595 /nfs/dbraw/zinc/67/75/95/1075677595.db2.gz WHHGATWGSKACNJ-ZYHUDNBSSA-N -1 3 386.376 -1.407 20 0 GAADHM CO[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1NC(=O)CN(C)C(C)=O ZINC001579851648 1075677384 /nfs/dbraw/zinc/67/73/84/1075677384.db2.gz WQUCWUQAWKYWRH-CHWSQXEVSA-N -1 3 390.404 -1.371 20 0 GAADHM 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CO[C@@H]1CN(CCS(C)(=O)=O)C[C@H]1NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579853231 1075677681 /nfs/dbraw/zinc/67/76/81/1075677681.db2.gz ALZHKAUXLAWFNP-VXGBXAGGSA-N -1 3 383.434 -1.332 20 0 GAADHM CO[C@@H]1CN(CCS(C)(=O)=O)C[C@H]1NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579853231 1075677679 /nfs/dbraw/zinc/67/76/79/1075677679.db2.gz ALZHKAUXLAWFNP-VXGBXAGGSA-N -1 3 383.434 -1.332 20 0 GAADHM CO[C@@H]1CN([C@H](C)c2nnnn2C)C[C@H]1NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579853269 1075677610 /nfs/dbraw/zinc/67/76/10/1075677610.db2.gz BJLOZBUZAYHTLU-GGZOMVNGSA-N -1 3 387.408 -1.092 20 0 GAADHM CO[C@@H]1CN([C@H](C)c2nnnn2C)C[C@H]1NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001579853269 1075677606 /nfs/dbraw/zinc/67/76/06/1075677606.db2.gz BJLOZBUZAYHTLU-GGZOMVNGSA-N -1 3 387.408 -1.092 20 0 GAADHM CO[C@@H]1CN([C@@H](C)c2nnnn2C)C[C@H]1NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001579853271 1075677651 /nfs/dbraw/zinc/67/76/51/1075677651.db2.gz BJLOZBUZAYHTLU-XXILOJSOSA-N -1 3 387.408 -1.092 20 0 GAADHM 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CO[C@@H]1COC[C@@H]1NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001579868485 1075684052 /nfs/dbraw/zinc/68/40/52/1075684052.db2.gz YSBLGZONXZJBHQ-NWDGAFQWSA-N -1 3 382.402 -1.325 20 0 GAADHM CO[C@@H]1COC[C@H]1NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001579868487 1075684026 /nfs/dbraw/zinc/68/40/26/1075684026.db2.gz YSBLGZONXZJBHQ-VXGBXAGGSA-N -1 3 382.402 -1.325 20 0 GAADHM CO[C@@H]1COC[C@H]1NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001579868487 1075684022 /nfs/dbraw/zinc/68/40/22/1075684022.db2.gz YSBLGZONXZJBHQ-VXGBXAGGSA-N -1 3 382.402 -1.325 20 0 GAADHM COc1c(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@@H]2O)cnn1C ZINC001579870885 1075684512 /nfs/dbraw/zinc/68/45/12/1075684512.db2.gz DKINDDFZRDBFHU-NEPJUHHUSA-N -1 3 385.388 -1.017 20 0 GAADHM COc1c(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@@H]2O)cnn1C ZINC001579870885 1075684508 /nfs/dbraw/zinc/68/45/08/1075684508.db2.gz DKINDDFZRDBFHU-NEPJUHHUSA-N -1 3 385.388 -1.017 20 0 GAADHM 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COc1c(C(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]2O)cnn1C ZINC001579871393 1075684885 /nfs/dbraw/zinc/68/48/85/1075684885.db2.gz PYJFZQLIHQZUJI-VXGBXAGGSA-N -1 3 385.388 -1.017 20 0 GAADHM COc1cc(-c2nn[n-]n2)ccc1C(=O)N1CCN(C(=O)Cn2cnnn2)CC1 ZINC001579877013 1075685257 /nfs/dbraw/zinc/68/52/57/1075685257.db2.gz UUAPZOMKRZAFEB-UHFFFAOYSA-N -1 3 398.387 -1.154 20 0 GAADHM COc1cc(-c2nnn[n-]2)ccc1C(=O)N1CCN(C(=O)Cn2cnnn2)CC1 ZINC001579877013 1075685256 /nfs/dbraw/zinc/68/52/56/1075685256.db2.gz UUAPZOMKRZAFEB-UHFFFAOYSA-N -1 3 398.387 -1.154 20 0 GAADHM COc1cc(-c2nn[n-]n2)ccc1OCC(=O)NC[C@@]1(O)CCS(=O)(=O)C1 ZINC001579885299 1075685247 /nfs/dbraw/zinc/68/52/47/1075685247.db2.gz DHDFHYGBTSUAKR-HNNXBMFYSA-N -1 3 397.413 -1.080 20 0 GAADHM COc1cc(-c2nnn[n-]2)ccc1OCC(=O)NC[C@@]1(O)CCS(=O)(=O)C1 ZINC001579885299 1075685244 /nfs/dbraw/zinc/68/52/44/1075685244.db2.gz DHDFHYGBTSUAKR-HNNXBMFYSA-N -1 3 397.413 -1.080 20 0 GAADHM COc1cc(-c2nn[n-]n2)ccc1OCC(=O)NC[C@]1(O)CCS(=O)(=O)C1 ZINC001579885300 1075685263 /nfs/dbraw/zinc/68/52/63/1075685263.db2.gz DHDFHYGBTSUAKR-OAHLLOKOSA-N -1 3 397.413 -1.080 20 0 GAADHM COc1cc(-c2nnn[n-]2)ccc1OCC(=O)NC[C@]1(O)CCS(=O)(=O)C1 ZINC001579885300 1075685262 /nfs/dbraw/zinc/68/52/62/1075685262.db2.gz DHDFHYGBTSUAKR-OAHLLOKOSA-N -1 3 397.413 -1.080 20 0 GAADHM COc1cc(-c2nn[n-]n2)ccc1OCC(=O)N1CC2(C1)C[C@@H](O)CNC2=O ZINC001579885532 1075685221 /nfs/dbraw/zinc/68/52/21/1075685221.db2.gz KSDTVZBROXQIOI-LLVKDONJSA-N -1 3 388.384 -1.037 20 0 GAADHM COc1cc(-c2nnn[n-]2)ccc1OCC(=O)N1CC2(C1)C[C@@H](O)CNC2=O ZINC001579885532 1075685219 /nfs/dbraw/zinc/68/52/19/1075685219.db2.gz KSDTVZBROXQIOI-LLVKDONJSA-N -1 3 388.384 -1.037 20 0 GAADHM COc1cc(-c2nn[n-]n2)ccc1OCC(=O)N1CC2(C1)C[C@H](O)CNC2=O ZINC001579885533 1075685267 /nfs/dbraw/zinc/68/52/67/1075685267.db2.gz KSDTVZBROXQIOI-NSHDSACASA-N -1 3 388.384 -1.037 20 0 GAADHM COc1cc(-c2nnn[n-]2)ccc1OCC(=O)N1CC2(C1)C[C@H](O)CNC2=O ZINC001579885533 1075685266 /nfs/dbraw/zinc/68/52/66/1075685266.db2.gz KSDTVZBROXQIOI-NSHDSACASA-N -1 3 388.384 -1.037 20 0 GAADHM COc1cc(-c2nn[n-]n2)ccc1OCC(=O)N[C@@H]1CS(=O)(=O)C[C@H]1O ZINC001579885597 1075685251 /nfs/dbraw/zinc/68/52/51/1075685251.db2.gz NATYOVCMNLCLNA-NXEZZACHSA-N -1 3 383.386 -1.472 20 0 GAADHM COc1cc(-c2nnn[n-]2)ccc1OCC(=O)N[C@@H]1CS(=O)(=O)C[C@H]1O ZINC001579885597 1075685250 /nfs/dbraw/zinc/68/52/50/1075685250.db2.gz NATYOVCMNLCLNA-NXEZZACHSA-N -1 3 383.386 -1.472 20 0 GAADHM COc1cc(-c2nn[n-]n2)ccc1OCC(=O)N1CC(NS(N)(=O)=O)C1 ZINC001579885607 1075685240 /nfs/dbraw/zinc/68/52/40/1075685240.db2.gz NMTNCNFKBCIUKK-UHFFFAOYSA-N -1 3 383.390 -1.742 20 0 GAADHM COc1cc(-c2nnn[n-]2)ccc1OCC(=O)N1CC(NS(N)(=O)=O)C1 ZINC001579885607 1075685237 /nfs/dbraw/zinc/68/52/37/1075685237.db2.gz NMTNCNFKBCIUKK-UHFFFAOYSA-N -1 3 383.390 -1.742 20 0 GAADHM COc1cc(-c2nn[n-]n2)ccc1OCC(=O)NC[C@H](O)CS(C)(=O)=O ZINC001579885957 1075685203 /nfs/dbraw/zinc/68/52/03/1075685203.db2.gz YOBJFLXWADUQLH-JTQLQIEISA-N -1 3 385.402 -1.224 20 0 GAADHM COc1cc(-c2nnn[n-]2)ccc1OCC(=O)NC[C@H](O)CS(C)(=O)=O ZINC001579885957 1075685199 /nfs/dbraw/zinc/68/51/99/1075685199.db2.gz YOBJFLXWADUQLH-JTQLQIEISA-N -1 3 385.402 -1.224 20 0 GAADHM COc1cc(-c2nn[n-]n2)ccc1OCC(=O)NC[C@@H](O)CS(C)(=O)=O ZINC001579885959 1075685254 /nfs/dbraw/zinc/68/52/54/1075685254.db2.gz YOBJFLXWADUQLH-SNVBAGLBSA-N -1 3 385.402 -1.224 20 0 GAADHM COc1cc(-c2nnn[n-]2)ccc1OCC(=O)NC[C@@H](O)CS(C)(=O)=O ZINC001579885959 1075685253 /nfs/dbraw/zinc/68/52/53/1075685253.db2.gz YOBJFLXWADUQLH-SNVBAGLBSA-N -1 3 385.402 -1.224 20 0 GAADHM COc1cc(-c2nn[n-]n2)ccc1S(=O)(=O)N1CC(=O)NCC12COC2 ZINC001579887056 1075685232 /nfs/dbraw/zinc/68/52/32/1075685232.db2.gz GGBFZCMFISPOTH-UHFFFAOYSA-N -1 3 380.386 -1.235 20 0 GAADHM COc1cc(-c2nnn[n-]2)ccc1S(=O)(=O)N1CC(=O)NCC12COC2 ZINC001579887056 1075685231 /nfs/dbraw/zinc/68/52/31/1075685231.db2.gz GGBFZCMFISPOTH-UHFFFAOYSA-N -1 3 380.386 -1.235 20 0 GAADHM COc1cc(-c2nn[n-]n2)ccc1S(=O)(=O)NC[C@@H](O)CS(C)(=O)=O ZINC001579887559 1075685178 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392.401 -1.104 20 0 GAADHM COc1cc(-c2nn[n-]n2)ccc1S(=O)(=O)N1CC2(C1)C[C@H](O)CNC2=O ZINC001579887572 1075685679 /nfs/dbraw/zinc/68/56/79/1075685679.db2.gz UOWIWLRBSDVBQP-JTQLQIEISA-N -1 3 394.413 -1.253 20 0 GAADHM COc1cc(-c2nnn[n-]2)ccc1S(=O)(=O)N1CC2(C1)C[C@H](O)CNC2=O ZINC001579887572 1075685676 /nfs/dbraw/zinc/68/56/76/1075685676.db2.gz UOWIWLRBSDVBQP-JTQLQIEISA-N -1 3 394.413 -1.253 20 0 GAADHM COc1cc(-c2nn[n-]n2)ccc1S(=O)(=O)N1CC2(C1)C[C@@H](O)CNC2=O ZINC001579887573 1075685618 /nfs/dbraw/zinc/68/56/18/1075685618.db2.gz UOWIWLRBSDVBQP-SNVBAGLBSA-N -1 3 394.413 -1.253 20 0 GAADHM COc1cc(-c2nnn[n-]2)ccc1S(=O)(=O)N1CC2(C1)C[C@@H](O)CNC2=O ZINC001579887573 1075685614 /nfs/dbraw/zinc/68/56/14/1075685614.db2.gz UOWIWLRBSDVBQP-SNVBAGLBSA-N -1 3 394.413 -1.253 20 0 GAADHM COc1cc(-c2nn[n-]n2)ccc1S(=O)(=O)NCC(=O)N1CCN(C)CC1 ZINC001579887895 1075685556 /nfs/dbraw/zinc/68/55/56/1075685556.db2.gz ZIHVHCXJJKURPB-UHFFFAOYSA-N -1 3 395.445 -1.072 20 0 GAADHM COc1cc(-c2nnn[n-]2)ccc1S(=O)(=O)NCC(=O)N1CCN(C)CC1 ZINC001579887895 1075685552 /nfs/dbraw/zinc/68/55/52/1075685552.db2.gz ZIHVHCXJJKURPB-UHFFFAOYSA-N -1 3 395.445 -1.072 20 0 GAADHM COc1cc(C(=O)N2CCN3[C@@H](CNS3(=O)=O)C2)ccc1-c1nn[n-]n1 ZINC001579893824 1075686111 /nfs/dbraw/zinc/68/61/11/1075686111.db2.gz QLMAAFIPNQGITG-JTQLQIEISA-N -1 3 379.402 -1.150 20 0 GAADHM COc1cc(C(=O)N2CCN3[C@@H](CNS3(=O)=O)C2)ccc1-c1nnn[n-]1 ZINC001579893824 1075686109 /nfs/dbraw/zinc/68/61/09/1075686109.db2.gz QLMAAFIPNQGITG-JTQLQIEISA-N -1 3 379.402 -1.150 20 0 GAADHM COc1cc(C(=O)N2CCN3[C@H](CNS3(=O)=O)C2)ccc1-c1nn[n-]n1 ZINC001579893825 1075686074 /nfs/dbraw/zinc/68/60/74/1075686074.db2.gz QLMAAFIPNQGITG-SNVBAGLBSA-N -1 3 379.402 -1.150 20 0 GAADHM COc1cc(C(=O)N2CCN3[C@H](CNS3(=O)=O)C2)ccc1-c1nnn[n-]1 ZINC001579893825 1075686068 /nfs/dbraw/zinc/68/60/68/1075686068.db2.gz QLMAAFIPNQGITG-SNVBAGLBSA-N -1 3 379.402 -1.150 20 0 GAADHM COc1cc(C(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@@H]2O)nn1C ZINC001579912042 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ZINC001580161931 1075701233 /nfs/dbraw/zinc/70/12/33/1075701233.db2.gz OLGYLSBXCLFYCB-UHFFFAOYSA-N -1 3 383.434 -1.594 20 0 GAADHM CS(=O)(=O)CCN1CC(CCO)(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001580161931 1075701227 /nfs/dbraw/zinc/70/12/27/1075701227.db2.gz OLGYLSBXCLFYCB-UHFFFAOYSA-N -1 3 383.434 -1.594 20 0 GAADHM CS(=O)(=O)CCN1CC(CCO)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001580161935 1075701348 /nfs/dbraw/zinc/70/13/48/1075701348.db2.gz OQUNKXBROOGSPV-UHFFFAOYSA-N -1 3 383.434 -1.594 20 0 GAADHM CS(=O)(=O)CCN1CC(CCO)(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001580161935 1075701343 /nfs/dbraw/zinc/70/13/43/1075701343.db2.gz OQUNKXBROOGSPV-UHFFFAOYSA-N -1 3 383.434 -1.594 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001580162000 1075701153 /nfs/dbraw/zinc/70/11/53/1075701153.db2.gz MWCODITVLUKSSM-NEPJUHHUSA-N -1 3 381.418 -1.638 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001580162000 1075701146 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383.434 -1.025 20 0 GAADHM CS(=O)(=O)CCCC(=O)NC[C@H](CO)Nc1ncccc1-c1nnn[n-]1 ZINC001580162005 1075701261 /nfs/dbraw/zinc/70/12/61/1075701261.db2.gz MYYLBJHQPSSJJY-SNVBAGLBSA-N -1 3 383.434 -1.025 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001580162033 1075701301 /nfs/dbraw/zinc/70/13/01/1075701301.db2.gz ODWFDVBYEZTMJT-JTQLQIEISA-N -1 3 381.418 -1.040 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001580162033 1075701299 /nfs/dbraw/zinc/70/12/99/1075701299.db2.gz ODWFDVBYEZTMJT-JTQLQIEISA-N -1 3 381.418 -1.040 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001580162034 1075701203 /nfs/dbraw/zinc/70/12/03/1075701203.db2.gz ODWFDVBYEZTMJT-SNVBAGLBSA-N -1 3 381.418 -1.040 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001580162034 1075701195 /nfs/dbraw/zinc/70/11/95/1075701195.db2.gz ODWFDVBYEZTMJT-SNVBAGLBSA-N -1 3 381.418 -1.040 20 0 GAADHM CS(=O)(=O)CCN1CC(CCO)(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001580162056 1075701109 /nfs/dbraw/zinc/70/11/09/1075701109.db2.gz QGKYWPUEDSQYHC-UHFFFAOYSA-N -1 3 383.434 -1.594 20 0 GAADHM CS(=O)(=O)CCN1CC(CCO)(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001580162056 1075701105 /nfs/dbraw/zinc/70/11/05/1075701105.db2.gz QGKYWPUEDSQYHC-UHFFFAOYSA-N -1 3 383.434 -1.594 20 0 GAADHM CS(=O)(=O)CCN1CCO[C@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001580162066 1075701646 /nfs/dbraw/zinc/70/16/46/1075701646.db2.gz QTOLULIJKHXONV-LLVKDONJSA-N -1 3 383.434 -1.330 20 0 GAADHM CS(=O)(=O)CCN1CCO[C@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001580162066 1075701642 /nfs/dbraw/zinc/70/16/42/1075701642.db2.gz QTOLULIJKHXONV-LLVKDONJSA-N -1 3 383.434 -1.330 20 0 GAADHM CS(=O)(=O)CCN1CCO[C@@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001580162067 1075701660 /nfs/dbraw/zinc/70/16/60/1075701660.db2.gz QTOLULIJKHXONV-NSHDSACASA-N -1 3 383.434 -1.330 20 0 GAADHM CS(=O)(=O)CCN1CCO[C@@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001580162067 1075701656 /nfs/dbraw/zinc/70/16/56/1075701656.db2.gz QTOLULIJKHXONV-NSHDSACASA-N -1 3 383.434 -1.330 20 0 GAADHM CS(=O)(=O)CCN1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@H](O)C1 ZINC001580162077 1075701721 /nfs/dbraw/zinc/70/17/21/1075701721.db2.gz RMGCKHMRSCEWRS-CMPLNLGQSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCN1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@H](O)C1 ZINC001580162077 1075701716 /nfs/dbraw/zinc/70/17/16/1075701716.db2.gz RMGCKHMRSCEWRS-CMPLNLGQSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCN1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001580162078 1075701569 /nfs/dbraw/zinc/70/15/69/1075701569.db2.gz RMGCKHMRSCEWRS-JQWIXIFHSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCN1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001580162078 1075701564 /nfs/dbraw/zinc/70/15/64/1075701564.db2.gz RMGCKHMRSCEWRS-JQWIXIFHSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCN1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001580162079 1075701470 /nfs/dbraw/zinc/70/14/70/1075701470.db2.gz RMGCKHMRSCEWRS-PWSUYJOCSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCN1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001580162079 1075701465 /nfs/dbraw/zinc/70/14/65/1075701465.db2.gz RMGCKHMRSCEWRS-PWSUYJOCSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCN1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@H](O)C1 ZINC001580162080 1075701486 /nfs/dbraw/zinc/70/14/86/1075701486.db2.gz RMGCKHMRSCEWRS-ZYHUDNBSSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCN1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@H](O)C1 ZINC001580162080 1075701479 /nfs/dbraw/zinc/70/14/79/1075701479.db2.gz RMGCKHMRSCEWRS-ZYHUDNBSSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001580162158 1075701615 /nfs/dbraw/zinc/70/16/15/1075701615.db2.gz PASPMLOLPRTOCV-SECBINFHSA-N -1 3 381.418 -1.040 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001580162158 1075701612 /nfs/dbraw/zinc/70/16/12/1075701612.db2.gz PASPMLOLPRTOCV-SECBINFHSA-N -1 3 381.418 -1.040 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001580162159 1075701508 /nfs/dbraw/zinc/70/15/08/1075701508.db2.gz PASPMLOLPRTOCV-VIFPVBQESA-N -1 3 381.418 -1.040 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001580162159 1075701503 /nfs/dbraw/zinc/70/15/03/1075701503.db2.gz PASPMLOLPRTOCV-VIFPVBQESA-N -1 3 381.418 -1.040 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CN(Cc2cccc(-c3nn[n-]n3)c2)C[C@H]1O ZINC001580162186 1075701757 /nfs/dbraw/zinc/70/17/57/1075701757.db2.gz QTMYWUKRQOWWKC-ZIAGYGMSSA-N -1 3 394.457 -1.037 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CN(Cc2cccc(-c3nnn[n-]3)c2)C[C@H]1O ZINC001580162186 1075701751 /nfs/dbraw/zinc/70/17/51/1075701751.db2.gz QTMYWUKRQOWWKC-ZIAGYGMSSA-N -1 3 394.457 -1.037 20 0 GAADHM CS(=O)(=O)CCCC(=O)NC[C@H](CO)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001580162193 1075701528 /nfs/dbraw/zinc/70/15/28/1075701528.db2.gz RHCNUDHALYVBKM-LLVKDONJSA-N -1 3 383.434 -1.025 20 0 GAADHM CS(=O)(=O)CCCC(=O)NC[C@H](CO)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001580162193 1075701521 /nfs/dbraw/zinc/70/15/21/1075701521.db2.gz RHCNUDHALYVBKM-LLVKDONJSA-N -1 3 383.434 -1.025 20 0 GAADHM CS(=O)(=O)CCCC(=O)NC[C@@H](CO)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001580162194 1075701704 /nfs/dbraw/zinc/70/17/04/1075701704.db2.gz RHCNUDHALYVBKM-NSHDSACASA-N -1 3 383.434 -1.025 20 0 GAADHM CS(=O)(=O)CCCC(=O)NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001580162194 1075701699 /nfs/dbraw/zinc/70/16/99/1075701699.db2.gz RHCNUDHALYVBKM-NSHDSACASA-N -1 3 383.434 -1.025 20 0 GAADHM CS(=O)(=O)CCC(=O)NCC1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001580162210 1075701546 /nfs/dbraw/zinc/70/15/46/1075701546.db2.gz SDCTYMQRPBJTIA-UHFFFAOYSA-N -1 3 381.418 -1.182 20 0 GAADHM CS(=O)(=O)CCC(=O)NCC1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001580162210 1075701541 /nfs/dbraw/zinc/70/15/41/1075701541.db2.gz SDCTYMQRPBJTIA-UHFFFAOYSA-N -1 3 381.418 -1.182 20 0 GAADHM CS(=O)(=O)CCC(=O)NC[C@@H]1CCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001580162214 1075701601 /nfs/dbraw/zinc/70/16/01/1075701601.db2.gz SFOPBJCIJBAPAB-JTQLQIEISA-N -1 3 381.418 -1.040 20 0 GAADHM CS(=O)(=O)CCC(=O)NC[C@@H]1CCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001580162214 1075701595 /nfs/dbraw/zinc/70/15/95/1075701595.db2.gz SFOPBJCIJBAPAB-JTQLQIEISA-N -1 3 381.418 -1.040 20 0 GAADHM CS(=O)(=O)CCC(=O)NC[C@H]1CCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001580162215 1075702005 /nfs/dbraw/zinc/70/20/05/1075702005.db2.gz SFOPBJCIJBAPAB-SNVBAGLBSA-N -1 3 381.418 -1.040 20 0 GAADHM CS(=O)(=O)CCC(=O)NC[C@H]1CCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001580162215 1075701998 /nfs/dbraw/zinc/70/19/98/1075701998.db2.gz SFOPBJCIJBAPAB-SNVBAGLBSA-N -1 3 381.418 -1.040 20 0 GAADHM CS(=O)(=O)CCN1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1 ZINC001580162279 1075702099 /nfs/dbraw/zinc/70/20/99/1075702099.db2.gz WMRGMHORMJZIRK-BXKDBHETSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCN1CC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H](O)C1 ZINC001580162279 1075702096 /nfs/dbraw/zinc/70/20/96/1075702096.db2.gz WMRGMHORMJZIRK-BXKDBHETSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCN1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001580162280 1075701906 /nfs/dbraw/zinc/70/19/06/1075701906.db2.gz WMRGMHORMJZIRK-CABZTGNLSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCN1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001580162280 1075701901 /nfs/dbraw/zinc/70/19/01/1075701901.db2.gz WMRGMHORMJZIRK-CABZTGNLSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCN1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1 ZINC001580162281 1075701969 /nfs/dbraw/zinc/70/19/69/1075701969.db2.gz WMRGMHORMJZIRK-JOYOIKCWSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCN1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H](O)C1 ZINC001580162281 1075701964 /nfs/dbraw/zinc/70/19/64/1075701964.db2.gz WMRGMHORMJZIRK-JOYOIKCWSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCN1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001580162282 1075702063 /nfs/dbraw/zinc/70/20/63/1075702063.db2.gz WMRGMHORMJZIRK-SKDRFNHKSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCN1CC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001580162282 1075702057 /nfs/dbraw/zinc/70/20/57/1075702057.db2.gz WMRGMHORMJZIRK-SKDRFNHKSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCN1CCO[C@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001580162326 1075701895 /nfs/dbraw/zinc/70/18/95/1075701895.db2.gz YGCFFWQIWKSNCW-LLVKDONJSA-N -1 3 383.434 -1.330 20 0 GAADHM CS(=O)(=O)CCN1CCO[C@H](CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001580162326 1075701892 /nfs/dbraw/zinc/70/18/92/1075701892.db2.gz YGCFFWQIWKSNCW-LLVKDONJSA-N -1 3 383.434 -1.330 20 0 GAADHM CS(=O)(=O)CCN1CCO[C@@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001580162327 1075702126 /nfs/dbraw/zinc/70/21/26/1075702126.db2.gz YGCFFWQIWKSNCW-NSHDSACASA-N -1 3 383.434 -1.330 20 0 GAADHM 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1075701885 /nfs/dbraw/zinc/70/18/85/1075701885.db2.gz VSSUOZBMBLPYRG-NSHDSACASA-N -1 3 383.434 -1.025 20 0 GAADHM CS(=O)(=O)CCCC(=O)NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001580162381 1075701880 /nfs/dbraw/zinc/70/18/80/1075701880.db2.gz VSSUOZBMBLPYRG-NSHDSACASA-N -1 3 383.434 -1.025 20 0 GAADHM CS(=O)(=O)CCC(=O)NC[C@H](CO)Nc1ncc(-c2nn[n-]n2)cc1F ZINC001580162388 1075702044 /nfs/dbraw/zinc/70/20/44/1075702044.db2.gz VYBCXBYYWWTVIM-SECBINFHSA-N -1 3 387.397 -1.276 20 0 GAADHM CS(=O)(=O)CCC(=O)NC[C@H](CO)Nc1ncc(-c2nnn[n-]2)cc1F ZINC001580162388 1075702040 /nfs/dbraw/zinc/70/20/40/1075702040.db2.gz VYBCXBYYWWTVIM-SECBINFHSA-N -1 3 387.397 -1.276 20 0 GAADHM CS(=O)(=O)CCC(=O)NC[C@@H](CO)Nc1ncc(-c2nn[n-]n2)cc1F ZINC001580162389 1075702077 /nfs/dbraw/zinc/70/20/77/1075702077.db2.gz VYBCXBYYWWTVIM-VIFPVBQESA-N -1 3 387.397 -1.276 20 0 GAADHM CS(=O)(=O)CCC(=O)NC[C@@H](CO)Nc1ncc(-c2nnn[n-]2)cc1F ZINC001580162389 1075702071 /nfs/dbraw/zinc/70/20/71/1075702071.db2.gz VYBCXBYYWWTVIM-VIFPVBQESA-N 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CS(=O)(=O)NCCN1CCCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001580167466 1075703195 /nfs/dbraw/zinc/70/31/95/1075703195.db2.gz COYZZWPFUBLDCW-UHFFFAOYSA-N -1 3 382.450 -1.108 20 0 GAADHM CS(=O)(=O)NCCN1CCCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001580167466 1075703194 /nfs/dbraw/zinc/70/31/94/1075703194.db2.gz COYZZWPFUBLDCW-UHFFFAOYSA-N -1 3 382.450 -1.108 20 0 GAADHM CS(=O)(=O)NCCC(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001580167472 1075703632 /nfs/dbraw/zinc/70/36/32/1075703632.db2.gz CUAMIZGAINRRTI-LLVKDONJSA-N -1 3 380.434 -1.104 20 0 GAADHM CS(=O)(=O)NCCC(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001580167472 1075703624 /nfs/dbraw/zinc/70/36/24/1075703624.db2.gz CUAMIZGAINRRTI-LLVKDONJSA-N -1 3 380.434 -1.104 20 0 GAADHM CS(=O)(=O)NCCC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001580167473 1075703610 /nfs/dbraw/zinc/70/36/10/1075703610.db2.gz CUAMIZGAINRRTI-NSHDSACASA-N -1 3 380.434 -1.104 20 0 GAADHM CS(=O)(=O)NCCC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001580167473 1075703600 /nfs/dbraw/zinc/70/36/00/1075703600.db2.gz CUAMIZGAINRRTI-NSHDSACASA-N -1 3 380.434 -1.104 20 0 GAADHM CS(=O)(=O)NCCC(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001580167510 1075703709 /nfs/dbraw/zinc/70/37/09/1075703709.db2.gz FYLOMBAQAJSTGU-MNOVXSKESA-N -1 3 396.433 -2.133 20 0 GAADHM CS(=O)(=O)NCCC(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001580167510 1075703702 /nfs/dbraw/zinc/70/37/02/1075703702.db2.gz FYLOMBAQAJSTGU-MNOVXSKESA-N -1 3 396.433 -2.133 20 0 GAADHM CS(=O)(=O)NCCC(=O)N1CC(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001580167511 1075703692 /nfs/dbraw/zinc/70/36/92/1075703692.db2.gz FYNHBFHXRNKYAI-UHFFFAOYSA-N -1 3 382.406 -1.925 20 0 GAADHM CS(=O)(=O)NCCC(=O)N1CC(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001580167511 1075703686 /nfs/dbraw/zinc/70/36/86/1075703686.db2.gz FYNHBFHXRNKYAI-UHFFFAOYSA-N -1 3 382.406 -1.925 20 0 GAADHM CS(=O)(=O)NCCN1CCC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001580167513 1075703730 /nfs/dbraw/zinc/70/37/30/1075703730.db2.gz GAZMAKLRTLMIKB-LLVKDONJSA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCN1CCC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001580167514 1075703586 /nfs/dbraw/zinc/70/35/86/1075703586.db2.gz GAZMAKLRTLMIKB-NSHDSACASA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCN1CCC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001580167516 1075703488 /nfs/dbraw/zinc/70/34/88/1075703488.db2.gz GGPTYLUULXUXKM-JTQLQIEISA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCN1CCC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001580167517 1075703510 /nfs/dbraw/zinc/70/35/10/1075703510.db2.gz GGPTYLUULXUXKM-SNVBAGLBSA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCC(=O)N1C[C@@H]2C[C@H]1CN2c1ncccc1-c1nn[n-]n1 ZINC001580167526 1075703459 /nfs/dbraw/zinc/70/34/59/1075703459.db2.gz GSHGAGCNBMDWFT-QWRGUYRKSA-N -1 3 392.445 -1.010 20 0 GAADHM CS(=O)(=O)NCCC(=O)N1C[C@@H]2C[C@H]1CN2c1ncccc1-c1nnn[n-]1 ZINC001580167526 1075703456 /nfs/dbraw/zinc/70/34/56/1075703456.db2.gz GSHGAGCNBMDWFT-QWRGUYRKSA-N -1 3 392.445 -1.010 20 0 GAADHM CS(=O)(=O)NCCC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nn[n-]n2)cn1 ZINC001580167530 1075703764 /nfs/dbraw/zinc/70/37/64/1075703764.db2.gz GYBNIAAPUDULIB-RYUDHWBXSA-N -1 3 392.445 -1.010 20 0 GAADHM CS(=O)(=O)NCCC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nnn[n-]2)cn1 ZINC001580167530 1075703759 /nfs/dbraw/zinc/70/37/59/1075703759.db2.gz GYBNIAAPUDULIB-RYUDHWBXSA-N -1 3 392.445 -1.010 20 0 GAADHM CS(=O)(=O)NCCC(=O)NC1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001580167536 1075703772 /nfs/dbraw/zinc/70/37/72/1075703772.db2.gz HEOGGYURTFBEPI-UHFFFAOYSA-N -1 3 382.406 -1.925 20 0 GAADHM CS(=O)(=O)NCCC(=O)NC1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001580167536 1075703771 /nfs/dbraw/zinc/70/37/71/1075703771.db2.gz HEOGGYURTFBEPI-UHFFFAOYSA-N -1 3 382.406 -1.925 20 0 GAADHM CS(=O)(=O)NCCN1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001580167537 1075704125 /nfs/dbraw/zinc/70/41/25/1075704125.db2.gz HEUHEOUFQSYXQH-GHMZBOCLSA-N -1 3 384.422 -2.481 20 0 GAADHM CS(=O)(=O)NCCN1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001580167537 1075704121 /nfs/dbraw/zinc/70/41/21/1075704121.db2.gz HEUHEOUFQSYXQH-GHMZBOCLSA-N -1 3 384.422 -2.481 20 0 GAADHM CS(=O)(=O)NCCC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]21 ZINC001580167540 1075703873 /nfs/dbraw/zinc/70/38/73/1075703873.db2.gz HJOYKETVGAFSKA-YABSGUDNSA-N -1 3 392.445 -1.248 20 0 GAADHM CS(=O)(=O)NCCC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@H]21 ZINC001580167540 1075703865 /nfs/dbraw/zinc/70/38/65/1075703865.db2.gz HJOYKETVGAFSKA-YABSGUDNSA-N -1 3 392.445 -1.248 20 0 GAADHM CS(=O)(=O)NCCN1CCC(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001580167570 1075703898 /nfs/dbraw/zinc/70/38/98/1075703898.db2.gz IXUXVBMDBRYHJG-UHFFFAOYSA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCN1CCC(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001580167570 1075703891 /nfs/dbraw/zinc/70/38/91/1075703891.db2.gz IXUXVBMDBRYHJG-UHFFFAOYSA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCN1CC(O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001580167573 1075704084 /nfs/dbraw/zinc/70/40/84/1075704084.db2.gz JBIPMJISNOIHLJ-UHFFFAOYSA-N -1 3 384.422 -2.480 20 0 GAADHM CS(=O)(=O)NCCN1CC(O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001580167573 1075704079 /nfs/dbraw/zinc/70/40/79/1075704079.db2.gz JBIPMJISNOIHLJ-UHFFFAOYSA-N -1 3 384.422 -2.480 20 0 GAADHM CS(=O)(=O)NCCN1CCCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001580167574 1075704174 /nfs/dbraw/zinc/70/41/74/1075704174.db2.gz JCBHIIWYAKJFAM-UHFFFAOYSA-N -1 3 382.450 -1.108 20 0 GAADHM CS(=O)(=O)NCCN1CCCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001580167574 1075704165 /nfs/dbraw/zinc/70/41/65/1075704165.db2.gz JCBHIIWYAKJFAM-UHFFFAOYSA-N -1 3 382.450 -1.108 20 0 GAADHM CS(=O)(=O)NCCC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001580167585 1075704032 /nfs/dbraw/zinc/70/40/32/1075704032.db2.gz JNLDBVOKSXPPHE-JTQLQIEISA-N -1 3 380.434 -1.104 20 0 GAADHM CS(=O)(=O)NCCC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001580167585 1075704028 /nfs/dbraw/zinc/70/40/28/1075704028.db2.gz JNLDBVOKSXPPHE-JTQLQIEISA-N -1 3 380.434 -1.104 20 0 GAADHM CS(=O)(=O)NCCC(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001580167586 1075703970 /nfs/dbraw/zinc/70/39/70/1075703970.db2.gz JNLDBVOKSXPPHE-SNVBAGLBSA-N -1 3 380.434 -1.104 20 0 GAADHM CS(=O)(=O)NCCC(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001580167586 1075703963 /nfs/dbraw/zinc/70/39/63/1075703963.db2.gz JNLDBVOKSXPPHE-SNVBAGLBSA-N -1 3 380.434 -1.104 20 0 GAADHM CS(=O)(=O)NCCC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nn[n-]n2)nc1 ZINC001580167587 1075704066 /nfs/dbraw/zinc/70/40/66/1075704066.db2.gz JNONJNQBHGOGKN-RYUDHWBXSA-N -1 3 392.445 -1.010 20 0 GAADHM CS(=O)(=O)NCCC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nnn[n-]2)nc1 ZINC001580167587 1075704062 /nfs/dbraw/zinc/70/40/62/1075704062.db2.gz JNONJNQBHGOGKN-RYUDHWBXSA-N -1 3 392.445 -1.010 20 0 GAADHM CS(=O)(=O)NCCN(CCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)C1CC1 ZINC001580167589 1075704002 /nfs/dbraw/zinc/70/40/02/1075704002.db2.gz JPOCSASGEVLUBP-UHFFFAOYSA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCN(CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)C1CC1 ZINC001580167589 1075703996 /nfs/dbraw/zinc/70/39/96/1075703996.db2.gz JPOCSASGEVLUBP-UHFFFAOYSA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCN1CCC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001580167594 1075704277 /nfs/dbraw/zinc/70/42/77/1075704277.db2.gz JYUDNHDRRKZZPJ-LLVKDONJSA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCN1CCC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001580167594 1075704270 /nfs/dbraw/zinc/70/42/70/1075704270.db2.gz JYUDNHDRRKZZPJ-LLVKDONJSA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCN1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001580167600 1075704216 /nfs/dbraw/zinc/70/42/16/1075704216.db2.gz KIDAWMRBKPKFNM-IAZYJMLFSA-N -1 3 380.434 -1.596 20 0 GAADHM CS(=O)(=O)NCCN1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001580167600 1075704209 /nfs/dbraw/zinc/70/42/09/1075704209.db2.gz KIDAWMRBKPKFNM-IAZYJMLFSA-N -1 3 380.434 -1.596 20 0 GAADHM CS(=O)(=O)NCCN1CCC[C@@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001580167613 1075704110 /nfs/dbraw/zinc/70/41/10/1075704110.db2.gz KYAVUSRCTZJFSG-LLVKDONJSA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCN1CCC[C@@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001580167613 1075704105 /nfs/dbraw/zinc/70/41/05/1075704105.db2.gz KYAVUSRCTZJFSG-LLVKDONJSA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCN1CCC[C@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001580167614 1075703929 /nfs/dbraw/zinc/70/39/29/1075703929.db2.gz KYAVUSRCTZJFSG-NSHDSACASA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCN1CCC[C@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001580167614 1075703924 /nfs/dbraw/zinc/70/39/24/1075703924.db2.gz KYAVUSRCTZJFSG-NSHDSACASA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCN1CCC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001580167615 1075704495 /nfs/dbraw/zinc/70/44/95/1075704495.db2.gz LCXZNSIFMSJWLA-JTQLQIEISA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCN1CCC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001580167615 1075704494 /nfs/dbraw/zinc/70/44/94/1075704494.db2.gz LCXZNSIFMSJWLA-JTQLQIEISA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCN1CCC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001580167616 1075704693 /nfs/dbraw/zinc/70/46/93/1075704693.db2.gz LCXZNSIFMSJWLA-SNVBAGLBSA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCN1CCC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001580167616 1075704685 /nfs/dbraw/zinc/70/46/85/1075704685.db2.gz LCXZNSIFMSJWLA-SNVBAGLBSA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCN1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001580167638 1075704571 /nfs/dbraw/zinc/70/45/71/1075704571.db2.gz MFBWUWLCSJDKPV-GHMZBOCLSA-N -1 3 384.422 -2.481 20 0 GAADHM CS(=O)(=O)NCCN1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001580167638 1075704566 /nfs/dbraw/zinc/70/45/66/1075704566.db2.gz MFBWUWLCSJDKPV-GHMZBOCLSA-N -1 3 384.422 -2.481 20 0 GAADHM CS(=O)(=O)NCCN1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001580167639 1075704440 /nfs/dbraw/zinc/70/44/40/1075704440.db2.gz MFBWUWLCSJDKPV-MNOVXSKESA-N -1 3 384.422 -2.481 20 0 GAADHM CS(=O)(=O)NCCN1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001580167639 1075704435 /nfs/dbraw/zinc/70/44/35/1075704435.db2.gz MFBWUWLCSJDKPV-MNOVXSKESA-N -1 3 384.422 -2.481 20 0 GAADHM CS(=O)(=O)NCCC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]21 ZINC001580167640 1075704660 /nfs/dbraw/zinc/70/46/60/1075704660.db2.gz MIRVELIUBALUEM-YABSGUDNSA-N -1 3 392.445 -1.248 20 0 GAADHM CS(=O)(=O)NCCC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]21 ZINC001580167640 1075704651 /nfs/dbraw/zinc/70/46/51/1075704651.db2.gz MIRVELIUBALUEM-YABSGUDNSA-N -1 3 392.445 -1.248 20 0 GAADHM CS(=O)(=O)NCCC(=O)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001580167642 1075704597 /nfs/dbraw/zinc/70/45/97/1075704597.db2.gz MNYFFNUPUDGUGF-UHFFFAOYSA-N -1 3 380.434 -1.150 20 0 GAADHM CS(=O)(=O)NCCC(=O)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001580167642 1075704590 /nfs/dbraw/zinc/70/45/90/1075704590.db2.gz MNYFFNUPUDGUGF-UHFFFAOYSA-N -1 3 380.434 -1.150 20 0 GAADHM CS(=O)(=O)NCCN(CCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)C1CC1 ZINC001580167665 1075704510 /nfs/dbraw/zinc/70/45/10/1075704510.db2.gz NSXGNPSOMCVOBQ-UHFFFAOYSA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCN(CCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)C1CC1 ZINC001580167665 1075704507 /nfs/dbraw/zinc/70/45/07/1075704507.db2.gz NSXGNPSOMCVOBQ-UHFFFAOYSA-N -1 3 382.450 -1.062 20 0 GAADHM CS(=O)(=O)NCCN1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001580167672 1075704524 /nfs/dbraw/zinc/70/45/24/1075704524.db2.gz ODVSTUVQIFKJBG-GHMZBOCLSA-N -1 3 384.422 -2.481 20 0 GAADHM CS(=O)(=O)NCCN1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001580167672 1075704519 /nfs/dbraw/zinc/70/45/19/1075704519.db2.gz ODVSTUVQIFKJBG-GHMZBOCLSA-N -1 3 384.422 -2.481 20 0 GAADHM 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1075712911 /nfs/dbraw/zinc/71/29/11/1075712911.db2.gz QTUYYSONLSJXSM-KOLCDFICSA-N -1 3 385.392 -1.009 20 0 GAADHM C[C@@H]1[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCN1C(=O)CCn1cnnn1 ZINC001580380784 1075712907 /nfs/dbraw/zinc/71/29/07/1075712907.db2.gz QTUYYSONLSJXSM-KOLCDFICSA-N -1 3 385.392 -1.009 20 0 GAADHM C[C@@H]1[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCN1CCNS(C)(=O)=O ZINC001580380831 1075712974 /nfs/dbraw/zinc/71/29/74/1075712974.db2.gz UHIISAWSOVSEDR-KOLCDFICSA-N -1 3 382.450 -1.063 20 0 GAADHM C[C@@H]1[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCN1C(=O)CN1CN=NC1=O ZINC001580380850 1075712956 /nfs/dbraw/zinc/71/29/56/1075712956.db2.gz VJJFTOCHRYITHH-SCZZXKLOSA-N -1 3 386.376 -1.089 20 0 GAADHM C[C@@H]1[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCN1C(=O)CN1CN=NC1=O ZINC001580380850 1075712954 /nfs/dbraw/zinc/71/29/54/1075712954.db2.gz VJJFTOCHRYITHH-SCZZXKLOSA-N -1 3 386.376 -1.089 20 0 GAADHM C[C@@H]1[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCN1C(=O)[C@@H]1CN(C)C(=O)N1 ZINC001580380929 1075712977 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ZINC001580381813 1075712920 /nfs/dbraw/zinc/71/29/20/1075712920.db2.gz BWBWARMGFZTTIO-PTRXPTGYSA-N -1 3 387.404 -1.062 20 0 GAADHM C[C@@H]1[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCN1C(=O)[C@H]1CN(C)C(=O)N1 ZINC001580381814 1075712983 /nfs/dbraw/zinc/71/29/83/1075712983.db2.gz BWBWARMGFZTTIO-VDDIYKPWSA-N -1 3 387.404 -1.062 20 0 GAADHM C[C@@H]1[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCN1C(=O)[C@H]1CN(C)C(=O)N1 ZINC001580381814 1075712982 /nfs/dbraw/zinc/71/29/82/1075712982.db2.gz BWBWARMGFZTTIO-VDDIYKPWSA-N -1 3 387.404 -1.062 20 0 GAADHM C[C@@H]1[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCN1C(=O)CN1CN=NC1=O ZINC001580382380 1075712858 /nfs/dbraw/zinc/71/28/58/1075712858.db2.gz CWSLAKXPWICHMY-BDAKNGLRSA-N -1 3 386.376 -1.089 20 0 GAADHM C[C@@H]1[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCN1C(=O)CN1CN=NC1=O ZINC001580382380 1075712852 /nfs/dbraw/zinc/71/28/52/1075712852.db2.gz CWSLAKXPWICHMY-BDAKNGLRSA-N -1 3 386.376 -1.089 20 0 GAADHM C[C@@H]1[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCN1CCNS(C)(=O)=O 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ZINC001580388796 1075714013 /nfs/dbraw/zinc/71/40/13/1075714013.db2.gz BNDBEVHAFZFUDU-GDLVEWKHSA-N -1 3 388.388 -1.835 20 0 GAADHM C[C@@]1(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)CCC(=O)N1 ZINC001580388797 1075714084 /nfs/dbraw/zinc/71/40/84/1075714084.db2.gz BNDBEVHAFZFUDU-UVWXRNBGSA-N -1 3 388.388 -1.835 20 0 GAADHM C[C@@]1(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)CCC(=O)N1 ZINC001580388797 1075714078 /nfs/dbraw/zinc/71/40/78/1075714078.db2.gz BNDBEVHAFZFUDU-UVWXRNBGSA-N -1 3 388.388 -1.835 20 0 GAADHM C[C@@]1(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)CCC(=O)N1 ZINC001580388952 1075714378 /nfs/dbraw/zinc/71/43/78/1075714378.db2.gz IPAIEVJKOKIKKI-HNNXBMFYSA-N -1 3 388.388 -1.833 20 0 GAADHM C[C@@]1(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)CCC(=O)N1 ZINC001580388952 1075714373 /nfs/dbraw/zinc/71/43/73/1075714373.db2.gz IPAIEVJKOKIKKI-HNNXBMFYSA-N -1 3 388.388 -1.833 20 0 GAADHM C[C@@]1(C(=O)NC[C@]2(O)CCN(c3ccc(-c4nn[n-]n4)nc3)C2)CCC(=O)N1 ZINC001580389010 1075714424 /nfs/dbraw/zinc/71/44/24/1075714424.db2.gz KZSQRXHPNKAQHB-DLBZAZTESA-N -1 3 386.416 -1.012 20 0 GAADHM C[C@@]1(C(=O)NC[C@]2(O)CCN(c3ccc(-c4nnn[n-]4)nc3)C2)CCC(=O)N1 ZINC001580389010 1075714419 /nfs/dbraw/zinc/71/44/19/1075714419.db2.gz KZSQRXHPNKAQHB-DLBZAZTESA-N -1 3 386.416 -1.012 20 0 GAADHM C[C@@]1(C(=O)NC[C@@]2(O)CCN(c3ccc(-c4nn[n-]n4)nc3)C2)CCC(=O)N1 ZINC001580389011 1075714482 /nfs/dbraw/zinc/71/44/82/1075714482.db2.gz KZSQRXHPNKAQHB-IRXDYDNUSA-N -1 3 386.416 -1.012 20 0 GAADHM C[C@@]1(C(=O)NC[C@@]2(O)CCN(c3ccc(-c4nnn[n-]4)nc3)C2)CCC(=O)N1 ZINC001580389011 1075714476 /nfs/dbraw/zinc/71/44/76/1075714476.db2.gz KZSQRXHPNKAQHB-IRXDYDNUSA-N -1 3 386.416 -1.012 20 0 GAADHM C[C@@]1(C(=O)NC[C@]2(O)CCN(c3ccc(-c4nn[n-]n4)cn3)C2)CCC(=O)N1 ZINC001580389051 1075714395 /nfs/dbraw/zinc/71/43/95/1075714395.db2.gz MLVBWWHGRSMJOS-DLBZAZTESA-N -1 3 386.416 -1.012 20 0 GAADHM C[C@@]1(C(=O)NC[C@]2(O)CCN(c3ccc(-c4nnn[n-]4)cn3)C2)CCC(=O)N1 ZINC001580389051 1075714391 /nfs/dbraw/zinc/71/43/91/1075714391.db2.gz MLVBWWHGRSMJOS-DLBZAZTESA-N -1 3 386.416 -1.012 20 0 GAADHM C[C@@]1(C(=O)NC[C@@]2(O)CCN(c3ccc(-c4nn[n-]n4)cn3)C2)CCC(=O)N1 ZINC001580389052 1075714561 /nfs/dbraw/zinc/71/45/61/1075714561.db2.gz MLVBWWHGRSMJOS-IRXDYDNUSA-N -1 3 386.416 -1.012 20 0 GAADHM C[C@@]1(C(=O)NC[C@@]2(O)CCN(c3ccc(-c4nnn[n-]4)cn3)C2)CCC(=O)N1 ZINC001580389052 1075714553 /nfs/dbraw/zinc/71/45/53/1075714553.db2.gz MLVBWWHGRSMJOS-IRXDYDNUSA-N -1 3 386.416 -1.012 20 0 GAADHM C[C@@]1(C(=O)NC[C@H](O)CNc2ncc(-c3nn[n-]n3)cc2F)CCC(=O)N1 ZINC001580389295 1075714363 /nfs/dbraw/zinc/71/43/63/1075714363.db2.gz SKQKPDCEACRQBN-PSLIRLAXSA-N -1 3 378.368 -1.042 20 0 GAADHM C[C@@]1(C(=O)NC[C@H](O)CNc2ncc(-c3nnn[n-]3)cc2F)CCC(=O)N1 ZINC001580389295 1075714357 /nfs/dbraw/zinc/71/43/57/1075714357.db2.gz SKQKPDCEACRQBN-PSLIRLAXSA-N -1 3 378.368 -1.042 20 0 GAADHM C[C@@]1(C(=O)NC[C@@H](O)CNc2ncc(-c3nn[n-]n3)cc2F)CCC(=O)N1 ZINC001580389297 1075714578 /nfs/dbraw/zinc/71/45/78/1075714578.db2.gz SKQKPDCEACRQBN-VFZGTOFNSA-N -1 3 378.368 -1.042 20 0 GAADHM C[C@@]1(C(=O)NC[C@@H](O)CNc2ncc(-c3nnn[n-]3)cc2F)CCC(=O)N1 ZINC001580389297 1075714572 /nfs/dbraw/zinc/71/45/72/1075714572.db2.gz SKQKPDCEACRQBN-VFZGTOFNSA-N -1 3 378.368 -1.042 20 0 GAADHM C[C@@]1(C(=O)N(CCO)CCNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCC(=O)N1 ZINC001580389344 1075714541 /nfs/dbraw/zinc/71/45/41/1075714541.db2.gz BGNSCHSHPUSWOC-INIZCTEOSA-N -1 3 390.404 -1.586 20 0 GAADHM C[C@@]1(C(=O)N(CCO)CCNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCC(=O)N1 ZINC001580389344 1075714538 /nfs/dbraw/zinc/71/45/38/1075714538.db2.gz BGNSCHSHPUSWOC-INIZCTEOSA-N -1 3 390.404 -1.586 20 0 GAADHM C[C@@]1(C(=O)N(CCO)CCNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCC(=O)N1 ZINC001580389346 1075714607 /nfs/dbraw/zinc/71/46/07/1075714607.db2.gz BJSLDVVVBLCKTO-INIZCTEOSA-N -1 3 390.404 -1.586 20 0 GAADHM C[C@@]1(C(=O)N(CCO)CCNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCC(=O)N1 ZINC001580389346 1075714602 /nfs/dbraw/zinc/71/46/02/1075714602.db2.gz BJSLDVVVBLCKTO-INIZCTEOSA-N -1 3 390.404 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GAADHM Cc1c(CC(=O)NC[C@@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cnn1C ZINC001580565093 1075725318 /nfs/dbraw/zinc/72/53/18/1075725318.db2.gz YASOELDOTVSMKB-GFCCVEGCSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1c(CC(=O)NC[C@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)cnn1C ZINC001580565097 1075725203 /nfs/dbraw/zinc/72/52/03/1075725203.db2.gz YASOELDOTVSMKB-LBPRGKRZSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1c(CC(=O)NC[C@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cnn1C ZINC001580565097 1075725201 /nfs/dbraw/zinc/72/52/01/1075725201.db2.gz YASOELDOTVSMKB-LBPRGKRZSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1c(CC(=O)NC[C@@H](O)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)cnn1C ZINC001580565123 1075725832 /nfs/dbraw/zinc/72/58/32/1075725832.db2.gz YBXNAPZZTPFYGM-LLVKDONJSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1c(CC(=O)NC[C@@H](O)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cnn1C ZINC001580565123 1075725827 /nfs/dbraw/zinc/72/58/27/1075725827.db2.gz YBXNAPZZTPFYGM-LLVKDONJSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1c(CC(=O)NC[C@H](O)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)cnn1C ZINC001580565125 1075725805 /nfs/dbraw/zinc/72/58/05/1075725805.db2.gz YBXNAPZZTPFYGM-NSHDSACASA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1c(CC(=O)NC[C@H](O)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cnn1C ZINC001580565125 1075725801 /nfs/dbraw/zinc/72/58/01/1075725801.db2.gz YBXNAPZZTPFYGM-NSHDSACASA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1cc(-c2nn[n-]n2)cc(N(C(=O)[C@@H]2CS(=O)(=O)CC(=O)N2)C2CC2)n1 ZINC001580616171 1075725658 /nfs/dbraw/zinc/72/56/58/1075725658.db2.gz GXUPTQYUKVGQRN-NSHDSACASA-N -1 3 391.413 -1.021 20 0 GAADHM Cc1cc(-c2nn[n-]n2)cnc1C(=O)N1CCN(CCS(N)(=O)=O)CC1 ZINC001580624455 1075725586 /nfs/dbraw/zinc/72/55/86/1075725586.db2.gz LMPRBCHXPLQGLP-UHFFFAOYSA-N -1 3 380.434 -1.384 20 0 GAADHM Cc1cc(-c2nnn[n-]2)cnc1C(=O)N1CCN(CCS(N)(=O)=O)CC1 ZINC001580624455 1075725581 /nfs/dbraw/zinc/72/55/81/1075725581.db2.gz LMPRBCHXPLQGLP-UHFFFAOYSA-N -1 3 380.434 -1.384 20 0 GAADHM Cc1cc(-c2nn[n-]n2)ccc1S(=O)(=O)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001580624461 1075725597 /nfs/dbraw/zinc/72/55/97/1075725597.db2.gz UBEKCVBKIMIMGJ-LLVKDONJSA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1cc(-c2nnn[n-]2)ccc1S(=O)(=O)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001580624461 1075725592 /nfs/dbraw/zinc/72/55/92/1075725592.db2.gz UBEKCVBKIMIMGJ-LLVKDONJSA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1cc(-c2nn[n-]n2)ccc1S(=O)(=O)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001580624462 1075725818 /nfs/dbraw/zinc/72/58/18/1075725818.db2.gz UBEKCVBKIMIMGJ-NSHDSACASA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1cc(-c2nnn[n-]2)ccc1S(=O)(=O)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001580624462 1075725814 /nfs/dbraw/zinc/72/58/14/1075725814.db2.gz UBEKCVBKIMIMGJ-NSHDSACASA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1cc(-c2nn[n-]n2)ccc1S(=O)(=O)NCc1nnc2n1CCNC2=O ZINC001580624524 1075725737 /nfs/dbraw/zinc/72/57/37/1075725737.db2.gz OJDXDADWUTWOQV-UHFFFAOYSA-N -1 3 389.401 -1.011 20 0 GAADHM Cc1cc(-c2nnn[n-]2)ccc1S(=O)(=O)NCc1nnc2n1CCNC2=O ZINC001580624524 1075725734 /nfs/dbraw/zinc/72/57/34/1075725734.db2.gz OJDXDADWUTWOQV-UHFFFAOYSA-N -1 3 389.401 -1.011 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(N(C)C[C@@H](O)CN(C)C(=O)Cc2nnc[nH]2)n1 ZINC001580634681 1075726448 /nfs/dbraw/zinc/72/64/48/1075726448.db2.gz JNJPCZZWMMUFBF-JTQLQIEISA-N -1 3 387.408 -1.419 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N(C)C[C@@H](O)CN(C)C(=O)Cc2nnc[nH]2)n1 ZINC001580634681 1075726444 /nfs/dbraw/zinc/72/64/44/1075726444.db2.gz JNJPCZZWMMUFBF-JTQLQIEISA-N -1 3 387.408 -1.419 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(N(C)C[C@H](O)CN(C)C(=O)Cc2nnc[nH]2)n1 ZINC001580634682 1075726650 /nfs/dbraw/zinc/72/66/50/1075726650.db2.gz JNJPCZZWMMUFBF-SNVBAGLBSA-N -1 3 387.408 -1.419 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N(C)C[C@H](O)CN(C)C(=O)Cc2nnc[nH]2)n1 ZINC001580634682 1075726648 /nfs/dbraw/zinc/72/66/48/1075726648.db2.gz JNJPCZZWMMUFBF-SNVBAGLBSA-N -1 3 387.408 -1.419 20 0 GAADHM Cc1n[nH]nc1C(=O)N(C)C[C@H](O)CN(C)c1nc(C)cc(-c2nnn[n-]2)n1 ZINC001580634859 1075726493 /nfs/dbraw/zinc/72/64/93/1075726493.db2.gz MAHGCLMOBCVQIL-JTQLQIEISA-N -1 3 387.408 -1.039 20 0 GAADHM Cc1n[nH]nc1C(=O)N(C)C[C@@H](O)CN(C)c1nc(C)cc(-c2nnn[n-]2)n1 ZINC001580634860 1075726894 /nfs/dbraw/zinc/72/68/94/1075726894.db2.gz MAHGCLMOBCVQIL-SNVBAGLBSA-N -1 3 387.408 -1.039 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2CC[C@H](NC(=O)Cn3ccnc3)[C@@H](O)C2)n1 ZINC001580659433 1075728980 /nfs/dbraw/zinc/72/89/80/1075728980.db2.gz FFQDQIIRWODOSC-AAEUAGOBSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2CC[C@@H](NC(=O)Cn3ccnc3)[C@H](O)C2)n1 ZINC001580659434 1075729098 /nfs/dbraw/zinc/72/90/98/1075729098.db2.gz FFQDQIIRWODOSC-DGCLKSJQSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2CC[C@H](NC(=O)Cn3ccnc3)[C@H](O)C2)n1 ZINC001580659435 1075729072 /nfs/dbraw/zinc/72/90/72/1075729072.db2.gz FFQDQIIRWODOSC-WCQYABFASA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2CC[C@@H](NC(=O)Cn3ccnc3)[C@@H](O)C2)n1 ZINC001580659436 1075728999 /nfs/dbraw/zinc/72/89/99/1075728999.db2.gz FFQDQIIRWODOSC-YPMHNXCESA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(N2CC[C@H](NC(=O)Cc3c[nH]cn3)[C@@H](O)C2)n1 ZINC001580660209 1075729116 /nfs/dbraw/zinc/72/91/16/1075729116.db2.gz VSTGMAMIYUDUPK-AAEUAGOBSA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2CC[C@H](NC(=O)Cc3c[nH]cn3)[C@@H](O)C2)n1 ZINC001580660209 1075729114 /nfs/dbraw/zinc/72/91/14/1075729114.db2.gz VSTGMAMIYUDUPK-AAEUAGOBSA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(N2CC[C@@H](NC(=O)Cc3c[nH]cn3)[C@H](O)C2)n1 ZINC001580660210 1075728904 /nfs/dbraw/zinc/72/89/04/1075728904.db2.gz VSTGMAMIYUDUPK-DGCLKSJQSA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2CC[C@@H](NC(=O)Cc3c[nH]cn3)[C@H](O)C2)n1 ZINC001580660210 1075728899 /nfs/dbraw/zinc/72/88/99/1075728899.db2.gz VSTGMAMIYUDUPK-DGCLKSJQSA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(N2CC[C@H](NC(=O)Cc3c[nH]cn3)[C@H](O)C2)n1 ZINC001580660211 1075729028 /nfs/dbraw/zinc/72/90/28/1075729028.db2.gz VSTGMAMIYUDUPK-WCQYABFASA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2CC[C@H](NC(=O)Cc3c[nH]cn3)[C@H](O)C2)n1 ZINC001580660211 1075729023 /nfs/dbraw/zinc/72/90/23/1075729023.db2.gz VSTGMAMIYUDUPK-WCQYABFASA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(N2CC[C@@H](NC(=O)Cc3c[nH]cn3)[C@@H](O)C2)n1 ZINC001580660212 1075728871 /nfs/dbraw/zinc/72/88/71/1075728871.db2.gz VSTGMAMIYUDUPK-YPMHNXCESA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2CC[C@@H](NC(=O)Cc3c[nH]cn3)[C@@H](O)C2)n1 ZINC001580660212 1075728868 /nfs/dbraw/zinc/72/88/68/1075728868.db2.gz VSTGMAMIYUDUPK-YPMHNXCESA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2CC[C@](O)(CNC(=O)Cn3ccnc3)C2)n1 ZINC001580662167 1075729910 /nfs/dbraw/zinc/72/99/10/1075729910.db2.gz KQIOYMRKSIJWRL-INIZCTEOSA-N -1 3 384.404 -1.081 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2CC[C@@](O)(CNC(=O)Cn3ccnc3)C2)n1 ZINC001580662168 1075729734 /nfs/dbraw/zinc/72/97/34/1075729734.db2.gz KQIOYMRKSIJWRL-MRXNPFEDSA-N -1 3 384.404 -1.081 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2C[C@@H](O)[C@H](NC(=O)Cc3cncn3C)C2)n1 ZINC001580677550 1075731536 /nfs/dbraw/zinc/73/15/36/1075731536.db2.gz FWUZNZCSIXRFQV-CHWSQXEVSA-N -1 3 384.404 -1.393 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2C[C@@H](O)[C@H](NC(=O)CCc3c[nH]cn3)C2)n1 ZINC001580677597 1075731690 /nfs/dbraw/zinc/73/16/90/1075731690.db2.gz ILQKIOYFDANKNQ-CHWSQXEVSA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1nccn1CC(=O)N[C@@H]1CN(c2nc(C)cc(-c3nn[n-]n3)n2)C[C@H]1O ZINC001580677673 1075732012 /nfs/dbraw/zinc/73/20/12/1075732012.db2.gz LTMFKIKVDIWILK-CHWSQXEVSA-N -1 3 384.404 -1.164 20 0 GAADHM Cc1nccn1CC(=O)N[C@@H]1CN(c2nc(C)cc(-c3nnn[n-]3)n2)C[C@H]1O ZINC001580677673 1075732007 /nfs/dbraw/zinc/73/20/07/1075732007.db2.gz LTMFKIKVDIWILK-CHWSQXEVSA-N -1 3 384.404 -1.164 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CN(C)CCO3)C2)n1 ZINC001580677864 1075732314 /nfs/dbraw/zinc/73/23/14/1075732314.db2.gz UTVOYCULYSXPTJ-JHJVBQTASA-N -1 3 389.420 -2.039 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CN(C)CCO3)C2)n1 ZINC001580677864 1075732311 /nfs/dbraw/zinc/73/23/11/1075732311.db2.gz UTVOYCULYSXPTJ-JHJVBQTASA-N -1 3 389.420 -2.039 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CN(C)CCO3)C2)n1 ZINC001580677865 1075732409 /nfs/dbraw/zinc/73/24/09/1075732409.db2.gz UTVOYCULYSXPTJ-UPJWGTAASA-N -1 3 389.420 -2.039 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CN(C)CCO3)C2)n1 ZINC001580677865 1075732404 /nfs/dbraw/zinc/73/24/04/1075732404.db2.gz UTVOYCULYSXPTJ-UPJWGTAASA-N -1 3 389.420 -2.039 20 0 GAADHM Cc1cncn1CC(=O)N[C@@H]1CN(c2nc(C)cc(-c3nn[n-]n3)n2)C[C@H]1O ZINC001580677987 1075732227 /nfs/dbraw/zinc/73/22/27/1075732227.db2.gz XUYQMWROMDFFNO-CHWSQXEVSA-N -1 3 384.404 -1.164 20 0 GAADHM Cc1cncn1CC(=O)N[C@@H]1CN(c2nc(C)cc(-c3nnn[n-]3)n2)C[C@H]1O ZINC001580677987 1075732223 /nfs/dbraw/zinc/73/22/23/1075732223.db2.gz XUYQMWROMDFFNO-CHWSQXEVSA-N -1 3 384.404 -1.164 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2C[C@@H](NC(=O)Cc3cncn3C)[C@@H](O)C2)n1 ZINC001580681389 1075733080 /nfs/dbraw/zinc/73/30/80/1075733080.db2.gz FWUZNZCSIXRFQV-OLZOCXBDSA-N -1 3 384.404 -1.393 20 0 GAADHM Cc1nc[nH]c1CC(=O)N[C@@H]1CN(c2nc(C)cc(-c3nn[n-]n3)n2)C[C@@H]1O ZINC001580681429 1075733044 /nfs/dbraw/zinc/73/30/44/1075733044.db2.gz IKCOJYNYKPLTPR-OLZOCXBDSA-N -1 3 384.404 -1.095 20 0 GAADHM Cc1nc[nH]c1CC(=O)N[C@@H]1CN(c2nc(C)cc(-c3nnn[n-]3)n2)C[C@@H]1O ZINC001580681429 1075733041 /nfs/dbraw/zinc/73/30/41/1075733041.db2.gz IKCOJYNYKPLTPR-OLZOCXBDSA-N -1 3 384.404 -1.095 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2C[C@@H](NC(=O)CCc3c[nH]cn3)[C@@H](O)C2)n1 ZINC001580681430 1075733146 /nfs/dbraw/zinc/73/31/46/1075733146.db2.gz ILQKIOYFDANKNQ-OLZOCXBDSA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1nccn1CC(=O)N[C@@H]1CN(c2nc(C)cc(-c3nn[n-]n3)n2)C[C@@H]1O ZINC001580681512 1075733443 /nfs/dbraw/zinc/73/34/43/1075733443.db2.gz LTMFKIKVDIWILK-OLZOCXBDSA-N -1 3 384.404 -1.164 20 0 GAADHM Cc1nccn1CC(=O)N[C@@H]1CN(c2nc(C)cc(-c3nnn[n-]3)n2)C[C@@H]1O ZINC001580681512 1075733435 /nfs/dbraw/zinc/73/34/35/1075733435.db2.gz LTMFKIKVDIWILK-OLZOCXBDSA-N -1 3 384.404 -1.164 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(N2C[C@@H](NC(=O)CCn3ccnc3)[C@@H](O)C2)n1 ZINC001580681594 1075733528 /nfs/dbraw/zinc/73/35/28/1075733528.db2.gz PCLGXPOOTFEKTF-OLZOCXBDSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2C[C@@H](NC(=O)CCn3ccnc3)[C@@H](O)C2)n1 ZINC001580681594 1075733524 /nfs/dbraw/zinc/73/35/24/1075733524.db2.gz PCLGXPOOTFEKTF-OLZOCXBDSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(N2C[C@@H](NC(=O)[C@@H]3CN(C)CCO3)[C@@H](O)C2)n1 ZINC001580681772 1075733935 /nfs/dbraw/zinc/73/39/35/1075733935.db2.gz UTVOYCULYSXPTJ-AGIUHOORSA-N -1 3 389.420 -2.039 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2C[C@@H](NC(=O)[C@@H]3CN(C)CCO3)[C@@H](O)C2)n1 ZINC001580681772 1075733934 /nfs/dbraw/zinc/73/39/34/1075733934.db2.gz UTVOYCULYSXPTJ-AGIUHOORSA-N -1 3 389.420 -2.039 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(N2C[C@@H](NC(=O)[C@H]3CN(C)CCO3)[C@@H](O)C2)n1 ZINC001580681773 1075733897 /nfs/dbraw/zinc/73/38/97/1075733897.db2.gz UTVOYCULYSXPTJ-FRRDWIJNSA-N -1 3 389.420 -2.039 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2C[C@@H](NC(=O)[C@H]3CN(C)CCO3)[C@@H](O)C2)n1 ZINC001580681773 1075733894 /nfs/dbraw/zinc/73/38/94/1075733894.db2.gz UTVOYCULYSXPTJ-FRRDWIJNSA-N -1 3 389.420 -2.039 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(N2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2CN(C)CCO2)n1 ZINC001580682735 1075733981 /nfs/dbraw/zinc/73/39/81/1075733981.db2.gz ADIPFOXAHSRCPZ-UZGDPCLZSA-N -1 3 385.432 -1.153 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2CN(C)CCO2)n1 ZINC001580682735 1075733975 /nfs/dbraw/zinc/73/39/75/1075733975.db2.gz ADIPFOXAHSRCPZ-UZGDPCLZSA-N -1 3 385.432 -1.153 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(N2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@H]2CN(C)CCO2)n1 ZINC001580682736 1075733874 /nfs/dbraw/zinc/73/38/74/1075733874.db2.gz ADIPFOXAHSRCPZ-WVWOOGAGSA-N -1 3 385.432 -1.153 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@H]2CN(C)CCO2)n1 ZINC001580682736 1075733871 /nfs/dbraw/zinc/73/38/71/1075733871.db2.gz ADIPFOXAHSRCPZ-WVWOOGAGSA-N -1 3 385.432 -1.153 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(N[C@@H](CO)CNC(=O)CCN2CCOCC2)n1 ZINC001580700059 1075735471 /nfs/dbraw/zinc/73/54/71/1075735471.db2.gz OIFMQBBLOBDTBN-GFCCVEGCSA-N -1 3 391.436 -1.424 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N[C@@H](CO)CNC(=O)CCN2CCOCC2)n1 ZINC001580700059 1075735467 /nfs/dbraw/zinc/73/54/67/1075735467.db2.gz OIFMQBBLOBDTBN-GFCCVEGCSA-N -1 3 391.436 -1.424 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(N[C@H](CO)CNC(=O)CCN2CCOCC2)n1 ZINC001580700060 1075735393 /nfs/dbraw/zinc/73/53/93/1075735393.db2.gz OIFMQBBLOBDTBN-LBPRGKRZSA-N -1 3 391.436 -1.424 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N[C@H](CO)CNC(=O)CCN2CCOCC2)n1 ZINC001580700060 1075735390 /nfs/dbraw/zinc/73/53/90/1075735390.db2.gz OIFMQBBLOBDTBN-LBPRGKRZSA-N -1 3 391.436 -1.424 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(N[C@H](CO)CNC(=O)[C@H]2CN(C)CCO2)n1 ZINC001580700333 1075735675 /nfs/dbraw/zinc/73/56/75/1075735675.db2.gz URQZAVBVKIQAES-CMPLNLGQSA-N -1 3 377.409 -1.815 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N[C@H](CO)CNC(=O)[C@H]2CN(C)CCO2)n1 ZINC001580700333 1075735673 /nfs/dbraw/zinc/73/56/73/1075735673.db2.gz URQZAVBVKIQAES-CMPLNLGQSA-N -1 3 377.409 -1.815 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(N[C@H](CO)CNC(=O)[C@@H]2CN(C)CCO2)n1 ZINC001580700334 1075735690 /nfs/dbraw/zinc/73/56/90/1075735690.db2.gz URQZAVBVKIQAES-JQWIXIFHSA-N -1 3 377.409 -1.815 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N[C@H](CO)CNC(=O)[C@@H]2CN(C)CCO2)n1 ZINC001580700334 1075735687 /nfs/dbraw/zinc/73/56/87/1075735687.db2.gz URQZAVBVKIQAES-JQWIXIFHSA-N -1 3 377.409 -1.815 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(N[C@@H](CO)CNC(=O)[C@@H]2CN(C)CCO2)n1 ZINC001580700335 1075735709 /nfs/dbraw/zinc/73/57/09/1075735709.db2.gz URQZAVBVKIQAES-PWSUYJOCSA-N -1 3 377.409 -1.815 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N[C@@H](CO)CNC(=O)[C@@H]2CN(C)CCO2)n1 ZINC001580700335 1075735705 /nfs/dbraw/zinc/73/57/05/1075735705.db2.gz URQZAVBVKIQAES-PWSUYJOCSA-N -1 3 377.409 -1.815 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(N[C@@H](CO)CNC(=O)[C@H]2CN(C)CCO2)n1 ZINC001580700336 1075735805 /nfs/dbraw/zinc/73/58/05/1075735805.db2.gz URQZAVBVKIQAES-ZYHUDNBSSA-N -1 3 377.409 -1.815 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N[C@@H](CO)CNC(=O)[C@H]2CN(C)CCO2)n1 ZINC001580700336 1075735800 /nfs/dbraw/zinc/73/58/00/1075735800.db2.gz URQZAVBVKIQAES-ZYHUDNBSSA-N -1 3 377.409 -1.815 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(NC2CCN(CCNC(=O)CC(N)=O)CC2)n1 ZINC001580717524 1075735928 /nfs/dbraw/zinc/73/59/28/1075735928.db2.gz LMUKGGOHQSKITK-UHFFFAOYSA-N -1 3 388.436 -1.167 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(NC[C@@H](O)CNC(=O)[C@H]2CN(C)CCO2)n1 ZINC001580725363 1075736295 /nfs/dbraw/zinc/73/62/95/1075736295.db2.gz BFGSTMDBQSMDBN-CMPLNLGQSA-N -1 3 377.409 -1.815 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(NC[C@@H](O)CNC(=O)[C@H]2CN(C)CCO2)n1 ZINC001580725363 1075736293 /nfs/dbraw/zinc/73/62/93/1075736293.db2.gz BFGSTMDBQSMDBN-CMPLNLGQSA-N -1 3 377.409 -1.815 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(NC[C@@H](O)CNC(=O)[C@@H]2CN(C)CCO2)n1 ZINC001580725364 1075736224 /nfs/dbraw/zinc/73/62/24/1075736224.db2.gz BFGSTMDBQSMDBN-JQWIXIFHSA-N -1 3 377.409 -1.815 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(NC[C@@H](O)CNC(=O)[C@@H]2CN(C)CCO2)n1 ZINC001580725364 1075736221 /nfs/dbraw/zinc/73/62/21/1075736221.db2.gz BFGSTMDBQSMDBN-JQWIXIFHSA-N -1 3 377.409 -1.815 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(NC[C@H](O)CNC(=O)[C@@H]2CN(C)CCO2)n1 ZINC001580725365 1075736072 /nfs/dbraw/zinc/73/60/72/1075736072.db2.gz BFGSTMDBQSMDBN-PWSUYJOCSA-N -1 3 377.409 -1.815 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(NC[C@H](O)CNC(=O)[C@@H]2CN(C)CCO2)n1 ZINC001580725365 1075736068 /nfs/dbraw/zinc/73/60/68/1075736068.db2.gz BFGSTMDBQSMDBN-PWSUYJOCSA-N -1 3 377.409 -1.815 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(NC[C@H](O)CNC(=O)[C@H]2CN(C)CCO2)n1 ZINC001580725366 1075736284 /nfs/dbraw/zinc/73/62/84/1075736284.db2.gz BFGSTMDBQSMDBN-ZYHUDNBSSA-N -1 3 377.409 -1.815 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(NC[C@H](O)CNC(=O)[C@H]2CN(C)CCO2)n1 ZINC001580725366 1075736281 /nfs/dbraw/zinc/73/62/81/1075736281.db2.gz BFGSTMDBQSMDBN-ZYHUDNBSSA-N -1 3 377.409 -1.815 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(NC[C@H](O)CN(C)C(=O)[C@@H]2CN(C)CCO2)n1 ZINC001580726695 1075736947 /nfs/dbraw/zinc/73/69/47/1075736947.db2.gz WBVUNBYWZYFHFZ-AAEUAGOBSA-N -1 3 391.436 -1.473 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(NC[C@H](O)CN(C)C(=O)[C@@H]2CN(C)CCO2)n1 ZINC001580726695 1075736946 /nfs/dbraw/zinc/73/69/46/1075736946.db2.gz WBVUNBYWZYFHFZ-AAEUAGOBSA-N -1 3 391.436 -1.473 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(NC[C@@H](O)CN(C)C(=O)[C@H]2CN(C)CCO2)n1 ZINC001580726696 1075736964 /nfs/dbraw/zinc/73/69/64/1075736964.db2.gz WBVUNBYWZYFHFZ-DGCLKSJQSA-N -1 3 391.436 -1.473 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(NC[C@@H](O)CN(C)C(=O)[C@H]2CN(C)CCO2)n1 ZINC001580726696 1075736961 /nfs/dbraw/zinc/73/69/61/1075736961.db2.gz WBVUNBYWZYFHFZ-DGCLKSJQSA-N -1 3 391.436 -1.473 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(NC[C@H](O)CN(C)C(=O)[C@H]2CN(C)CCO2)n1 ZINC001580726697 1075737027 /nfs/dbraw/zinc/73/70/27/1075737027.db2.gz WBVUNBYWZYFHFZ-WCQYABFASA-N -1 3 391.436 -1.473 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(NC[C@H](O)CN(C)C(=O)[C@H]2CN(C)CCO2)n1 ZINC001580726697 1075737024 /nfs/dbraw/zinc/73/70/24/1075737024.db2.gz WBVUNBYWZYFHFZ-WCQYABFASA-N -1 3 391.436 -1.473 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(NC[C@@H](O)CN(C)C(=O)[C@@H]2CN(C)CCO2)n1 ZINC001580726698 1075736984 /nfs/dbraw/zinc/73/69/84/1075736984.db2.gz WBVUNBYWZYFHFZ-YPMHNXCESA-N -1 3 391.436 -1.473 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(NC[C@@H](O)CN(C)C(=O)[C@@H]2CN(C)CCO2)n1 ZINC001580726698 1075736982 /nfs/dbraw/zinc/73/69/82/1075736982.db2.gz WBVUNBYWZYFHFZ-YPMHNXCESA-N -1 3 391.436 -1.473 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n(C)n1 ZINC001580786001 1075739976 /nfs/dbraw/zinc/73/99/76/1075739976.db2.gz DGLAQXINDPAUIP-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n(C)n1 ZINC001580786001 1075739975 /nfs/dbraw/zinc/73/99/75/1075739975.db2.gz DGLAQXINDPAUIP-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)ncn1 ZINC001580786315 1075739924 /nfs/dbraw/zinc/73/99/24/1075739924.db2.gz GIMKVQLJIPQEEL-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)ncn1 ZINC001580786315 1075739920 /nfs/dbraw/zinc/73/99/20/1075739920.db2.gz GIMKVQLJIPQEEL-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)nn1C ZINC001580786555 1075740052 /nfs/dbraw/zinc/74/00/52/1075740052.db2.gz JGFRDVWIAJWXEV-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)nn1C ZINC001580786555 1075740050 /nfs/dbraw/zinc/74/00/50/1075740050.db2.gz JGFRDVWIAJWXEV-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)nn1C ZINC001580786825 1075739910 /nfs/dbraw/zinc/73/99/10/1075739910.db2.gz MXMQZLFBBJJZOU-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)nn1C ZINC001580786825 1075739906 /nfs/dbraw/zinc/73/99/06/1075739906.db2.gz MXMQZLFBBJJZOU-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)ncn1 ZINC001580786954 1075740009 /nfs/dbraw/zinc/74/00/09/1075740009.db2.gz NVRXBUHPBKKUDM-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)ncn1 ZINC001580786954 1075740005 /nfs/dbraw/zinc/74/00/05/1075740005.db2.gz NVRXBUHPBKKUDM-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n(C)n1 ZINC001580787029 1075739988 /nfs/dbraw/zinc/73/99/88/1075739988.db2.gz PTMGJAMNCHWFNQ-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n(C)n1 ZINC001580787029 1075739984 /nfs/dbraw/zinc/73/99/84/1075739984.db2.gz PTMGJAMNCHWFNQ-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)cnn1 ZINC001580787171 1075739968 /nfs/dbraw/zinc/73/99/68/1075739968.db2.gz SKOOBGLRBBBAPK-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)cnn1 ZINC001580787171 1075739965 /nfs/dbraw/zinc/73/99/65/1075739965.db2.gz SKOOBGLRBBBAPK-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)nn1C ZINC001580787315 1075739895 /nfs/dbraw/zinc/73/98/95/1075739895.db2.gz VUXRZIAMILOGIH-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)nn1C ZINC001580787315 1075739892 /nfs/dbraw/zinc/73/98/92/1075739892.db2.gz VUXRZIAMILOGIH-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n(C)n1 ZINC001580787439 1075740031 /nfs/dbraw/zinc/74/00/31/1075740031.db2.gz WIFQDRKRULHXIT-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n(C)n1 ZINC001580787439 1075740027 /nfs/dbraw/zinc/74/00/27/1075740027.db2.gz WIFQDRKRULHXIT-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)cnn1 ZINC001580787522 1075739998 /nfs/dbraw/zinc/73/99/98/1075739998.db2.gz YLXUMAPCMILGBZ-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1cc(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)cnn1 ZINC001580787522 1075739995 /nfs/dbraw/zinc/73/99/95/1075739995.db2.gz YLXUMAPCMILGBZ-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)cnn1 ZINC001580812580 1075740194 /nfs/dbraw/zinc/74/01/94/1075740194.db2.gz CPXUNYNSVALCLN-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)cnn1 ZINC001580812580 1075740190 /nfs/dbraw/zinc/74/01/90/1075740190.db2.gz CPXUNYNSVALCLN-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)n(C)n1 ZINC001580812601 1075740467 /nfs/dbraw/zinc/74/04/67/1075740467.db2.gz DVXSLPXDELVAAQ-YPMHNXCESA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)n(C)n1 ZINC001580812601 1075740464 /nfs/dbraw/zinc/74/04/64/1075740464.db2.gz DVXSLPXDELVAAQ-YPMHNXCESA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)ncn1 ZINC001580812621 1075740205 /nfs/dbraw/zinc/74/02/05/1075740205.db2.gz FVUYVOOJIRTPSZ-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)ncn1 ZINC001580812621 1075740202 /nfs/dbraw/zinc/74/02/02/1075740202.db2.gz FVUYVOOJIRTPSZ-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)nn1C ZINC001580812622 1075740385 /nfs/dbraw/zinc/74/03/85/1075740385.db2.gz FXEFFRZYAWPKEK-OLZOCXBDSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)nn1C ZINC001580812622 1075740378 /nfs/dbraw/zinc/74/03/78/1075740378.db2.gz FXEFFRZYAWPKEK-OLZOCXBDSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)nn1C ZINC001580812629 1075740238 /nfs/dbraw/zinc/74/02/38/1075740238.db2.gz GJZSWWKKPIIUDJ-OLZOCXBDSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)nn1C ZINC001580812629 1075740234 /nfs/dbraw/zinc/74/02/34/1075740234.db2.gz GJZSWWKKPIIUDJ-OLZOCXBDSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)ncn1 ZINC001580812650 1075740339 /nfs/dbraw/zinc/74/03/39/1075740339.db2.gz HNTJENYPBWKITO-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)ncn1 ZINC001580812650 1075740335 /nfs/dbraw/zinc/74/03/35/1075740335.db2.gz HNTJENYPBWKITO-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)cnn1 ZINC001580813031 1075740368 /nfs/dbraw/zinc/74/03/68/1075740368.db2.gz SIWXFEMGQBKUHD-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)cnn1 ZINC001580813031 1075740362 /nfs/dbraw/zinc/74/03/62/1075740362.db2.gz SIWXFEMGQBKUHD-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)n(C)n1 ZINC001580813077 1075740307 /nfs/dbraw/zinc/74/03/07/1075740307.db2.gz UIANXXNTJMJTND-YPMHNXCESA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)n(C)n1 ZINC001580813077 1075740302 /nfs/dbraw/zinc/74/03/02/1075740302.db2.gz UIANXXNTJMJTND-YPMHNXCESA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)cnn1 ZINC001580813168 1075740274 /nfs/dbraw/zinc/74/02/74/1075740274.db2.gz XXVLYXRQYFAFQP-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)cnn1 ZINC001580813168 1075740271 /nfs/dbraw/zinc/74/02/71/1075740271.db2.gz XXVLYXRQYFAFQP-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)nn1C ZINC001580813216 1075740250 /nfs/dbraw/zinc/74/02/50/1075740250.db2.gz YZTRVPIADPTEPJ-OLZOCXBDSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)nn1C ZINC001580813216 1075740246 /nfs/dbraw/zinc/74/02/46/1075740246.db2.gz YZTRVPIADPTEPJ-OLZOCXBDSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)cnn1 ZINC001580813899 1075740415 /nfs/dbraw/zinc/74/04/15/1075740415.db2.gz CPXUNYNSVALCLN-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)cnn1 ZINC001580813899 1075740412 /nfs/dbraw/zinc/74/04/12/1075740412.db2.gz CPXUNYNSVALCLN-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)ncn1 ZINC001580813941 1075740457 /nfs/dbraw/zinc/74/04/57/1075740457.db2.gz FVUYVOOJIRTPSZ-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)ncn1 ZINC001580813941 1075740453 /nfs/dbraw/zinc/74/04/53/1075740453.db2.gz FVUYVOOJIRTPSZ-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)nn1C ZINC001580813943 1075740445 /nfs/dbraw/zinc/74/04/45/1075740445.db2.gz FXEFFRZYAWPKEK-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)nn1C ZINC001580813943 1075740442 /nfs/dbraw/zinc/74/04/42/1075740442.db2.gz FXEFFRZYAWPKEK-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)nn1C ZINC001580813947 1075740349 /nfs/dbraw/zinc/74/03/49/1075740349.db2.gz GJZSWWKKPIIUDJ-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)nn1C ZINC001580813947 1075740344 /nfs/dbraw/zinc/74/03/44/1075740344.db2.gz GJZSWWKKPIIUDJ-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)ncn1 ZINC001580813959 1075740264 /nfs/dbraw/zinc/74/02/64/1075740264.db2.gz HNTJENYPBWKITO-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)ncn1 ZINC001580813959 1075740260 /nfs/dbraw/zinc/74/02/60/1075740260.db2.gz HNTJENYPBWKITO-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n(C)n1 ZINC001580814323 1075740432 /nfs/dbraw/zinc/74/04/32/1075740432.db2.gz RPXZQEHADHUYAE-DGCLKSJQSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n(C)n1 ZINC001580814323 1075740427 /nfs/dbraw/zinc/74/04/27/1075740427.db2.gz RPXZQEHADHUYAE-DGCLKSJQSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)cnn1 ZINC001580814668 1075740289 /nfs/dbraw/zinc/74/02/89/1075740289.db2.gz SIWXFEMGQBKUHD-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)cnn1 ZINC001580814668 1075740283 /nfs/dbraw/zinc/74/02/83/1075740283.db2.gz SIWXFEMGQBKUHD-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n(C)n1 ZINC001580814715 1075740403 /nfs/dbraw/zinc/74/04/03/1075740403.db2.gz UIANXXNTJMJTND-DGCLKSJQSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n(C)n1 ZINC001580814715 1075740398 /nfs/dbraw/zinc/74/03/98/1075740398.db2.gz UIANXXNTJMJTND-DGCLKSJQSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)ncn1 ZINC001580814750 1075740224 /nfs/dbraw/zinc/74/02/24/1075740224.db2.gz XBBXOMBXFKQZTA-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)ncn1 ZINC001580814750 1075740220 /nfs/dbraw/zinc/74/02/20/1075740220.db2.gz XBBXOMBXFKQZTA-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)nn1C ZINC001580814798 1075740326 /nfs/dbraw/zinc/74/03/26/1075740326.db2.gz YZTRVPIADPTEPJ-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)nn1C ZINC001580814798 1075740319 /nfs/dbraw/zinc/74/03/19/1075740319.db2.gz YZTRVPIADPTEPJ-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)NCC2(O)CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)ncn1 ZINC001580855512 1075740786 /nfs/dbraw/zinc/74/07/86/1075740786.db2.gz KKMNXZVKIDYXMC-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1cc(C(=O)NCC2(O)CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)ncn1 ZINC001580855512 1075740782 /nfs/dbraw/zinc/74/07/82/1075740782.db2.gz KKMNXZVKIDYXMC-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1cc(C(=O)NCC2(O)CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n(C)n1 ZINC001580855550 1075740602 /nfs/dbraw/zinc/74/06/02/1075740602.db2.gz MEZSODFFNCXZSV-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1cc(C(=O)NCC2(O)CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n(C)n1 ZINC001580855550 1075740599 /nfs/dbraw/zinc/74/05/99/1075740599.db2.gz MEZSODFFNCXZSV-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1cc(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n(C)n1 ZINC001580855844 1075740643 /nfs/dbraw/zinc/74/06/43/1075740643.db2.gz PZIWZJVDGDCRLW-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1cc(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n(C)n1 ZINC001580855844 1075740638 /nfs/dbraw/zinc/74/06/38/1075740638.db2.gz PZIWZJVDGDCRLW-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1cc(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)cnn1 ZINC001580856082 1075740724 /nfs/dbraw/zinc/74/07/24/1075740724.db2.gz SOFAKEOSGOSOFJ-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1cc(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)cnn1 ZINC001580856082 1075740721 /nfs/dbraw/zinc/74/07/21/1075740721.db2.gz SOFAKEOSGOSOFJ-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1cc(C(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)ncn1 ZINC001580856275 1075740687 /nfs/dbraw/zinc/74/06/87/1075740687.db2.gz WIOIECCXYJQSEE-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1cc(C(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)ncn1 ZINC001580856275 1075740683 /nfs/dbraw/zinc/74/06/83/1075740683.db2.gz WIOIECCXYJQSEE-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)cnn1 ZINC001580874138 1075740711 /nfs/dbraw/zinc/74/07/11/1075740711.db2.gz GSLFLOPIVVRSNQ-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)cnn1 ZINC001580874138 1075740707 /nfs/dbraw/zinc/74/07/07/1075740707.db2.gz GSLFLOPIVVRSNQ-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)n(C)n1 ZINC001580874229 1075740659 /nfs/dbraw/zinc/74/06/59/1075740659.db2.gz YIHCCTZYXRCDFG-YPMHNXCESA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)n(C)n1 ZINC001580874229 1075740655 /nfs/dbraw/zinc/74/06/55/1075740655.db2.gz YIHCCTZYXRCDFG-YPMHNXCESA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)cnn1 ZINC001580874324 1075740765 /nfs/dbraw/zinc/74/07/65/1075740765.db2.gz GALBZOLLZOHDJN-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)cnn1 ZINC001580874324 1075740760 /nfs/dbraw/zinc/74/07/60/1075740760.db2.gz GALBZOLLZOHDJN-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)cnn1 ZINC001580874325 1075740583 /nfs/dbraw/zinc/74/05/83/1075740583.db2.gz GALBZOLLZOHDJN-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)cnn1 ZINC001580874325 1075740579 /nfs/dbraw/zinc/74/05/79/1075740579.db2.gz GALBZOLLZOHDJN-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)cnn1 ZINC001580874339 1075740631 /nfs/dbraw/zinc/74/06/31/1075740631.db2.gz GSLFLOPIVVRSNQ-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)cnn1 ZINC001580874339 1075740626 /nfs/dbraw/zinc/74/06/26/1075740626.db2.gz GSLFLOPIVVRSNQ-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)ncn1 ZINC001580874489 1075741021 /nfs/dbraw/zinc/74/10/21/1075741021.db2.gz PCANPOFHTMWSKJ-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)ncn1 ZINC001580874489 1075741020 /nfs/dbraw/zinc/74/10/20/1075741020.db2.gz PCANPOFHTMWSKJ-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)ncn1 ZINC001580874490 1075741049 /nfs/dbraw/zinc/74/10/49/1075741049.db2.gz PCANPOFHTMWSKJ-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)ncn1 ZINC001580874490 1075741045 /nfs/dbraw/zinc/74/10/45/1075741045.db2.gz PCANPOFHTMWSKJ-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)ncn1 ZINC001580874688 1075741009 /nfs/dbraw/zinc/74/10/09/1075741009.db2.gz VPVJXNUODBCCSY-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)ncn1 ZINC001580874688 1075741007 /nfs/dbraw/zinc/74/10/07/1075741007.db2.gz VPVJXNUODBCCSY-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)ncn1 ZINC001580874689 1075740982 /nfs/dbraw/zinc/74/09/82/1075740982.db2.gz VPVJXNUODBCCSY-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)ncn1 ZINC001580874689 1075740979 /nfs/dbraw/zinc/74/09/79/1075740979.db2.gz VPVJXNUODBCCSY-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)cnn1 ZINC001580874717 1075741074 /nfs/dbraw/zinc/74/10/74/1075741074.db2.gz WYQWETJELFJNED-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)cnn1 ZINC001580874717 1075741071 /nfs/dbraw/zinc/74/10/71/1075741071.db2.gz WYQWETJELFJNED-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)n(C)n1 ZINC001580874720 1075741103 /nfs/dbraw/zinc/74/11/03/1075741103.db2.gz XHMMWKBKVLXBGZ-DGCLKSJQSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)n(C)n1 ZINC001580874720 1075741101 /nfs/dbraw/zinc/74/11/01/1075741101.db2.gz XHMMWKBKVLXBGZ-DGCLKSJQSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)n(C)n1 ZINC001580874721 1075741028 /nfs/dbraw/zinc/74/10/28/1075741028.db2.gz XHMMWKBKVLXBGZ-YPMHNXCESA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)n(C)n1 ZINC001580874721 1075741025 /nfs/dbraw/zinc/74/10/25/1075741025.db2.gz XHMMWKBKVLXBGZ-YPMHNXCESA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)ncn1 ZINC001580874738 1075740992 /nfs/dbraw/zinc/74/09/92/1075740992.db2.gz XUGHUSGSHIHCDL-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)ncn1 ZINC001580874738 1075740989 /nfs/dbraw/zinc/74/09/89/1075740989.db2.gz XUGHUSGSHIHCDL-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)n(C)n1 ZINC001580874742 1075741039 /nfs/dbraw/zinc/74/10/39/1075741039.db2.gz XVZXUOQLQMJOQX-DGCLKSJQSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)n(C)n1 ZINC001580874742 1075741037 /nfs/dbraw/zinc/74/10/37/1075741037.db2.gz XVZXUOQLQMJOQX-DGCLKSJQSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)n(C)n1 ZINC001580874743 1075741068 /nfs/dbraw/zinc/74/10/68/1075741068.db2.gz XVZXUOQLQMJOQX-YPMHNXCESA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)n(C)n1 ZINC001580874743 1075741065 /nfs/dbraw/zinc/74/10/65/1075741065.db2.gz XVZXUOQLQMJOQX-YPMHNXCESA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)n(C)n1 ZINC001580874754 1075741002 /nfs/dbraw/zinc/74/10/02/1075741002.db2.gz YIHCCTZYXRCDFG-DGCLKSJQSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)n(C)n1 ZINC001580874754 1075740997 /nfs/dbraw/zinc/74/09/97/1075740997.db2.gz YIHCCTZYXRCDFG-DGCLKSJQSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cc(C)n(CC(=O)NC[C@H](CO)NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001580910673 1075741514 /nfs/dbraw/zinc/74/15/14/1075741514.db2.gz FZXBEDYESUFGIU-GFCCVEGCSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)NC[C@H](CO)NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001580910673 1075741510 /nfs/dbraw/zinc/74/15/10/1075741510.db2.gz FZXBEDYESUFGIU-GFCCVEGCSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)NC[C@@H](CO)NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001580910674 1075741477 /nfs/dbraw/zinc/74/14/77/1075741477.db2.gz FZXBEDYESUFGIU-LBPRGKRZSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)NC[C@@H](CO)NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001580910674 1075741475 /nfs/dbraw/zinc/74/14/75/1075741475.db2.gz FZXBEDYESUFGIU-LBPRGKRZSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)N[C@@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001580910980 1075741492 /nfs/dbraw/zinc/74/14/92/1075741492.db2.gz LTQISIQZPFWWHF-GFCCVEGCSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)N[C@@H](CO)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001580910980 1075741488 /nfs/dbraw/zinc/74/14/88/1075741488.db2.gz LTQISIQZPFWWHF-GFCCVEGCSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)N[C@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001580910981 1075741522 /nfs/dbraw/zinc/74/15/22/1075741522.db2.gz LTQISIQZPFWWHF-LBPRGKRZSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)N[C@H](CO)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001580910981 1075741519 /nfs/dbraw/zinc/74/15/19/1075741519.db2.gz LTQISIQZPFWWHF-LBPRGKRZSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)N[C@@H](CO)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001580911255 1075741378 /nfs/dbraw/zinc/74/13/78/1075741378.db2.gz QFCDPVKMWWGTIG-LLVKDONJSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)N[C@@H](CO)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001580911255 1075741372 /nfs/dbraw/zinc/74/13/72/1075741372.db2.gz QFCDPVKMWWGTIG-LLVKDONJSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)N[C@H](CO)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001580911256 1075741555 /nfs/dbraw/zinc/74/15/55/1075741555.db2.gz QFCDPVKMWWGTIG-NSHDSACASA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)N[C@H](CO)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001580911256 1075741554 /nfs/dbraw/zinc/74/15/54/1075741554.db2.gz QFCDPVKMWWGTIG-NSHDSACASA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)NC[C@H](CO)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001580911364 1075741364 /nfs/dbraw/zinc/74/13/64/1075741364.db2.gz QVRBLXFIKQXKTF-LLVKDONJSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)NC[C@H](CO)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001580911364 1075741360 /nfs/dbraw/zinc/74/13/60/1075741360.db2.gz QVRBLXFIKQXKTF-LLVKDONJSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)NC[C@@H](CO)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001580911365 1075741543 /nfs/dbraw/zinc/74/15/43/1075741543.db2.gz QVRBLXFIKQXKTF-NSHDSACASA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)NC[C@@H](CO)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001580911365 1075741540 /nfs/dbraw/zinc/74/15/40/1075741540.db2.gz QVRBLXFIKQXKTF-NSHDSACASA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)NC[C@@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001580911433 1075741413 /nfs/dbraw/zinc/74/14/13/1075741413.db2.gz UQDQSSVVIWJONG-GFCCVEGCSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)NC[C@@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001580911433 1075741408 /nfs/dbraw/zinc/74/14/08/1075741408.db2.gz UQDQSSVVIWJONG-GFCCVEGCSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)NC[C@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001580911434 1075741502 /nfs/dbraw/zinc/74/15/02/1075741502.db2.gz UQDQSSVVIWJONG-LBPRGKRZSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)NC[C@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001580911434 1075741498 /nfs/dbraw/zinc/74/14/98/1075741498.db2.gz UQDQSSVVIWJONG-LBPRGKRZSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)NC[C@H](CO)NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001580911549 1075741903 /nfs/dbraw/zinc/74/19/03/1075741903.db2.gz YRVGPPABNYAWBQ-GFCCVEGCSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)NC[C@H](CO)NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001580911549 1075741900 /nfs/dbraw/zinc/74/19/00/1075741900.db2.gz YRVGPPABNYAWBQ-GFCCVEGCSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)NC[C@@H](CO)NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001580911550 1075741909 /nfs/dbraw/zinc/74/19/09/1075741909.db2.gz YRVGPPABNYAWBQ-LBPRGKRZSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(C)n(CC(=O)NC[C@@H](CO)NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001580911550 1075741907 /nfs/dbraw/zinc/74/19/07/1075741907.db2.gz YRVGPPABNYAWBQ-LBPRGKRZSA-N -1 3 387.404 -1.085 20 0 GAADHM Cc1cc(CC(=O)N2CC(O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)[nH]n1 ZINC001580915131 1075741770 /nfs/dbraw/zinc/74/17/70/1075741770.db2.gz AQXZCRPDTPOKNV-UHFFFAOYSA-N -1 3 385.388 -1.228 20 0 GAADHM Cc1cc(CC(=O)N2CC(O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)[nH]n1 ZINC001580915131 1075741765 /nfs/dbraw/zinc/74/17/65/1075741765.db2.gz AQXZCRPDTPOKNV-UHFFFAOYSA-N -1 3 385.388 -1.228 20 0 GAADHM Cc1cc(CC(=O)N2CC(O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)[nH]n1 ZINC001580915468 1075741678 /nfs/dbraw/zinc/74/16/78/1075741678.db2.gz LAABMKVCNHUCCA-UHFFFAOYSA-N -1 3 385.388 -1.228 20 0 GAADHM Cc1cc(CC(=O)N2CC(O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)[nH]n1 ZINC001580915468 1075741675 /nfs/dbraw/zinc/74/16/75/1075741675.db2.gz LAABMKVCNHUCCA-UHFFFAOYSA-N -1 3 385.388 -1.228 20 0 GAADHM Cc1cc(CC(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)[nH]n1 ZINC001580915842 1075741693 /nfs/dbraw/zinc/74/16/93/1075741693.db2.gz UBJIBKCYLAQUNC-UHFFFAOYSA-N -1 3 385.388 -1.228 20 0 GAADHM Cc1cc(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)[nH]n1 ZINC001580917250 1075741838 /nfs/dbraw/zinc/74/18/38/1075741838.db2.gz FNQOHIHIACKJCS-CHWSQXEVSA-N -1 3 385.388 -1.229 20 0 GAADHM Cc1cc(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)[nH]n1 ZINC001580917250 1075741834 /nfs/dbraw/zinc/74/18/34/1075741834.db2.gz FNQOHIHIACKJCS-CHWSQXEVSA-N -1 3 385.388 -1.229 20 0 GAADHM Cc1cc(CC(=O)N2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)[nH]n1 ZINC001580917252 1075741851 /nfs/dbraw/zinc/74/18/51/1075741851.db2.gz FNQOHIHIACKJCS-OLZOCXBDSA-N -1 3 385.388 -1.229 20 0 GAADHM Cc1cc(CC(=O)N2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)[nH]n1 ZINC001580917252 1075741846 /nfs/dbraw/zinc/74/18/46/1075741846.db2.gz FNQOHIHIACKJCS-OLZOCXBDSA-N -1 3 385.388 -1.229 20 0 GAADHM Cc1cc(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)[nH]n1 ZINC001580917581 1075741861 /nfs/dbraw/zinc/74/18/61/1075741861.db2.gz LMRPHKWCOVISDV-CHWSQXEVSA-N -1 3 385.388 -1.229 20 0 GAADHM Cc1cc(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)[nH]n1 ZINC001580917581 1075741857 /nfs/dbraw/zinc/74/18/57/1075741857.db2.gz LMRPHKWCOVISDV-CHWSQXEVSA-N -1 3 385.388 -1.229 20 0 GAADHM Cc1cc(CC(=O)N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)[nH]n1 ZINC001580917584 1075741734 /nfs/dbraw/zinc/74/17/34/1075741734.db2.gz LMRPHKWCOVISDV-OLZOCXBDSA-N -1 3 385.388 -1.229 20 0 GAADHM Cc1cc(CC(=O)N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)[nH]n1 ZINC001580917584 1075741727 /nfs/dbraw/zinc/74/17/27/1075741727.db2.gz LMRPHKWCOVISDV-OLZOCXBDSA-N -1 3 385.388 -1.229 20 0 GAADHM Cc1cc(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)[nH]n1 ZINC001580918159 1075741933 /nfs/dbraw/zinc/74/19/33/1075741933.db2.gz WJONNCHDGHCKPI-CHWSQXEVSA-N -1 3 385.388 -1.229 20 0 GAADHM Cc1cc(CC(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)[nH]n1 ZINC001580918160 1075741787 /nfs/dbraw/zinc/74/17/87/1075741787.db2.gz WJONNCHDGHCKPI-OLZOCXBDSA-N -1 3 385.388 -1.229 20 0 GAADHM Cc1cc(CC(=O)NC[C@@H](O)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n(C)n1 ZINC001580918709 1075741712 /nfs/dbraw/zinc/74/17/12/1075741712.db2.gz MEMVEOXXAZXKKV-GFCCVEGCSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1cc(CC(=O)NC[C@@H](O)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n(C)n1 ZINC001580918709 1075741708 /nfs/dbraw/zinc/74/17/08/1075741708.db2.gz MEMVEOXXAZXKKV-GFCCVEGCSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1cc(CC(=O)NC[C@H](O)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n(C)n1 ZINC001580918710 1075741927 /nfs/dbraw/zinc/74/19/27/1075741927.db2.gz MEMVEOXXAZXKKV-LBPRGKRZSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1cc(CC(=O)NC[C@H](O)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n(C)n1 ZINC001580918710 1075741926 /nfs/dbraw/zinc/74/19/26/1075741926.db2.gz MEMVEOXXAZXKKV-LBPRGKRZSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1cc(CC(=O)NC[C@@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n(C)n1 ZINC001580918837 1075741893 /nfs/dbraw/zinc/74/18/93/1075741893.db2.gz PSPKAPCCARPVDK-GFCCVEGCSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1cc(CC(=O)NC[C@@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n(C)n1 ZINC001580918837 1075741890 /nfs/dbraw/zinc/74/18/90/1075741890.db2.gz PSPKAPCCARPVDK-GFCCVEGCSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1cc(CC(=O)NC[C@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n(C)n1 ZINC001580918838 1075741915 /nfs/dbraw/zinc/74/19/15/1075741915.db2.gz PSPKAPCCARPVDK-LBPRGKRZSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1cc(CC(=O)NC[C@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n(C)n1 ZINC001580918838 1075741913 /nfs/dbraw/zinc/74/19/13/1075741913.db2.gz PSPKAPCCARPVDK-LBPRGKRZSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1cc(CC(=O)N[C@H](CO)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n(C)n1 ZINC001580918840 1075741805 /nfs/dbraw/zinc/74/18/05/1075741805.db2.gz PTQQBZISPPZVFR-JTQLQIEISA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1cc(CC(=O)N[C@H](CO)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n(C)n1 ZINC001580918840 1075741800 /nfs/dbraw/zinc/74/18/00/1075741800.db2.gz PTQQBZISPPZVFR-JTQLQIEISA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1cc(CC(=O)N[C@@H](CO)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n(C)n1 ZINC001580918841 1075742068 /nfs/dbraw/zinc/74/20/68/1075742068.db2.gz PTQQBZISPPZVFR-SNVBAGLBSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1cc(CC(=O)N[C@@H](CO)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n(C)n1 ZINC001580918841 1075742065 /nfs/dbraw/zinc/74/20/65/1075742065.db2.gz PTQQBZISPPZVFR-SNVBAGLBSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1cc(CC(=O)N[C@@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n(C)n1 ZINC001580919307 1075742089 /nfs/dbraw/zinc/74/20/89/1075742089.db2.gz ZOTCNIYFHATXLB-LLVKDONJSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1cc(CC(=O)N[C@@H](CO)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n(C)n1 ZINC001580919307 1075742086 /nfs/dbraw/zinc/74/20/86/1075742086.db2.gz ZOTCNIYFHATXLB-LLVKDONJSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1cc(CC(=O)N[C@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n(C)n1 ZINC001580919308 1075742176 /nfs/dbraw/zinc/74/21/76/1075742176.db2.gz ZOTCNIYFHATXLB-NSHDSACASA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1cc(CC(=O)N[C@H](CO)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n(C)n1 ZINC001580919308 1075742173 /nfs/dbraw/zinc/74/21/73/1075742173.db2.gz ZOTCNIYFHATXLB-NSHDSACASA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1cc(F)cc(-c2nnn[n-]2)c1S(=O)(=O)N[C@@H]1CS(=O)(=O)C[C@H]1O ZINC001580934019 1075742197 /nfs/dbraw/zinc/74/21/97/1075742197.db2.gz ISYOFGXCCWPBAS-NXEZZACHSA-N -1 3 391.406 -1.250 20 0 GAADHM Cc1cc(N2CC[C@@H](NC(=O)Cn3c(=O)[n-][nH]c3=O)C2)c(-c2nnn[n-]2)c[nH+]1 ZINC001580958500 1075742475 /nfs/dbraw/zinc/74/24/75/1075742475.db2.gz CYEWIJLMBZQWHF-SECBINFHSA-N -1 3 386.376 -1.032 20 0 GAADHM Cc1cc(N2CC[C@H](NC(=O)Cn3c(=O)[n-][nH]c3=O)C2)c(-c2nnn[n-]2)c[nH+]1 ZINC001580958501 1075742787 /nfs/dbraw/zinc/74/27/87/1075742787.db2.gz CYEWIJLMBZQWHF-VIFPVBQESA-N -1 3 386.376 -1.032 20 0 GAADHM Cc1cc(N2CCN(C(=O)Cn3c(=O)[n-][nH]c3=O)CC2)c(-c2nnn[n-]2)c[nH+]1 ZINC001580970134 1075743332 /nfs/dbraw/zinc/74/33/32/1075743332.db2.gz DVROADJZDGVQSJ-UHFFFAOYSA-N -1 3 386.376 -1.078 20 0 GAADHM Cc1cc(N2CCN([C@@H]3CS(=O)(=O)C[C@H]3O)CC2)ncc1-c1nn[n-]n1 ZINC001580970666 1075743365 /nfs/dbraw/zinc/74/33/65/1075743365.db2.gz VEAHSWVZCHRDSY-CHWSQXEVSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1cc(N2CCN([C@@H]3CS(=O)(=O)C[C@H]3O)CC2)ncc1-c1nnn[n-]1 ZINC001580970666 1075743363 /nfs/dbraw/zinc/74/33/63/1075743363.db2.gz VEAHSWVZCHRDSY-CHWSQXEVSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1cc(N2CCN([C@@H]3CS(=O)(=O)C[C@@H]3O)CC2)ncc1-c1nn[n-]n1 ZINC001580970669 1075743393 /nfs/dbraw/zinc/74/33/93/1075743393.db2.gz VEAHSWVZCHRDSY-OLZOCXBDSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1cc(N2CCN([C@@H]3CS(=O)(=O)C[C@@H]3O)CC2)ncc1-c1nnn[n-]1 ZINC001580970669 1075743390 /nfs/dbraw/zinc/74/33/90/1075743390.db2.gz VEAHSWVZCHRDSY-OLZOCXBDSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1cc(N2CCN([C@H]3CS(=O)(=O)C[C@H]3O)CC2)ncc1-c1nn[n-]n1 ZINC001580970671 1075743517 /nfs/dbraw/zinc/74/35/17/1075743517.db2.gz VEAHSWVZCHRDSY-QWHCGFSZSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1cc(N2CCN([C@H]3CS(=O)(=O)C[C@H]3O)CC2)ncc1-c1nnn[n-]1 ZINC001580970671 1075743512 /nfs/dbraw/zinc/74/35/12/1075743512.db2.gz VEAHSWVZCHRDSY-QWHCGFSZSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1cc(N2CCN([C@H]3CS(=O)(=O)C[C@@H]3O)CC2)ncc1-c1nn[n-]n1 ZINC001580970672 1075743598 /nfs/dbraw/zinc/74/35/98/1075743598.db2.gz VEAHSWVZCHRDSY-STQMWFEESA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1cc(N2CCN([C@H]3CS(=O)(=O)C[C@@H]3O)CC2)ncc1-c1nnn[n-]1 ZINC001580970672 1075743594 /nfs/dbraw/zinc/74/35/94/1075743594.db2.gz VEAHSWVZCHRDSY-STQMWFEESA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1cc(N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)nc(CO)n1 ZINC001580973906 1075743877 /nfs/dbraw/zinc/74/38/77/1075743877.db2.gz CCLGMCVOFLTEGD-VXGBXAGGSA-N -1 3 385.388 -1.235 20 0 GAADHM Cc1cc(N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)nc(CO)n1 ZINC001580973906 1075743875 /nfs/dbraw/zinc/74/38/75/1075743875.db2.gz CCLGMCVOFLTEGD-VXGBXAGGSA-N -1 3 385.388 -1.235 20 0 GAADHM Cc1cc(N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)nc(CO)n1 ZINC001580976310 1075744164 /nfs/dbraw/zinc/74/41/64/1075744164.db2.gz CCLGMCVOFLTEGD-NEPJUHHUSA-N -1 3 385.388 -1.235 20 0 GAADHM Cc1cc(N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)nc(CO)n1 ZINC001580976310 1075744159 /nfs/dbraw/zinc/74/41/59/1075744159.db2.gz CCLGMCVOFLTEGD-NEPJUHHUSA-N -1 3 385.388 -1.235 20 0 GAADHM Cc1cc(N2C[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)nc(CO)n1 ZINC001580976312 1075744265 /nfs/dbraw/zinc/74/42/65/1075744265.db2.gz CFGLOBOAKSNOFA-NEPJUHHUSA-N -1 3 385.388 -1.235 20 0 GAADHM Cc1cc(N2C[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)nc(CO)n1 ZINC001580976312 1075744259 /nfs/dbraw/zinc/74/42/59/1075744259.db2.gz CFGLOBOAKSNOFA-NEPJUHHUSA-N -1 3 385.388 -1.235 20 0 GAADHM Cc1cc(NC(=O)N2CCN3[C@H](CNS3(=O)=O)C2)ncc1-c1nn[n-]n1 ZINC001580982910 1075744712 /nfs/dbraw/zinc/74/47/12/1075744712.db2.gz XLXGLNFEVQBVEK-SECBINFHSA-N -1 3 379.406 -1.064 20 0 GAADHM Cc1cc(NC(=O)N2CCN3[C@H](CNS3(=O)=O)C2)ncc1-c1nnn[n-]1 ZINC001580982910 1075744708 /nfs/dbraw/zinc/74/47/08/1075744708.db2.gz XLXGLNFEVQBVEK-SECBINFHSA-N -1 3 379.406 -1.064 20 0 GAADHM Cc1cc(NC(=O)N2CCN3[C@@H](CNS3(=O)=O)C2)ncc1-c1nn[n-]n1 ZINC001580982911 1075744874 /nfs/dbraw/zinc/74/48/74/1075744874.db2.gz XLXGLNFEVQBVEK-VIFPVBQESA-N -1 3 379.406 -1.064 20 0 GAADHM Cc1cc(NC(=O)N2CCN3[C@@H](CNS3(=O)=O)C2)ncc1-c1nnn[n-]1 ZINC001580982911 1075744872 /nfs/dbraw/zinc/74/48/72/1075744872.db2.gz XLXGLNFEVQBVEK-VIFPVBQESA-N -1 3 379.406 -1.064 20 0 GAADHM Cc1cc(N[C@H](C)CN(C)C(=O)Cn2c(=O)[n-][nH]c2=O)c(-c2nnn[n-]2)c[nH+]1 ZINC001580993189 1075744726 /nfs/dbraw/zinc/74/47/26/1075744726.db2.gz CEYWELIRWRCCIR-SECBINFHSA-N -1 3 388.392 -1.046 20 0 GAADHM Cc1cc(N[C@@H](C)CN(C)C(=O)Cn2c(=O)[n-][nH]c2=O)c(-c2nnn[n-]2)c[nH+]1 ZINC001580993194 1075745072 /nfs/dbraw/zinc/74/50/72/1075745072.db2.gz CEYWELIRWRCCIR-VIFPVBQESA-N -1 3 388.392 -1.046 20 0 GAADHM Cc1cc(N[C@@H]2CCN(C(=O)Cn3c(=O)[n-][nH]c3=O)C2)c(-c2nnn[n-]2)c[nH+]1 ZINC001581006441 1075746853 /nfs/dbraw/zinc/74/68/53/1075746853.db2.gz RLRYZLDDNLQXQJ-SECBINFHSA-N -1 3 386.376 -1.292 20 0 GAADHM Cc1cc(NC[C@@H](C)N(C)C(=O)Cn2c(=O)[n-][nH]c2=O)c(-c2nnn[n-]2)c[nH+]1 ZINC001581011159 1075747142 /nfs/dbraw/zinc/74/71/42/1075747142.db2.gz DMYRAOGDTWLOLP-SECBINFHSA-N -1 3 388.392 -1.046 20 0 GAADHM Cc1cc(NC[C@H](C)N(C)C(=O)Cn2c(=O)[n-][nH]c2=O)c(-c2nnn[n-]2)c[nH+]1 ZINC001581011160 1075747288 /nfs/dbraw/zinc/74/72/88/1075747288.db2.gz DMYRAOGDTWLOLP-VIFPVBQESA-N -1 3 388.392 -1.046 20 0 GAADHM Cc1cc(S(=O)(=O)NC[C@@H](O)CS(C)(=O)=O)ccc1-c1nn[n-]n1 ZINC001581043273 1075751644 /nfs/dbraw/zinc/75/16/44/1075751644.db2.gz BMQULFWAAKONQC-SECBINFHSA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1cc(S(=O)(=O)NC[C@@H](O)CS(C)(=O)=O)ccc1-c1nnn[n-]1 ZINC001581043273 1075751641 /nfs/dbraw/zinc/75/16/41/1075751641.db2.gz BMQULFWAAKONQC-SECBINFHSA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1cc(S(=O)(=O)NC[C@H](O)CS(C)(=O)=O)ccc1-c1nn[n-]n1 ZINC001581043274 1075751694 /nfs/dbraw/zinc/75/16/94/1075751694.db2.gz BMQULFWAAKONQC-VIFPVBQESA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1cc(S(=O)(=O)NC[C@H](O)CS(C)(=O)=O)ccc1-c1nnn[n-]1 ZINC001581043274 1075751690 /nfs/dbraw/zinc/75/16/90/1075751690.db2.gz BMQULFWAAKONQC-VIFPVBQESA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1cc(S(=O)(=O)NCc2nnc3n2CCNC3=O)ccc1-c1nn[n-]n1 ZINC001581043339 1075751729 /nfs/dbraw/zinc/75/17/29/1075751729.db2.gz FGHBRDRFTYFIOT-UHFFFAOYSA-N -1 3 389.401 -1.011 20 0 GAADHM Cc1cc(S(=O)(=O)NCc2nnc3n2CCNC3=O)ccc1-c1nnn[n-]1 ZINC001581043339 1075751725 /nfs/dbraw/zinc/75/17/25/1075751725.db2.gz FGHBRDRFTYFIOT-UHFFFAOYSA-N -1 3 389.401 -1.011 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)[C@H](C)CNC(=O)CN2CCNC(=O)C2)n1 ZINC001581053529 1075751776 /nfs/dbraw/zinc/75/17/76/1075751776.db2.gz QOXUNBCUNMZIGX-GFCCVEGCSA-N -1 3 387.448 -1.057 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)[C@H](C)CNC(=O)CN2CCNC(=O)C2)n1 ZINC001581053529 1075751774 /nfs/dbraw/zinc/75/17/74/1075751774.db2.gz QOXUNBCUNMZIGX-GFCCVEGCSA-N -1 3 387.448 -1.057 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)[C@@H](C)CNC(=O)CN2CCNC(=O)C2)n1 ZINC001581053530 1075751749 /nfs/dbraw/zinc/75/17/49/1075751749.db2.gz QOXUNBCUNMZIGX-LBPRGKRZSA-N -1 3 387.448 -1.057 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)[C@@H](C)CNC(=O)CN2CCNC(=O)C2)n1 ZINC001581053530 1075751746 /nfs/dbraw/zinc/75/17/46/1075751746.db2.gz QOXUNBCUNMZIGX-LBPRGKRZSA-N -1 3 387.448 -1.057 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)C[C@@H](C)NC(=O)CN2CCNC(=O)C2)n1 ZINC001581056853 1075751682 /nfs/dbraw/zinc/75/16/82/1075751682.db2.gz ZGMJYWJZLZSDAG-GFCCVEGCSA-N -1 3 387.448 -1.057 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)C[C@@H](C)NC(=O)CN2CCNC(=O)C2)n1 ZINC001581056853 1075751677 /nfs/dbraw/zinc/75/16/77/1075751677.db2.gz ZGMJYWJZLZSDAG-GFCCVEGCSA-N -1 3 387.448 -1.057 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)C[C@H](C)NC(=O)CN2CCNC(=O)C2)n1 ZINC001581056854 1075751608 /nfs/dbraw/zinc/75/16/08/1075751608.db2.gz ZGMJYWJZLZSDAG-LBPRGKRZSA-N -1 3 387.448 -1.057 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)C[C@H](C)NC(=O)CN2CCNC(=O)C2)n1 ZINC001581056854 1075751606 /nfs/dbraw/zinc/75/16/06/1075751606.db2.gz ZGMJYWJZLZSDAG-LBPRGKRZSA-N -1 3 387.448 -1.057 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)C[C@H](O)CN(C)C(=O)[C@H]2CNC(=O)N2)n1 ZINC001581057400 1075751711 /nfs/dbraw/zinc/75/17/11/1075751711.db2.gz BUKDDGBIMCLCBP-CMPLNLGQSA-N -1 3 389.420 -1.493 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)C[C@H](O)CN(C)C(=O)[C@H]2CNC(=O)N2)n1 ZINC001581057400 1075751707 /nfs/dbraw/zinc/75/17/07/1075751707.db2.gz BUKDDGBIMCLCBP-CMPLNLGQSA-N -1 3 389.420 -1.493 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)C[C@H](O)CN(C)C(=O)[C@@H]2CNC(=O)N2)n1 ZINC001581057401 1075751741 /nfs/dbraw/zinc/75/17/41/1075751741.db2.gz BUKDDGBIMCLCBP-JQWIXIFHSA-N -1 3 389.420 -1.493 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)C[C@H](O)CN(C)C(=O)[C@@H]2CNC(=O)N2)n1 ZINC001581057401 1075751738 /nfs/dbraw/zinc/75/17/38/1075751738.db2.gz BUKDDGBIMCLCBP-JQWIXIFHSA-N -1 3 389.420 -1.493 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)C[C@@H](O)CN(C)C(=O)[C@@H]2CNC(=O)N2)n1 ZINC001581057402 1075751765 /nfs/dbraw/zinc/75/17/65/1075751765.db2.gz BUKDDGBIMCLCBP-PWSUYJOCSA-N -1 3 389.420 -1.493 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)C[C@@H](O)CN(C)C(=O)[C@@H]2CNC(=O)N2)n1 ZINC001581057402 1075751763 /nfs/dbraw/zinc/75/17/63/1075751763.db2.gz BUKDDGBIMCLCBP-PWSUYJOCSA-N -1 3 389.420 -1.493 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)C[C@@H](O)CN(C)C(=O)[C@H]2CNC(=O)N2)n1 ZINC001581057403 1075751596 /nfs/dbraw/zinc/75/15/96/1075751596.db2.gz BUKDDGBIMCLCBP-ZYHUDNBSSA-N -1 3 389.420 -1.493 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)C[C@@H](O)CN(C)C(=O)[C@H]2CNC(=O)N2)n1 ZINC001581057403 1075751591 /nfs/dbraw/zinc/75/15/91/1075751591.db2.gz BUKDDGBIMCLCBP-ZYHUDNBSSA-N -1 3 389.420 -1.493 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)C[C@H](O)CN(C)C(=O)[C@H](C)NC(N)=O)n1 ZINC001581057787 1075751628 /nfs/dbraw/zinc/75/16/28/1075751628.db2.gz FNPCBCQRUCPDHD-QWRGUYRKSA-N -1 3 391.436 -1.118 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)C[C@H](O)CN(C)C(=O)[C@H](C)NC(N)=O)n1 ZINC001581057787 1075751626 /nfs/dbraw/zinc/75/16/26/1075751626.db2.gz FNPCBCQRUCPDHD-QWRGUYRKSA-N -1 3 391.436 -1.118 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)C[C@@H](O)CN(C)C(=O)[C@H](C)NC(N)=O)n1 ZINC001581057788 1075751719 /nfs/dbraw/zinc/75/17/19/1075751719.db2.gz FNPCBCQRUCPDHD-WDEREUQCSA-N -1 3 391.436 -1.118 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)C[C@@H](O)CN(C)C(=O)[C@H](C)NC(N)=O)n1 ZINC001581057788 1075751717 /nfs/dbraw/zinc/75/17/17/1075751717.db2.gz FNPCBCQRUCPDHD-WDEREUQCSA-N -1 3 391.436 -1.118 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)C[C@H](O)CN(C)C(=O)Cn2ncnn2)n1 ZINC001581057789 1075751657 /nfs/dbraw/zinc/75/16/57/1075751657.db2.gz FQSGJDJBHOAWGY-LLVKDONJSA-N -1 3 387.408 -1.488 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)C[C@H](O)CN(C)C(=O)Cn2ncnn2)n1 ZINC001581057789 1075751651 /nfs/dbraw/zinc/75/16/51/1075751651.db2.gz FQSGJDJBHOAWGY-LLVKDONJSA-N -1 3 387.408 -1.488 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)C[C@@H](O)CN(C)C(=O)Cn2ncnn2)n1 ZINC001581057790 1075751621 /nfs/dbraw/zinc/75/16/21/1075751621.db2.gz FQSGJDJBHOAWGY-NSHDSACASA-N -1 3 387.408 -1.488 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)C[C@@H](O)CN(C)C(=O)Cn2ncnn2)n1 ZINC001581057790 1075751618 /nfs/dbraw/zinc/75/16/18/1075751618.db2.gz FQSGJDJBHOAWGY-NSHDSACASA-N -1 3 387.408 -1.488 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)C[C@H](O)CN(C)C(=O)Cn2cnnn2)n1 ZINC001581058599 1075751781 /nfs/dbraw/zinc/75/17/81/1075751781.db2.gz UPMPKNUAXNXBTB-LLVKDONJSA-N -1 3 387.408 -1.488 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)C[C@H](O)CN(C)C(=O)Cn2cnnn2)n1 ZINC001581058599 1075751780 /nfs/dbraw/zinc/75/17/80/1075751780.db2.gz UPMPKNUAXNXBTB-LLVKDONJSA-N -1 3 387.408 -1.488 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)C[C@@H](O)CN(C)C(=O)Cn2cnnn2)n1 ZINC001581058600 1075752123 /nfs/dbraw/zinc/75/21/23/1075752123.db2.gz UPMPKNUAXNXBTB-NSHDSACASA-N -1 3 387.408 -1.488 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)C[C@@H](O)CN(C)C(=O)Cn2cnnn2)n1 ZINC001581058600 1075752121 /nfs/dbraw/zinc/75/21/21/1075752121.db2.gz UPMPKNUAXNXBTB-NSHDSACASA-N -1 3 387.408 -1.488 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)C[C@H](O)CN(C)C(=O)[C@H]2COC(=O)N2)n1 ZINC001581058735 1075752051 /nfs/dbraw/zinc/75/20/51/1075752051.db2.gz XYOQTYCLLCSHTF-CMPLNLGQSA-N -1 3 390.404 -1.066 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)C[C@H](O)CN(C)C(=O)[C@H]2COC(=O)N2)n1 ZINC001581058735 1075752046 /nfs/dbraw/zinc/75/20/46/1075752046.db2.gz XYOQTYCLLCSHTF-CMPLNLGQSA-N -1 3 390.404 -1.066 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)C[C@H](O)CN(C)C(=O)[C@@H]2COC(=O)N2)n1 ZINC001581058736 1075752139 /nfs/dbraw/zinc/75/21/39/1075752139.db2.gz XYOQTYCLLCSHTF-JQWIXIFHSA-N -1 3 390.404 -1.066 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)C[C@H](O)CN(C)C(=O)[C@@H]2COC(=O)N2)n1 ZINC001581058736 1075752137 /nfs/dbraw/zinc/75/21/37/1075752137.db2.gz XYOQTYCLLCSHTF-JQWIXIFHSA-N -1 3 390.404 -1.066 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)C[C@@H](O)CN(C)C(=O)[C@@H]2COC(=O)N2)n1 ZINC001581058737 1075752115 /nfs/dbraw/zinc/75/21/15/1075752115.db2.gz XYOQTYCLLCSHTF-PWSUYJOCSA-N -1 3 390.404 -1.066 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)C[C@@H](O)CN(C)C(=O)[C@@H]2COC(=O)N2)n1 ZINC001581058737 1075752113 /nfs/dbraw/zinc/75/21/13/1075752113.db2.gz XYOQTYCLLCSHTF-PWSUYJOCSA-N -1 3 390.404 -1.066 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)C[C@@H](O)CN(C)C(=O)[C@H]2COC(=O)N2)n1 ZINC001581058738 1075752079 /nfs/dbraw/zinc/75/20/79/1075752079.db2.gz XYOQTYCLLCSHTF-ZYHUDNBSSA-N -1 3 390.404 -1.066 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)C[C@@H](O)CN(C)C(=O)[C@H]2COC(=O)N2)n1 ZINC001581058738 1075752076 /nfs/dbraw/zinc/75/20/76/1075752076.db2.gz XYOQTYCLLCSHTF-ZYHUDNBSSA-N -1 3 390.404 -1.066 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)C[C@H](O)CN(C)C(=O)c2nnn(C)n2)n1 ZINC001581058783 1075752097 /nfs/dbraw/zinc/75/20/97/1075752097.db2.gz YXVKSZKUOPQPKK-JTQLQIEISA-N -1 3 387.408 -1.337 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)C[C@H](O)CN(C)C(=O)c2nnn(C)n2)n1 ZINC001581058783 1075752095 /nfs/dbraw/zinc/75/20/95/1075752095.db2.gz YXVKSZKUOPQPKK-JTQLQIEISA-N -1 3 387.408 -1.337 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)C[C@@H](O)CN(C)C(=O)c2nnn(C)n2)n1 ZINC001581058784 1075752061 /nfs/dbraw/zinc/75/20/61/1075752061.db2.gz YXVKSZKUOPQPKK-SNVBAGLBSA-N -1 3 387.408 -1.337 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)C[C@@H](O)CN(C)C(=O)c2nnn(C)n2)n1 ZINC001581058784 1075752057 /nfs/dbraw/zinc/75/20/57/1075752057.db2.gz YXVKSZKUOPQPKK-SNVBAGLBSA-N -1 3 387.408 -1.337 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)CCCNC(=O)CN2CCNC(=O)C2)n1 ZINC001581059622 1075752011 /nfs/dbraw/zinc/75/20/11/1075752011.db2.gz BIFXDCOOVHENMU-UHFFFAOYSA-N -1 3 387.448 -1.056 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)CCCNC(=O)CN2CCNC(=O)C2)n1 ZINC001581059622 1075752004 /nfs/dbraw/zinc/75/20/04/1075752004.db2.gz BIFXDCOOVHENMU-UHFFFAOYSA-N -1 3 387.448 -1.056 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)CCN(C)C(=O)CN2CCNC(=O)C2)n1 ZINC001581061774 1075752084 /nfs/dbraw/zinc/75/20/84/1075752084.db2.gz TXECYJUFZSCYIO-UHFFFAOYSA-N -1 3 387.448 -1.103 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)CCN(C)C(=O)CN2CCNC(=O)C2)n1 ZINC001581061774 1075752083 /nfs/dbraw/zinc/75/20/83/1075752083.db2.gz TXECYJUFZSCYIO-UHFFFAOYSA-N -1 3 387.448 -1.103 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)CCOCCNC(=O)c2nnn(C)n2)n1 ZINC001581062802 1075751972 /nfs/dbraw/zinc/75/19/72/1075751972.db2.gz GBJIKXJKBJBAFB-UHFFFAOYSA-N -1 3 387.408 -1.024 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)CCOCCNC(=O)c2nnn(C)n2)n1 ZINC001581062802 1075751965 /nfs/dbraw/zinc/75/19/65/1075751965.db2.gz GBJIKXJKBJBAFB-UHFFFAOYSA-N -1 3 387.408 -1.024 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@H](NC(=O)CN3CCNC(=O)C3)C2)n1 ZINC001581070613 1075752070 /nfs/dbraw/zinc/75/20/70/1075752070.db2.gz FCGHHWUFNRDNBH-GFCCVEGCSA-N -1 3 385.432 -1.303 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@H](NC(=O)CN3CCNC(=O)C3)C2)n1 ZINC001581070613 1075752066 /nfs/dbraw/zinc/75/20/66/1075752066.db2.gz FCGHHWUFNRDNBH-GFCCVEGCSA-N -1 3 385.432 -1.303 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@H](NC(=O)CN3CCNC(=O)C3)C2)n1 ZINC001581070615 1075752128 /nfs/dbraw/zinc/75/21/28/1075752128.db2.gz FCGHHWUFNRDNBH-LBPRGKRZSA-N -1 3 385.432 -1.303 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@H](NC(=O)CN3CCNC(=O)C3)C2)n1 ZINC001581070615 1075752126 /nfs/dbraw/zinc/75/21/26/1075752126.db2.gz FCGHHWUFNRDNBH-LBPRGKRZSA-N -1 3 385.432 -1.303 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@](O)(CNC(=O)[C@H]3CCC(=O)N3)C2)n1 ZINC001581072874 1075752110 /nfs/dbraw/zinc/75/21/10/1075752110.db2.gz BQACDZKSJXJKDS-PXAZEXFGSA-N -1 3 386.416 -1.094 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@](O)(CNC(=O)[C@H]3CCC(=O)N3)C2)n1 ZINC001581072874 1075752107 /nfs/dbraw/zinc/75/21/07/1075752107.db2.gz BQACDZKSJXJKDS-PXAZEXFGSA-N -1 3 386.416 -1.094 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@](O)(CNC(=O)[C@@H]3CCC(=O)N3)C2)n1 ZINC001581072875 1075751992 /nfs/dbraw/zinc/75/19/92/1075751992.db2.gz BQACDZKSJXJKDS-SJCJKPOMSA-N -1 3 386.416 -1.094 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@](O)(CNC(=O)[C@@H]3CCC(=O)N3)C2)n1 ZINC001581072875 1075751986 /nfs/dbraw/zinc/75/19/86/1075751986.db2.gz BQACDZKSJXJKDS-SJCJKPOMSA-N -1 3 386.416 -1.094 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@](O)(CNC(=O)[C@H]3CCC(=O)N3)C2)n1 ZINC001581072876 1075752092 /nfs/dbraw/zinc/75/20/92/1075752092.db2.gz BQACDZKSJXJKDS-SJKOYZFVSA-N -1 3 386.416 -1.094 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@](O)(CNC(=O)[C@H]3CCC(=O)N3)C2)n1 ZINC001581072876 1075752090 /nfs/dbraw/zinc/75/20/90/1075752090.db2.gz BQACDZKSJXJKDS-SJKOYZFVSA-N -1 3 386.416 -1.094 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@](O)(CNC(=O)[C@@H]3CCC(=O)N3)C2)n1 ZINC001581072877 1075752037 /nfs/dbraw/zinc/75/20/37/1075752037.db2.gz BQACDZKSJXJKDS-YVEFUNNKSA-N -1 3 386.416 -1.094 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@](O)(CNC(=O)[C@@H]3CCC(=O)N3)C2)n1 ZINC001581072877 1075752032 /nfs/dbraw/zinc/75/20/32/1075752032.db2.gz BQACDZKSJXJKDS-YVEFUNNKSA-N -1 3 386.416 -1.094 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@](O)(CNC(=O)c3nnn(C)n3)C2)n1 ZINC001581073453 1075752360 /nfs/dbraw/zinc/75/23/60/1075752360.db2.gz HEVAJTYWHDSXTR-HNNXBMFYSA-N -1 3 385.392 -1.535 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@](O)(CNC(=O)c3nnn(C)n3)C2)n1 ZINC001581073453 1075752356 /nfs/dbraw/zinc/75/23/56/1075752356.db2.gz HEVAJTYWHDSXTR-HNNXBMFYSA-N -1 3 385.392 -1.535 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@](O)(CNC(=O)c3nnn(C)n3)C2)n1 ZINC001581073455 1075752348 /nfs/dbraw/zinc/75/23/48/1075752348.db2.gz HEVAJTYWHDSXTR-OAHLLOKOSA-N -1 3 385.392 -1.535 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@](O)(CNC(=O)c3nnn(C)n3)C2)n1 ZINC001581073455 1075752344 /nfs/dbraw/zinc/75/23/44/1075752344.db2.gz HEVAJTYWHDSXTR-OAHLLOKOSA-N -1 3 385.392 -1.535 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@](O)(CNC(=O)Cn3ncnn3)C2)n1 ZINC001581073572 1075752388 /nfs/dbraw/zinc/75/23/88/1075752388.db2.gz IZSGVMJLMRJGSW-HNNXBMFYSA-N -1 3 385.392 -1.686 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@](O)(CNC(=O)Cn3ncnn3)C2)n1 ZINC001581073572 1075752385 /nfs/dbraw/zinc/75/23/85/1075752385.db2.gz IZSGVMJLMRJGSW-HNNXBMFYSA-N -1 3 385.392 -1.686 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@](O)(CNC(=O)Cn3ncnn3)C2)n1 ZINC001581073573 1075752424 /nfs/dbraw/zinc/75/24/24/1075752424.db2.gz IZSGVMJLMRJGSW-OAHLLOKOSA-N -1 3 385.392 -1.686 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@](O)(CNC(=O)Cn3ncnn3)C2)n1 ZINC001581073573 1075752422 /nfs/dbraw/zinc/75/24/22/1075752422.db2.gz IZSGVMJLMRJGSW-OAHLLOKOSA-N -1 3 385.392 -1.686 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@](O)(CNC(=O)Cn3cncn3)C2)n1 ZINC001581073766 1075752436 /nfs/dbraw/zinc/75/24/36/1075752436.db2.gz KIRQNWYVUHSTFS-INIZCTEOSA-N -1 3 384.404 -1.081 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@](O)(CNC(=O)Cn3cncn3)C2)n1 ZINC001581073766 1075752433 /nfs/dbraw/zinc/75/24/33/1075752433.db2.gz KIRQNWYVUHSTFS-INIZCTEOSA-N -1 3 384.404 -1.081 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@](O)(CNC(=O)Cn3cncn3)C2)n1 ZINC001581073767 1075752399 /nfs/dbraw/zinc/75/23/99/1075752399.db2.gz KIRQNWYVUHSTFS-MRXNPFEDSA-N -1 3 384.404 -1.081 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@](O)(CNC(=O)Cn3cncn3)C2)n1 ZINC001581073767 1075752397 /nfs/dbraw/zinc/75/23/97/1075752397.db2.gz KIRQNWYVUHSTFS-MRXNPFEDSA-N -1 3 384.404 -1.081 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@H](NC(=O)[C@@H]3CC(=O)NC(=O)N3)C2)n1 ZINC001581073807 1075752380 /nfs/dbraw/zinc/75/23/80/1075752380.db2.gz MKFNSKAOJNCEQB-KOLCDFICSA-N -1 3 385.388 -1.137 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@H](NC(=O)[C@@H]3CC(=O)NC(=O)N3)C2)n1 ZINC001581073807 1075752378 /nfs/dbraw/zinc/75/23/78/1075752378.db2.gz MKFNSKAOJNCEQB-KOLCDFICSA-N -1 3 385.388 -1.137 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@H](NC(=O)[C@@H]3CC(=O)NC(=O)N3)C2)n1 ZINC001581073808 1075752393 /nfs/dbraw/zinc/75/23/93/1075752393.db2.gz MKFNSKAOJNCEQB-ONGXEEELSA-N -1 3 385.388 -1.137 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@H](NC(=O)[C@@H]3CC(=O)NC(=O)N3)C2)n1 ZINC001581073808 1075752391 /nfs/dbraw/zinc/75/23/91/1075752391.db2.gz MKFNSKAOJNCEQB-ONGXEEELSA-N -1 3 385.388 -1.137 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@](O)(CNC(=O)Cn3cnnn3)C2)n1 ZINC001581074260 1075752369 /nfs/dbraw/zinc/75/23/69/1075752369.db2.gz OXIUFSLTMUVIBV-HNNXBMFYSA-N -1 3 385.392 -1.686 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@](O)(CNC(=O)Cn3cnnn3)C2)n1 ZINC001581074260 1075752367 /nfs/dbraw/zinc/75/23/67/1075752367.db2.gz OXIUFSLTMUVIBV-HNNXBMFYSA-N -1 3 385.392 -1.686 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@](O)(CNC(=O)Cn3cnnn3)C2)n1 ZINC001581074262 1075752375 /nfs/dbraw/zinc/75/23/75/1075752375.db2.gz OXIUFSLTMUVIBV-OAHLLOKOSA-N -1 3 385.392 -1.686 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@](O)(CNC(=O)Cn3cnnn3)C2)n1 ZINC001581074262 1075752373 /nfs/dbraw/zinc/75/23/73/1075752373.db2.gz OXIUFSLTMUVIBV-OAHLLOKOSA-N -1 3 385.392 -1.686 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@H](NC(=O)Cn3ncn(C)c3=O)C2)n1 ZINC001581074479 1075752449 /nfs/dbraw/zinc/75/24/49/1075752449.db2.gz WNYBZESSVFZCSJ-NSHDSACASA-N -1 3 384.404 -1.140 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@H](NC(=O)Cn3ncn(C)c3=O)C2)n1 ZINC001581074479 1075752447 /nfs/dbraw/zinc/75/24/47/1075752447.db2.gz WNYBZESSVFZCSJ-NSHDSACASA-N -1 3 384.404 -1.140 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@H](NC(=O)Cn3ncnn3)[C@@H](O)C2)n1 ZINC001581074569 1075752312 /nfs/dbraw/zinc/75/23/12/1075752312.db2.gz YSJDKBMOGNKKDT-NEPJUHHUSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@H](NC(=O)Cn3ncnn3)[C@@H](O)C2)n1 ZINC001581074569 1075752305 /nfs/dbraw/zinc/75/23/05/1075752305.db2.gz YSJDKBMOGNKKDT-NEPJUHHUSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@H](NC(=O)Cn3ncnn3)[C@H](O)C2)n1 ZINC001581074570 1075752322 /nfs/dbraw/zinc/75/23/22/1075752322.db2.gz YSJDKBMOGNKKDT-NWDGAFQWSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@H](NC(=O)Cn3ncnn3)[C@H](O)C2)n1 ZINC001581074570 1075752319 /nfs/dbraw/zinc/75/23/19/1075752319.db2.gz YSJDKBMOGNKKDT-NWDGAFQWSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@H](NC(=O)Cn3ncnn3)[C@@H](O)C2)n1 ZINC001581074571 1075752429 /nfs/dbraw/zinc/75/24/29/1075752429.db2.gz YSJDKBMOGNKKDT-RYUDHWBXSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@H](NC(=O)Cn3ncnn3)[C@@H](O)C2)n1 ZINC001581074571 1075752428 /nfs/dbraw/zinc/75/24/28/1075752428.db2.gz YSJDKBMOGNKKDT-RYUDHWBXSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@H](NC(=O)Cn3ncnn3)[C@H](O)C2)n1 ZINC001581074572 1075752442 /nfs/dbraw/zinc/75/24/42/1075752442.db2.gz YSJDKBMOGNKKDT-VXGBXAGGSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@H](NC(=O)Cn3ncnn3)[C@H](O)C2)n1 ZINC001581074572 1075752441 /nfs/dbraw/zinc/75/24/41/1075752441.db2.gz YSJDKBMOGNKKDT-VXGBXAGGSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@](O)(CNC(=O)[C@H]3COC(=O)N3)C2)n1 ZINC001581074654 1075752414 /nfs/dbraw/zinc/75/24/14/1075752414.db2.gz SZJDRIDETCCEBP-BDJLRTHQSA-N -1 3 388.388 -1.264 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@](O)(CNC(=O)[C@H]3COC(=O)N3)C2)n1 ZINC001581074654 1075752412 /nfs/dbraw/zinc/75/24/12/1075752412.db2.gz SZJDRIDETCCEBP-BDJLRTHQSA-N -1 3 388.388 -1.264 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@](O)(CNC(=O)[C@H]3COC(=O)N3)C2)n1 ZINC001581074655 1075752727 /nfs/dbraw/zinc/75/27/27/1075752727.db2.gz SZJDRIDETCCEBP-BZNIZROVSA-N -1 3 388.388 -1.264 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@](O)(CNC(=O)[C@H]3COC(=O)N3)C2)n1 ZINC001581074655 1075752724 /nfs/dbraw/zinc/75/27/24/1075752724.db2.gz SZJDRIDETCCEBP-BZNIZROVSA-N -1 3 388.388 -1.264 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@](O)(CNC(=O)[C@@H]3COC(=O)N3)C2)n1 ZINC001581074656 1075752576 /nfs/dbraw/zinc/75/25/76/1075752576.db2.gz SZJDRIDETCCEBP-MEDUHNTESA-N -1 3 388.388 -1.264 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@](O)(CNC(=O)[C@@H]3COC(=O)N3)C2)n1 ZINC001581074656 1075752572 /nfs/dbraw/zinc/75/25/72/1075752572.db2.gz SZJDRIDETCCEBP-MEDUHNTESA-N -1 3 388.388 -1.264 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@](O)(CNC(=O)[C@@H]3COC(=O)N3)C2)n1 ZINC001581074657 1075752648 /nfs/dbraw/zinc/75/26/48/1075752648.db2.gz SZJDRIDETCCEBP-ZBEGNZNMSA-N -1 3 388.388 -1.264 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@](O)(CNC(=O)[C@@H]3COC(=O)N3)C2)n1 ZINC001581074657 1075752644 /nfs/dbraw/zinc/75/26/44/1075752644.db2.gz SZJDRIDETCCEBP-ZBEGNZNMSA-N -1 3 388.388 -1.264 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@H](NC(=O)c3nnn(C)n3)[C@H](O)C2)n1 ZINC001581074756 1075752717 /nfs/dbraw/zinc/75/27/17/1075752717.db2.gz UIBWMVVVNONOBI-GHMZBOCLSA-N -1 3 385.392 -1.537 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@H](NC(=O)c3nnn(C)n3)[C@H](O)C2)n1 ZINC001581074756 1075752713 /nfs/dbraw/zinc/75/27/13/1075752713.db2.gz UIBWMVVVNONOBI-GHMZBOCLSA-N -1 3 385.392 -1.537 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@H](NC(=O)c3nnn(C)n3)[C@@H](O)C2)n1 ZINC001581074757 1075752762 /nfs/dbraw/zinc/75/27/62/1075752762.db2.gz UIBWMVVVNONOBI-MNOVXSKESA-N -1 3 385.392 -1.537 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@H](NC(=O)c3nnn(C)n3)[C@@H](O)C2)n1 ZINC001581074757 1075752760 /nfs/dbraw/zinc/75/27/60/1075752760.db2.gz UIBWMVVVNONOBI-MNOVXSKESA-N -1 3 385.392 -1.537 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@H](NC(=O)c3nnn(C)n3)[C@@H](O)C2)n1 ZINC001581074758 1075752771 /nfs/dbraw/zinc/75/27/71/1075752771.db2.gz UIBWMVVVNONOBI-QWRGUYRKSA-N -1 3 385.392 -1.537 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@H](NC(=O)c3nnn(C)n3)[C@@H](O)C2)n1 ZINC001581074758 1075752769 /nfs/dbraw/zinc/75/27/69/1075752769.db2.gz UIBWMVVVNONOBI-QWRGUYRKSA-N -1 3 385.392 -1.537 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@H](NC(=O)c3nnn(C)n3)[C@H](O)C2)n1 ZINC001581074759 1075752745 /nfs/dbraw/zinc/75/27/45/1075752745.db2.gz UIBWMVVVNONOBI-WDEREUQCSA-N -1 3 385.392 -1.537 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@H](NC(=O)c3nnn(C)n3)[C@H](O)C2)n1 ZINC001581074759 1075752742 /nfs/dbraw/zinc/75/27/42/1075752742.db2.gz UIBWMVVVNONOBI-WDEREUQCSA-N -1 3 385.392 -1.537 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@](O)(CNC(=O)[C@H]3C[C@H]3C(N)=O)C2)n1 ZINC001581074848 1075752690 /nfs/dbraw/zinc/75/26/90/1075752690.db2.gz VPWPQNRWUYUBIC-BWACUDIHSA-N -1 3 386.416 -1.251 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@](O)(CNC(=O)[C@H]3C[C@H]3C(N)=O)C2)n1 ZINC001581074848 1075752687 /nfs/dbraw/zinc/75/26/87/1075752687.db2.gz VPWPQNRWUYUBIC-BWACUDIHSA-N -1 3 386.416 -1.251 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@](O)(CNC(=O)[C@H]3C[C@H]3C(N)=O)C2)n1 ZINC001581074850 1075752588 /nfs/dbraw/zinc/75/25/88/1075752588.db2.gz VPWPQNRWUYUBIC-PEBVRCNWSA-N -1 3 386.416 -1.251 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@](O)(CNC(=O)[C@H]3C[C@H]3C(N)=O)C2)n1 ZINC001581074850 1075752584 /nfs/dbraw/zinc/75/25/84/1075752584.db2.gz VPWPQNRWUYUBIC-PEBVRCNWSA-N -1 3 386.416 -1.251 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCN(C(=O)CN3CCNC(=O)C3)CC2)n1 ZINC001581080294 1075752635 /nfs/dbraw/zinc/75/26/35/1075752635.db2.gz VZUISEGNMAMKFE-UHFFFAOYSA-N -1 3 385.432 -1.349 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCN(C(=O)CN3CCNC(=O)C3)CC2)n1 ZINC001581080294 1075752631 /nfs/dbraw/zinc/75/26/31/1075752631.db2.gz VZUISEGNMAMKFE-UHFFFAOYSA-N -1 3 385.432 -1.349 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCO[C@@H](CNC(=O)[C@H]3CNC(=O)N3)C2)n1 ZINC001581080424 1075752779 /nfs/dbraw/zinc/75/27/79/1075752779.db2.gz CNFFSRYVIQRWIE-CMPLNLGQSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCO[C@@H](CNC(=O)[C@H]3CNC(=O)N3)C2)n1 ZINC001581080424 1075752776 /nfs/dbraw/zinc/75/27/76/1075752776.db2.gz CNFFSRYVIQRWIE-CMPLNLGQSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCO[C@@H](CNC(=O)[C@@H]3CNC(=O)N3)C2)n1 ZINC001581080425 1075752658 /nfs/dbraw/zinc/75/26/58/1075752658.db2.gz CNFFSRYVIQRWIE-JQWIXIFHSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCO[C@@H](CNC(=O)[C@@H]3CNC(=O)N3)C2)n1 ZINC001581080425 1075752656 /nfs/dbraw/zinc/75/26/56/1075752656.db2.gz CNFFSRYVIQRWIE-JQWIXIFHSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCO[C@H](CNC(=O)[C@@H]3CNC(=O)N3)C2)n1 ZINC001581080426 1075752704 /nfs/dbraw/zinc/75/27/04/1075752704.db2.gz CNFFSRYVIQRWIE-PWSUYJOCSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCO[C@H](CNC(=O)[C@@H]3CNC(=O)N3)C2)n1 ZINC001581080426 1075752700 /nfs/dbraw/zinc/75/27/00/1075752700.db2.gz CNFFSRYVIQRWIE-PWSUYJOCSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCO[C@H](CNC(=O)[C@H]3CNC(=O)N3)C2)n1 ZINC001581080427 1075752735 /nfs/dbraw/zinc/75/27/35/1075752735.db2.gz CNFFSRYVIQRWIE-ZYHUDNBSSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCO[C@H](CNC(=O)[C@H]3CNC(=O)N3)C2)n1 ZINC001581080427 1075752732 /nfs/dbraw/zinc/75/27/32/1075752732.db2.gz CNFFSRYVIQRWIE-ZYHUDNBSSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCO[C@H](CNC(=O)CCNC(N)=O)C2)n1 ZINC001581080961 1075752783 /nfs/dbraw/zinc/75/27/83/1075752783.db2.gz VCCPGMVFBWQHCL-LLVKDONJSA-N -1 3 389.420 -1.050 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCO[C@H](CNC(=O)CCNC(N)=O)C2)n1 ZINC001581080961 1075752782 /nfs/dbraw/zinc/75/27/82/1075752782.db2.gz VCCPGMVFBWQHCL-LLVKDONJSA-N -1 3 389.420 -1.050 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCO[C@@H](CNC(=O)CCNC(N)=O)C2)n1 ZINC001581080962 1075752672 /nfs/dbraw/zinc/75/26/72/1075752672.db2.gz VCCPGMVFBWQHCL-NSHDSACASA-N -1 3 389.420 -1.050 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCO[C@@H](CNC(=O)CCNC(N)=O)C2)n1 ZINC001581080962 1075752670 /nfs/dbraw/zinc/75/26/70/1075752670.db2.gz VCCPGMVFBWQHCL-NSHDSACASA-N -1 3 389.420 -1.050 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCN(C(=O)[C@@H]3CC(=O)NC(=O)N3)CC2)n1 ZINC001581080976 1075752622 /nfs/dbraw/zinc/75/26/22/1075752622.db2.gz VORQAWNOUXFNHZ-NSHDSACASA-N -1 3 385.388 -1.183 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCN(C(=O)[C@@H]3CC(=O)NC(=O)N3)CC2)n1 ZINC001581080976 1075752615 /nfs/dbraw/zinc/75/26/15/1075752615.db2.gz VORQAWNOUXFNHZ-NSHDSACASA-N -1 3 385.388 -1.183 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCO[C@H](CNC(=O)Cn3ncnn3)C2)n1 ZINC001581080984 1075752755 /nfs/dbraw/zinc/75/27/55/1075752755.db2.gz VVRQPHBFSKKWDP-LLVKDONJSA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCO[C@H](CNC(=O)Cn3ncnn3)C2)n1 ZINC001581080984 1075752752 /nfs/dbraw/zinc/75/27/52/1075752752.db2.gz VVRQPHBFSKKWDP-LLVKDONJSA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCO[C@@H](CNC(=O)Cn3ncnn3)C2)n1 ZINC001581080985 1075753009 /nfs/dbraw/zinc/75/30/09/1075753009.db2.gz VVRQPHBFSKKWDP-NSHDSACASA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCO[C@@H](CNC(=O)Cn3ncnn3)C2)n1 ZINC001581080985 1075753007 /nfs/dbraw/zinc/75/30/07/1075753007.db2.gz VVRQPHBFSKKWDP-NSHDSACASA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCO[C@@H](CNC(=O)[C@H]3COC(=O)N3)C2)n1 ZINC001581080995 1075752942 /nfs/dbraw/zinc/75/29/42/1075752942.db2.gz WAYTZYFFLJSJER-CMPLNLGQSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCO[C@@H](CNC(=O)[C@H]3COC(=O)N3)C2)n1 ZINC001581080995 1075752937 /nfs/dbraw/zinc/75/29/37/1075752937.db2.gz WAYTZYFFLJSJER-CMPLNLGQSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCO[C@@H](CNC(=O)[C@@H]3COC(=O)N3)C2)n1 ZINC001581080997 1075753015 /nfs/dbraw/zinc/75/30/15/1075753015.db2.gz WAYTZYFFLJSJER-JQWIXIFHSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCO[C@@H](CNC(=O)[C@@H]3COC(=O)N3)C2)n1 ZINC001581080997 1075753013 /nfs/dbraw/zinc/75/30/13/1075753013.db2.gz WAYTZYFFLJSJER-JQWIXIFHSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCO[C@H](CNC(=O)[C@@H]3COC(=O)N3)C2)n1 ZINC001581080998 1075753045 /nfs/dbraw/zinc/75/30/45/1075753045.db2.gz WAYTZYFFLJSJER-PWSUYJOCSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCO[C@H](CNC(=O)[C@@H]3COC(=O)N3)C2)n1 ZINC001581080998 1075753044 /nfs/dbraw/zinc/75/30/44/1075753044.db2.gz WAYTZYFFLJSJER-PWSUYJOCSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCO[C@H](CNC(=O)[C@H]3COC(=O)N3)C2)n1 ZINC001581080999 1075752988 /nfs/dbraw/zinc/75/29/88/1075752988.db2.gz WAYTZYFFLJSJER-ZYHUDNBSSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCO[C@H](CNC(=O)[C@H]3COC(=O)N3)C2)n1 ZINC001581080999 1075752984 /nfs/dbraw/zinc/75/29/84/1075752984.db2.gz WAYTZYFFLJSJER-ZYHUDNBSSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCO[C@@H](CNC(=O)c3nnn(C)n3)C2)n1 ZINC001581081063 1075753023 /nfs/dbraw/zinc/75/30/23/1075753023.db2.gz BYTXWUOIMCZIFP-JTQLQIEISA-N -1 3 385.392 -1.271 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCO[C@@H](CNC(=O)c3nnn(C)n3)C2)n1 ZINC001581081063 1075753022 /nfs/dbraw/zinc/75/30/22/1075753022.db2.gz BYTXWUOIMCZIFP-JTQLQIEISA-N -1 3 385.392 -1.271 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCO[C@H](CNC(=O)c3nnn(C)n3)C2)n1 ZINC001581081065 1075752997 /nfs/dbraw/zinc/75/29/97/1075752997.db2.gz BYTXWUOIMCZIFP-SNVBAGLBSA-N -1 3 385.392 -1.271 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCO[C@H](CNC(=O)c3nnn(C)n3)C2)n1 ZINC001581081065 1075752994 /nfs/dbraw/zinc/75/29/94/1075752994.db2.gz BYTXWUOIMCZIFP-SNVBAGLBSA-N -1 3 385.392 -1.271 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@H](NC(=O)CN3C(=O)CNC3=O)C2)n1 ZINC001581081104 1075752978 /nfs/dbraw/zinc/75/29/78/1075752978.db2.gz FBRUOIKPMCWUGS-SNVBAGLBSA-N -1 3 385.388 -1.183 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@H](NC(=O)CN3C(=O)CNC3=O)C2)n1 ZINC001581081104 1075752974 /nfs/dbraw/zinc/75/29/74/1075752974.db2.gz FBRUOIKPMCWUGS-SNVBAGLBSA-N -1 3 385.388 -1.183 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCOC[C@@H]2CNC(=O)c2nnn(C)n2)n1 ZINC001581081129 1075753027 /nfs/dbraw/zinc/75/30/27/1075753027.db2.gz GQLZLXZVSZATDK-JTQLQIEISA-N -1 3 385.392 -1.271 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCOC[C@@H]2CNC(=O)c2nnn(C)n2)n1 ZINC001581081129 1075753025 /nfs/dbraw/zinc/75/30/25/1075753025.db2.gz GQLZLXZVSZATDK-JTQLQIEISA-N -1 3 385.392 -1.271 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCOC[C@H]2CNC(=O)c2nnn(C)n2)n1 ZINC001581081130 1075752930 /nfs/dbraw/zinc/75/29/30/1075752930.db2.gz GQLZLXZVSZATDK-SNVBAGLBSA-N -1 3 385.392 -1.271 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCOC[C@H]2CNC(=O)c2nnn(C)n2)n1 ZINC001581081130 1075752926 /nfs/dbraw/zinc/75/29/26/1075752926.db2.gz GQLZLXZVSZATDK-SNVBAGLBSA-N -1 3 385.392 -1.271 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCO[C@@H](CNC(=O)[C@H](C)NC(N)=O)C2)n1 ZINC001581081143 1075753050 /nfs/dbraw/zinc/75/30/50/1075753050.db2.gz XORGGJDIWZFRAV-QWRGUYRKSA-N -1 3 389.420 -1.052 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCO[C@@H](CNC(=O)[C@H](C)NC(N)=O)C2)n1 ZINC001581081143 1075753049 /nfs/dbraw/zinc/75/30/49/1075753049.db2.gz XORGGJDIWZFRAV-QWRGUYRKSA-N -1 3 389.420 -1.052 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCO[C@H](CNC(=O)[C@H](C)NC(N)=O)C2)n1 ZINC001581081144 1075753034 /nfs/dbraw/zinc/75/30/34/1075753034.db2.gz XORGGJDIWZFRAV-WDEREUQCSA-N -1 3 389.420 -1.052 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCO[C@H](CNC(=O)[C@H](C)NC(N)=O)C2)n1 ZINC001581081144 1075753033 /nfs/dbraw/zinc/75/30/33/1075753033.db2.gz XORGGJDIWZFRAV-WDEREUQCSA-N -1 3 389.420 -1.052 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCN(C(=O)Cn3ncn(C)c3=O)CC2)n1 ZINC001581081179 1075753003 /nfs/dbraw/zinc/75/30/03/1075753003.db2.gz ZAQDMPCQIWXVBX-UHFFFAOYSA-N -1 3 384.404 -1.186 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCN(C(=O)Cn3ncn(C)c3=O)CC2)n1 ZINC001581081179 1075753002 /nfs/dbraw/zinc/75/30/02/1075753002.db2.gz ZAQDMPCQIWXVBX-UHFFFAOYSA-N -1 3 384.404 -1.186 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCOC[C@H]2CNC(=O)Cn2ncnn2)n1 ZINC001581081244 1075753030 /nfs/dbraw/zinc/75/30/30/1075753030.db2.gz IXXIJAFAPFHHNA-LLVKDONJSA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCOC[C@H]2CNC(=O)Cn2ncnn2)n1 ZINC001581081244 1075753029 /nfs/dbraw/zinc/75/30/29/1075753029.db2.gz IXXIJAFAPFHHNA-LLVKDONJSA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCOC[C@@H]2CNC(=O)Cn2ncnn2)n1 ZINC001581081245 1075753038 /nfs/dbraw/zinc/75/30/38/1075753038.db2.gz IXXIJAFAPFHHNA-NSHDSACASA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCOC[C@@H]2CNC(=O)Cn2ncnn2)n1 ZINC001581081245 1075753036 /nfs/dbraw/zinc/75/30/36/1075753036.db2.gz IXXIJAFAPFHHNA-NSHDSACASA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCOC[C@@H]2CNC(=O)[C@H]2COC(=O)N2)n1 ZINC001581081373 1075753018 /nfs/dbraw/zinc/75/30/18/1075753018.db2.gz OONCPXLFRIYFHU-CMPLNLGQSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCOC[C@@H]2CNC(=O)[C@H]2COC(=O)N2)n1 ZINC001581081373 1075753017 /nfs/dbraw/zinc/75/30/17/1075753017.db2.gz OONCPXLFRIYFHU-CMPLNLGQSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCOC[C@@H]2CNC(=O)[C@@H]2COC(=O)N2)n1 ZINC001581081374 1075753042 /nfs/dbraw/zinc/75/30/42/1075753042.db2.gz OONCPXLFRIYFHU-JQWIXIFHSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCOC[C@@H]2CNC(=O)[C@@H]2COC(=O)N2)n1 ZINC001581081374 1075753040 /nfs/dbraw/zinc/75/30/40/1075753040.db2.gz OONCPXLFRIYFHU-JQWIXIFHSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCOC[C@H]2CNC(=O)[C@@H]2COC(=O)N2)n1 ZINC001581081375 1075752956 /nfs/dbraw/zinc/75/29/56/1075752956.db2.gz OONCPXLFRIYFHU-PWSUYJOCSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCOC[C@H]2CNC(=O)[C@@H]2COC(=O)N2)n1 ZINC001581081375 1075752951 /nfs/dbraw/zinc/75/29/51/1075752951.db2.gz OONCPXLFRIYFHU-PWSUYJOCSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCOC[C@H]2CNC(=O)[C@H]2COC(=O)N2)n1 ZINC001581081376 1075752969 /nfs/dbraw/zinc/75/29/69/1075752969.db2.gz OONCPXLFRIYFHU-ZYHUDNBSSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCOC[C@H]2CNC(=O)[C@H]2COC(=O)N2)n1 ZINC001581081376 1075752966 /nfs/dbraw/zinc/75/29/66/1075752966.db2.gz OONCPXLFRIYFHU-ZYHUDNBSSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCOC[C@H]2CNC(=O)Cn2cnnn2)n1 ZINC001581081447 1075753053 /nfs/dbraw/zinc/75/30/53/1075753053.db2.gz SMIRSJNEFJCUPJ-LLVKDONJSA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCOC[C@H]2CNC(=O)Cn2cnnn2)n1 ZINC001581081447 1075753052 /nfs/dbraw/zinc/75/30/52/1075753052.db2.gz SMIRSJNEFJCUPJ-LLVKDONJSA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCOC[C@@H]2CNC(=O)Cn2cnnn2)n1 ZINC001581081448 1075753416 /nfs/dbraw/zinc/75/34/16/1075753416.db2.gz SMIRSJNEFJCUPJ-NSHDSACASA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCOC[C@@H]2CNC(=O)Cn2cnnn2)n1 ZINC001581081448 1075753413 /nfs/dbraw/zinc/75/34/13/1075753413.db2.gz SMIRSJNEFJCUPJ-NSHDSACASA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCOC[C@@H]2CNC(=O)[C@H](C)NC(N)=O)n1 ZINC001581081493 1075753354 /nfs/dbraw/zinc/75/33/54/1075753354.db2.gz VPGPZQDMRDFZPX-QWRGUYRKSA-N -1 3 389.420 -1.052 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCOC[C@@H]2CNC(=O)[C@H](C)NC(N)=O)n1 ZINC001581081493 1075753352 /nfs/dbraw/zinc/75/33/52/1075753352.db2.gz VPGPZQDMRDFZPX-QWRGUYRKSA-N -1 3 389.420 -1.052 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCOC[C@H]2CNC(=O)[C@H](C)NC(N)=O)n1 ZINC001581081494 1075753428 /nfs/dbraw/zinc/75/34/28/1075753428.db2.gz VPGPZQDMRDFZPX-WDEREUQCSA-N -1 3 389.420 -1.052 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCOC[C@H]2CNC(=O)[C@H](C)NC(N)=O)n1 ZINC001581081494 1075753425 /nfs/dbraw/zinc/75/34/25/1075753425.db2.gz VPGPZQDMRDFZPX-WDEREUQCSA-N -1 3 389.420 -1.052 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)C[C@@H]3CCC(=O)N3)C2)n1 ZINC001581083310 1075753319 /nfs/dbraw/zinc/75/33/19/1075753319.db2.gz BFDMEJZCJHLLFG-CYZMBNFOSA-N -1 3 386.416 -1.095 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)C[C@@H]3CCC(=O)N3)C2)n1 ZINC001581083310 1075753314 /nfs/dbraw/zinc/75/33/14/1075753314.db2.gz BFDMEJZCJHLLFG-CYZMBNFOSA-N -1 3 386.416 -1.095 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)C[C@H]3CCC(=O)N3)C2)n1 ZINC001581083311 1075753238 /nfs/dbraw/zinc/75/32/38/1075753238.db2.gz BFDMEJZCJHLLFG-RAIGVLPGSA-N -1 3 386.416 -1.095 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)C[C@H]3CCC(=O)N3)C2)n1 ZINC001581083311 1075753230 /nfs/dbraw/zinc/75/32/30/1075753230.db2.gz BFDMEJZCJHLLFG-RAIGVLPGSA-N -1 3 386.416 -1.095 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCC(=O)NC3)C2)n1 ZINC001581083351 1075753272 /nfs/dbraw/zinc/75/32/72/1075753272.db2.gz DHNHVLFYHLZXKH-CYZMBNFOSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCC(=O)NC3)C2)n1 ZINC001581083351 1075753269 /nfs/dbraw/zinc/75/32/69/1075753269.db2.gz DHNHVLFYHLZXKH-CYZMBNFOSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCC(=O)NC3)C2)n1 ZINC001581083352 1075753331 /nfs/dbraw/zinc/75/33/31/1075753331.db2.gz DHNHVLFYHLZXKH-RAIGVLPGSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCC(=O)NC3)C2)n1 ZINC001581083352 1075753328 /nfs/dbraw/zinc/75/33/28/1075753328.db2.gz DHNHVLFYHLZXKH-RAIGVLPGSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)CN3CCOCC3)C2)n1 ZINC001581083356 1075753306 /nfs/dbraw/zinc/75/33/06/1075753306.db2.gz DJMYRXOTANBYTL-ZIAGYGMSSA-N -1 3 388.432 -1.432 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)CN3CCOCC3)C2)n1 ZINC001581083356 1075753300 /nfs/dbraw/zinc/75/33/00/1075753300.db2.gz DJMYRXOTANBYTL-ZIAGYGMSSA-N -1 3 388.432 -1.432 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CC(=O)N(C)C3)C2)n1 ZINC001581083394 1075753255 /nfs/dbraw/zinc/75/32/55/1075753255.db2.gz FSQRJJZTWOHZAB-CYZMBNFOSA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CC(=O)N(C)C3)C2)n1 ZINC001581083394 1075753250 /nfs/dbraw/zinc/75/32/50/1075753250.db2.gz FSQRJJZTWOHZAB-CYZMBNFOSA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CC(=O)N(C)C3)C2)n1 ZINC001581083395 1075753451 /nfs/dbraw/zinc/75/34/51/1075753451.db2.gz FSQRJJZTWOHZAB-RAIGVLPGSA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CC(=O)N(C)C3)C2)n1 ZINC001581083395 1075753447 /nfs/dbraw/zinc/75/34/47/1075753447.db2.gz FSQRJJZTWOHZAB-RAIGVLPGSA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)[C@]3(C)CCC(=O)N3)C2)n1 ZINC001581083434 1075753376 /nfs/dbraw/zinc/75/33/76/1075753376.db2.gz HULUBKBXTSRXBC-QFSBIZTOSA-N -1 3 386.416 -1.095 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)[C@]3(C)CCC(=O)N3)C2)n1 ZINC001581083434 1075753373 /nfs/dbraw/zinc/75/33/73/1075753373.db2.gz HULUBKBXTSRXBC-QFSBIZTOSA-N -1 3 386.416 -1.095 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)CN3CCCC3=O)C2)n1 ZINC001581083441 1075753343 /nfs/dbraw/zinc/75/33/43/1075753343.db2.gz HYYDFYVZXXRZDW-CHWSQXEVSA-N -1 3 386.416 -1.142 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)CN3CCCC3=O)C2)n1 ZINC001581083441 1075753341 /nfs/dbraw/zinc/75/33/41/1075753341.db2.gz HYYDFYVZXXRZDW-CHWSQXEVSA-N -1 3 386.416 -1.142 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(=O)n3C)C2)n1 ZINC001581083448 1075753365 /nfs/dbraw/zinc/75/33/65/1075753365.db2.gz IICXMLUDGMIBQM-ZYHUDNBSSA-N -1 3 385.388 -1.011 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(=O)n3C)C2)n1 ZINC001581083448 1075753362 /nfs/dbraw/zinc/75/33/62/1075753362.db2.gz IICXMLUDGMIBQM-ZYHUDNBSSA-N -1 3 385.388 -1.011 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(=O)cn3)C2)n1 ZINC001581083466 1075753217 /nfs/dbraw/zinc/75/32/17/1075753217.db2.gz JPKMJRORWAJDJW-VXGBXAGGSA-N -1 3 383.372 -1.367 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(=O)cn3)C2)n1 ZINC001581083466 1075753215 /nfs/dbraw/zinc/75/32/15/1075753215.db2.gz JPKMJRORWAJDJW-VXGBXAGGSA-N -1 3 383.372 -1.367 20 0 GAADHM Cc1c(C(=O)N[C@@H]2CN(c3nc(C)ccc3-c3nn[n-]n3)C[C@H]2O)nnn1C ZINC001581083506 1075753439 /nfs/dbraw/zinc/75/34/39/1075753439.db2.gz LRJAICDWNFAALO-VXGBXAGGSA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1c(C(=O)N[C@@H]2CN(c3nc(C)ccc3-c3nnn[n-]3)C[C@H]2O)nnn1C ZINC001581083506 1075753434 /nfs/dbraw/zinc/75/34/34/1075753434.db2.gz LRJAICDWNFAALO-VXGBXAGGSA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)CCn3cncn3)C2)n1 ZINC001581083537 1075753292 /nfs/dbraw/zinc/75/32/92/1075753292.db2.gz NFJZJCYCZOTUDD-CHWSQXEVSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)CCn3cncn3)C2)n1 ZINC001581083537 1075753290 /nfs/dbraw/zinc/75/32/90/1075753290.db2.gz NFJZJCYCZOTUDD-CHWSQXEVSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCNC(=O)C3)C2)n1 ZINC001581083626 1075753386 /nfs/dbraw/zinc/75/33/86/1075753386.db2.gz SMCMEDUIXXASSC-CYZMBNFOSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCNC(=O)C3)C2)n1 ZINC001581083626 1075753382 /nfs/dbraw/zinc/75/33/82/1075753382.db2.gz SMCMEDUIXXASSC-CYZMBNFOSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCNC(=O)C3)C2)n1 ZINC001581083627 1075753282 /nfs/dbraw/zinc/75/32/82/1075753282.db2.gz SMCMEDUIXXASSC-RAIGVLPGSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCNC(=O)C3)C2)n1 ZINC001581083627 1075753280 /nfs/dbraw/zinc/75/32/80/1075753280.db2.gz SMCMEDUIXXASSC-RAIGVLPGSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCC(=O)N3C)C2)n1 ZINC001581083628 1075753406 /nfs/dbraw/zinc/75/34/06/1075753406.db2.gz SPBQUMLYUUWKNR-JHJVBQTASA-N -1 3 386.416 -1.143 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCC(=O)N3C)C2)n1 ZINC001581083628 1075753402 /nfs/dbraw/zinc/75/34/02/1075753402.db2.gz SPBQUMLYUUWKNR-JHJVBQTASA-N -1 3 386.416 -1.143 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)CCn3cnnn3)C2)n1 ZINC001581083638 1075753763 /nfs/dbraw/zinc/75/37/63/1075753763.db2.gz TWZNHWWAGGAEDC-VXGBXAGGSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)CCn3cnnn3)C2)n1 ZINC001581083638 1075753759 /nfs/dbraw/zinc/75/37/59/1075753759.db2.gz TWZNHWWAGGAEDC-VXGBXAGGSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CN(C)CCO3)C2)n1 ZINC001581083640 1075753606 /nfs/dbraw/zinc/75/36/06/1075753606.db2.gz TXOVJGALSDEWHP-MCIONIFRSA-N -1 3 388.432 -1.434 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CN(C)CCO3)C2)n1 ZINC001581083640 1075753604 /nfs/dbraw/zinc/75/36/04/1075753604.db2.gz TXOVJGALSDEWHP-MCIONIFRSA-N -1 3 388.432 -1.434 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CN(C)CCO3)C2)n1 ZINC001581083641 1075753715 /nfs/dbraw/zinc/75/37/15/1075753715.db2.gz TXOVJGALSDEWHP-MGPQQGTHSA-N -1 3 388.432 -1.434 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CN(C)CCO3)C2)n1 ZINC001581083641 1075753713 /nfs/dbraw/zinc/75/37/13/1075753713.db2.gz TXOVJGALSDEWHP-MGPQQGTHSA-N -1 3 388.432 -1.434 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)c3cn(C)c(=O)[nH]3)C2)n1 ZINC001581083708 1075753621 /nfs/dbraw/zinc/75/36/21/1075753621.db2.gz WYIALZCLIKKXIO-ZYHUDNBSSA-N -1 3 385.388 -1.011 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCCC(=O)N3)C2)n1 ZINC001581083753 1075753627 /nfs/dbraw/zinc/75/36/27/1075753627.db2.gz YXTHNZUEPZDCKC-JHJVBQTASA-N -1 3 386.416 -1.095 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCCC(=O)N3)C2)n1 ZINC001581083753 1075753624 /nfs/dbraw/zinc/75/36/24/1075753624.db2.gz YXTHNZUEPZDCKC-JHJVBQTASA-N -1 3 386.416 -1.095 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)C[C@H]3CCC(=O)N3)[C@@H](O)C2)n1 ZINC001581083913 1075753685 /nfs/dbraw/zinc/75/36/85/1075753685.db2.gz BFDMEJZCJHLLFG-RTXFEEFZSA-N -1 3 386.416 -1.095 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)C[C@H]3CCC(=O)N3)[C@@H](O)C2)n1 ZINC001581083913 1075753681 /nfs/dbraw/zinc/75/36/81/1075753681.db2.gz BFDMEJZCJHLLFG-RTXFEEFZSA-N -1 3 386.416 -1.095 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)C[C@@H]3CCC(=O)N3)[C@@H](O)C2)n1 ZINC001581083914 1075753660 /nfs/dbraw/zinc/75/36/60/1075753660.db2.gz BFDMEJZCJHLLFG-UHTWSYAYSA-N -1 3 386.416 -1.095 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)C[C@@H]3CCC(=O)N3)[C@@H](O)C2)n1 ZINC001581083914 1075753657 /nfs/dbraw/zinc/75/36/57/1075753657.db2.gz BFDMEJZCJHLLFG-UHTWSYAYSA-N -1 3 386.416 -1.095 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@@H]3CCC(=O)NC3)[C@@H](O)C2)n1 ZINC001581083951 1075753771 /nfs/dbraw/zinc/75/37/71/1075753771.db2.gz DHNHVLFYHLZXKH-RTXFEEFZSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@@H]3CCC(=O)NC3)[C@@H](O)C2)n1 ZINC001581083951 1075753770 /nfs/dbraw/zinc/75/37/70/1075753770.db2.gz DHNHVLFYHLZXKH-RTXFEEFZSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@H]3CCC(=O)NC3)[C@@H](O)C2)n1 ZINC001581083952 1075753593 /nfs/dbraw/zinc/75/35/93/1075753593.db2.gz DHNHVLFYHLZXKH-UHTWSYAYSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@H]3CCC(=O)NC3)[C@@H](O)C2)n1 ZINC001581083952 1075753590 /nfs/dbraw/zinc/75/35/90/1075753590.db2.gz DHNHVLFYHLZXKH-UHTWSYAYSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)CN3CCOCC3)[C@@H](O)C2)n1 ZINC001581083953 1075753748 /nfs/dbraw/zinc/75/37/48/1075753748.db2.gz DJMYRXOTANBYTL-KGLIPLIRSA-N -1 3 388.432 -1.432 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)CN3CCOCC3)[C@@H](O)C2)n1 ZINC001581083953 1075753744 /nfs/dbraw/zinc/75/37/44/1075753744.db2.gz DJMYRXOTANBYTL-KGLIPLIRSA-N -1 3 388.432 -1.432 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@@H]3CC(=O)N(C)C3)[C@@H](O)C2)n1 ZINC001581084051 1075753674 /nfs/dbraw/zinc/75/36/74/1075753674.db2.gz FSQRJJZTWOHZAB-RTXFEEFZSA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@@H]3CC(=O)N(C)C3)[C@@H](O)C2)n1 ZINC001581084051 1075753669 /nfs/dbraw/zinc/75/36/69/1075753669.db2.gz FSQRJJZTWOHZAB-RTXFEEFZSA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@H]3CC(=O)N(C)C3)[C@@H](O)C2)n1 ZINC001581084053 1075753737 /nfs/dbraw/zinc/75/37/37/1075753737.db2.gz FSQRJJZTWOHZAB-UHTWSYAYSA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@H]3CC(=O)N(C)C3)[C@@H](O)C2)n1 ZINC001581084053 1075753734 /nfs/dbraw/zinc/75/37/34/1075753734.db2.gz FSQRJJZTWOHZAB-UHTWSYAYSA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@]3(C)CCC(=O)N3)[C@@H](O)C2)n1 ZINC001581084140 1075753695 /nfs/dbraw/zinc/75/36/95/1075753695.db2.gz HULUBKBXTSRXBC-PEBVRCNWSA-N -1 3 386.416 -1.095 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@]3(C)CCC(=O)N3)[C@@H](O)C2)n1 ZINC001581084140 1075753692 /nfs/dbraw/zinc/75/36/92/1075753692.db2.gz HULUBKBXTSRXBC-PEBVRCNWSA-N -1 3 386.416 -1.095 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)CN3CCCC3=O)[C@@H](O)C2)n1 ZINC001581084152 1075753638 /nfs/dbraw/zinc/75/36/38/1075753638.db2.gz HYYDFYVZXXRZDW-OLZOCXBDSA-N -1 3 386.416 -1.142 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)CN3CCCC3=O)[C@@H](O)C2)n1 ZINC001581084152 1075753634 /nfs/dbraw/zinc/75/36/34/1075753634.db2.gz HYYDFYVZXXRZDW-OLZOCXBDSA-N -1 3 386.416 -1.142 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@H]3CN(C)C(=O)N3)[C@@H](O)C2)n1 ZINC001581084194 1075753791 /nfs/dbraw/zinc/75/37/91/1075753791.db2.gz IXOFYTYRIRPCCE-UTUOFQBUSA-N -1 3 387.404 -1.741 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@H]3CN(C)C(=O)N3)[C@@H](O)C2)n1 ZINC001581084194 1075753788 /nfs/dbraw/zinc/75/37/88/1075753788.db2.gz IXOFYTYRIRPCCE-UTUOFQBUSA-N -1 3 387.404 -1.741 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@@H]3CN(C)C(=O)N3)[C@@H](O)C2)n1 ZINC001581084196 1075753780 /nfs/dbraw/zinc/75/37/80/1075753780.db2.gz IXOFYTYRIRPCCE-WOPDTQHZSA-N -1 3 387.404 -1.741 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@@H]3CN(C)C(=O)N3)[C@@H](O)C2)n1 ZINC001581084196 1075753778 /nfs/dbraw/zinc/75/37/78/1075753778.db2.gz IXOFYTYRIRPCCE-WOPDTQHZSA-N -1 3 387.404 -1.741 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)c3c[nH]c(=O)cn3)[C@@H](O)C2)n1 ZINC001581084247 1075753724 /nfs/dbraw/zinc/75/37/24/1075753724.db2.gz JPKMJRORWAJDJW-NEPJUHHUSA-N -1 3 383.372 -1.367 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)c3c[nH]c(=O)cn3)[C@@H](O)C2)n1 ZINC001581084247 1075753723 /nfs/dbraw/zinc/75/37/23/1075753723.db2.gz JPKMJRORWAJDJW-NEPJUHHUSA-N -1 3 383.372 -1.367 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)C[C@H]3CCNC3=O)[C@@H](O)C2)n1 ZINC001581084262 1075753651 /nfs/dbraw/zinc/75/36/51/1075753651.db2.gz KLDDAYWGWBOTDF-RTXFEEFZSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)C[C@H]3CCNC3=O)[C@@H](O)C2)n1 ZINC001581084262 1075753647 /nfs/dbraw/zinc/75/36/47/1075753647.db2.gz KLDDAYWGWBOTDF-RTXFEEFZSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)C[C@@H]3CCNC3=O)[C@@H](O)C2)n1 ZINC001581084263 1075753730 /nfs/dbraw/zinc/75/37/30/1075753730.db2.gz KLDDAYWGWBOTDF-UHTWSYAYSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)C[C@@H]3CCNC3=O)[C@@H](O)C2)n1 ZINC001581084263 1075753728 /nfs/dbraw/zinc/75/37/28/1075753728.db2.gz KLDDAYWGWBOTDF-UHTWSYAYSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1c(C(=O)N[C@@H]2CN(c3nc(C)ccc3-c3nn[n-]n3)C[C@@H]2O)nnn1C ZINC001581084283 1075754201 /nfs/dbraw/zinc/75/42/01/1075754201.db2.gz LRJAICDWNFAALO-NEPJUHHUSA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1c(C(=O)N[C@@H]2CN(c3nc(C)ccc3-c3nnn[n-]3)C[C@@H]2O)nnn1C ZINC001581084283 1075754197 /nfs/dbraw/zinc/75/41/97/1075754197.db2.gz LRJAICDWNFAALO-NEPJUHHUSA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)CNC(=O)C3CC3)[C@@H](O)C2)n1 ZINC001581084293 1075754157 /nfs/dbraw/zinc/75/41/57/1075754157.db2.gz MGDHSZZQUPETQL-OLZOCXBDSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)CNC(=O)C3CC3)[C@@H](O)C2)n1 ZINC001581084293 1075754153 /nfs/dbraw/zinc/75/41/53/1075754153.db2.gz MGDHSZZQUPETQL-OLZOCXBDSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)CCn3cncn3)[C@@H](O)C2)n1 ZINC001581084349 1075754048 /nfs/dbraw/zinc/75/40/48/1075754048.db2.gz NFJZJCYCZOTUDD-OLZOCXBDSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)CCn3cncn3)[C@@H](O)C2)n1 ZINC001581084349 1075754044 /nfs/dbraw/zinc/75/40/44/1075754044.db2.gz NFJZJCYCZOTUDD-OLZOCXBDSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)CS(C)(=O)=O)[C@@H](O)C2)n1 ZINC001581084443 1075754004 /nfs/dbraw/zinc/75/40/04/1075754004.db2.gz ORUVIJWBYLTJFU-MNOVXSKESA-N -1 3 381.418 -1.720 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)CS(C)(=O)=O)[C@@H](O)C2)n1 ZINC001581084443 1075754002 /nfs/dbraw/zinc/75/40/02/1075754002.db2.gz ORUVIJWBYLTJFU-MNOVXSKESA-N -1 3 381.418 -1.720 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)c3cnn(C)c3N)[C@@H](O)C2)n1 ZINC001581084513 1075754178 /nfs/dbraw/zinc/75/41/78/1075754178.db2.gz SGLPKYDZJDDTIJ-NEPJUHHUSA-N -1 3 384.404 -1.135 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)c3cnn(C)c3N)[C@@H](O)C2)n1 ZINC001581084513 1075754174 /nfs/dbraw/zinc/75/41/74/1075754174.db2.gz SGLPKYDZJDDTIJ-NEPJUHHUSA-N -1 3 384.404 -1.135 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@@H]3CCC(=O)N3C)[C@@H](O)C2)n1 ZINC001581084523 1075754007 /nfs/dbraw/zinc/75/40/07/1075754007.db2.gz SPBQUMLYUUWKNR-AGIUHOORSA-N -1 3 386.416 -1.143 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@@H]3CCC(=O)N3C)[C@@H](O)C2)n1 ZINC001581084523 1075754006 /nfs/dbraw/zinc/75/40/06/1075754006.db2.gz SPBQUMLYUUWKNR-AGIUHOORSA-N -1 3 386.416 -1.143 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@H]3CCC(=O)N3C)[C@@H](O)C2)n1 ZINC001581084524 1075754134 /nfs/dbraw/zinc/75/41/34/1075754134.db2.gz SPBQUMLYUUWKNR-UPJWGTAASA-N -1 3 386.416 -1.143 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@H]3CCC(=O)N3C)[C@@H](O)C2)n1 ZINC001581084524 1075754130 /nfs/dbraw/zinc/75/41/30/1075754130.db2.gz SPBQUMLYUUWKNR-UPJWGTAASA-N -1 3 386.416 -1.143 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)CCn3cnnn3)[C@@H](O)C2)n1 ZINC001581084530 1075754122 /nfs/dbraw/zinc/75/41/22/1075754122.db2.gz TWZNHWWAGGAEDC-NEPJUHHUSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)CCn3cnnn3)[C@@H](O)C2)n1 ZINC001581084530 1075754120 /nfs/dbraw/zinc/75/41/20/1075754120.db2.gz TWZNHWWAGGAEDC-NEPJUHHUSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)CCn3ccnn3)[C@@H](O)C2)n1 ZINC001581084667 1075754034 /nfs/dbraw/zinc/75/40/34/1075754034.db2.gz VYTJXRYGKFUZKO-OLZOCXBDSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)CCn3ccnn3)[C@@H](O)C2)n1 ZINC001581084667 1075754032 /nfs/dbraw/zinc/75/40/32/1075754032.db2.gz VYTJXRYGKFUZKO-OLZOCXBDSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)c3cn(C)c(=O)[nH]3)[C@@H](O)C2)n1 ZINC001581084692 1075754112 /nfs/dbraw/zinc/75/41/12/1075754112.db2.gz WYIALZCLIKKXIO-PWSUYJOCSA-N -1 3 385.388 -1.011 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@H]3CCCC(=O)N3)[C@@H](O)C2)n1 ZINC001581084743 1075754218 /nfs/dbraw/zinc/75/42/18/1075754218.db2.gz YXTHNZUEPZDCKC-UPJWGTAASA-N -1 3 386.416 -1.095 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@H]3CCCC(=O)N3)[C@@H](O)C2)n1 ZINC001581084743 1075754216 /nfs/dbraw/zinc/75/42/16/1075754216.db2.gz YXTHNZUEPZDCKC-UPJWGTAASA-N -1 3 386.416 -1.095 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H](CO)CNC(=O)CN2CCOCC2)n1 ZINC001581095659 1075754100 /nfs/dbraw/zinc/75/41/00/1075754100.db2.gz BCFYKSJWYKKWSG-GFCCVEGCSA-N -1 3 376.421 -1.209 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H](CO)CNC(=O)CN2CCOCC2)n1 ZINC001581095659 1075754096 /nfs/dbraw/zinc/75/40/96/1075754096.db2.gz BCFYKSJWYKKWSG-GFCCVEGCSA-N -1 3 376.421 -1.209 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H](CO)CNC(=O)CN2CCOCC2)n1 ZINC001581095660 1075754076 /nfs/dbraw/zinc/75/40/76/1075754076.db2.gz BCFYKSJWYKKWSG-LBPRGKRZSA-N -1 3 376.421 -1.209 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H](CO)CNC(=O)CN2CCOCC2)n1 ZINC001581095660 1075754073 /nfs/dbraw/zinc/75/40/73/1075754073.db2.gz BCFYKSJWYKKWSG-LBPRGKRZSA-N -1 3 376.421 -1.209 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H](CO)CNC(=O)C2CS(=O)(=O)C2)n1 ZINC001581095673 1075754167 /nfs/dbraw/zinc/75/41/67/1075754167.db2.gz BMMDQQROFIPSAY-JTQLQIEISA-N -1 3 381.418 -1.496 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H](CO)CNC(=O)C2CS(=O)(=O)C2)n1 ZINC001581095673 1075754164 /nfs/dbraw/zinc/75/41/64/1075754164.db2.gz BMMDQQROFIPSAY-JTQLQIEISA-N -1 3 381.418 -1.496 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H](CO)CNC(=O)C2CS(=O)(=O)C2)n1 ZINC001581095674 1075754022 /nfs/dbraw/zinc/75/40/22/1075754022.db2.gz BMMDQQROFIPSAY-SNVBAGLBSA-N -1 3 381.418 -1.496 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H](CO)CNC(=O)C2CS(=O)(=O)C2)n1 ZINC001581095674 1075754017 /nfs/dbraw/zinc/75/40/17/1075754017.db2.gz BMMDQQROFIPSAY-SNVBAGLBSA-N -1 3 381.418 -1.496 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H](CO)CNC(=O)[C@H]2CN(C)C(=O)N2)n1 ZINC001581095939 1075754060 /nfs/dbraw/zinc/75/40/60/1075754060.db2.gz HEUUYNDPAKGOOF-GXSJLCMTSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H](CO)CNC(=O)[C@H]2CN(C)C(=O)N2)n1 ZINC001581095939 1075754057 /nfs/dbraw/zinc/75/40/57/1075754057.db2.gz HEUUYNDPAKGOOF-GXSJLCMTSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H](CO)CNC(=O)[C@@H]2CN(C)C(=O)N2)n1 ZINC001581095940 1075754188 /nfs/dbraw/zinc/75/41/88/1075754188.db2.gz HEUUYNDPAKGOOF-KOLCDFICSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H](CO)CNC(=O)[C@@H]2CN(C)C(=O)N2)n1 ZINC001581095940 1075754184 /nfs/dbraw/zinc/75/41/84/1075754184.db2.gz HEUUYNDPAKGOOF-KOLCDFICSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H](CO)CNC(=O)[C@H]2CN(C)C(=O)N2)n1 ZINC001581095941 1075754209 /nfs/dbraw/zinc/75/42/09/1075754209.db2.gz HEUUYNDPAKGOOF-MWLCHTKSSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H](CO)CNC(=O)[C@H]2CN(C)C(=O)N2)n1 ZINC001581095941 1075754206 /nfs/dbraw/zinc/75/42/06/1075754206.db2.gz HEUUYNDPAKGOOF-MWLCHTKSSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H](CO)CNC(=O)[C@@H]2CN(C)C(=O)N2)n1 ZINC001581095942 1075754145 /nfs/dbraw/zinc/75/41/45/1075754145.db2.gz HEUUYNDPAKGOOF-ONGXEEELSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H](CO)CNC(=O)[C@@H]2CN(C)C(=O)N2)n1 ZINC001581095942 1075754140 /nfs/dbraw/zinc/75/41/40/1075754140.db2.gz HEUUYNDPAKGOOF-ONGXEEELSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H](CO)CNC(=O)CN2CCNC(=O)C2)n1 ZINC001581096181 1075754510 /nfs/dbraw/zinc/75/45/10/1075754510.db2.gz MLLWTADGCHIIAV-LLVKDONJSA-N -1 3 389.420 -2.109 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H](CO)CNC(=O)CN2CCNC(=O)C2)n1 ZINC001581096181 1075754508 /nfs/dbraw/zinc/75/45/08/1075754508.db2.gz MLLWTADGCHIIAV-LLVKDONJSA-N -1 3 389.420 -2.109 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H](CO)CNC(=O)CN2CCNC(=O)C2)n1 ZINC001581096182 1075754545 /nfs/dbraw/zinc/75/45/45/1075754545.db2.gz MLLWTADGCHIIAV-NSHDSACASA-N -1 3 389.420 -2.109 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H](CO)CNC(=O)CN2CCNC(=O)C2)n1 ZINC001581096182 1075754543 /nfs/dbraw/zinc/75/45/43/1075754543.db2.gz MLLWTADGCHIIAV-NSHDSACASA-N -1 3 389.420 -2.109 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H](CO)CNC(=O)CN2CCOCC2=O)n1 ZINC001581096189 1075754492 /nfs/dbraw/zinc/75/44/92/1075754492.db2.gz MROUAYNMYBSPDM-LLVKDONJSA-N -1 3 390.404 -1.682 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H](CO)CNC(=O)CN2CCOCC2=O)n1 ZINC001581096189 1075754489 /nfs/dbraw/zinc/75/44/89/1075754489.db2.gz MROUAYNMYBSPDM-LLVKDONJSA-N -1 3 390.404 -1.682 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H](CO)CNC(=O)CN2CCOCC2=O)n1 ZINC001581096190 1075754551 /nfs/dbraw/zinc/75/45/51/1075754551.db2.gz MROUAYNMYBSPDM-NSHDSACASA-N -1 3 390.404 -1.682 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H](CO)CNC(=O)CN2CCOCC2=O)n1 ZINC001581096190 1075754549 /nfs/dbraw/zinc/75/45/49/1075754549.db2.gz MROUAYNMYBSPDM-NSHDSACASA-N -1 3 390.404 -1.682 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H](CO)CNC(=O)Cn2ncn(C)c2=O)n1 ZINC001581096261 1075754478 /nfs/dbraw/zinc/75/44/78/1075754478.db2.gz OLTNUXUCLZHPTO-JTQLQIEISA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H](CO)CNC(=O)Cn2ncn(C)c2=O)n1 ZINC001581096261 1075754473 /nfs/dbraw/zinc/75/44/73/1075754473.db2.gz OLTNUXUCLZHPTO-JTQLQIEISA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H](CO)CNC(=O)Cn2ncn(C)c2=O)n1 ZINC001581096262 1075754540 /nfs/dbraw/zinc/75/45/40/1075754540.db2.gz OLTNUXUCLZHPTO-SNVBAGLBSA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H](CO)CNC(=O)Cn2ncn(C)c2=O)n1 ZINC001581096262 1075754537 /nfs/dbraw/zinc/75/45/37/1075754537.db2.gz OLTNUXUCLZHPTO-SNVBAGLBSA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H](CO)CNC(=O)[C@@H]2CN(C)CCO2)n1 ZINC001581096419 1075754433 /nfs/dbraw/zinc/75/44/33/1075754433.db2.gz RPJPYJBRCMNZCC-AAEUAGOBSA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H](CO)CNC(=O)[C@@H]2CN(C)CCO2)n1 ZINC001581096419 1075754426 /nfs/dbraw/zinc/75/44/26/1075754426.db2.gz RPJPYJBRCMNZCC-AAEUAGOBSA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H](CO)CNC(=O)[C@H]2CN(C)CCO2)n1 ZINC001581096420 1075754504 /nfs/dbraw/zinc/75/45/04/1075754504.db2.gz RPJPYJBRCMNZCC-DGCLKSJQSA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H](CO)CNC(=O)[C@H]2CN(C)CCO2)n1 ZINC001581096420 1075754502 /nfs/dbraw/zinc/75/45/02/1075754502.db2.gz RPJPYJBRCMNZCC-DGCLKSJQSA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H](CO)CNC(=O)[C@H]2CN(C)CCO2)n1 ZINC001581096421 1075754393 /nfs/dbraw/zinc/75/43/93/1075754393.db2.gz RPJPYJBRCMNZCC-WCQYABFASA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H](CO)CNC(=O)[C@H]2CN(C)CCO2)n1 ZINC001581096421 1075754385 /nfs/dbraw/zinc/75/43/85/1075754385.db2.gz RPJPYJBRCMNZCC-WCQYABFASA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H](CO)CNC(=O)[C@@H]2CN(C)CCO2)n1 ZINC001581096422 1075754527 /nfs/dbraw/zinc/75/45/27/1075754527.db2.gz RPJPYJBRCMNZCC-YPMHNXCESA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H](CO)CNC(=O)[C@@H]2CN(C)CCO2)n1 ZINC001581096422 1075754526 /nfs/dbraw/zinc/75/45/26/1075754526.db2.gz RPJPYJBRCMNZCC-YPMHNXCESA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H](CO)CNC(=O)CCS(C)(=O)=O)n1 ZINC001581096493 1075754566 /nfs/dbraw/zinc/75/45/66/1075754566.db2.gz UEDULTWSIZBBBG-JTQLQIEISA-N -1 3 383.434 -1.106 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H](CO)CNC(=O)CCS(C)(=O)=O)n1 ZINC001581096493 1075754564 /nfs/dbraw/zinc/75/45/64/1075754564.db2.gz UEDULTWSIZBBBG-JTQLQIEISA-N -1 3 383.434 -1.106 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H](CO)CNC(=O)CCS(C)(=O)=O)n1 ZINC001581096494 1075754574 /nfs/dbraw/zinc/75/45/74/1075754574.db2.gz UEDULTWSIZBBBG-SNVBAGLBSA-N -1 3 383.434 -1.106 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H](CO)CNC(=O)CCS(C)(=O)=O)n1 ZINC001581096494 1075754572 /nfs/dbraw/zinc/75/45/72/1075754572.db2.gz UEDULTWSIZBBBG-SNVBAGLBSA-N -1 3 383.434 -1.106 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H](CO)CNC(=O)CN2CCCNC2=O)n1 ZINC001581096495 1075754409 /nfs/dbraw/zinc/75/44/09/1075754409.db2.gz UEOQFEHSWVELPK-LLVKDONJSA-N -1 3 389.420 -1.126 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H](CO)CNC(=O)CN2CCCNC2=O)n1 ZINC001581096495 1075754404 /nfs/dbraw/zinc/75/44/04/1075754404.db2.gz UEOQFEHSWVELPK-LLVKDONJSA-N -1 3 389.420 -1.126 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H](CO)CNC(=O)CN2CCCNC2=O)n1 ZINC001581096496 1075754557 /nfs/dbraw/zinc/75/45/57/1075754557.db2.gz UEOQFEHSWVELPK-NSHDSACASA-N -1 3 389.420 -1.126 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H](CO)CNC(=O)CN2CCCNC2=O)n1 ZINC001581096496 1075754556 /nfs/dbraw/zinc/75/45/56/1075754556.db2.gz UEOQFEHSWVELPK-NSHDSACASA-N -1 3 389.420 -1.126 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H](CO)CNC(=O)[C@@H](C)S(C)(=O)=O)n1 ZINC001581096631 1075754561 /nfs/dbraw/zinc/75/45/61/1075754561.db2.gz WPOYKIAWTRDKJN-NXEZZACHSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H](CO)CNC(=O)[C@@H](C)S(C)(=O)=O)n1 ZINC001581096631 1075754560 /nfs/dbraw/zinc/75/45/60/1075754560.db2.gz WPOYKIAWTRDKJN-NXEZZACHSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H](CO)CNC(=O)[C@H](C)S(C)(=O)=O)n1 ZINC001581096632 1075754532 /nfs/dbraw/zinc/75/45/32/1075754532.db2.gz WPOYKIAWTRDKJN-UWVGGRQHSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H](CO)CNC(=O)[C@H](C)S(C)(=O)=O)n1 ZINC001581096632 1075754531 /nfs/dbraw/zinc/75/45/31/1075754531.db2.gz WPOYKIAWTRDKJN-UWVGGRQHSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H](CO)CNC(=O)[C@H](C)S(C)(=O)=O)n1 ZINC001581096633 1075754448 /nfs/dbraw/zinc/75/44/48/1075754448.db2.gz WPOYKIAWTRDKJN-VHSXEESVSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H](CO)CNC(=O)[C@H](C)S(C)(=O)=O)n1 ZINC001581096633 1075754443 /nfs/dbraw/zinc/75/44/43/1075754443.db2.gz WPOYKIAWTRDKJN-VHSXEESVSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H](CO)CNC(=O)[C@@H](C)S(C)(=O)=O)n1 ZINC001581096634 1075754517 /nfs/dbraw/zinc/75/45/17/1075754517.db2.gz WPOYKIAWTRDKJN-ZJUUUORDSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H](CO)CNC(=O)[C@@H](C)S(C)(=O)=O)n1 ZINC001581096634 1075754514 /nfs/dbraw/zinc/75/45/14/1075754514.db2.gz WPOYKIAWTRDKJN-ZJUUUORDSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H](CO)CNC(=O)c2ccc(=O)n(C)n2)n1 ZINC001581096771 1075754463 /nfs/dbraw/zinc/75/44/63/1075754463.db2.gz ZTAXYWTVJVBHAK-JTQLQIEISA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H](CO)CNC(=O)c2ccc(=O)n(C)n2)n1 ZINC001581096771 1075754458 /nfs/dbraw/zinc/75/44/58/1075754458.db2.gz ZTAXYWTVJVBHAK-JTQLQIEISA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H](CO)CNC(=O)c2ccc(=O)n(C)n2)n1 ZINC001581096772 1075754361 /nfs/dbraw/zinc/75/43/61/1075754361.db2.gz ZTAXYWTVJVBHAK-SNVBAGLBSA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H](CO)CNC(=O)c2ccc(=O)n(C)n2)n1 ZINC001581096772 1075754356 /nfs/dbraw/zinc/75/43/56/1075754356.db2.gz ZTAXYWTVJVBHAK-SNVBAGLBSA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H](CO)CNC(=O)CN2C(=O)CCC2=O)n1 ZINC001581096775 1075754788 /nfs/dbraw/zinc/75/47/88/1075754788.db2.gz ZTQHBHUNEQLQRG-JTQLQIEISA-N -1 3 388.388 -1.392 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H](CO)CNC(=O)CN2C(=O)CCC2=O)n1 ZINC001581096775 1075754781 /nfs/dbraw/zinc/75/47/81/1075754781.db2.gz ZTQHBHUNEQLQRG-JTQLQIEISA-N -1 3 388.388 -1.392 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H](CO)CNC(=O)CN2C(=O)CCC2=O)n1 ZINC001581096776 1075754847 /nfs/dbraw/zinc/75/48/47/1075754847.db2.gz ZTQHBHUNEQLQRG-SNVBAGLBSA-N -1 3 388.388 -1.392 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H](CO)CNC(=O)CN2C(=O)CCC2=O)n1 ZINC001581096776 1075754846 /nfs/dbraw/zinc/75/48/46/1075754846.db2.gz ZTQHBHUNEQLQRG-SNVBAGLBSA-N -1 3 388.388 -1.392 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H](CO)CNC(=O)c2cn(C)c(=O)n2C)n1 ZINC001581097100 1075754853 /nfs/dbraw/zinc/75/48/53/1075754853.db2.gz IFSJXFWNYQBBID-JTQLQIEISA-N -1 3 387.404 -1.190 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H](CO)CNC(=O)c2cn(C)c(=O)n2C)n1 ZINC001581097100 1075754851 /nfs/dbraw/zinc/75/48/51/1075754851.db2.gz IFSJXFWNYQBBID-JTQLQIEISA-N -1 3 387.404 -1.190 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H](CO)CNC(=O)c2cn(C)c(=O)n2C)n1 ZINC001581097103 1075754905 /nfs/dbraw/zinc/75/49/05/1075754905.db2.gz IFSJXFWNYQBBID-SNVBAGLBSA-N -1 3 387.404 -1.190 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H](CO)CNC(=O)c2cn(C)c(=O)n2C)n1 ZINC001581097103 1075754903 /nfs/dbraw/zinc/75/49/03/1075754903.db2.gz IFSJXFWNYQBBID-SNVBAGLBSA-N -1 3 387.404 -1.190 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CN(C)C(=O)[C@H]2CN(C)C(=O)N2)n1 ZINC001581111735 1075754891 /nfs/dbraw/zinc/75/48/91/1075754891.db2.gz DCMLDDJSAKLLKX-CMPLNLGQSA-N -1 3 389.420 -1.175 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CN(C)C(=O)[C@H]2CN(C)C(=O)N2)n1 ZINC001581111735 1075754889 /nfs/dbraw/zinc/75/48/89/1075754889.db2.gz DCMLDDJSAKLLKX-CMPLNLGQSA-N -1 3 389.420 -1.175 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CN(C)C(=O)[C@@H]2CN(C)C(=O)N2)n1 ZINC001581111736 1075754807 /nfs/dbraw/zinc/75/48/07/1075754807.db2.gz DCMLDDJSAKLLKX-JQWIXIFHSA-N -1 3 389.420 -1.175 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CN(C)C(=O)[C@@H]2CN(C)C(=O)N2)n1 ZINC001581111736 1075754802 /nfs/dbraw/zinc/75/48/02/1075754802.db2.gz DCMLDDJSAKLLKX-JQWIXIFHSA-N -1 3 389.420 -1.175 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CN(C)C(=O)[C@@H]2CN(C)C(=O)N2)n1 ZINC001581111737 1075754885 /nfs/dbraw/zinc/75/48/85/1075754885.db2.gz DCMLDDJSAKLLKX-PWSUYJOCSA-N -1 3 389.420 -1.175 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CN(C)C(=O)[C@@H]2CN(C)C(=O)N2)n1 ZINC001581111737 1075754883 /nfs/dbraw/zinc/75/48/83/1075754883.db2.gz DCMLDDJSAKLLKX-PWSUYJOCSA-N -1 3 389.420 -1.175 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CN(C)C(=O)[C@H]2CN(C)C(=O)N2)n1 ZINC001581111738 1075754824 /nfs/dbraw/zinc/75/48/24/1075754824.db2.gz DCMLDDJSAKLLKX-ZYHUDNBSSA-N -1 3 389.420 -1.175 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CN(C)C(=O)[C@H]2CN(C)C(=O)N2)n1 ZINC001581111738 1075754818 /nfs/dbraw/zinc/75/48/18/1075754818.db2.gz DCMLDDJSAKLLKX-ZYHUDNBSSA-N -1 3 389.420 -1.175 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CNC(=O)[C@@H](C)S(C)(=O)=O)n1 ZINC001581112641 1075754768 /nfs/dbraw/zinc/75/47/68/1075754768.db2.gz SGZURBFGUPDONY-NXEZZACHSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CNC(=O)[C@@H](C)S(C)(=O)=O)n1 ZINC001581112641 1075754763 /nfs/dbraw/zinc/75/47/63/1075754763.db2.gz SGZURBFGUPDONY-NXEZZACHSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CNC(=O)[C@H](C)S(C)(=O)=O)n1 ZINC001581112642 1075754870 /nfs/dbraw/zinc/75/48/70/1075754870.db2.gz SGZURBFGUPDONY-UWVGGRQHSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CNC(=O)[C@H](C)S(C)(=O)=O)n1 ZINC001581112642 1075754867 /nfs/dbraw/zinc/75/48/67/1075754867.db2.gz SGZURBFGUPDONY-UWVGGRQHSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CNC(=O)[C@H](C)S(C)(=O)=O)n1 ZINC001581112644 1075754877 /nfs/dbraw/zinc/75/48/77/1075754877.db2.gz SGZURBFGUPDONY-VHSXEESVSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CNC(=O)[C@H](C)S(C)(=O)=O)n1 ZINC001581112644 1075754874 /nfs/dbraw/zinc/75/48/74/1075754874.db2.gz SGZURBFGUPDONY-VHSXEESVSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CNC(=O)[C@@H](C)S(C)(=O)=O)n1 ZINC001581112645 1075754941 /nfs/dbraw/zinc/75/49/41/1075754941.db2.gz SGZURBFGUPDONY-ZJUUUORDSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CNC(=O)[C@@H](C)S(C)(=O)=O)n1 ZINC001581112645 1075754939 /nfs/dbraw/zinc/75/49/39/1075754939.db2.gz SGZURBFGUPDONY-ZJUUUORDSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CN(C)C(=O)CS(C)(=O)=O)n1 ZINC001581113013 1075754863 /nfs/dbraw/zinc/75/48/63/1075754863.db2.gz WBHVGPGSUBANSZ-JTQLQIEISA-N -1 3 383.434 -1.154 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CN(C)C(=O)CS(C)(=O)=O)n1 ZINC001581113013 1075754860 /nfs/dbraw/zinc/75/48/60/1075754860.db2.gz WBHVGPGSUBANSZ-JTQLQIEISA-N -1 3 383.434 -1.154 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CN(C)C(=O)CS(C)(=O)=O)n1 ZINC001581113015 1075754947 /nfs/dbraw/zinc/75/49/47/1075754947.db2.gz WBHVGPGSUBANSZ-SNVBAGLBSA-N -1 3 383.434 -1.154 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CN(C)C(=O)CS(C)(=O)=O)n1 ZINC001581113015 1075754945 /nfs/dbraw/zinc/75/49/45/1075754945.db2.gz WBHVGPGSUBANSZ-SNVBAGLBSA-N -1 3 383.434 -1.154 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CN(C)C(=O)[C@H]2CNC(=O)N2)n1 ZINC001581113071 1075754929 /nfs/dbraw/zinc/75/49/29/1075754929.db2.gz XBXMSIMRZYTHHB-GXSJLCMTSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CN(C)C(=O)[C@H]2CNC(=O)N2)n1 ZINC001581113071 1075754927 /nfs/dbraw/zinc/75/49/27/1075754927.db2.gz XBXMSIMRZYTHHB-GXSJLCMTSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CN(C)C(=O)[C@@H]2CNC(=O)N2)n1 ZINC001581113072 1075754898 /nfs/dbraw/zinc/75/48/98/1075754898.db2.gz XBXMSIMRZYTHHB-KOLCDFICSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CN(C)C(=O)[C@@H]2CNC(=O)N2)n1 ZINC001581113072 1075754896 /nfs/dbraw/zinc/75/48/96/1075754896.db2.gz XBXMSIMRZYTHHB-KOLCDFICSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CN(C)C(=O)[C@H]2CNC(=O)N2)n1 ZINC001581113074 1075754842 /nfs/dbraw/zinc/75/48/42/1075754842.db2.gz XBXMSIMRZYTHHB-MWLCHTKSSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CN(C)C(=O)[C@H]2CNC(=O)N2)n1 ZINC001581113074 1075754837 /nfs/dbraw/zinc/75/48/37/1075754837.db2.gz XBXMSIMRZYTHHB-MWLCHTKSSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CN(C)C(=O)[C@@H]2CNC(=O)N2)n1 ZINC001581113076 1075754935 /nfs/dbraw/zinc/75/49/35/1075754935.db2.gz XBXMSIMRZYTHHB-ONGXEEELSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CN(C)C(=O)[C@@H]2CNC(=O)N2)n1 ZINC001581113076 1075754933 /nfs/dbraw/zinc/75/49/33/1075754933.db2.gz XBXMSIMRZYTHHB-ONGXEEELSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CN(C)C(=O)[C@H]2COC(=O)N2)n1 ZINC001581113077 1075754912 /nfs/dbraw/zinc/75/49/12/1075754912.db2.gz XCGZTUISONKBIM-GXSJLCMTSA-N -1 3 376.377 -1.090 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CN(C)C(=O)[C@H]2COC(=O)N2)n1 ZINC001581113077 1075754910 /nfs/dbraw/zinc/75/49/10/1075754910.db2.gz XCGZTUISONKBIM-GXSJLCMTSA-N -1 3 376.377 -1.090 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CN(C)C(=O)[C@@H]2COC(=O)N2)n1 ZINC001581113078 1075754921 /nfs/dbraw/zinc/75/49/21/1075754921.db2.gz XCGZTUISONKBIM-KOLCDFICSA-N -1 3 376.377 -1.090 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CN(C)C(=O)[C@@H]2COC(=O)N2)n1 ZINC001581113078 1075754917 /nfs/dbraw/zinc/75/49/17/1075754917.db2.gz XCGZTUISONKBIM-KOLCDFICSA-N -1 3 376.377 -1.090 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CN(C)C(=O)[C@H]2COC(=O)N2)n1 ZINC001581113079 1075755195 /nfs/dbraw/zinc/75/51/95/1075755195.db2.gz XCGZTUISONKBIM-MWLCHTKSSA-N -1 3 376.377 -1.090 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CN(C)C(=O)[C@H]2COC(=O)N2)n1 ZINC001581113079 1075755193 /nfs/dbraw/zinc/75/51/93/1075755193.db2.gz XCGZTUISONKBIM-MWLCHTKSSA-N -1 3 376.377 -1.090 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CN(C)C(=O)[C@@H]2COC(=O)N2)n1 ZINC001581113080 1075755177 /nfs/dbraw/zinc/75/51/77/1075755177.db2.gz XCGZTUISONKBIM-ONGXEEELSA-N -1 3 376.377 -1.090 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CN(C)C(=O)[C@@H]2COC(=O)N2)n1 ZINC001581113080 1075755174 /nfs/dbraw/zinc/75/51/74/1075755174.db2.gz XCGZTUISONKBIM-ONGXEEELSA-N -1 3 376.377 -1.090 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CN(C)C(=O)CCn2cnnn2)n1 ZINC001581113171 1075755205 /nfs/dbraw/zinc/75/52/05/1075755205.db2.gz XVOIMHUXIBWRRQ-LLVKDONJSA-N -1 3 387.408 -1.122 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CN(C)C(=O)CCn2cnnn2)n1 ZINC001581113171 1075755202 /nfs/dbraw/zinc/75/52/02/1075755202.db2.gz XVOIMHUXIBWRRQ-LLVKDONJSA-N -1 3 387.408 -1.122 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CN(C)C(=O)CCn2cnnn2)n1 ZINC001581113173 1075755245 /nfs/dbraw/zinc/75/52/45/1075755245.db2.gz XVOIMHUXIBWRRQ-NSHDSACASA-N -1 3 387.408 -1.122 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CN(C)C(=O)CCn2cnnn2)n1 ZINC001581113173 1075755241 /nfs/dbraw/zinc/75/52/41/1075755241.db2.gz XVOIMHUXIBWRRQ-NSHDSACASA-N -1 3 387.408 -1.122 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CNC(=O)CCS(C)(=O)=O)n1 ZINC001581114049 1075755120 /nfs/dbraw/zinc/75/51/20/1075755120.db2.gz DUNFNCMZQOWEFK-JTQLQIEISA-N -1 3 383.434 -1.106 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CNC(=O)CCS(C)(=O)=O)n1 ZINC001581114049 1075755117 /nfs/dbraw/zinc/75/51/17/1075755117.db2.gz DUNFNCMZQOWEFK-JTQLQIEISA-N -1 3 383.434 -1.106 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CNC(=O)CCS(C)(=O)=O)n1 ZINC001581114050 1075755167 /nfs/dbraw/zinc/75/51/67/1075755167.db2.gz DUNFNCMZQOWEFK-SNVBAGLBSA-N -1 3 383.434 -1.106 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CNC(=O)CCS(C)(=O)=O)n1 ZINC001581114050 1075755164 /nfs/dbraw/zinc/75/51/64/1075755164.db2.gz DUNFNCMZQOWEFK-SNVBAGLBSA-N -1 3 383.434 -1.106 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CNC(=O)Cn2ncn(C)c2=O)n1 ZINC001581114391 1075755270 /nfs/dbraw/zinc/75/52/70/1075755270.db2.gz IAQSCVVPPCHLLA-JTQLQIEISA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CNC(=O)Cn2ncn(C)c2=O)n1 ZINC001581114391 1075755265 /nfs/dbraw/zinc/75/52/65/1075755265.db2.gz IAQSCVVPPCHLLA-JTQLQIEISA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CNC(=O)Cn2ncn(C)c2=O)n1 ZINC001581114392 1075755291 /nfs/dbraw/zinc/75/52/91/1075755291.db2.gz IAQSCVVPPCHLLA-SNVBAGLBSA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CNC(=O)Cn2ncn(C)c2=O)n1 ZINC001581114392 1075755288 /nfs/dbraw/zinc/75/52/88/1075755288.db2.gz IAQSCVVPPCHLLA-SNVBAGLBSA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CNC(=O)CN2CCCNC2=O)n1 ZINC001581114399 1075755185 /nfs/dbraw/zinc/75/51/85/1075755185.db2.gz ICDKGMZSDYKFSP-LLVKDONJSA-N -1 3 389.420 -1.126 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CNC(=O)CN2CCCNC2=O)n1 ZINC001581114399 1075755183 /nfs/dbraw/zinc/75/51/83/1075755183.db2.gz ICDKGMZSDYKFSP-LLVKDONJSA-N -1 3 389.420 -1.126 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CNC(=O)CN2CCCNC2=O)n1 ZINC001581114400 1075755318 /nfs/dbraw/zinc/75/53/18/1075755318.db2.gz ICDKGMZSDYKFSP-NSHDSACASA-N -1 3 389.420 -1.126 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CNC(=O)CN2CCCNC2=O)n1 ZINC001581114400 1075755314 /nfs/dbraw/zinc/75/53/14/1075755314.db2.gz ICDKGMZSDYKFSP-NSHDSACASA-N -1 3 389.420 -1.126 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CNC(=O)[C@@H]2CN(C)CCO2)n1 ZINC001581114701 1075755234 /nfs/dbraw/zinc/75/52/34/1075755234.db2.gz LSXKNSUYUAVMRF-AAEUAGOBSA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CNC(=O)[C@@H]2CN(C)CCO2)n1 ZINC001581114701 1075755230 /nfs/dbraw/zinc/75/52/30/1075755230.db2.gz LSXKNSUYUAVMRF-AAEUAGOBSA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CNC(=O)[C@H]2CN(C)CCO2)n1 ZINC001581114702 1075755218 /nfs/dbraw/zinc/75/52/18/1075755218.db2.gz LSXKNSUYUAVMRF-DGCLKSJQSA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CNC(=O)[C@H]2CN(C)CCO2)n1 ZINC001581114702 1075755216 /nfs/dbraw/zinc/75/52/16/1075755216.db2.gz LSXKNSUYUAVMRF-DGCLKSJQSA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CNC(=O)[C@H]2CN(C)CCO2)n1 ZINC001581114703 1075755147 /nfs/dbraw/zinc/75/51/47/1075755147.db2.gz LSXKNSUYUAVMRF-WCQYABFASA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CNC(=O)[C@H]2CN(C)CCO2)n1 ZINC001581114703 1075755145 /nfs/dbraw/zinc/75/51/45/1075755145.db2.gz LSXKNSUYUAVMRF-WCQYABFASA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CNC(=O)[C@@H]2CN(C)CCO2)n1 ZINC001581114704 1075755104 /nfs/dbraw/zinc/75/51/04/1075755104.db2.gz LSXKNSUYUAVMRF-YPMHNXCESA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CNC(=O)[C@@H]2CN(C)CCO2)n1 ZINC001581114704 1075755102 /nfs/dbraw/zinc/75/51/02/1075755102.db2.gz LSXKNSUYUAVMRF-YPMHNXCESA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CNC(=O)CN2CCOCC2)n1 ZINC001581114709 1075755133 /nfs/dbraw/zinc/75/51/33/1075755133.db2.gz LUXIUTXUNQGIPV-GFCCVEGCSA-N -1 3 376.421 -1.209 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CNC(=O)CN2CCOCC2)n1 ZINC001581114709 1075755128 /nfs/dbraw/zinc/75/51/28/1075755128.db2.gz LUXIUTXUNQGIPV-GFCCVEGCSA-N -1 3 376.421 -1.209 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CNC(=O)CN2CCOCC2)n1 ZINC001581114710 1075755257 /nfs/dbraw/zinc/75/52/57/1075755257.db2.gz LUXIUTXUNQGIPV-LBPRGKRZSA-N -1 3 376.421 -1.209 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CNC(=O)CN2CCOCC2)n1 ZINC001581114710 1075755254 /nfs/dbraw/zinc/75/52/54/1075755254.db2.gz LUXIUTXUNQGIPV-LBPRGKRZSA-N -1 3 376.421 -1.209 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CNC(=O)C2CS(=O)(=O)C2)n1 ZINC001581114751 1075755281 /nfs/dbraw/zinc/75/52/81/1075755281.db2.gz MOUVCCHSKJDYER-JTQLQIEISA-N -1 3 381.418 -1.496 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CNC(=O)C2CS(=O)(=O)C2)n1 ZINC001581114751 1075755276 /nfs/dbraw/zinc/75/52/76/1075755276.db2.gz MOUVCCHSKJDYER-JTQLQIEISA-N -1 3 381.418 -1.496 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CNC(=O)C2CS(=O)(=O)C2)n1 ZINC001581114752 1075755159 /nfs/dbraw/zinc/75/51/59/1075755159.db2.gz MOUVCCHSKJDYER-SNVBAGLBSA-N -1 3 381.418 -1.496 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CNC(=O)C2CS(=O)(=O)C2)n1 ZINC001581114752 1075755154 /nfs/dbraw/zinc/75/51/54/1075755154.db2.gz MOUVCCHSKJDYER-SNVBAGLBSA-N -1 3 381.418 -1.496 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CNC(=O)CN2CCNC(=O)C2)n1 ZINC001581114795 1075755306 /nfs/dbraw/zinc/75/53/06/1075755306.db2.gz NPCLLTXVUJVASP-LLVKDONJSA-N -1 3 389.420 -2.109 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CNC(=O)CN2CCNC(=O)C2)n1 ZINC001581114795 1075755302 /nfs/dbraw/zinc/75/53/02/1075755302.db2.gz NPCLLTXVUJVASP-LLVKDONJSA-N -1 3 389.420 -2.109 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CNC(=O)CN2CCNC(=O)C2)n1 ZINC001581114796 1075755111 /nfs/dbraw/zinc/75/51/11/1075755111.db2.gz NPCLLTXVUJVASP-NSHDSACASA-N -1 3 389.420 -2.109 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CNC(=O)CN2CCNC(=O)C2)n1 ZINC001581114796 1075755109 /nfs/dbraw/zinc/75/51/09/1075755109.db2.gz NPCLLTXVUJVASP-NSHDSACASA-N -1 3 389.420 -2.109 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CNC(=O)c2ccc(=O)n(C)n2)n1 ZINC001581114867 1075755518 /nfs/dbraw/zinc/75/55/18/1075755518.db2.gz PCFFHVVNYXDKBL-JTQLQIEISA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CNC(=O)c2ccc(=O)n(C)n2)n1 ZINC001581114867 1075755517 /nfs/dbraw/zinc/75/55/17/1075755517.db2.gz PCFFHVVNYXDKBL-JTQLQIEISA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CNC(=O)c2ccc(=O)n(C)n2)n1 ZINC001581114868 1075755544 /nfs/dbraw/zinc/75/55/44/1075755544.db2.gz PCFFHVVNYXDKBL-SNVBAGLBSA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CNC(=O)c2ccc(=O)n(C)n2)n1 ZINC001581114868 1075755542 /nfs/dbraw/zinc/75/55/42/1075755542.db2.gz PCFFHVVNYXDKBL-SNVBAGLBSA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CNC(=O)c2cc(=O)n(C)cn2)n1 ZINC001581114907 1075755494 /nfs/dbraw/zinc/75/54/94/1075755494.db2.gz QFIDPIULNCJYDA-JTQLQIEISA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CNC(=O)c2cc(=O)n(C)cn2)n1 ZINC001581114907 1075755493 /nfs/dbraw/zinc/75/54/93/1075755493.db2.gz QFIDPIULNCJYDA-JTQLQIEISA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CNC(=O)c2cc(=O)n(C)cn2)n1 ZINC001581114908 1075755521 /nfs/dbraw/zinc/75/55/21/1075755521.db2.gz QFIDPIULNCJYDA-SNVBAGLBSA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CNC(=O)c2cc(=O)n(C)cn2)n1 ZINC001581114908 1075755520 /nfs/dbraw/zinc/75/55/20/1075755520.db2.gz QFIDPIULNCJYDA-SNVBAGLBSA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CNC(=O)CN2CCOCC2=O)n1 ZINC001581114969 1075755512 /nfs/dbraw/zinc/75/55/12/1075755512.db2.gz ROCVMXXWCWNQRR-LLVKDONJSA-N -1 3 390.404 -1.682 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CNC(=O)CN2CCOCC2=O)n1 ZINC001581114969 1075755511 /nfs/dbraw/zinc/75/55/11/1075755511.db2.gz ROCVMXXWCWNQRR-LLVKDONJSA-N -1 3 390.404 -1.682 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CNC(=O)CN2CCOCC2=O)n1 ZINC001581114970 1075755497 /nfs/dbraw/zinc/75/54/97/1075755497.db2.gz ROCVMXXWCWNQRR-NSHDSACASA-N -1 3 390.404 -1.682 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CNC(=O)CN2CCOCC2=O)n1 ZINC001581114970 1075755496 /nfs/dbraw/zinc/75/54/96/1075755496.db2.gz ROCVMXXWCWNQRR-NSHDSACASA-N -1 3 390.404 -1.682 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CNC(=O)c2cn(C)c(=O)n2C)n1 ZINC001581115067 1075755589 /nfs/dbraw/zinc/75/55/89/1075755589.db2.gz UCNHVAAJDUMTMT-JTQLQIEISA-N -1 3 387.404 -1.190 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CNC(=O)c2cn(C)c(=O)n2C)n1 ZINC001581115067 1075755585 /nfs/dbraw/zinc/75/55/85/1075755585.db2.gz UCNHVAAJDUMTMT-JTQLQIEISA-N -1 3 387.404 -1.190 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CNC(=O)c2cn(C)c(=O)n2C)n1 ZINC001581115068 1075755578 /nfs/dbraw/zinc/75/55/78/1075755578.db2.gz UCNHVAAJDUMTMT-SNVBAGLBSA-N -1 3 387.404 -1.190 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CNC(=O)c2cn(C)c(=O)n2C)n1 ZINC001581115068 1075755575 /nfs/dbraw/zinc/75/55/75/1075755575.db2.gz UCNHVAAJDUMTMT-SNVBAGLBSA-N -1 3 387.404 -1.190 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CNC(=O)[C@H]2CN(C)C(=O)N2)n1 ZINC001581115113 1075755515 /nfs/dbraw/zinc/75/55/15/1075755515.db2.gz VCBAKXKCRKHYGW-GXSJLCMTSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CNC(=O)[C@H]2CN(C)C(=O)N2)n1 ZINC001581115113 1075755514 /nfs/dbraw/zinc/75/55/14/1075755514.db2.gz VCBAKXKCRKHYGW-GXSJLCMTSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CNC(=O)[C@@H]2CN(C)C(=O)N2)n1 ZINC001581115114 1075755509 /nfs/dbraw/zinc/75/55/09/1075755509.db2.gz VCBAKXKCRKHYGW-KOLCDFICSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CNC(=O)[C@@H]2CN(C)C(=O)N2)n1 ZINC001581115114 1075755508 /nfs/dbraw/zinc/75/55/08/1075755508.db2.gz VCBAKXKCRKHYGW-KOLCDFICSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CNC(=O)[C@H]2CN(C)C(=O)N2)n1 ZINC001581115115 1075755530 /nfs/dbraw/zinc/75/55/30/1075755530.db2.gz VCBAKXKCRKHYGW-MWLCHTKSSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CNC(=O)[C@H]2CN(C)C(=O)N2)n1 ZINC001581115115 1075755529 /nfs/dbraw/zinc/75/55/29/1075755529.db2.gz VCBAKXKCRKHYGW-MWLCHTKSSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CNC(=O)[C@@H]2CN(C)C(=O)N2)n1 ZINC001581115116 1075755506 /nfs/dbraw/zinc/75/55/06/1075755506.db2.gz VCBAKXKCRKHYGW-ONGXEEELSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CNC(=O)[C@@H]2CN(C)C(=O)N2)n1 ZINC001581115116 1075755505 /nfs/dbraw/zinc/75/55/05/1075755505.db2.gz VCBAKXKCRKHYGW-ONGXEEELSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H]2CN(C(=O)Cn3ncnn3)CCO2)n1 ZINC001581118674 1075755558 /nfs/dbraw/zinc/75/55/58/1075755558.db2.gz HCKUKWQHURQHGS-LLVKDONJSA-N -1 3 385.392 -1.104 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H]2CN(C(=O)Cn3ncnn3)CCO2)n1 ZINC001581118674 1075755557 /nfs/dbraw/zinc/75/55/57/1075755557.db2.gz HCKUKWQHURQHGS-LLVKDONJSA-N -1 3 385.392 -1.104 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H]2CN(C(=O)Cn3ncnn3)CCO2)n1 ZINC001581118675 1075755500 /nfs/dbraw/zinc/75/55/00/1075755500.db2.gz HCKUKWQHURQHGS-NSHDSACASA-N -1 3 385.392 -1.104 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H]2CN(C(=O)Cn3ncnn3)CCO2)n1 ZINC001581118675 1075755499 /nfs/dbraw/zinc/75/54/99/1075755499.db2.gz HCKUKWQHURQHGS-NSHDSACASA-N -1 3 385.392 -1.104 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NCCN(CCO)C(=O)[C@H]2CN(C)C(=O)N2)n1 ZINC001581125015 1075755567 /nfs/dbraw/zinc/75/55/67/1075755567.db2.gz KLPHCUNMANCDMV-GFCCVEGCSA-N -1 3 389.420 -1.173 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NCCN(CCO)C(=O)[C@H]2CN(C)C(=O)N2)n1 ZINC001581125015 1075755562 /nfs/dbraw/zinc/75/55/62/1075755562.db2.gz KLPHCUNMANCDMV-GFCCVEGCSA-N -1 3 389.420 -1.173 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NCCN(CCO)C(=O)[C@@H]2CN(C)C(=O)N2)n1 ZINC001581125018 1075755525 /nfs/dbraw/zinc/75/55/25/1075755525.db2.gz KLPHCUNMANCDMV-LBPRGKRZSA-N -1 3 389.420 -1.173 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NCCN(CCO)C(=O)[C@@H]2CN(C)C(=O)N2)n1 ZINC001581125018 1075755524 /nfs/dbraw/zinc/75/55/24/1075755524.db2.gz KLPHCUNMANCDMV-LBPRGKRZSA-N -1 3 389.420 -1.173 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NCCN(CCO)C(=O)[C@H]2CNC(=O)N2)n1 ZINC001581125069 1075755491 /nfs/dbraw/zinc/75/54/91/1075755491.db2.gz MDHNYIULEQTFJX-LLVKDONJSA-N -1 3 375.393 -1.516 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NCCN(CCO)C(=O)[C@H]2CNC(=O)N2)n1 ZINC001581125069 1075755490 /nfs/dbraw/zinc/75/54/90/1075755490.db2.gz MDHNYIULEQTFJX-LLVKDONJSA-N -1 3 375.393 -1.516 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NCCN(CCO)C(=O)[C@@H]2CNC(=O)N2)n1 ZINC001581125070 1075755552 /nfs/dbraw/zinc/75/55/52/1075755552.db2.gz MDHNYIULEQTFJX-NSHDSACASA-N -1 3 375.393 -1.516 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NCCN(CCO)C(=O)[C@@H]2CNC(=O)N2)n1 ZINC001581125070 1075755548 /nfs/dbraw/zinc/75/55/48/1075755548.db2.gz MDHNYIULEQTFJX-NSHDSACASA-N -1 3 375.393 -1.516 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NCCN(CCO)C(=O)CS(C)(=O)=O)n1 ZINC001581125151 1075755503 /nfs/dbraw/zinc/75/55/03/1075755503.db2.gz OHHTXILOGMXUFA-UHFFFAOYSA-N -1 3 383.434 -1.152 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NCCN(CCO)C(=O)CS(C)(=O)=O)n1 ZINC001581125151 1075755502 /nfs/dbraw/zinc/75/55/02/1075755502.db2.gz OHHTXILOGMXUFA-UHFFFAOYSA-N -1 3 383.434 -1.152 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NCCNC(=O)CN2C(=O)C(=O)N(C)C2=O)n1 ZINC001581125565 1075755537 /nfs/dbraw/zinc/75/55/37/1075755537.db2.gz WMVIRTVDRHHITO-UHFFFAOYSA-N -1 3 387.360 -1.481 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NCCNC(=O)CN2C(=O)C(=O)N(C)C2=O)n1 ZINC001581125565 1075755535 /nfs/dbraw/zinc/75/55/35/1075755535.db2.gz WMVIRTVDRHHITO-UHFFFAOYSA-N -1 3 387.360 -1.481 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NCCN(CCO)C(=O)CCn2cnnn2)n1 ZINC001581125717 1075755798 /nfs/dbraw/zinc/75/57/98/1075755798.db2.gz ZTMNHCDGNQQIIW-UHFFFAOYSA-N -1 3 387.408 -1.120 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NCCN(CCO)C(=O)CCn2cnnn2)n1 ZINC001581125717 1075755796 /nfs/dbraw/zinc/75/57/96/1075755796.db2.gz ZTMNHCDGNQQIIW-UHFFFAOYSA-N -1 3 387.408 -1.120 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N(C)CCNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581137309 1075755818 /nfs/dbraw/zinc/75/58/18/1075755818.db2.gz ARRARVTTZFWRHD-UHFFFAOYSA-N -1 3 385.388 -1.052 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N(C)CCNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581137309 1075755813 /nfs/dbraw/zinc/75/58/13/1075755813.db2.gz ARRARVTTZFWRHD-UHFFFAOYSA-N -1 3 385.388 -1.052 20 0 GAADHM Cc1ccc(=O)n(CC(=O)NC[C@H](C)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581137315 1075755828 /nfs/dbraw/zinc/75/58/28/1075755828.db2.gz AWLKGIMKECIMOX-JTQLQIEISA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(=O)n(CC(=O)NC[C@H](C)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581137315 1075755825 /nfs/dbraw/zinc/75/58/25/1075755825.db2.gz AWLKGIMKECIMOX-JTQLQIEISA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(=O)n(CC(=O)NC[C@@H](C)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581137316 1075755885 /nfs/dbraw/zinc/75/58/85/1075755885.db2.gz AWLKGIMKECIMOX-SNVBAGLBSA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(=O)n(CC(=O)NC[C@@H](C)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581137316 1075755881 /nfs/dbraw/zinc/75/58/81/1075755881.db2.gz AWLKGIMKECIMOX-SNVBAGLBSA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(=O)n(CC(=O)NC[C@H](C)NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581137345 1075755833 /nfs/dbraw/zinc/75/58/33/1075755833.db2.gz CBEVMTPVEQKHMY-JTQLQIEISA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(=O)n(CC(=O)NC[C@H](C)NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581137345 1075755832 /nfs/dbraw/zinc/75/58/32/1075755832.db2.gz CBEVMTPVEQKHMY-JTQLQIEISA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(=O)n(CC(=O)NC[C@@H](C)NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581137346 1075755891 /nfs/dbraw/zinc/75/58/91/1075755891.db2.gz CBEVMTPVEQKHMY-SNVBAGLBSA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(=O)n(CC(=O)NC[C@@H](C)NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581137346 1075755890 /nfs/dbraw/zinc/75/58/90/1075755890.db2.gz CBEVMTPVEQKHMY-SNVBAGLBSA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)cc1S(=O)(=O)NCc1nnc2n1CCNC2=O ZINC001581137367 1075755900 /nfs/dbraw/zinc/75/59/00/1075755900.db2.gz CXQAFZOEXDELAB-UHFFFAOYSA-N -1 3 389.401 -1.011 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)cc1S(=O)(=O)NCc1nnc2n1CCNC2=O ZINC001581137367 1075755897 /nfs/dbraw/zinc/75/58/97/1075755897.db2.gz CXQAFZOEXDELAB-UHFFFAOYSA-N -1 3 389.401 -1.011 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N2CC(NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581137371 1075755777 /nfs/dbraw/zinc/75/57/77/1075755777.db2.gz DIIRLVONIAVSOE-UHFFFAOYSA-N -1 3 383.372 -1.299 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N2CC(NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581137371 1075755774 /nfs/dbraw/zinc/75/57/74/1075755774.db2.gz DIIRLVONIAVSOE-UHFFFAOYSA-N -1 3 383.372 -1.299 20 0 GAADHM Cc1ccc(=O)n(CC(=O)NCCCNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581137394 1075755841 /nfs/dbraw/zinc/75/58/41/1075755841.db2.gz FMFALIPBCVVEAE-UHFFFAOYSA-N -1 3 385.388 -1.004 20 0 GAADHM Cc1ccc(=O)n(CC(=O)NCCCNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581137394 1075755839 /nfs/dbraw/zinc/75/58/39/1075755839.db2.gz FMFALIPBCVVEAE-UHFFFAOYSA-N -1 3 385.388 -1.004 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N(C)CCNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581137486 1075755944 /nfs/dbraw/zinc/75/59/44/1075755944.db2.gz IRFVFNPKGKQRTL-UHFFFAOYSA-N -1 3 385.388 -1.052 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N(C)CCNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581137486 1075755938 /nfs/dbraw/zinc/75/59/38/1075755938.db2.gz IRFVFNPKGKQRTL-UHFFFAOYSA-N -1 3 385.388 -1.052 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N2CC(NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581137529 1075755837 /nfs/dbraw/zinc/75/58/37/1075755837.db2.gz JKAJQQXMLZWRPN-UHFFFAOYSA-N -1 3 383.372 -1.299 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N2CC(NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581137529 1075755836 /nfs/dbraw/zinc/75/58/36/1075755836.db2.gz JKAJQQXMLZWRPN-UHFFFAOYSA-N -1 3 383.372 -1.299 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N[C@@H](C)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581137932 1075755789 /nfs/dbraw/zinc/75/57/89/1075755789.db2.gz PJYBUKYKFQWFKB-JTQLQIEISA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N[C@@H](C)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581137932 1075755785 /nfs/dbraw/zinc/75/57/85/1075755785.db2.gz PJYBUKYKFQWFKB-JTQLQIEISA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N[C@H](C)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581137933 1075755913 /nfs/dbraw/zinc/75/59/13/1075755913.db2.gz PJYBUKYKFQWFKB-SNVBAGLBSA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N[C@H](C)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581137933 1075755909 /nfs/dbraw/zinc/75/59/09/1075755909.db2.gz PJYBUKYKFQWFKB-SNVBAGLBSA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N(C)CCNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581138207 1075755846 /nfs/dbraw/zinc/75/58/46/1075755846.db2.gz UJMCFWUBPCUMDD-UHFFFAOYSA-N -1 3 385.388 -1.052 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N(C)CCNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581138207 1075755844 /nfs/dbraw/zinc/75/58/44/1075755844.db2.gz UJMCFWUBPCUMDD-UHFFFAOYSA-N -1 3 385.388 -1.052 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N[C@@H](C)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581138242 1075755806 /nfs/dbraw/zinc/75/58/06/1075755806.db2.gz VNIJGQRLJAROGS-JTQLQIEISA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N[C@@H](C)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581138242 1075755804 /nfs/dbraw/zinc/75/58/04/1075755804.db2.gz VNIJGQRLJAROGS-JTQLQIEISA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N[C@H](C)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581138243 1075755958 /nfs/dbraw/zinc/75/59/58/1075755958.db2.gz VNIJGQRLJAROGS-SNVBAGLBSA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N[C@H](C)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581138243 1075755954 /nfs/dbraw/zinc/75/59/54/1075755954.db2.gz VNIJGQRLJAROGS-SNVBAGLBSA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N2CC(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581138252 1075755862 /nfs/dbraw/zinc/75/58/62/1075755862.db2.gz VXYNRQOKBKIUBP-UHFFFAOYSA-N -1 3 383.372 -1.299 20 0 GAADHM Cc1ccc(=O)n(CC(=O)N2CC(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581138252 1075755861 /nfs/dbraw/zinc/75/58/61/1075755861.db2.gz VXYNRQOKBKIUBP-UHFFFAOYSA-N -1 3 383.372 -1.299 20 0 GAADHM Cc1ccc(=O)n(CC(=O)NC[C@H](C)NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581138265 1075755872 /nfs/dbraw/zinc/75/58/72/1075755872.db2.gz WLLVHGGJOCBTFI-JTQLQIEISA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(=O)n(CC(=O)NC[C@H](C)NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581138265 1075755868 /nfs/dbraw/zinc/75/58/68/1075755868.db2.gz WLLVHGGJOCBTFI-JTQLQIEISA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(=O)n(CC(=O)NC[C@@H](C)NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581138266 1075755929 /nfs/dbraw/zinc/75/59/29/1075755929.db2.gz WLLVHGGJOCBTFI-SNVBAGLBSA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(=O)n(CC(=O)NC[C@@H](C)NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581138266 1075755922 /nfs/dbraw/zinc/75/59/22/1075755922.db2.gz WLLVHGGJOCBTFI-SNVBAGLBSA-N -1 3 385.388 -1.005 20 0 GAADHM Cc1ccc(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)nn1 ZINC001581143848 1075755855 /nfs/dbraw/zinc/75/58/55/1075755855.db2.gz ABSDTHHDDUMWNM-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccc(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)nn1 ZINC001581143848 1075755852 /nfs/dbraw/zinc/75/58/52/1075755852.db2.gz ABSDTHHDDUMWNM-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccc(C(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)nn1 ZINC001581144922 1075756189 /nfs/dbraw/zinc/75/61/89/1075756189.db2.gz OQYUYCKUBTWTQK-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccc(C(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)nn1 ZINC001581144922 1075756184 /nfs/dbraw/zinc/75/61/84/1075756184.db2.gz OQYUYCKUBTWTQK-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccc(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)nn1 ZINC001581145826 1075756176 /nfs/dbraw/zinc/75/61/76/1075756176.db2.gz ZYTANWGURCAAAG-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccc(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)nn1 ZINC001581145826 1075756174 /nfs/dbraw/zinc/75/61/74/1075756174.db2.gz ZYTANWGURCAAAG-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)nn1 ZINC001581151776 1075756161 /nfs/dbraw/zinc/75/61/61/1075756161.db2.gz KUUWTPJHIAYXNW-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)nn1 ZINC001581151776 1075756159 /nfs/dbraw/zinc/75/61/59/1075756159.db2.gz KUUWTPJHIAYXNW-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)nn1 ZINC001581151783 1075756136 /nfs/dbraw/zinc/75/61/36/1075756136.db2.gz LDNLYDCCCVYEJQ-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)nn1 ZINC001581151783 1075756133 /nfs/dbraw/zinc/75/61/33/1075756133.db2.gz LDNLYDCCCVYEJQ-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)nn1 ZINC001581152086 1075756143 /nfs/dbraw/zinc/75/61/43/1075756143.db2.gz ZKZWBPQDNHIYBJ-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)nn1 ZINC001581152086 1075756141 /nfs/dbraw/zinc/75/61/41/1075756141.db2.gz ZKZWBPQDNHIYBJ-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)nn1 ZINC001581153183 1075756202 /nfs/dbraw/zinc/75/62/02/1075756202.db2.gz KUUWTPJHIAYXNW-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)nn1 ZINC001581153183 1075756196 /nfs/dbraw/zinc/75/61/96/1075756196.db2.gz KUUWTPJHIAYXNW-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)nn1 ZINC001581153192 1075756120 /nfs/dbraw/zinc/75/61/20/1075756120.db2.gz LDNLYDCCCVYEJQ-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)nn1 ZINC001581153192 1075756118 /nfs/dbraw/zinc/75/61/18/1075756118.db2.gz LDNLYDCCCVYEJQ-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)nn1 ZINC001581153913 1075756279 /nfs/dbraw/zinc/75/62/79/1075756279.db2.gz ZKZWBPQDNHIYBJ-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)nn1 ZINC001581153913 1075756277 /nfs/dbraw/zinc/75/62/77/1075756277.db2.gz ZKZWBPQDNHIYBJ-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)NCC2(O)CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)nn1 ZINC001581167042 1075756303 /nfs/dbraw/zinc/75/63/03/1075756303.db2.gz AGLXZJPVEPZPPV-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccc(C(=O)NCC2(O)CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)nn1 ZINC001581167042 1075756302 /nfs/dbraw/zinc/75/63/02/1075756302.db2.gz AGLXZJPVEPZPPV-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccc(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)nn1 ZINC001581168351 1075756236 /nfs/dbraw/zinc/75/62/36/1075756236.db2.gz PWODKAHZQBSZLR-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccc(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)nn1 ZINC001581168351 1075756231 /nfs/dbraw/zinc/75/62/31/1075756231.db2.gz PWODKAHZQBSZLR-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccc(C(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)nn1 ZINC001581168647 1075756262 /nfs/dbraw/zinc/75/62/62/1075756262.db2.gz SGVHEHOMQGZXQD-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccc(C(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)nn1 ZINC001581168647 1075756257 /nfs/dbraw/zinc/75/62/57/1075756257.db2.gz SGVHEHOMQGZXQD-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)nn1 ZINC001581171654 1075756112 /nfs/dbraw/zinc/75/61/12/1075756112.db2.gz HIAGBMFMSRPWGN-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)nn1 ZINC001581171654 1075756109 /nfs/dbraw/zinc/75/61/09/1075756109.db2.gz HIAGBMFMSRPWGN-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)nn1 ZINC001581171655 1075756217 /nfs/dbraw/zinc/75/62/17/1075756217.db2.gz HIAGBMFMSRPWGN-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)nn1 ZINC001581171655 1075756212 /nfs/dbraw/zinc/75/62/12/1075756212.db2.gz HIAGBMFMSRPWGN-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)nn1 ZINC001581171746 1075756168 /nfs/dbraw/zinc/75/61/68/1075756168.db2.gz NCDWJJQMHPUOAI-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)nn1 ZINC001581171746 1075756166 /nfs/dbraw/zinc/75/61/66/1075756166.db2.gz NCDWJJQMHPUOAI-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)nn1 ZINC001581171747 1075756307 /nfs/dbraw/zinc/75/63/07/1075756307.db2.gz NCDWJJQMHPUOAI-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)nn1 ZINC001581171747 1075756306 /nfs/dbraw/zinc/75/63/06/1075756306.db2.gz NCDWJJQMHPUOAI-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(S(=O)(=O)N2CCN(CC(N)=O)C(=O)C2)c(-c2nn[n-]n2)c1 ZINC001581210998 1075756503 /nfs/dbraw/zinc/75/65/03/1075756503.db2.gz NZVVDCMWXUXMJM-UHFFFAOYSA-N -1 3 379.402 -1.507 20 0 GAADHM Cc1ccc(S(=O)(=O)N2CCN(CC(N)=O)C(=O)C2)c(-c2nnn[n-]2)c1 ZINC001581210998 1075756501 /nfs/dbraw/zinc/75/65/01/1075756501.db2.gz NZVVDCMWXUXMJM-UHFFFAOYSA-N -1 3 379.402 -1.507 20 0 GAADHM Cc1ccc(S(=O)(=O)N2CCN(S(N)(=O)=O)CC2)c(-c2nn[n-]n2)c1 ZINC001581211205 1075756634 /nfs/dbraw/zinc/75/66/34/1075756634.db2.gz XAFRSTOEMQMGGM-UHFFFAOYSA-N -1 3 387.447 -1.315 20 0 GAADHM Cc1ccc(S(=O)(=O)N2CCN(S(N)(=O)=O)CC2)c(-c2nnn[n-]2)c1 ZINC001581211205 1075756630 /nfs/dbraw/zinc/75/66/30/1075756630.db2.gz XAFRSTOEMQMGGM-UHFFFAOYSA-N -1 3 387.447 -1.315 20 0 GAADHM Cc1ccc(S(=O)(=O)NC[C@@H](O)CS(C)(=O)=O)c(-c2nn[n-]n2)c1 ZINC001581211847 1075756598 /nfs/dbraw/zinc/75/65/98/1075756598.db2.gz NRUUVIOTQPNDHE-SECBINFHSA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1ccc(S(=O)(=O)NC[C@@H](O)CS(C)(=O)=O)c(-c2nnn[n-]2)c1 ZINC001581211847 1075756595 /nfs/dbraw/zinc/75/65/95/1075756595.db2.gz NRUUVIOTQPNDHE-SECBINFHSA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1ccc(S(=O)(=O)NC[C@H](O)CS(C)(=O)=O)c(-c2nn[n-]n2)c1 ZINC001581211848 1075756570 /nfs/dbraw/zinc/75/65/70/1075756570.db2.gz NRUUVIOTQPNDHE-VIFPVBQESA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1ccc(S(=O)(=O)NC[C@H](O)CS(C)(=O)=O)c(-c2nnn[n-]2)c1 ZINC001581211848 1075756567 /nfs/dbraw/zinc/75/65/67/1075756567.db2.gz NRUUVIOTQPNDHE-VIFPVBQESA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1cccc(-c2nn[n-]n2)c1S(=O)(=O)NC[C@@H](O)CS(C)(=O)=O ZINC001581218241 1075756581 /nfs/dbraw/zinc/75/65/81/1075756581.db2.gz WFGBYMMEWBLZDO-SECBINFHSA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1cccc(-c2nnn[n-]2)c1S(=O)(=O)NC[C@@H](O)CS(C)(=O)=O ZINC001581218241 1075756577 /nfs/dbraw/zinc/75/65/77/1075756577.db2.gz WFGBYMMEWBLZDO-SECBINFHSA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1cccc(-c2nn[n-]n2)c1S(=O)(=O)NC[C@H](O)CS(C)(=O)=O ZINC001581218242 1075756527 /nfs/dbraw/zinc/75/65/27/1075756527.db2.gz WFGBYMMEWBLZDO-VIFPVBQESA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1cccc(-c2nnn[n-]2)c1S(=O)(=O)NC[C@H](O)CS(C)(=O)=O ZINC001581218242 1075756525 /nfs/dbraw/zinc/75/65/25/1075756525.db2.gz WFGBYMMEWBLZDO-VIFPVBQESA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1cccc(-c2nn[n-]n2)c1S(=O)(=O)NCc1nnc2n1CCNC2=O ZINC001581218787 1075756494 /nfs/dbraw/zinc/75/64/94/1075756494.db2.gz DALBVASVOQYWHB-UHFFFAOYSA-N -1 3 389.401 -1.011 20 0 GAADHM Cc1cccc(-c2nnn[n-]2)c1S(=O)(=O)NCc1nnc2n1CCNC2=O ZINC001581218787 1075756492 /nfs/dbraw/zinc/75/64/92/1075756492.db2.gz DALBVASVOQYWHB-UHFFFAOYSA-N -1 3 389.401 -1.011 20 0 GAADHM Cc1cccc(S(=O)(=O)N2CCN3[C@@H](CNS3(=O)=O)C2)c1-c1nn[n-]n1 ZINC001581246734 1075756605 /nfs/dbraw/zinc/75/66/05/1075756605.db2.gz GIAFONNCGLSSMR-JTQLQIEISA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1cccc(S(=O)(=O)N2CCN3[C@@H](CNS3(=O)=O)C2)c1-c1nnn[n-]1 ZINC001581246734 1075756603 /nfs/dbraw/zinc/75/66/03/1075756603.db2.gz GIAFONNCGLSSMR-JTQLQIEISA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1cccc(S(=O)(=O)N2CCN3[C@H](CNS3(=O)=O)C2)c1-c1nn[n-]n1 ZINC001581246735 1075756623 /nfs/dbraw/zinc/75/66/23/1075756623.db2.gz GIAFONNCGLSSMR-SNVBAGLBSA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1cccc(S(=O)(=O)N2CCN3[C@H](CNS3(=O)=O)C2)c1-c1nnn[n-]1 ZINC001581246735 1075756622 /nfs/dbraw/zinc/75/66/22/1075756622.db2.gz GIAFONNCGLSSMR-SNVBAGLBSA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1cccc(S(=O)(=O)NC[C@@H](O)CS(C)(=O)=O)c1-c1nn[n-]n1 ZINC001581247863 1075756483 /nfs/dbraw/zinc/75/64/83/1075756483.db2.gz LSPBEBHDWARJPN-SECBINFHSA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1cccc(S(=O)(=O)NC[C@@H](O)CS(C)(=O)=O)c1-c1nnn[n-]1 ZINC001581247863 1075756480 /nfs/dbraw/zinc/75/64/80/1075756480.db2.gz LSPBEBHDWARJPN-SECBINFHSA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1cccc(S(=O)(=O)NC[C@H](O)CS(C)(=O)=O)c1-c1nn[n-]n1 ZINC001581247864 1075756614 /nfs/dbraw/zinc/75/66/14/1075756614.db2.gz LSPBEBHDWARJPN-VIFPVBQESA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1cccc(S(=O)(=O)NC[C@H](O)CS(C)(=O)=O)c1-c1nnn[n-]1 ZINC001581247864 1075756610 /nfs/dbraw/zinc/75/66/10/1075756610.db2.gz LSPBEBHDWARJPN-VIFPVBQESA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1cccc(S(=O)(=O)NCc2nnc3n2CCNC3=O)c1-c1nn[n-]n1 ZINC001581248022 1075756555 /nfs/dbraw/zinc/75/65/55/1075756555.db2.gz OPCKFYSDZXKWEP-UHFFFAOYSA-N -1 3 389.401 -1.011 20 0 GAADHM Cc1cccc(S(=O)(=O)NCc2nnc3n2CCNC3=O)c1-c1nnn[n-]1 ZINC001581248022 1075756553 /nfs/dbraw/zinc/75/65/53/1075756553.db2.gz OPCKFYSDZXKWEP-UHFFFAOYSA-N -1 3 389.401 -1.011 20 0 GAADHM Cc1ccn(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581271476 1075756645 /nfs/dbraw/zinc/75/66/45/1075756645.db2.gz DEXBVBYCVGWHFA-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccn(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581271476 1075756643 /nfs/dbraw/zinc/75/66/43/1075756643.db2.gz DEXBVBYCVGWHFA-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccn(CC(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)n1 ZINC001581271477 1075756534 /nfs/dbraw/zinc/75/65/34/1075756534.db2.gz DEXBVBYCVGWHFA-OLZOCXBDSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccn(CC(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)n1 ZINC001581271477 1075756532 /nfs/dbraw/zinc/75/65/32/1075756532.db2.gz DEXBVBYCVGWHFA-OLZOCXBDSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccn(CC(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581271512 1075756547 /nfs/dbraw/zinc/75/65/47/1075756547.db2.gz FKUAKHMHEWKHBV-UHFFFAOYSA-N -1 3 385.388 -1.297 20 0 GAADHM Cc1ccn(CC(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581271512 1075756546 /nfs/dbraw/zinc/75/65/46/1075756546.db2.gz FKUAKHMHEWKHBV-UHFFFAOYSA-N -1 3 385.388 -1.297 20 0 GAADHM Cc1ccn(CC(=O)N2CC(O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581271757 1075756510 /nfs/dbraw/zinc/75/65/10/1075756510.db2.gz PCYNGSYQEHBCDL-UHFFFAOYSA-N -1 3 385.388 -1.297 20 0 GAADHM Cc1ccn(CC(=O)N2CC(O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581271757 1075756508 /nfs/dbraw/zinc/75/65/08/1075756508.db2.gz PCYNGSYQEHBCDL-UHFFFAOYSA-N -1 3 385.388 -1.297 20 0 GAADHM Cc1ccn(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581271789 1075756660 /nfs/dbraw/zinc/75/66/60/1075756660.db2.gz QMDYGPMETQXJIY-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccn(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581271789 1075756656 /nfs/dbraw/zinc/75/66/56/1075756656.db2.gz QMDYGPMETQXJIY-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccn(CC(=O)N2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)n1 ZINC001581271790 1075756589 /nfs/dbraw/zinc/75/65/89/1075756589.db2.gz QMDYGPMETQXJIY-OLZOCXBDSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccn(CC(=O)N2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)n1 ZINC001581271790 1075756588 /nfs/dbraw/zinc/75/65/88/1075756588.db2.gz QMDYGPMETQXJIY-OLZOCXBDSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccn(CC(=O)NC[C@@H](O)CN(C)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581272086 1075757005 /nfs/dbraw/zinc/75/70/05/1075757005.db2.gz CVLJHTUNCUYIPB-GFCCVEGCSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccn(CC(=O)NC[C@@H](O)CN(C)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581272086 1075757002 /nfs/dbraw/zinc/75/70/02/1075757002.db2.gz CVLJHTUNCUYIPB-GFCCVEGCSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccn(CC(=O)NC[C@H](O)CN(C)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581272087 1075756833 /nfs/dbraw/zinc/75/68/33/1075756833.db2.gz CVLJHTUNCUYIPB-LBPRGKRZSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccn(CC(=O)NC[C@H](O)CN(C)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581272087 1075756829 /nfs/dbraw/zinc/75/68/29/1075756829.db2.gz CVLJHTUNCUYIPB-LBPRGKRZSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccn(CC(=O)NC[C@@H](O)CN(C)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581272616 1075757417 /nfs/dbraw/zinc/75/74/17/1075757417.db2.gz PWQKPKBGVUGFAC-GFCCVEGCSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccn(CC(=O)NC[C@@H](O)CN(C)C(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581272616 1075757414 /nfs/dbraw/zinc/75/74/14/1075757414.db2.gz PWQKPKBGVUGFAC-GFCCVEGCSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccn(CC(=O)NC[C@H](O)CN(C)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581272618 1075757289 /nfs/dbraw/zinc/75/72/89/1075757289.db2.gz PWQKPKBGVUGFAC-LBPRGKRZSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccn(CC(=O)NC[C@H](O)CN(C)C(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581272618 1075757283 /nfs/dbraw/zinc/75/72/83/1075757283.db2.gz PWQKPKBGVUGFAC-LBPRGKRZSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccn(CC(=O)NCCN(CCO)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581272847 1075757239 /nfs/dbraw/zinc/75/72/39/1075757239.db2.gz UJDZCENHPGQWHX-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1ccn(CC(=O)NCCN(CCO)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581272847 1075757233 /nfs/dbraw/zinc/75/72/33/1075757233.db2.gz UJDZCENHPGQWHX-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1ccn(CC(=O)NCCN(CCO)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581273191 1075757209 /nfs/dbraw/zinc/75/72/09/1075757209.db2.gz XJCKUUORSYZUMW-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1ccn(CC(=O)NCCN(CCO)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581273191 1075757202 /nfs/dbraw/zinc/75/72/02/1075757202.db2.gz XJCKUUORSYZUMW-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1ccn(CC(=O)NCCN(CCO)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581273319 1075757371 /nfs/dbraw/zinc/75/73/71/1075757371.db2.gz ZFLAUGRRUVGQKX-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1ccn(CC(=O)NCCN(CCO)C(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581273319 1075757365 /nfs/dbraw/zinc/75/73/65/1075757365.db2.gz ZFLAUGRRUVGQKX-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1ccnc(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581274037 1075757273 /nfs/dbraw/zinc/75/72/73/1075757273.db2.gz ISPIBOKIYLDGPF-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccnc(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581274037 1075757269 /nfs/dbraw/zinc/75/72/69/1075757269.db2.gz ISPIBOKIYLDGPF-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccnc(C(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581274383 1075757390 /nfs/dbraw/zinc/75/73/90/1075757390.db2.gz NHZLJVJSEXYADU-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccnc(C(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581274383 1075757383 /nfs/dbraw/zinc/75/73/83/1075757383.db2.gz NHZLJVJSEXYADU-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccnc(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581274554 1075757352 /nfs/dbraw/zinc/75/73/52/1075757352.db2.gz RXUKAYLJRRTDRC-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccnc(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581274554 1075757347 /nfs/dbraw/zinc/75/73/47/1075757347.db2.gz RXUKAYLJRRTDRC-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccnc(C(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581276131 1075757327 /nfs/dbraw/zinc/75/73/27/1075757327.db2.gz NBDYGFHSIOXXAZ-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccnc(C(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581276131 1075757321 /nfs/dbraw/zinc/75/73/21/1075757321.db2.gz NBDYGFHSIOXXAZ-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccnc(C(=O)NCC2(O)CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581276142 1075757841 /nfs/dbraw/zinc/75/78/41/1075757841.db2.gz NKNDMFDWMOHLBY-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccnc(C(=O)NCC2(O)CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581276142 1075757839 /nfs/dbraw/zinc/75/78/39/1075757839.db2.gz NKNDMFDWMOHLBY-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccnc(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581276609 1075757676 /nfs/dbraw/zinc/75/76/76/1075757676.db2.gz USSSKIUOTUOYGH-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccnc(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581276609 1075757671 /nfs/dbraw/zinc/75/76/71/1075757671.db2.gz USSSKIUOTUOYGH-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1ccnc(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)n1 ZINC001581277735 1075757694 /nfs/dbraw/zinc/75/76/94/1075757694.db2.gz NNYVGAMBMZQKKB-NEPJUHHUSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)n1 ZINC001581277735 1075757689 /nfs/dbraw/zinc/75/76/89/1075757689.db2.gz NNYVGAMBMZQKKB-NEPJUHHUSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581277736 1075757639 /nfs/dbraw/zinc/75/76/39/1075757639.db2.gz NNYVGAMBMZQKKB-VXGBXAGGSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581277736 1075757629 /nfs/dbraw/zinc/75/76/29/1075757629.db2.gz NNYVGAMBMZQKKB-VXGBXAGGSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)n1 ZINC001581277783 1075757764 /nfs/dbraw/zinc/75/77/64/1075757764.db2.gz OEJBJHSPEVCMPD-NEPJUHHUSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)n1 ZINC001581277783 1075757758 /nfs/dbraw/zinc/75/77/58/1075757758.db2.gz OEJBJHSPEVCMPD-NEPJUHHUSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581277784 1075757833 /nfs/dbraw/zinc/75/78/33/1075757833.db2.gz OEJBJHSPEVCMPD-VXGBXAGGSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581277784 1075757832 /nfs/dbraw/zinc/75/78/32/1075757832.db2.gz OEJBJHSPEVCMPD-VXGBXAGGSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)n1 ZINC001581277914 1075757615 /nfs/dbraw/zinc/75/76/15/1075757615.db2.gz SLKJOHUVZHHNCR-NEPJUHHUSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)n1 ZINC001581277914 1075757608 /nfs/dbraw/zinc/75/76/08/1075757608.db2.gz SLKJOHUVZHHNCR-NEPJUHHUSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)n1 ZINC001581278232 1075757735 /nfs/dbraw/zinc/75/77/35/1075757735.db2.gz DAYKCTYDESTPBK-NEPJUHHUSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)n1 ZINC001581278232 1075757730 /nfs/dbraw/zinc/75/77/30/1075757730.db2.gz DAYKCTYDESTPBK-NEPJUHHUSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)n1 ZINC001581278233 1075757827 /nfs/dbraw/zinc/75/78/27/1075757827.db2.gz DAYKCTYDESTPBK-VXGBXAGGSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)n1 ZINC001581278233 1075757824 /nfs/dbraw/zinc/75/78/24/1075757824.db2.gz DAYKCTYDESTPBK-VXGBXAGGSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)n1 ZINC001581278453 1075757657 /nfs/dbraw/zinc/75/76/57/1075757657.db2.gz PWBDTLQEBMWWLY-VXGBXAGGSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)n1 ZINC001581278453 1075757651 /nfs/dbraw/zinc/75/76/51/1075757651.db2.gz PWBDTLQEBMWWLY-VXGBXAGGSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)n1 ZINC001581278477 1075757776 /nfs/dbraw/zinc/75/77/76/1075757776.db2.gz QTLJCRBPKHEPTE-NEPJUHHUSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)n1 ZINC001581278477 1075757772 /nfs/dbraw/zinc/75/77/72/1075757772.db2.gz QTLJCRBPKHEPTE-NEPJUHHUSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)n1 ZINC001581278478 1075757799 /nfs/dbraw/zinc/75/77/99/1075757799.db2.gz QTLJCRBPKHEPTE-VXGBXAGGSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)n1 ZINC001581278478 1075757794 /nfs/dbraw/zinc/75/77/94/1075757794.db2.gz QTLJCRBPKHEPTE-VXGBXAGGSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnn1CC(=O)N(C)C[C@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581290564 1075757820 /nfs/dbraw/zinc/75/78/20/1075757820.db2.gz GVSPEQJSUIKWRW-LLVKDONJSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccnn1CC(=O)N(C)C[C@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581290564 1075757817 /nfs/dbraw/zinc/75/78/17/1075757817.db2.gz GVSPEQJSUIKWRW-LLVKDONJSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccnn1CC(=O)N(C)C[C@@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581290565 1075757592 /nfs/dbraw/zinc/75/75/92/1075757592.db2.gz GVSPEQJSUIKWRW-NSHDSACASA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccnn1CC(=O)N(C)C[C@@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581290565 1075757586 /nfs/dbraw/zinc/75/75/86/1075757586.db2.gz GVSPEQJSUIKWRW-NSHDSACASA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccnn1CC(=O)N(C)C[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581290848 1075757787 /nfs/dbraw/zinc/75/77/87/1075757787.db2.gz MIMHDBVAPUNSQR-GFCCVEGCSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccnn1CC(=O)N(C)C[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581290848 1075757784 /nfs/dbraw/zinc/75/77/84/1075757784.db2.gz MIMHDBVAPUNSQR-GFCCVEGCSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccnn1CC(=O)N(C)C[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581290849 1075757749 /nfs/dbraw/zinc/75/77/49/1075757749.db2.gz MIMHDBVAPUNSQR-LBPRGKRZSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccnn1CC(=O)N(C)C[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581290849 1075757744 /nfs/dbraw/zinc/75/77/44/1075757744.db2.gz MIMHDBVAPUNSQR-LBPRGKRZSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccnn1CC(=O)N1CC(O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581290912 1075757813 /nfs/dbraw/zinc/75/78/13/1075757813.db2.gz OHOHFSJASBMRKA-UHFFFAOYSA-N -1 3 385.388 -1.297 20 0 GAADHM Cc1ccnn1CC(=O)N1CC(O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581290912 1075757811 /nfs/dbraw/zinc/75/78/11/1075757811.db2.gz OHOHFSJASBMRKA-UHFFFAOYSA-N -1 3 385.388 -1.297 20 0 GAADHM Cc1ccnn1CC(=O)N(CCO)CCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581290953 1075757807 /nfs/dbraw/zinc/75/78/07/1075757807.db2.gz PHSRNZMPFPTKMV-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1ccnn1CC(=O)N(CCO)CCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581290953 1075757805 /nfs/dbraw/zinc/75/78/05/1075757805.db2.gz PHSRNZMPFPTKMV-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1ccnn1CC(=O)N1CC(O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581290965 1075757847 /nfs/dbraw/zinc/75/78/47/1075757847.db2.gz PQBNKMYBUHAOFA-UHFFFAOYSA-N -1 3 385.388 -1.297 20 0 GAADHM Cc1ccnn1CC(=O)N1CC(O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581290965 1075757846 /nfs/dbraw/zinc/75/78/46/1075757846.db2.gz PQBNKMYBUHAOFA-UHFFFAOYSA-N -1 3 385.388 -1.297 20 0 GAADHM Cc1ccnn1CC(=O)N(CCO)CCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581290993 1075757717 /nfs/dbraw/zinc/75/77/17/1075757717.db2.gz QTENTQWCFRBWSW-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1ccnn1CC(=O)N(CCO)CCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581290993 1075757711 /nfs/dbraw/zinc/75/77/11/1075757711.db2.gz QTENTQWCFRBWSW-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1ccnn1CC(=O)N(C)C[C@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581291110 1075758120 /nfs/dbraw/zinc/75/81/20/1075758120.db2.gz VLOFJAJQXLDONG-GFCCVEGCSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccnn1CC(=O)N(C)C[C@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581291110 1075758116 /nfs/dbraw/zinc/75/81/16/1075758116.db2.gz VLOFJAJQXLDONG-GFCCVEGCSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccnn1CC(=O)N(C)C[C@@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581291111 1075758008 /nfs/dbraw/zinc/75/80/08/1075758008.db2.gz VLOFJAJQXLDONG-LBPRGKRZSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccnn1CC(=O)N(C)C[C@@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581291111 1075758003 /nfs/dbraw/zinc/75/80/03/1075758003.db2.gz VLOFJAJQXLDONG-LBPRGKRZSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1ccnn1CC(=O)N(CCO)CCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581291116 1075758071 /nfs/dbraw/zinc/75/80/71/1075758071.db2.gz VOJNFBYOTKGTHU-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1ccnn1CC(=O)N(CCO)CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581291116 1075758067 /nfs/dbraw/zinc/75/80/67/1075758067.db2.gz VOJNFBYOTKGTHU-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1ccnn1CC(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581292267 1075757982 /nfs/dbraw/zinc/75/79/82/1075757982.db2.gz CXVGSEFAZQJHLY-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccnn1CC(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581292267 1075757975 /nfs/dbraw/zinc/75/79/75/1075757975.db2.gz CXVGSEFAZQJHLY-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccnn1CC(=O)N1C[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001581292268 1075758150 /nfs/dbraw/zinc/75/81/50/1075758150.db2.gz CXVGSEFAZQJHLY-OLZOCXBDSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccnn1CC(=O)N1C[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001581292268 1075758145 /nfs/dbraw/zinc/75/81/45/1075758145.db2.gz CXVGSEFAZQJHLY-OLZOCXBDSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccnn1CC(=O)N1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001581293320 1075758187 /nfs/dbraw/zinc/75/81/87/1075758187.db2.gz OJUXKMVQOAJSCC-OLZOCXBDSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccnn1CC(=O)N1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001581293320 1075758185 /nfs/dbraw/zinc/75/81/85/1075758185.db2.gz OJUXKMVQOAJSCC-OLZOCXBDSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccnn1CC(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O ZINC001581293968 1075758061 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Cc1cnn(CC(=O)NCC2(O)CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)c1 ZINC001581346987 1075760740 /nfs/dbraw/zinc/76/07/40/1075760740.db2.gz FCLQFNLHGADULD-UHFFFAOYSA-N -1 3 385.388 -1.297 20 0 GAADHM Cc1cnn(CC(=O)NC[C@@H](O)CN(C)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)c1 ZINC001581347116 1075760887 /nfs/dbraw/zinc/76/08/87/1075760887.db2.gz HWVMOPSJCKPIQY-GFCCVEGCSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1cnn(CC(=O)NC[C@@H](O)CN(C)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)c1 ZINC001581347116 1075760879 /nfs/dbraw/zinc/76/08/79/1075760879.db2.gz HWVMOPSJCKPIQY-GFCCVEGCSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1cnn(CC(=O)NC[C@H](O)CN(C)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)c1 ZINC001581347117 1075760911 /nfs/dbraw/zinc/76/09/11/1075760911.db2.gz HWVMOPSJCKPIQY-LBPRGKRZSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1cnn(CC(=O)NC[C@H](O)CN(C)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)c1 ZINC001581347117 1075760906 /nfs/dbraw/zinc/76/09/06/1075760906.db2.gz HWVMOPSJCKPIQY-LBPRGKRZSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1cnn(CC(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)c1 ZINC001581347550 1075760688 /nfs/dbraw/zinc/76/06/88/1075760688.db2.gz NOULIBUYCWAWRJ-UHFFFAOYSA-N -1 3 385.388 -1.297 20 0 GAADHM Cc1cnn(CC(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)c1 ZINC001581347550 1075760685 /nfs/dbraw/zinc/76/06/85/1075760685.db2.gz NOULIBUYCWAWRJ-UHFFFAOYSA-N -1 3 385.388 -1.297 20 0 GAADHM Cc1cnn(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)c1 ZINC001581347852 1075760849 /nfs/dbraw/zinc/76/08/49/1075760849.db2.gz WNHAUAIQBRYNHV-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1cnn(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)c1 ZINC001581347852 1075760841 /nfs/dbraw/zinc/76/08/41/1075760841.db2.gz WNHAUAIQBRYNHV-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1cnn(CC(=O)N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)c1 ZINC001581347853 1075760643 /nfs/dbraw/zinc/76/06/43/1075760643.db2.gz WNHAUAIQBRYNHV-OLZOCXBDSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1cnn(CC(=O)N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)c1 ZINC001581347853 1075760640 /nfs/dbraw/zinc/76/06/40/1075760640.db2.gz WNHAUAIQBRYNHV-OLZOCXBDSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1cnn(CC(=O)NC[C@@H](O)CN(C)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)c1 ZINC001581347970 1075760751 /nfs/dbraw/zinc/76/07/51/1075760751.db2.gz RVRGKQNATZAERQ-GFCCVEGCSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1cnn(CC(=O)NC[C@@H](O)CN(C)C(=O)c2c[nH]c(-c3nnn[n-]3)c2)c1 ZINC001581347970 1075760748 /nfs/dbraw/zinc/76/07/48/1075760748.db2.gz RVRGKQNATZAERQ-GFCCVEGCSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1cnn(CC(=O)NC[C@H](O)CN(C)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)c1 ZINC001581347972 1075761270 /nfs/dbraw/zinc/76/12/70/1075761270.db2.gz RVRGKQNATZAERQ-LBPRGKRZSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1cnn(CC(=O)NC[C@H](O)CN(C)C(=O)c2c[nH]c(-c3nnn[n-]3)c2)c1 ZINC001581347972 1075761268 /nfs/dbraw/zinc/76/12/68/1075761268.db2.gz RVRGKQNATZAERQ-LBPRGKRZSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1cnn(CC(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)c1 ZINC001581348919 1075761136 /nfs/dbraw/zinc/76/11/36/1075761136.db2.gz ADVNLEIHAFYSJC-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1cnn(CC(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)c1 ZINC001581348919 1075761133 /nfs/dbraw/zinc/76/11/33/1075761133.db2.gz ADVNLEIHAFYSJC-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1cnn(CC(=O)NCCN(CCO)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)c1 ZINC001581349120 1075761157 /nfs/dbraw/zinc/76/11/57/1075761157.db2.gz FFPOHLUCRWBFRK-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1cnn(CC(=O)NCCN(CCO)C(=O)c2c[nH]c(-c3nnn[n-]3)c2)c1 ZINC001581349120 1075761154 /nfs/dbraw/zinc/76/11/54/1075761154.db2.gz FFPOHLUCRWBFRK-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1cnn(CC(=O)NCCN(CCO)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)c1 ZINC001581349142 1075761233 /nfs/dbraw/zinc/76/12/33/1075761233.db2.gz FYWIRVJFMFAODD-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1cnn(CC(=O)NCCN(CCO)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)c1 ZINC001581349142 1075761230 /nfs/dbraw/zinc/76/12/30/1075761230.db2.gz FYWIRVJFMFAODD-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1cnn(CC(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)c1 ZINC001581349376 1075761297 /nfs/dbraw/zinc/76/12/97/1075761297.db2.gz NUYLYMGVUFKEFB-OLZOCXBDSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1cnn(CC(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)c1 ZINC001581349376 1075761291 /nfs/dbraw/zinc/76/12/91/1075761291.db2.gz NUYLYMGVUFKEFB-OLZOCXBDSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1cnn(CC(=O)NCCN(CCO)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)c1 ZINC001581349380 1075761407 /nfs/dbraw/zinc/76/14/07/1075761407.db2.gz OCZSUNORGJJREQ-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1cnn(CC(=O)NCCN(CCO)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)c1 ZINC001581349380 1075761404 /nfs/dbraw/zinc/76/14/04/1075761404.db2.gz OCZSUNORGJJREQ-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1cnn(CC(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)c1 ZINC001581349483 1075761554 /nfs/dbraw/zinc/76/15/54/1075761554.db2.gz TWMDYQVRANNEFB-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1cnn(CC(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)c1 ZINC001581349483 1075761547 /nfs/dbraw/zinc/76/15/47/1075761547.db2.gz TWMDYQVRANNEFB-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1cnn(CC(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)c1 ZINC001581349484 1075761613 /nfs/dbraw/zinc/76/16/13/1075761613.db2.gz TWMDYQVRANNEFB-OLZOCXBDSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1cnn(CC(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)c1 ZINC001581349484 1075761608 /nfs/dbraw/zinc/76/16/08/1075761608.db2.gz TWMDYQVRANNEFB-OLZOCXBDSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@H](CO)NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)c1 ZINC001581349858 1075761669 /nfs/dbraw/zinc/76/16/69/1075761669.db2.gz CHHNKJCIDQOIEF-GFCCVEGCSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@H](CO)NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)c1 ZINC001581349858 1075761667 /nfs/dbraw/zinc/76/16/67/1075761667.db2.gz CHHNKJCIDQOIEF-GFCCVEGCSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@@H](CO)NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)c1 ZINC001581349859 1075761575 /nfs/dbraw/zinc/76/15/75/1075761575.db2.gz CHHNKJCIDQOIEF-LBPRGKRZSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@@H](CO)NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)c1 ZINC001581349859 1075761570 /nfs/dbraw/zinc/76/15/70/1075761570.db2.gz CHHNKJCIDQOIEF-LBPRGKRZSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)N[C@@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)c1 ZINC001581349922 1075761442 /nfs/dbraw/zinc/76/14/42/1075761442.db2.gz ILHDUAVTUMNPGH-GFCCVEGCSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)N[C@@H](CO)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)c1 ZINC001581349922 1075761436 /nfs/dbraw/zinc/76/14/36/1075761436.db2.gz ILHDUAVTUMNPGH-GFCCVEGCSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)N[C@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)c1 ZINC001581349923 1075761472 /nfs/dbraw/zinc/76/14/72/1075761472.db2.gz ILHDUAVTUMNPGH-LBPRGKRZSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)N[C@H](CO)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)c1 ZINC001581349923 1075761469 /nfs/dbraw/zinc/76/14/69/1075761469.db2.gz ILHDUAVTUMNPGH-LBPRGKRZSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@H](CO)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)c1 ZINC001581350631 1075761534 /nfs/dbraw/zinc/76/15/34/1075761534.db2.gz JKBVJTCELKRHSC-LLVKDONJSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@H](CO)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)c1 ZINC001581350631 1075761530 /nfs/dbraw/zinc/76/15/30/1075761530.db2.gz JKBVJTCELKRHSC-LLVKDONJSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@@H](CO)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)c1 ZINC001581350632 1075761625 /nfs/dbraw/zinc/76/16/25/1075761625.db2.gz JKBVJTCELKRHSC-NSHDSACASA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@@H](CO)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)c1 ZINC001581350632 1075761620 /nfs/dbraw/zinc/76/16/20/1075761620.db2.gz JKBVJTCELKRHSC-NSHDSACASA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)N[C@@H](CO)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)c1 ZINC001581350641 1075761487 /nfs/dbraw/zinc/76/14/87/1075761487.db2.gz JSJHRKBOGUBHKH-GFCCVEGCSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)N[C@@H](CO)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)c1 ZINC001581350641 1075761482 /nfs/dbraw/zinc/76/14/82/1075761482.db2.gz JSJHRKBOGUBHKH-GFCCVEGCSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)N[C@H](CO)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)c1 ZINC001581350642 1075761639 /nfs/dbraw/zinc/76/16/39/1075761639.db2.gz JSJHRKBOGUBHKH-LBPRGKRZSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)N[C@H](CO)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)c1 ZINC001581350642 1075761634 /nfs/dbraw/zinc/76/16/34/1075761634.db2.gz JSJHRKBOGUBHKH-LBPRGKRZSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@@H](O)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)c1 ZINC001581350711 1075761651 /nfs/dbraw/zinc/76/16/51/1075761651.db2.gz MUFBEHIYVUUGIH-GFCCVEGCSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@@H](O)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)c1 ZINC001581350711 1075761649 /nfs/dbraw/zinc/76/16/49/1075761649.db2.gz MUFBEHIYVUUGIH-GFCCVEGCSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@H](O)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)c1 ZINC001581350712 1075761518 /nfs/dbraw/zinc/76/15/18/1075761518.db2.gz MUFBEHIYVUUGIH-LBPRGKRZSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@H](O)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)c1 ZINC001581350712 1075761513 /nfs/dbraw/zinc/76/15/13/1075761513.db2.gz MUFBEHIYVUUGIH-LBPRGKRZSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@H](CO)NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)c1 ZINC001581350742 1075761423 /nfs/dbraw/zinc/76/14/23/1075761423.db2.gz NVAXKEMFJUMTSK-GFCCVEGCSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@H](CO)NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)c1 ZINC001581350742 1075761420 /nfs/dbraw/zinc/76/14/20/1075761420.db2.gz NVAXKEMFJUMTSK-GFCCVEGCSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@@H](CO)NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)c1 ZINC001581350743 1075761505 /nfs/dbraw/zinc/76/15/05/1075761505.db2.gz NVAXKEMFJUMTSK-LBPRGKRZSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@@H](CO)NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)c1 ZINC001581350743 1075761499 /nfs/dbraw/zinc/76/14/99/1075761499.db2.gz NVAXKEMFJUMTSK-LBPRGKRZSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)c1 ZINC001581350872 1075761459 /nfs/dbraw/zinc/76/14/59/1075761459.db2.gz SUBLWIIYDPYJKG-GFCCVEGCSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)c1 ZINC001581350872 1075761453 /nfs/dbraw/zinc/76/14/53/1075761453.db2.gz SUBLWIIYDPYJKG-GFCCVEGCSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)c1 ZINC001581350873 1075761676 /nfs/dbraw/zinc/76/16/76/1075761676.db2.gz SUBLWIIYDPYJKG-LBPRGKRZSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)c1 ZINC001581350873 1075761674 /nfs/dbraw/zinc/76/16/74/1075761674.db2.gz SUBLWIIYDPYJKG-LBPRGKRZSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@@H](O)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)c1 ZINC001581351010 1075762005 /nfs/dbraw/zinc/76/20/05/1075762005.db2.gz VPRIQOAPQFBNQR-LLVKDONJSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@@H](O)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)c1 ZINC001581351010 1075762001 /nfs/dbraw/zinc/76/20/01/1075762001.db2.gz VPRIQOAPQFBNQR-LLVKDONJSA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@H](O)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)c1 ZINC001581351011 1075761946 /nfs/dbraw/zinc/76/19/46/1075761946.db2.gz VPRIQOAPQFBNQR-NSHDSACASA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1cnn(CCC(=O)NC[C@H](O)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)c1 ZINC001581351011 1075761944 /nfs/dbraw/zinc/76/19/44/1075761944.db2.gz VPRIQOAPQFBNQR-NSHDSACASA-N -1 3 387.404 -1.003 20 0 GAADHM Cc1nnc(CC(=O)N(C)C[C@@H](O)CN(C)c2ccc(-c3nnn[n-]3)nn2)[nH]1 ZINC001581395685 1075762252 /nfs/dbraw/zinc/76/22/52/1075762252.db2.gz HUEXGJYFXPAFHW-JTQLQIEISA-N -1 3 387.408 -1.419 20 0 GAADHM Cc1nnc(CC(=O)N(C)C[C@H](O)CN(C)c2ccc(-c3nnn[n-]3)nn2)[nH]1 ZINC001581395686 1075762212 /nfs/dbraw/zinc/76/22/12/1075762212.db2.gz HUEXGJYFXPAFHW-SNVBAGLBSA-N -1 3 387.408 -1.419 20 0 GAADHM Cc1nnc(CC(=O)N2CCO[C@@H](CNc3cnc(-c4nnn[n-]4)cn3)C2)[nH]1 ZINC001581396418 1075762238 /nfs/dbraw/zinc/76/22/38/1075762238.db2.gz BANPVAXEZOSSJT-JTQLQIEISA-N -1 3 385.392 -1.035 20 0 GAADHM Cc1nnc(CC(=O)N2CCO[C@H](CNc3cnc(-c4nnn[n-]4)cn3)C2)[nH]1 ZINC001581396419 1075762259 /nfs/dbraw/zinc/76/22/59/1075762259.db2.gz BANPVAXEZOSSJT-SNVBAGLBSA-N -1 3 385.392 -1.035 20 0 GAADHM Cc1nnc(CC(=O)NC[C@H]2COCCN2c2ccc(-c3nnn[n-]3)nn2)[nH]1 ZINC001581397207 1075762314 /nfs/dbraw/zinc/76/23/14/1075762314.db2.gz CMMFQQZOENABGJ-JTQLQIEISA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@@H]2COCCN2c2ccc(-c3nnn[n-]3)nn2)[nH]1 ZINC001581397208 1075762287 /nfs/dbraw/zinc/76/22/87/1075762287.db2.gz CMMFQQZOENABGJ-SNVBAGLBSA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@H]2CN(c3ccc(-c4nnn[n-]4)nn3)CCO2)[nH]1 ZINC001581397585 1075762543 /nfs/dbraw/zinc/76/25/43/1075762543.db2.gz GDPWLLBNHCXWBN-JTQLQIEISA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@@H]2CN(c3ccc(-c4nnn[n-]4)nn3)CCO2)[nH]1 ZINC001581397586 1075762559 /nfs/dbraw/zinc/76/25/59/1075762559.db2.gz GDPWLLBNHCXWBN-SNVBAGLBSA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@H]2COCCN2c2ccnc(-c3nn[n-]n3)n2)[nH]1 ZINC001581397857 1075762492 /nfs/dbraw/zinc/76/24/92/1075762492.db2.gz IMQGGYXHURVOCN-JTQLQIEISA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@@H]2COCCN2c2ccnc(-c3nn[n-]n3)n2)[nH]1 ZINC001581397858 1075762521 /nfs/dbraw/zinc/76/25/21/1075762521.db2.gz IMQGGYXHURVOCN-SNVBAGLBSA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@H]2CN(c3nccnc3-c3nn[n-]n3)CCO2)[nH]1 ZINC001581397896 1075762683 /nfs/dbraw/zinc/76/26/83/1075762683.db2.gz JHHYIQDKHFEGLX-JTQLQIEISA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@H]2CN(c3nccnc3-c3nnn[n-]3)CCO2)[nH]1 ZINC001581397896 1075762680 /nfs/dbraw/zinc/76/26/80/1075762680.db2.gz JHHYIQDKHFEGLX-JTQLQIEISA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@@H]2CN(c3nccnc3-c3nn[n-]n3)CCO2)[nH]1 ZINC001581397897 1075762659 /nfs/dbraw/zinc/76/26/59/1075762659.db2.gz JHHYIQDKHFEGLX-SNVBAGLBSA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@@H]2CN(c3nccnc3-c3nnn[n-]3)CCO2)[nH]1 ZINC001581397897 1075762652 /nfs/dbraw/zinc/76/26/52/1075762652.db2.gz JHHYIQDKHFEGLX-SNVBAGLBSA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@H]2CN(c3cncc(-c4nn[n-]n4)n3)CCO2)[nH]1 ZINC001581398054 1075762507 /nfs/dbraw/zinc/76/25/07/1075762507.db2.gz MZZHKPTZPAQIQA-JTQLQIEISA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@H]2CN(c3cncc(-c4nnn[n-]4)n3)CCO2)[nH]1 ZINC001581398054 1075762503 /nfs/dbraw/zinc/76/25/03/1075762503.db2.gz MZZHKPTZPAQIQA-JTQLQIEISA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@@H]2CN(c3cncc(-c4nn[n-]n4)n3)CCO2)[nH]1 ZINC001581398055 1075762576 /nfs/dbraw/zinc/76/25/76/1075762576.db2.gz MZZHKPTZPAQIQA-SNVBAGLBSA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@@H]2CN(c3cncc(-c4nnn[n-]4)n3)CCO2)[nH]1 ZINC001581398055 1075762572 /nfs/dbraw/zinc/76/25/72/1075762572.db2.gz MZZHKPTZPAQIQA-SNVBAGLBSA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@H]2COCCN2c2nccnc2-c2nn[n-]n2)[nH]1 ZINC001581398225 1075762614 /nfs/dbraw/zinc/76/26/14/1075762614.db2.gz OQBIOZVRLKYLNB-JTQLQIEISA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@H]2COCCN2c2nccnc2-c2nnn[n-]2)[nH]1 ZINC001581398225 1075762610 /nfs/dbraw/zinc/76/26/10/1075762610.db2.gz OQBIOZVRLKYLNB-JTQLQIEISA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@@H]2COCCN2c2nccnc2-c2nn[n-]n2)[nH]1 ZINC001581398226 1075762602 /nfs/dbraw/zinc/76/26/02/1075762602.db2.gz OQBIOZVRLKYLNB-SNVBAGLBSA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@@H]2COCCN2c2nccnc2-c2nnn[n-]2)[nH]1 ZINC001581398226 1075762599 /nfs/dbraw/zinc/76/25/99/1075762599.db2.gz OQBIOZVRLKYLNB-SNVBAGLBSA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@H]2CN(c3cnc(-c4nnn[n-]4)cn3)CCO2)[nH]1 ZINC001581398229 1075762698 /nfs/dbraw/zinc/76/26/98/1075762698.db2.gz OUVPNHGLDUECKC-JTQLQIEISA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@@H]2CN(c3cnc(-c4nnn[n-]4)cn3)CCO2)[nH]1 ZINC001581398230 1075762533 /nfs/dbraw/zinc/76/25/33/1075762533.db2.gz OUVPNHGLDUECKC-SNVBAGLBSA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@H]2COCCN2c2cncc(-c3nn[n-]n3)n2)[nH]1 ZINC001581398258 1075762720 /nfs/dbraw/zinc/76/27/20/1075762720.db2.gz PSBNQZVBVMCTPB-JTQLQIEISA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@H]2COCCN2c2cncc(-c3nnn[n-]3)n2)[nH]1 ZINC001581398258 1075762716 /nfs/dbraw/zinc/76/27/16/1075762716.db2.gz PSBNQZVBVMCTPB-JTQLQIEISA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@@H]2COCCN2c2cncc(-c3nn[n-]n3)n2)[nH]1 ZINC001581398259 1075762734 /nfs/dbraw/zinc/76/27/34/1075762734.db2.gz PSBNQZVBVMCTPB-SNVBAGLBSA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@@H]2COCCN2c2cncc(-c3nnn[n-]3)n2)[nH]1 ZINC001581398259 1075762731 /nfs/dbraw/zinc/76/27/31/1075762731.db2.gz PSBNQZVBVMCTPB-SNVBAGLBSA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@H]2CN(c3ccnc(-c4nn[n-]n4)n3)CCO2)[nH]1 ZINC001581398788 1075763049 /nfs/dbraw/zinc/76/30/49/1075763049.db2.gz YXFVLJWKNQVDJP-JTQLQIEISA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@@H]2CN(c3ccnc(-c4nn[n-]n4)n3)CCO2)[nH]1 ZINC001581398789 1075763058 /nfs/dbraw/zinc/76/30/58/1075763058.db2.gz YXFVLJWKNQVDJP-SNVBAGLBSA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NCCOCCN(C)c2cncc(-c3nn[n-]n3)n2)[nH]1 ZINC001581399011 1075763009 /nfs/dbraw/zinc/76/30/09/1075763009.db2.gz MODUZJYDSBLLPK-UHFFFAOYSA-N -1 3 387.408 -1.105 20 0 GAADHM Cc1nnc(CC(=O)NCCOCCN(C)c2cncc(-c3nnn[n-]3)n2)[nH]1 ZINC001581399011 1075763003 /nfs/dbraw/zinc/76/30/03/1075763003.db2.gz MODUZJYDSBLLPK-UHFFFAOYSA-N -1 3 387.408 -1.105 20 0 GAADHM Cc1[nH]nc(NC(=O)c2cc3n(n2)CCN(C)S3(=O)=O)c1-c1nnn[n-]1 ZINC001581402650 1075763191 /nfs/dbraw/zinc/76/31/91/1075763191.db2.gz CZKSPCIZIATJFI-UHFFFAOYSA-N -1 3 378.378 -1.019 20 0 GAADHM Cc1[nH]nc(NC(=O)[C@H]2[C@@H](O)C(=O)N(C)[C@@H]2c2cnn(C)c2)c1-c1nnn[n-]1 ZINC001581402745 1075763295 /nfs/dbraw/zinc/76/32/95/1075763295.db2.gz IEYAQKLKLXLGCW-GMTAPVOTSA-N -1 3 386.376 -1.239 20 0 GAADHM Cc1[nH]nc(NC(=O)c2cnn3c2S(=O)(=O)N(C)CC3)c1-c1nnn[n-]1 ZINC001581403891 1075763283 /nfs/dbraw/zinc/76/32/83/1075763283.db2.gz XKVXCTHCQPTJSZ-UHFFFAOYSA-N -1 3 378.378 -1.019 20 0 GAADHM Cc1n[nH]nc1C(=O)N1CCOC[C@@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581405516 1075763227 /nfs/dbraw/zinc/76/32/27/1075763227.db2.gz FBSNCNWHMDRBAE-JTQLQIEISA-N -1 3 386.376 -1.108 20 0 GAADHM Cc1n[nH]nc1C(=O)N1CCOC[C@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581405517 1075763180 /nfs/dbraw/zinc/76/31/80/1075763180.db2.gz FBSNCNWHMDRBAE-SNVBAGLBSA-N -1 3 386.376 -1.108 20 0 GAADHM Cc1n[nH]nc1C(=O)N1CCO[C@@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581405670 1075763243 /nfs/dbraw/zinc/76/32/43/1075763243.db2.gz JQTJHRANTYOAEZ-JTQLQIEISA-N -1 3 386.376 -1.108 20 0 GAADHM Cc1n[nH]nc1C(=O)N1CCO[C@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581405671 1075763368 /nfs/dbraw/zinc/76/33/68/1075763368.db2.gz JQTJHRANTYOAEZ-SNVBAGLBSA-N -1 3 386.376 -1.108 20 0 GAADHM Cc1n[nH]nc1C(=O)N1CCO[C@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581405746 1075763398 /nfs/dbraw/zinc/76/33/98/1075763398.db2.gz LWFULIJLBGVTCG-SECBINFHSA-N -1 3 386.376 -1.108 20 0 GAADHM Cc1n[nH]nc1C(=O)N1CCO[C@@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581405747 1075763412 /nfs/dbraw/zinc/76/34/12/1075763412.db2.gz LWFULIJLBGVTCG-VIFPVBQESA-N -1 3 386.376 -1.108 20 0 GAADHM Cc1n[nH]nc1C(=O)N1CCOC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581405821 1075763255 /nfs/dbraw/zinc/76/32/55/1075763255.db2.gz OPYSGTZMJTZTQC-SECBINFHSA-N -1 3 386.376 -1.108 20 0 GAADHM Cc1n[nH]nc1C(=O)N1CCOC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581405822 1075763307 /nfs/dbraw/zinc/76/33/07/1075763307.db2.gz OPYSGTZMJTZTQC-VIFPVBQESA-N -1 3 386.376 -1.108 20 0 GAADHM Cc1nn[nH]c1C(=O)NCCN1CCN(c2cnc(-c3nnn[n-]3)cn2)CC1 ZINC001581407942 1075763742 /nfs/dbraw/zinc/76/37/42/1075763742.db2.gz AHYBCLCKHTUOJU-UHFFFAOYSA-N -1 3 384.408 -1.365 20 0 GAADHM Cc1nn[nH]c1C(=O)NC[C@H]1COCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581408059 1075763662 /nfs/dbraw/zinc/76/36/62/1075763662.db2.gz GAGLWWWJHZFJMK-JTQLQIEISA-N -1 3 386.376 -1.108 20 0 GAADHM Cc1nn[nH]c1C(=O)NC[C@H]1COCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581408059 1075763659 /nfs/dbraw/zinc/76/36/59/1075763659.db2.gz GAGLWWWJHZFJMK-JTQLQIEISA-N -1 3 386.376 -1.108 20 0 GAADHM Cc1nn[nH]c1C(=O)NC[C@@H]1COCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581408060 1075763606 /nfs/dbraw/zinc/76/36/06/1075763606.db2.gz GAGLWWWJHZFJMK-SNVBAGLBSA-N -1 3 386.376 -1.108 20 0 GAADHM Cc1nn[nH]c1C(=O)NC[C@@H]1COCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581408060 1075763598 /nfs/dbraw/zinc/76/35/98/1075763598.db2.gz GAGLWWWJHZFJMK-SNVBAGLBSA-N -1 3 386.376 -1.108 20 0 GAADHM Cc1nn[nH]c1C(=O)NCCN1CCN(c2ccc(-c3nnn[n-]3)nn2)CC1 ZINC001581408129 1075763638 /nfs/dbraw/zinc/76/36/38/1075763638.db2.gz HVSDDIOUJXRROO-UHFFFAOYSA-N -1 3 384.408 -1.365 20 0 GAADHM Cc1nn[nH]c1C(=O)NCCN1CCN(c2nccnc2-c2nn[n-]n2)CC1 ZINC001581408191 1075763726 /nfs/dbraw/zinc/76/37/26/1075763726.db2.gz KVGYYFRAHTUFNW-UHFFFAOYSA-N -1 3 384.408 -1.365 20 0 GAADHM Cc1nn[nH]c1C(=O)NCCN1CCN(c2nccnc2-c2nnn[n-]2)CC1 ZINC001581408191 1075763723 /nfs/dbraw/zinc/76/37/23/1075763723.db2.gz KVGYYFRAHTUFNW-UHFFFAOYSA-N -1 3 384.408 -1.365 20 0 GAADHM Cc1nn[nH]c1C(=O)NC[C@@H]1COCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581408304 1075763758 /nfs/dbraw/zinc/76/37/58/1075763758.db2.gz QYWIPJCHSOYXQT-SECBINFHSA-N -1 3 386.376 -1.108 20 0 GAADHM Cc1nn[nH]c1C(=O)NC[C@H]1COCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581408305 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Cc1nc(N(C)C[C@H](O)CN(C)C(=O)[C@H](C)NC(N)=O)ccc1-c1nn[n-]n1 ZINC001581459915 1075764559 /nfs/dbraw/zinc/76/45/59/1075764559.db2.gz SZPTVTOVBVHJCZ-QWRGUYRKSA-N -1 3 391.436 -1.118 20 0 GAADHM Cc1nc(N(C)C[C@H](O)CN(C)C(=O)[C@H](C)NC(N)=O)ccc1-c1nnn[n-]1 ZINC001581459915 1075764557 /nfs/dbraw/zinc/76/45/57/1075764557.db2.gz SZPTVTOVBVHJCZ-QWRGUYRKSA-N -1 3 391.436 -1.118 20 0 GAADHM Cc1nc(N(C)C[C@@H](O)CN(C)C(=O)[C@H](C)NC(N)=O)ccc1-c1nn[n-]n1 ZINC001581459917 1075764433 /nfs/dbraw/zinc/76/44/33/1075764433.db2.gz SZPTVTOVBVHJCZ-WDEREUQCSA-N -1 3 391.436 -1.118 20 0 GAADHM Cc1nc(N(C)C[C@@H](O)CN(C)C(=O)[C@H](C)NC(N)=O)ccc1-c1nnn[n-]1 ZINC001581459917 1075764428 /nfs/dbraw/zinc/76/44/28/1075764428.db2.gz SZPTVTOVBVHJCZ-WDEREUQCSA-N -1 3 391.436 -1.118 20 0 GAADHM Cc1nc(N(C)C[C@H](O)CN(C)C(=O)c2nnn(C)n2)ccc1-c1nn[n-]n1 ZINC001581460160 1075764505 /nfs/dbraw/zinc/76/45/05/1075764505.db2.gz WJGRBDFYAZLTLS-JTQLQIEISA-N -1 3 387.408 -1.337 20 0 GAADHM Cc1nc(N(C)C[C@H](O)CN(C)C(=O)c2nnn(C)n2)ccc1-c1nnn[n-]1 ZINC001581460160 1075764501 /nfs/dbraw/zinc/76/45/01/1075764501.db2.gz WJGRBDFYAZLTLS-JTQLQIEISA-N -1 3 387.408 -1.337 20 0 GAADHM Cc1nc(N(C)C[C@@H](O)CN(C)C(=O)c2nnn(C)n2)ccc1-c1nn[n-]n1 ZINC001581460161 1075764317 /nfs/dbraw/zinc/76/43/17/1075764317.db2.gz WJGRBDFYAZLTLS-SNVBAGLBSA-N -1 3 387.408 -1.337 20 0 GAADHM Cc1nc(N(C)C[C@@H](O)CN(C)C(=O)c2nnn(C)n2)ccc1-c1nnn[n-]1 ZINC001581460161 1075764316 /nfs/dbraw/zinc/76/43/16/1075764316.db2.gz WJGRBDFYAZLTLS-SNVBAGLBSA-N -1 3 387.408 -1.337 20 0 GAADHM Cc1nc(N(C)C[C@H](O)CN(C)C(=O)[C@H]2COC(=O)N2)ccc1-c1nn[n-]n1 ZINC001581460331 1075764470 /nfs/dbraw/zinc/76/44/70/1075764470.db2.gz YVLHGSZISHEVAR-CMPLNLGQSA-N -1 3 390.404 -1.066 20 0 GAADHM Cc1nc(N(C)C[C@H](O)CN(C)C(=O)[C@H]2COC(=O)N2)ccc1-c1nnn[n-]1 ZINC001581460331 1075764464 /nfs/dbraw/zinc/76/44/64/1075764464.db2.gz YVLHGSZISHEVAR-CMPLNLGQSA-N -1 3 390.404 -1.066 20 0 GAADHM Cc1nc(N(C)C[C@H](O)CN(C)C(=O)[C@@H]2COC(=O)N2)ccc1-c1nn[n-]n1 ZINC001581460334 1075764488 /nfs/dbraw/zinc/76/44/88/1075764488.db2.gz YVLHGSZISHEVAR-JQWIXIFHSA-N -1 3 390.404 -1.066 20 0 GAADHM Cc1nc(N(C)C[C@H](O)CN(C)C(=O)[C@@H]2COC(=O)N2)ccc1-c1nnn[n-]1 ZINC001581460334 1075764481 /nfs/dbraw/zinc/76/44/81/1075764481.db2.gz YVLHGSZISHEVAR-JQWIXIFHSA-N -1 3 390.404 -1.066 20 0 GAADHM Cc1nc(N(C)C[C@@H](O)CN(C)C(=O)[C@@H]2COC(=O)N2)ccc1-c1nn[n-]n1 ZINC001581460336 1075764371 /nfs/dbraw/zinc/76/43/71/1075764371.db2.gz YVLHGSZISHEVAR-PWSUYJOCSA-N -1 3 390.404 -1.066 20 0 GAADHM Cc1nc(N(C)C[C@@H](O)CN(C)C(=O)[C@@H]2COC(=O)N2)ccc1-c1nnn[n-]1 ZINC001581460336 1075764365 /nfs/dbraw/zinc/76/43/65/1075764365.db2.gz YVLHGSZISHEVAR-PWSUYJOCSA-N -1 3 390.404 -1.066 20 0 GAADHM Cc1nc(N(C)C[C@@H](O)CN(C)C(=O)[C@H]2COC(=O)N2)ccc1-c1nn[n-]n1 ZINC001581460338 1075764415 /nfs/dbraw/zinc/76/44/15/1075764415.db2.gz YVLHGSZISHEVAR-ZYHUDNBSSA-N -1 3 390.404 -1.066 20 0 GAADHM Cc1nc(N(C)C[C@@H](O)CN(C)C(=O)[C@H]2COC(=O)N2)ccc1-c1nnn[n-]1 ZINC001581460338 1075764410 /nfs/dbraw/zinc/76/44/10/1075764410.db2.gz YVLHGSZISHEVAR-ZYHUDNBSSA-N -1 3 390.404 -1.066 20 0 GAADHM Cc1nc(N(C)CCN(C)C(=O)CN2CCNC(=O)C2)ccc1-c1nn[n-]n1 ZINC001581461710 1075764398 /nfs/dbraw/zinc/76/43/98/1075764398.db2.gz OEYBRAGXQINZFJ-UHFFFAOYSA-N -1 3 387.448 -1.103 20 0 GAADHM Cc1nc(N(C)CCN(C)C(=O)CN2CCNC(=O)C2)ccc1-c1nnn[n-]1 ZINC001581461710 1075764392 /nfs/dbraw/zinc/76/43/92/1075764392.db2.gz OEYBRAGXQINZFJ-UHFFFAOYSA-N -1 3 387.448 -1.103 20 0 GAADHM Cc1nc(N(C)CCNC(=O)CN2CCN(C)C(=O)C2)ccc1-c1nn[n-]n1 ZINC001581462478 1075764354 /nfs/dbraw/zinc/76/43/54/1075764354.db2.gz CLWOXIDBUSMWKL-UHFFFAOYSA-N -1 3 387.448 -1.103 20 0 GAADHM Cc1nc(N(C)CCNC(=O)CN2CCN(C)C(=O)C2)ccc1-c1nnn[n-]1 ZINC001581462478 1075764350 /nfs/dbraw/zinc/76/43/50/1075764350.db2.gz CLWOXIDBUSMWKL-UHFFFAOYSA-N -1 3 387.448 -1.103 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)[C@H]3CCS(=O)(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581470456 1075764520 /nfs/dbraw/zinc/76/45/20/1075764520.db2.gz FZHYCGKLECQRPQ-CMPLNLGQSA-N -1 3 392.445 -1.043 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)[C@H]3CCS(=O)(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581470456 1075764517 /nfs/dbraw/zinc/76/45/17/1075764517.db2.gz FZHYCGKLECQRPQ-CMPLNLGQSA-N -1 3 392.445 -1.043 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)[C@@H]3CCS(=O)(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581470457 1075764911 /nfs/dbraw/zinc/76/49/11/1075764911.db2.gz FZHYCGKLECQRPQ-JQWIXIFHSA-N -1 3 392.445 -1.043 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)[C@@H]3CCS(=O)(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581470457 1075764910 /nfs/dbraw/zinc/76/49/10/1075764910.db2.gz FZHYCGKLECQRPQ-JQWIXIFHSA-N -1 3 392.445 -1.043 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)[C@@H]3CCS(=O)(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581470458 1075764878 /nfs/dbraw/zinc/76/48/78/1075764878.db2.gz FZHYCGKLECQRPQ-PWSUYJOCSA-N -1 3 392.445 -1.043 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)[C@@H]3CCS(=O)(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581470458 1075764874 /nfs/dbraw/zinc/76/48/74/1075764874.db2.gz FZHYCGKLECQRPQ-PWSUYJOCSA-N -1 3 392.445 -1.043 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)[C@H]3CCS(=O)(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581470459 1075764837 /nfs/dbraw/zinc/76/48/37/1075764837.db2.gz FZHYCGKLECQRPQ-ZYHUDNBSSA-N -1 3 392.445 -1.043 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)[C@H]3CCS(=O)(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581470459 1075764830 /nfs/dbraw/zinc/76/48/30/1075764830.db2.gz FZHYCGKLECQRPQ-ZYHUDNBSSA-N -1 3 392.445 -1.043 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)CN3CCNC(=O)C3)C2)ccc1-c1nn[n-]n1 ZINC001581470637 1075764900 /nfs/dbraw/zinc/76/49/00/1075764900.db2.gz HYINOAGEPVAICH-GFCCVEGCSA-N -1 3 385.432 -1.303 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)CN3CCNC(=O)C3)C2)ccc1-c1nnn[n-]1 ZINC001581470637 1075764899 /nfs/dbraw/zinc/76/48/99/1075764899.db2.gz HYINOAGEPVAICH-GFCCVEGCSA-N -1 3 385.432 -1.303 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)CN3CCNC(=O)C3)C2)ccc1-c1nn[n-]n1 ZINC001581470638 1075764817 /nfs/dbraw/zinc/76/48/17/1075764817.db2.gz HYINOAGEPVAICH-LBPRGKRZSA-N -1 3 385.432 -1.303 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)CN3CCNC(=O)C3)C2)ccc1-c1nnn[n-]1 ZINC001581470638 1075764811 /nfs/dbraw/zinc/76/48/11/1075764811.db2.gz HYINOAGEPVAICH-LBPRGKRZSA-N -1 3 385.432 -1.303 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)Cn3cnnn3)[C@@H](O)C2)ccc1-c1nn[n-]n1 ZINC001581472727 1075764761 /nfs/dbraw/zinc/76/47/61/1075764761.db2.gz GORDOMTVDLJOHN-NEPJUHHUSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)Cn3cnnn3)[C@@H](O)C2)ccc1-c1nnn[n-]1 ZINC001581472727 1075764758 /nfs/dbraw/zinc/76/47/58/1075764758.db2.gz GORDOMTVDLJOHN-NEPJUHHUSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)Cn3cnnn3)[C@H](O)C2)ccc1-c1nn[n-]n1 ZINC001581472728 1075764797 /nfs/dbraw/zinc/76/47/97/1075764797.db2.gz GORDOMTVDLJOHN-NWDGAFQWSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)Cn3cnnn3)[C@H](O)C2)ccc1-c1nnn[n-]1 ZINC001581472728 1075764789 /nfs/dbraw/zinc/76/47/89/1075764789.db2.gz GORDOMTVDLJOHN-NWDGAFQWSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)Cn3cnnn3)[C@@H](O)C2)ccc1-c1nn[n-]n1 ZINC001581472729 1075764907 /nfs/dbraw/zinc/76/49/07/1075764907.db2.gz GORDOMTVDLJOHN-RYUDHWBXSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)Cn3cnnn3)[C@@H](O)C2)ccc1-c1nnn[n-]1 ZINC001581472729 1075764904 /nfs/dbraw/zinc/76/49/04/1075764904.db2.gz GORDOMTVDLJOHN-RYUDHWBXSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)Cn3cnnn3)[C@H](O)C2)ccc1-c1nn[n-]n1 ZINC001581472730 1075764914 /nfs/dbraw/zinc/76/49/14/1075764914.db2.gz GORDOMTVDLJOHN-VXGBXAGGSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)Cn3cnnn3)[C@H](O)C2)ccc1-c1nnn[n-]1 ZINC001581472730 1075764913 /nfs/dbraw/zinc/76/49/13/1075764913.db2.gz GORDOMTVDLJOHN-VXGBXAGGSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)c3nnn(C)n3)[C@H](O)C2)ccc1-c1nn[n-]n1 ZINC001581472796 1075764894 /nfs/dbraw/zinc/76/48/94/1075764894.db2.gz IKDSTDOIBNDVRQ-GHMZBOCLSA-N -1 3 385.392 -1.537 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)c3nnn(C)n3)[C@H](O)C2)ccc1-c1nnn[n-]1 ZINC001581472796 1075764891 /nfs/dbraw/zinc/76/48/91/1075764891.db2.gz IKDSTDOIBNDVRQ-GHMZBOCLSA-N -1 3 385.392 -1.537 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)c3nnn(C)n3)[C@@H](O)C2)ccc1-c1nn[n-]n1 ZINC001581472797 1075764917 /nfs/dbraw/zinc/76/49/17/1075764917.db2.gz IKDSTDOIBNDVRQ-MNOVXSKESA-N -1 3 385.392 -1.537 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)c3nnn(C)n3)[C@@H](O)C2)ccc1-c1nnn[n-]1 ZINC001581472797 1075764916 /nfs/dbraw/zinc/76/49/16/1075764916.db2.gz IKDSTDOIBNDVRQ-MNOVXSKESA-N -1 3 385.392 -1.537 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)c3nnn(C)n3)[C@@H](O)C2)ccc1-c1nn[n-]n1 ZINC001581472798 1075764866 /nfs/dbraw/zinc/76/48/66/1075764866.db2.gz IKDSTDOIBNDVRQ-QWRGUYRKSA-N -1 3 385.392 -1.537 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)c3nnn(C)n3)[C@@H](O)C2)ccc1-c1nnn[n-]1 ZINC001581472798 1075764860 /nfs/dbraw/zinc/76/48/60/1075764860.db2.gz IKDSTDOIBNDVRQ-QWRGUYRKSA-N -1 3 385.392 -1.537 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)c3nnn(C)n3)[C@H](O)C2)ccc1-c1nn[n-]n1 ZINC001581472799 1075764922 /nfs/dbraw/zinc/76/49/22/1075764922.db2.gz IKDSTDOIBNDVRQ-WDEREUQCSA-N -1 3 385.392 -1.537 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)c3nnn(C)n3)[C@H](O)C2)ccc1-c1nnn[n-]1 ZINC001581472799 1075764921 /nfs/dbraw/zinc/76/49/21/1075764921.db2.gz IKDSTDOIBNDVRQ-WDEREUQCSA-N -1 3 385.392 -1.537 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)[C@H]3CNC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581472952 1075764887 /nfs/dbraw/zinc/76/48/87/1075764887.db2.gz MAXOWPUMBMKMNS-BDJLRTHQSA-N -1 3 387.404 -1.691 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)[C@H]3CNC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581472952 1075764886 /nfs/dbraw/zinc/76/48/86/1075764886.db2.gz MAXOWPUMBMKMNS-BDJLRTHQSA-N -1 3 387.404 -1.691 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)[C@H]3CNC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581472953 1075764733 /nfs/dbraw/zinc/76/47/33/1075764733.db2.gz MAXOWPUMBMKMNS-BZNIZROVSA-N -1 3 387.404 -1.691 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)[C@H]3CNC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581472953 1075764729 /nfs/dbraw/zinc/76/47/29/1075764729.db2.gz MAXOWPUMBMKMNS-BZNIZROVSA-N -1 3 387.404 -1.691 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)[C@@H]3CNC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581472954 1075764852 /nfs/dbraw/zinc/76/48/52/1075764852.db2.gz MAXOWPUMBMKMNS-MEDUHNTESA-N -1 3 387.404 -1.691 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)[C@@H]3CNC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581472954 1075764848 /nfs/dbraw/zinc/76/48/48/1075764848.db2.gz MAXOWPUMBMKMNS-MEDUHNTESA-N -1 3 387.404 -1.691 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)[C@@H]3CNC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581472955 1075765212 /nfs/dbraw/zinc/76/52/12/1075765212.db2.gz MAXOWPUMBMKMNS-ZBEGNZNMSA-N -1 3 387.404 -1.691 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)[C@@H]3CNC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581472955 1075765210 /nfs/dbraw/zinc/76/52/10/1075765210.db2.gz MAXOWPUMBMKMNS-ZBEGNZNMSA-N -1 3 387.404 -1.691 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)Cn3ncnn3)[C@@H](O)C2)ccc1-c1nn[n-]n1 ZINC001581472971 1075765241 /nfs/dbraw/zinc/76/52/41/1075765241.db2.gz MMOGZMJZEBFLND-NEPJUHHUSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)Cn3ncnn3)[C@@H](O)C2)ccc1-c1nnn[n-]1 ZINC001581472971 1075765235 /nfs/dbraw/zinc/76/52/35/1075765235.db2.gz MMOGZMJZEBFLND-NEPJUHHUSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)Cn3ncnn3)[C@H](O)C2)ccc1-c1nn[n-]n1 ZINC001581472972 1075765256 /nfs/dbraw/zinc/76/52/56/1075765256.db2.gz MMOGZMJZEBFLND-NWDGAFQWSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)Cn3ncnn3)[C@H](O)C2)ccc1-c1nnn[n-]1 ZINC001581472972 1075765249 /nfs/dbraw/zinc/76/52/49/1075765249.db2.gz MMOGZMJZEBFLND-NWDGAFQWSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)Cn3ncnn3)[C@@H](O)C2)ccc1-c1nn[n-]n1 ZINC001581472973 1075765227 /nfs/dbraw/zinc/76/52/27/1075765227.db2.gz MMOGZMJZEBFLND-RYUDHWBXSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)Cn3ncnn3)[C@@H](O)C2)ccc1-c1nnn[n-]1 ZINC001581472973 1075765222 /nfs/dbraw/zinc/76/52/22/1075765222.db2.gz MMOGZMJZEBFLND-RYUDHWBXSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)Cn3ncnn3)[C@H](O)C2)ccc1-c1nn[n-]n1 ZINC001581472974 1075765204 /nfs/dbraw/zinc/76/52/04/1075765204.db2.gz MMOGZMJZEBFLND-VXGBXAGGSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)Cn3ncnn3)[C@H](O)C2)ccc1-c1nnn[n-]1 ZINC001581472974 1075765201 /nfs/dbraw/zinc/76/52/01/1075765201.db2.gz MMOGZMJZEBFLND-VXGBXAGGSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)[C@H]3COC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581473210 1075765078 /nfs/dbraw/zinc/76/50/78/1075765078.db2.gz RTKFAEZTNCZCOS-BDJLRTHQSA-N -1 3 388.388 -1.264 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)[C@H]3COC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581473210 1075765072 /nfs/dbraw/zinc/76/50/72/1075765072.db2.gz RTKFAEZTNCZCOS-BDJLRTHQSA-N -1 3 388.388 -1.264 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)[C@H]3COC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581473211 1075765147 /nfs/dbraw/zinc/76/51/47/1075765147.db2.gz RTKFAEZTNCZCOS-BZNIZROVSA-N -1 3 388.388 -1.264 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)[C@H]3COC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581473211 1075765145 /nfs/dbraw/zinc/76/51/45/1075765145.db2.gz RTKFAEZTNCZCOS-BZNIZROVSA-N -1 3 388.388 -1.264 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)[C@@H]3COC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581473212 1075765120 /nfs/dbraw/zinc/76/51/20/1075765120.db2.gz RTKFAEZTNCZCOS-MEDUHNTESA-N -1 3 388.388 -1.264 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)[C@@H]3COC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581473212 1075765117 /nfs/dbraw/zinc/76/51/17/1075765117.db2.gz RTKFAEZTNCZCOS-MEDUHNTESA-N -1 3 388.388 -1.264 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)[C@@H]3COC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581473213 1075765187 /nfs/dbraw/zinc/76/51/87/1075765187.db2.gz RTKFAEZTNCZCOS-ZBEGNZNMSA-N -1 3 388.388 -1.264 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)[C@@H]3COC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581473213 1075765183 /nfs/dbraw/zinc/76/51/83/1075765183.db2.gz RTKFAEZTNCZCOS-ZBEGNZNMSA-N -1 3 388.388 -1.264 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)[C@@H]3CC(=O)NC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581473448 1075765167 /nfs/dbraw/zinc/76/51/67/1075765167.db2.gz YUTFTFUDPYYDAH-KOLCDFICSA-N -1 3 385.388 -1.137 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)[C@@H]3CC(=O)NC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581473448 1075765163 /nfs/dbraw/zinc/76/51/63/1075765163.db2.gz YUTFTFUDPYYDAH-KOLCDFICSA-N -1 3 385.388 -1.137 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)Cn3cncn3)C2)ccc1-c1nn[n-]n1 ZINC001581473752 1075765140 /nfs/dbraw/zinc/76/51/40/1075765140.db2.gz GEKDIXLVZQRNPJ-INIZCTEOSA-N -1 3 384.404 -1.081 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)Cn3cncn3)C2)ccc1-c1nnn[n-]1 ZINC001581473752 1075765138 /nfs/dbraw/zinc/76/51/38/1075765138.db2.gz GEKDIXLVZQRNPJ-INIZCTEOSA-N -1 3 384.404 -1.081 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)Cn3cncn3)C2)ccc1-c1nn[n-]n1 ZINC001581473753 1075765156 /nfs/dbraw/zinc/76/51/56/1075765156.db2.gz GEKDIXLVZQRNPJ-MRXNPFEDSA-N -1 3 384.404 -1.081 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)Cn3cncn3)C2)ccc1-c1nnn[n-]1 ZINC001581473753 1075765154 /nfs/dbraw/zinc/76/51/54/1075765154.db2.gz GEKDIXLVZQRNPJ-MRXNPFEDSA-N -1 3 384.404 -1.081 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)Cn3cnnn3)C2)ccc1-c1nn[n-]n1 ZINC001581473847 1075765134 /nfs/dbraw/zinc/76/51/34/1075765134.db2.gz IBGWYWPZWAYIEH-HNNXBMFYSA-N -1 3 385.392 -1.686 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)Cn3cnnn3)C2)ccc1-c1nnn[n-]1 ZINC001581473847 1075765133 /nfs/dbraw/zinc/76/51/33/1075765133.db2.gz IBGWYWPZWAYIEH-HNNXBMFYSA-N -1 3 385.392 -1.686 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)Cn3cnnn3)C2)ccc1-c1nn[n-]n1 ZINC001581473848 1075765128 /nfs/dbraw/zinc/76/51/28/1075765128.db2.gz IBGWYWPZWAYIEH-OAHLLOKOSA-N -1 3 385.392 -1.686 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)Cn3cnnn3)C2)ccc1-c1nnn[n-]1 ZINC001581473848 1075765125 /nfs/dbraw/zinc/76/51/25/1075765125.db2.gz IBGWYWPZWAYIEH-OAHLLOKOSA-N -1 3 385.392 -1.686 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)[C@H]3CCC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581474152 1075765061 /nfs/dbraw/zinc/76/50/61/1075765061.db2.gz ORBBBESGRFHKRZ-PXAZEXFGSA-N -1 3 386.416 -1.094 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)[C@H]3CCC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581474152 1075765056 /nfs/dbraw/zinc/76/50/56/1075765056.db2.gz ORBBBESGRFHKRZ-PXAZEXFGSA-N -1 3 386.416 -1.094 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)[C@@H]3CCC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581474153 1075765175 /nfs/dbraw/zinc/76/51/75/1075765175.db2.gz ORBBBESGRFHKRZ-SJCJKPOMSA-N -1 3 386.416 -1.094 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)[C@@H]3CCC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581474153 1075765173 /nfs/dbraw/zinc/76/51/73/1075765173.db2.gz ORBBBESGRFHKRZ-SJCJKPOMSA-N -1 3 386.416 -1.094 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)[C@H]3CCC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581474154 1075765092 /nfs/dbraw/zinc/76/50/92/1075765092.db2.gz ORBBBESGRFHKRZ-SJKOYZFVSA-N -1 3 386.416 -1.094 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)[C@H]3CCC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581474154 1075765088 /nfs/dbraw/zinc/76/50/88/1075765088.db2.gz ORBBBESGRFHKRZ-SJKOYZFVSA-N -1 3 386.416 -1.094 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)[C@@H]3CCC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581474155 1075765102 /nfs/dbraw/zinc/76/51/02/1075765102.db2.gz ORBBBESGRFHKRZ-YVEFUNNKSA-N -1 3 386.416 -1.094 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)[C@@H]3CCC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581474155 1075765099 /nfs/dbraw/zinc/76/50/99/1075765099.db2.gz ORBBBESGRFHKRZ-YVEFUNNKSA-N -1 3 386.416 -1.094 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)[C@H]3C[C@H]3C(N)=O)C2)ccc1-c1nn[n-]n1 ZINC001581474465 1075765456 /nfs/dbraw/zinc/76/54/56/1075765456.db2.gz VZIKPIRKUHMCQI-BWACUDIHSA-N -1 3 386.416 -1.251 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)[C@H]3C[C@H]3C(N)=O)C2)ccc1-c1nnn[n-]1 ZINC001581474465 1075765453 /nfs/dbraw/zinc/76/54/53/1075765453.db2.gz VZIKPIRKUHMCQI-BWACUDIHSA-N -1 3 386.416 -1.251 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)[C@H]3C[C@H]3C(N)=O)C2)ccc1-c1nn[n-]n1 ZINC001581474466 1075765510 /nfs/dbraw/zinc/76/55/10/1075765510.db2.gz VZIKPIRKUHMCQI-PEBVRCNWSA-N -1 3 386.416 -1.251 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)[C@H]3C[C@H]3C(N)=O)C2)ccc1-c1nnn[n-]1 ZINC001581474466 1075765505 /nfs/dbraw/zinc/76/55/05/1075765505.db2.gz VZIKPIRKUHMCQI-PEBVRCNWSA-N -1 3 386.416 -1.251 20 0 GAADHM Cc1nc(N2CCN(C(=O)[C@H]3CCS(=O)(=O)N3)CC2)ccc1-c1nn[n-]n1 ZINC001581478766 1075765541 /nfs/dbraw/zinc/76/55/41/1075765541.db2.gz AWGICDUTRMZLHN-GFCCVEGCSA-N -1 3 392.445 -1.090 20 0 GAADHM Cc1nc(N2CCN(C(=O)[C@H]3CCS(=O)(=O)N3)CC2)ccc1-c1nnn[n-]1 ZINC001581478766 1075765537 /nfs/dbraw/zinc/76/55/37/1075765537.db2.gz AWGICDUTRMZLHN-GFCCVEGCSA-N -1 3 392.445 -1.090 20 0 GAADHM Cc1nc(N2CCN(C(=O)[C@@H]3CCS(=O)(=O)N3)CC2)ccc1-c1nn[n-]n1 ZINC001581478767 1075765523 /nfs/dbraw/zinc/76/55/23/1075765523.db2.gz AWGICDUTRMZLHN-LBPRGKRZSA-N -1 3 392.445 -1.090 20 0 GAADHM Cc1nc(N2CCN(C(=O)[C@@H]3CCS(=O)(=O)N3)CC2)ccc1-c1nnn[n-]1 ZINC001581478767 1075765519 /nfs/dbraw/zinc/76/55/19/1075765519.db2.gz AWGICDUTRMZLHN-LBPRGKRZSA-N -1 3 392.445 -1.090 20 0 GAADHM Cc1nc(N2CCOC[C@@H]2CNC(=O)c2nnn(C)n2)ccc1-c1nn[n-]n1 ZINC001581479238 1075765440 /nfs/dbraw/zinc/76/54/40/1075765440.db2.gz DYHXIOMHMZGFMJ-JTQLQIEISA-N -1 3 385.392 -1.271 20 0 GAADHM Cc1nc(N2CCOC[C@@H]2CNC(=O)c2nnn(C)n2)ccc1-c1nnn[n-]1 ZINC001581479238 1075765437 /nfs/dbraw/zinc/76/54/37/1075765437.db2.gz DYHXIOMHMZGFMJ-JTQLQIEISA-N -1 3 385.392 -1.271 20 0 GAADHM Cc1nc(N2CCOC[C@H]2CNC(=O)c2nnn(C)n2)ccc1-c1nn[n-]n1 ZINC001581479239 1075765610 /nfs/dbraw/zinc/76/56/10/1075765610.db2.gz DYHXIOMHMZGFMJ-SNVBAGLBSA-N -1 3 385.392 -1.271 20 0 GAADHM Cc1nc(N2CCOC[C@H]2CNC(=O)c2nnn(C)n2)ccc1-c1nnn[n-]1 ZINC001581479239 1075765603 /nfs/dbraw/zinc/76/56/03/1075765603.db2.gz DYHXIOMHMZGFMJ-SNVBAGLBSA-N -1 3 385.392 -1.271 20 0 GAADHM Cc1nc(N2CCOC[C@H]2CNC(=O)Cn2ncnn2)ccc1-c1nn[n-]n1 ZINC001581479240 1075765679 /nfs/dbraw/zinc/76/56/79/1075765679.db2.gz FGOIMCUVTMRDIK-LLVKDONJSA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1nc(N2CCOC[C@H]2CNC(=O)Cn2ncnn2)ccc1-c1nnn[n-]1 ZINC001581479240 1075765675 /nfs/dbraw/zinc/76/56/75/1075765675.db2.gz FGOIMCUVTMRDIK-LLVKDONJSA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1nc(N2CCOC[C@@H]2CNC(=O)Cn2ncnn2)ccc1-c1nn[n-]n1 ZINC001581479241 1075765463 /nfs/dbraw/zinc/76/54/63/1075765463.db2.gz FGOIMCUVTMRDIK-NSHDSACASA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1nc(N2CCOC[C@@H]2CNC(=O)Cn2ncnn2)ccc1-c1nnn[n-]1 ZINC001581479241 1075765462 /nfs/dbraw/zinc/76/54/62/1075765462.db2.gz FGOIMCUVTMRDIK-NSHDSACASA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)CN3C(=O)CNC3=O)C2)ccc1-c1nn[n-]n1 ZINC001581479313 1075765646 /nfs/dbraw/zinc/76/56/46/1075765646.db2.gz KFHVLQWZVATNSU-SNVBAGLBSA-N -1 3 385.388 -1.183 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)CN3C(=O)CNC3=O)C2)ccc1-c1nnn[n-]1 ZINC001581479313 1075765640 /nfs/dbraw/zinc/76/56/40/1075765640.db2.gz KFHVLQWZVATNSU-SNVBAGLBSA-N -1 3 385.388 -1.183 20 0 GAADHM Cc1nc(N2CCOC[C@H]2CNC(=O)CCNC(N)=O)ccc1-c1nn[n-]n1 ZINC001581479331 1075765492 /nfs/dbraw/zinc/76/54/92/1075765492.db2.gz LYMOXJZRNIWUNY-LLVKDONJSA-N -1 3 389.420 -1.050 20 0 GAADHM Cc1nc(N2CCOC[C@H]2CNC(=O)CCNC(N)=O)ccc1-c1nnn[n-]1 ZINC001581479331 1075765489 /nfs/dbraw/zinc/76/54/89/1075765489.db2.gz LYMOXJZRNIWUNY-LLVKDONJSA-N -1 3 389.420 -1.050 20 0 GAADHM Cc1nc(N2CCOC[C@@H]2CNC(=O)CCNC(N)=O)ccc1-c1nn[n-]n1 ZINC001581479332 1075765663 /nfs/dbraw/zinc/76/56/63/1075765663.db2.gz LYMOXJZRNIWUNY-NSHDSACASA-N -1 3 389.420 -1.050 20 0 GAADHM Cc1nc(N2CCOC[C@@H]2CNC(=O)CCNC(N)=O)ccc1-c1nnn[n-]1 ZINC001581479332 1075765659 /nfs/dbraw/zinc/76/56/59/1075765659.db2.gz LYMOXJZRNIWUNY-NSHDSACASA-N -1 3 389.420 -1.050 20 0 GAADHM Cc1nc(N2CCOC[C@@H]2CNC(=O)[C@H]2CNC(=O)N2)ccc1-c1nn[n-]n1 ZINC001581479371 1075765592 /nfs/dbraw/zinc/76/55/92/1075765592.db2.gz NPRCIIIFWKMBAJ-CMPLNLGQSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1nc(N2CCOC[C@@H]2CNC(=O)[C@H]2CNC(=O)N2)ccc1-c1nnn[n-]1 ZINC001581479371 1075765585 /nfs/dbraw/zinc/76/55/85/1075765585.db2.gz NPRCIIIFWKMBAJ-CMPLNLGQSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1nc(N2CCOC[C@@H]2CNC(=O)[C@@H]2CNC(=O)N2)ccc1-c1nn[n-]n1 ZINC001581479372 1075765448 /nfs/dbraw/zinc/76/54/48/1075765448.db2.gz NPRCIIIFWKMBAJ-JQWIXIFHSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1nc(N2CCOC[C@@H]2CNC(=O)[C@@H]2CNC(=O)N2)ccc1-c1nnn[n-]1 ZINC001581479372 1075765445 /nfs/dbraw/zinc/76/54/45/1075765445.db2.gz NPRCIIIFWKMBAJ-JQWIXIFHSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1nc(N2CCOC[C@H]2CNC(=O)[C@@H]2CNC(=O)N2)ccc1-c1nn[n-]n1 ZINC001581479373 1075765500 /nfs/dbraw/zinc/76/55/00/1075765500.db2.gz NPRCIIIFWKMBAJ-PWSUYJOCSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1nc(N2CCOC[C@H]2CNC(=O)[C@@H]2CNC(=O)N2)ccc1-c1nnn[n-]1 ZINC001581479373 1075765497 /nfs/dbraw/zinc/76/54/97/1075765497.db2.gz NPRCIIIFWKMBAJ-PWSUYJOCSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1nc(N2CCOC[C@H]2CNC(=O)[C@H]2CNC(=O)N2)ccc1-c1nn[n-]n1 ZINC001581479374 1075765556 /nfs/dbraw/zinc/76/55/56/1075765556.db2.gz NPRCIIIFWKMBAJ-ZYHUDNBSSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1nc(N2CCOC[C@H]2CNC(=O)[C@H]2CNC(=O)N2)ccc1-c1nnn[n-]1 ZINC001581479374 1075765551 /nfs/dbraw/zinc/76/55/51/1075765551.db2.gz NPRCIIIFWKMBAJ-ZYHUDNBSSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)Cn3ncn(C)c3=O)C2)ccc1-c1nn[n-]n1 ZINC001581479401 1075765625 /nfs/dbraw/zinc/76/56/25/1075765625.db2.gz OPDVFDZLJNGTBJ-LLVKDONJSA-N -1 3 384.404 -1.140 20 0 GAADHM Cc1nc(N2CC[C@@H](NC(=O)Cn3ncn(C)c3=O)C2)ccc1-c1nnn[n-]1 ZINC001581479401 1075765619 /nfs/dbraw/zinc/76/56/19/1075765619.db2.gz OPDVFDZLJNGTBJ-LLVKDONJSA-N -1 3 384.404 -1.140 20 0 GAADHM Cc1nc(N2CCOC[C@@H]2CNC(=O)[C@H]2COC(=O)N2)ccc1-c1nn[n-]n1 ZINC001581479431 1075765574 /nfs/dbraw/zinc/76/55/74/1075765574.db2.gz POQKNAWOOFYVQR-CMPLNLGQSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1nc(N2CCOC[C@@H]2CNC(=O)[C@H]2COC(=O)N2)ccc1-c1nnn[n-]1 ZINC001581479431 1075765567 /nfs/dbraw/zinc/76/55/67/1075765567.db2.gz POQKNAWOOFYVQR-CMPLNLGQSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1nc(N2CCOC[C@@H]2CNC(=O)[C@@H]2COC(=O)N2)ccc1-c1nn[n-]n1 ZINC001581479432 1075765469 /nfs/dbraw/zinc/76/54/69/1075765469.db2.gz POQKNAWOOFYVQR-JQWIXIFHSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1nc(N2CCOC[C@@H]2CNC(=O)[C@@H]2COC(=O)N2)ccc1-c1nnn[n-]1 ZINC001581479432 1075765467 /nfs/dbraw/zinc/76/54/67/1075765467.db2.gz POQKNAWOOFYVQR-JQWIXIFHSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1nc(N2CCOC[C@H]2CNC(=O)[C@@H]2COC(=O)N2)ccc1-c1nn[n-]n1 ZINC001581479433 1075765476 /nfs/dbraw/zinc/76/54/76/1075765476.db2.gz POQKNAWOOFYVQR-PWSUYJOCSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1nc(N2CCOC[C@H]2CNC(=O)[C@@H]2COC(=O)N2)ccc1-c1nnn[n-]1 ZINC001581479433 1075765474 /nfs/dbraw/zinc/76/54/74/1075765474.db2.gz POQKNAWOOFYVQR-PWSUYJOCSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1nc(N2CCOC[C@H]2CNC(=O)[C@H]2COC(=O)N2)ccc1-c1nn[n-]n1 ZINC001581479434 1075765483 /nfs/dbraw/zinc/76/54/83/1075765483.db2.gz POQKNAWOOFYVQR-ZYHUDNBSSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1nc(N2CCOC[C@H]2CNC(=O)[C@H]2COC(=O)N2)ccc1-c1nnn[n-]1 ZINC001581479434 1075765481 /nfs/dbraw/zinc/76/54/81/1075765481.db2.gz POQKNAWOOFYVQR-ZYHUDNBSSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1nc(N2CCO[C@H](CNC(=O)CCNC(N)=O)C2)ccc1-c1nn[n-]n1 ZINC001581480659 1075765852 /nfs/dbraw/zinc/76/58/52/1075765852.db2.gz BTDGGTXJOKWLLE-LLVKDONJSA-N -1 3 389.420 -1.050 20 0 GAADHM Cc1nc(N2CCO[C@H](CNC(=O)CCNC(N)=O)C2)ccc1-c1nnn[n-]1 ZINC001581480659 1075765845 /nfs/dbraw/zinc/76/58/45/1075765845.db2.gz BTDGGTXJOKWLLE-LLVKDONJSA-N -1 3 389.420 -1.050 20 0 GAADHM Cc1nc(N2CCO[C@@H](CNC(=O)CCNC(N)=O)C2)ccc1-c1nn[n-]n1 ZINC001581480660 1075766020 /nfs/dbraw/zinc/76/60/20/1075766020.db2.gz BTDGGTXJOKWLLE-NSHDSACASA-N -1 3 389.420 -1.050 20 0 GAADHM Cc1nc(N2CCO[C@@H](CNC(=O)CCNC(N)=O)C2)ccc1-c1nnn[n-]1 ZINC001581480660 1075766016 /nfs/dbraw/zinc/76/60/16/1075766016.db2.gz BTDGGTXJOKWLLE-NSHDSACASA-N -1 3 389.420 -1.050 20 0 GAADHM Cc1nc(N2CCO[C@@H](CNC(=O)[C@H]3COC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581480832 1075765938 /nfs/dbraw/zinc/76/59/38/1075765938.db2.gz ITKCADWUAODKHU-CMPLNLGQSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1nc(N2CCO[C@@H](CNC(=O)[C@H]3COC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581480832 1075765929 /nfs/dbraw/zinc/76/59/29/1075765929.db2.gz ITKCADWUAODKHU-CMPLNLGQSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1nc(N2CCO[C@@H](CNC(=O)[C@@H]3COC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581480833 1075766037 /nfs/dbraw/zinc/76/60/37/1075766037.db2.gz ITKCADWUAODKHU-JQWIXIFHSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1nc(N2CCO[C@@H](CNC(=O)[C@@H]3COC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581480833 1075766032 /nfs/dbraw/zinc/76/60/32/1075766032.db2.gz ITKCADWUAODKHU-JQWIXIFHSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1nc(N2CCO[C@H](CNC(=O)[C@@H]3COC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581480834 1075765955 /nfs/dbraw/zinc/76/59/55/1075765955.db2.gz ITKCADWUAODKHU-PWSUYJOCSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1nc(N2CCO[C@H](CNC(=O)[C@@H]3COC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581480834 1075765951 /nfs/dbraw/zinc/76/59/51/1075765951.db2.gz ITKCADWUAODKHU-PWSUYJOCSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1nc(N2CCO[C@H](CNC(=O)[C@H]3COC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581480835 1075765835 /nfs/dbraw/zinc/76/58/35/1075765835.db2.gz ITKCADWUAODKHU-ZYHUDNBSSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1nc(N2CCO[C@H](CNC(=O)[C@H]3COC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581480835 1075765832 /nfs/dbraw/zinc/76/58/32/1075765832.db2.gz ITKCADWUAODKHU-ZYHUDNBSSA-N -1 3 388.388 -1.000 20 0 GAADHM Cc1nc(N2CCO[C@H](CNC(=O)Cn3cnnn3)C2)ccc1-c1nn[n-]n1 ZINC001581480858 1075765867 /nfs/dbraw/zinc/76/58/67/1075765867.db2.gz JPSMMOFWJRRBPK-LLVKDONJSA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1nc(N2CCO[C@H](CNC(=O)Cn3cnnn3)C2)ccc1-c1nnn[n-]1 ZINC001581480858 1075765861 /nfs/dbraw/zinc/76/58/61/1075765861.db2.gz JPSMMOFWJRRBPK-LLVKDONJSA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1nc(N2CCO[C@@H](CNC(=O)Cn3cnnn3)C2)ccc1-c1nn[n-]n1 ZINC001581480859 1075765883 /nfs/dbraw/zinc/76/58/83/1075765883.db2.gz JPSMMOFWJRRBPK-NSHDSACASA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1nc(N2CCO[C@@H](CNC(=O)Cn3cnnn3)C2)ccc1-c1nnn[n-]1 ZINC001581480859 1075765879 /nfs/dbraw/zinc/76/58/79/1075765879.db2.gz JPSMMOFWJRRBPK-NSHDSACASA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1nc(N2CCO[C@H](CNC(=O)Cn3ncnn3)C2)ccc1-c1nn[n-]n1 ZINC001581480887 1075766102 /nfs/dbraw/zinc/76/61/02/1075766102.db2.gz KKEQVSPQJAYMGP-LLVKDONJSA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1nc(N2CCO[C@H](CNC(=O)Cn3ncnn3)C2)ccc1-c1nnn[n-]1 ZINC001581480887 1075766098 /nfs/dbraw/zinc/76/60/98/1075766098.db2.gz KKEQVSPQJAYMGP-LLVKDONJSA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1nc(N2CCO[C@@H](CNC(=O)Cn3ncnn3)C2)ccc1-c1nn[n-]n1 ZINC001581480888 1075765991 /nfs/dbraw/zinc/76/59/91/1075765991.db2.gz KKEQVSPQJAYMGP-NSHDSACASA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1nc(N2CCO[C@@H](CNC(=O)Cn3ncnn3)C2)ccc1-c1nnn[n-]1 ZINC001581480888 1075765986 /nfs/dbraw/zinc/76/59/86/1075765986.db2.gz KKEQVSPQJAYMGP-NSHDSACASA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1nc(N2CCN(C(=O)CN3CCNC(=O)C3)CC2)ccc1-c1nn[n-]n1 ZINC001581481022 1075765973 /nfs/dbraw/zinc/76/59/73/1075765973.db2.gz PTASZEJACHXBLE-UHFFFAOYSA-N -1 3 385.432 -1.349 20 0 GAADHM Cc1nc(N2CCN(C(=O)CN3CCNC(=O)C3)CC2)ccc1-c1nnn[n-]1 ZINC001581481022 1075765968 /nfs/dbraw/zinc/76/59/68/1075765968.db2.gz PTASZEJACHXBLE-UHFFFAOYSA-N -1 3 385.432 -1.349 20 0 GAADHM Cc1nc(N2CCN(C(=O)[C@@H]3CC(=O)NC(=O)N3)CC2)ccc1-c1nn[n-]n1 ZINC001581481278 1075765900 /nfs/dbraw/zinc/76/59/00/1075765900.db2.gz YVODUEWZQWNBBA-NSHDSACASA-N -1 3 385.388 -1.183 20 0 GAADHM Cc1nc(N2CCN(C(=O)[C@@H]3CC(=O)NC(=O)N3)CC2)ccc1-c1nnn[n-]1 ZINC001581481278 1075765896 /nfs/dbraw/zinc/76/58/96/1075765896.db2.gz YVODUEWZQWNBBA-NSHDSACASA-N -1 3 385.388 -1.183 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)Cn3ncn(C)c3=O)C2)ccc1-c1nn[n-]n1 ZINC001581481455 1075766006 /nfs/dbraw/zinc/76/60/06/1075766006.db2.gz OPDVFDZLJNGTBJ-NSHDSACASA-N -1 3 384.404 -1.140 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)Cn3ncn(C)c3=O)C2)ccc1-c1nnn[n-]1 ZINC001581481455 1075766000 /nfs/dbraw/zinc/76/60/00/1075766000.db2.gz OPDVFDZLJNGTBJ-NSHDSACASA-N -1 3 384.404 -1.140 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CN(C)CCO3)C2)ccc1-c1nn[n-]n1 ZINC001581482046 1075766050 /nfs/dbraw/zinc/76/60/50/1075766050.db2.gz IREHQJBNQFIQML-MCIONIFRSA-N -1 3 388.432 -1.434 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CN(C)CCO3)C2)ccc1-c1nn[n-]n1 ZINC001581482047 1075766079 /nfs/dbraw/zinc/76/60/79/1075766079.db2.gz IREHQJBNQFIQML-MGPQQGTHSA-N -1 3 388.432 -1.434 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCNC(=O)C3)C2)ccc1-c1nn[n-]n1 ZINC001581482204 1075766067 /nfs/dbraw/zinc/76/60/67/1075766067.db2.gz LDXIHSOKPHMWJM-CYZMBNFOSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCNC(=O)C3)C2)ccc1-c1nnn[n-]1 ZINC001581482204 1075766064 /nfs/dbraw/zinc/76/60/64/1075766064.db2.gz LDXIHSOKPHMWJM-CYZMBNFOSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCNC(=O)C3)C2)ccc1-c1nn[n-]n1 ZINC001581482206 1075766094 /nfs/dbraw/zinc/76/60/94/1075766094.db2.gz LDXIHSOKPHMWJM-RAIGVLPGSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCNC(=O)C3)C2)ccc1-c1nnn[n-]1 ZINC001581482206 1075766092 /nfs/dbraw/zinc/76/60/92/1075766092.db2.gz LDXIHSOKPHMWJM-RAIGVLPGSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CC(=O)N(C)C3)C2)ccc1-c1nn[n-]n1 ZINC001581482377 1075766086 /nfs/dbraw/zinc/76/60/86/1075766086.db2.gz OQIMMZBUSWTJDK-CYZMBNFOSA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CC(=O)N(C)C3)C2)ccc1-c1nnn[n-]1 ZINC001581482377 1075766084 /nfs/dbraw/zinc/76/60/84/1075766084.db2.gz OQIMMZBUSWTJDK-CYZMBNFOSA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CC(=O)N(C)C3)C2)ccc1-c1nn[n-]n1 ZINC001581482378 1075765920 /nfs/dbraw/zinc/76/59/20/1075765920.db2.gz OQIMMZBUSWTJDK-RAIGVLPGSA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CC(=O)N(C)C3)C2)ccc1-c1nnn[n-]1 ZINC001581482378 1075765915 /nfs/dbraw/zinc/76/59/15/1075765915.db2.gz OQIMMZBUSWTJDK-RAIGVLPGSA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CN(C)C(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581482777 1075766263 /nfs/dbraw/zinc/76/62/63/1075766263.db2.gz WJHVBFLXDQVTAG-GRYCIOLGSA-N -1 3 387.404 -1.741 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CN(C)C(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581482777 1075766261 /nfs/dbraw/zinc/76/62/61/1075766261.db2.gz WJHVBFLXDQVTAG-GRYCIOLGSA-N -1 3 387.404 -1.741 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CN(C)C(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001581482779 1075766488 /nfs/dbraw/zinc/76/64/88/1075766488.db2.gz WJHVBFLXDQVTAG-IJLUTSLNSA-N -1 3 387.404 -1.741 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CN(C)C(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001581482779 1075766481 /nfs/dbraw/zinc/76/64/81/1075766481.db2.gz WJHVBFLXDQVTAG-IJLUTSLNSA-N -1 3 387.404 -1.741 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)C[C@@H]3CCNC3=O)C2)ccc1-c1nn[n-]n1 ZINC001581483040 1075766253 /nfs/dbraw/zinc/76/62/53/1075766253.db2.gz HLMWLGVGROZTMK-CYZMBNFOSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)C[C@@H]3CCNC3=O)C2)ccc1-c1nnn[n-]1 ZINC001581483040 1075766251 /nfs/dbraw/zinc/76/62/51/1075766251.db2.gz HLMWLGVGROZTMK-CYZMBNFOSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)C[C@H]3CCNC3=O)C2)ccc1-c1nn[n-]n1 ZINC001581483041 1075766314 /nfs/dbraw/zinc/76/63/14/1075766314.db2.gz HLMWLGVGROZTMK-RAIGVLPGSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)C[C@H]3CCNC3=O)C2)ccc1-c1nnn[n-]1 ZINC001581483041 1075766310 /nfs/dbraw/zinc/76/63/10/1075766310.db2.gz HLMWLGVGROZTMK-RAIGVLPGSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(=O)cn3)C2)ccc1-c1nn[n-]n1 ZINC001581483047 1075766333 /nfs/dbraw/zinc/76/63/33/1075766333.db2.gz HPDLFMNQRGCAQT-VXGBXAGGSA-N -1 3 383.372 -1.367 20 0 GAADHM 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Cc1nc(N2C[C@@H](NC(=O)[C@H]3CN(C)C(=O)N3)[C@@H](O)C2)ccc1-c1nnn[n-]1 ZINC001581483875 1075766689 /nfs/dbraw/zinc/76/66/89/1075766689.db2.gz WJHVBFLXDQVTAG-UTUOFQBUSA-N -1 3 387.404 -1.741 20 0 GAADHM Cc1nc(N2C[C@@H](NC(=O)[C@@H]3CN(C)C(=O)N3)[C@@H](O)C2)ccc1-c1nn[n-]n1 ZINC001581483876 1075766829 /nfs/dbraw/zinc/76/68/29/1075766829.db2.gz WJHVBFLXDQVTAG-WOPDTQHZSA-N -1 3 387.404 -1.741 20 0 GAADHM Cc1nc(N2C[C@@H](NC(=O)[C@@H]3CN(C)C(=O)N3)[C@@H](O)C2)ccc1-c1nnn[n-]1 ZINC001581483876 1075766824 /nfs/dbraw/zinc/76/68/24/1075766824.db2.gz WJHVBFLXDQVTAG-WOPDTQHZSA-N -1 3 387.404 -1.741 20 0 GAADHM Cc1c(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)c(C)n3)C[C@@H]2O)nnn1C ZINC001581484422 1075766756 /nfs/dbraw/zinc/76/67/56/1075766756.db2.gz BJAXQFPYDXZQEO-NEPJUHHUSA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1c(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)c(C)n3)C[C@@H]2O)nnn1C ZINC001581484422 1075766749 /nfs/dbraw/zinc/76/67/49/1075766749.db2.gz BJAXQFPYDXZQEO-NEPJUHHUSA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)C2CS(=O)(=O)C2)ccc1-c1nn[n-]n1 ZINC001581494811 1075767142 /nfs/dbraw/zinc/76/71/42/1075767142.db2.gz BEZJEGVQFWKXJN-JTQLQIEISA-N -1 3 381.418 -1.496 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)C2CS(=O)(=O)C2)ccc1-c1nnn[n-]1 ZINC001581494811 1075767137 /nfs/dbraw/zinc/76/71/37/1075767137.db2.gz BEZJEGVQFWKXJN-JTQLQIEISA-N -1 3 381.418 -1.496 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)C2CS(=O)(=O)C2)ccc1-c1nn[n-]n1 ZINC001581494812 1075767164 /nfs/dbraw/zinc/76/71/64/1075767164.db2.gz BEZJEGVQFWKXJN-SNVBAGLBSA-N -1 3 381.418 -1.496 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)C2CS(=O)(=O)C2)ccc1-c1nnn[n-]1 ZINC001581494812 1075767162 /nfs/dbraw/zinc/76/71/62/1075767162.db2.gz BEZJEGVQFWKXJN-SNVBAGLBSA-N -1 3 381.418 -1.496 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)CN2CCNC(=O)C2)ccc1-c1nn[n-]n1 ZINC001581494955 1075767038 /nfs/dbraw/zinc/76/70/38/1075767038.db2.gz FGMJZNGAKZCJPF-LLVKDONJSA-N -1 3 389.420 -2.109 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)CN2CCNC(=O)C2)ccc1-c1nnn[n-]1 ZINC001581494955 1075767034 /nfs/dbraw/zinc/76/70/34/1075767034.db2.gz FGMJZNGAKZCJPF-LLVKDONJSA-N -1 3 389.420 -2.109 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)CN2CCNC(=O)C2)ccc1-c1nn[n-]n1 ZINC001581494956 1075767157 /nfs/dbraw/zinc/76/71/57/1075767157.db2.gz FGMJZNGAKZCJPF-NSHDSACASA-N -1 3 389.420 -2.109 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)CN2CCNC(=O)C2)ccc1-c1nnn[n-]1 ZINC001581494956 1075767152 /nfs/dbraw/zinc/76/71/52/1075767152.db2.gz FGMJZNGAKZCJPF-NSHDSACASA-N -1 3 389.420 -2.109 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)CN2CCOCC2=O)ccc1-c1nn[n-]n1 ZINC001581495340 1075767225 /nfs/dbraw/zinc/76/72/25/1075767225.db2.gz LTPFFBNKAABBSJ-LLVKDONJSA-N -1 3 390.404 -1.682 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)CN2CCOCC2=O)ccc1-c1nnn[n-]1 ZINC001581495340 1075767221 /nfs/dbraw/zinc/76/72/21/1075767221.db2.gz LTPFFBNKAABBSJ-LLVKDONJSA-N -1 3 390.404 -1.682 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)CN2CCOCC2=O)ccc1-c1nn[n-]n1 ZINC001581495341 1075767127 /nfs/dbraw/zinc/76/71/27/1075767127.db2.gz LTPFFBNKAABBSJ-NSHDSACASA-N -1 3 390.404 -1.682 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)CN2CCOCC2=O)ccc1-c1nnn[n-]1 ZINC001581495341 1075767123 /nfs/dbraw/zinc/76/71/23/1075767123.db2.gz LTPFFBNKAABBSJ-NSHDSACASA-N -1 3 390.404 -1.682 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)CN2CCCNC2=O)ccc1-c1nn[n-]n1 ZINC001581495399 1075767245 /nfs/dbraw/zinc/76/72/45/1075767245.db2.gz MXSWEEXQRKRPBM-LLVKDONJSA-N -1 3 389.420 -1.126 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)CN2CCCNC2=O)ccc1-c1nnn[n-]1 ZINC001581495399 1075767242 /nfs/dbraw/zinc/76/72/42/1075767242.db2.gz MXSWEEXQRKRPBM-LLVKDONJSA-N -1 3 389.420 -1.126 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)CN2CCCNC2=O)ccc1-c1nn[n-]n1 ZINC001581495400 1075767092 /nfs/dbraw/zinc/76/70/92/1075767092.db2.gz MXSWEEXQRKRPBM-NSHDSACASA-N -1 3 389.420 -1.126 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)CN2CCCNC2=O)ccc1-c1nnn[n-]1 ZINC001581495400 1075767087 /nfs/dbraw/zinc/76/70/87/1075767087.db2.gz MXSWEEXQRKRPBM-NSHDSACASA-N -1 3 389.420 -1.126 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)[C@H]2CN(C)C(=O)N2)ccc1-c1nn[n-]n1 ZINC001581495527 1075767052 /nfs/dbraw/zinc/76/70/52/1075767052.db2.gz PQKYCWZJLBVCNQ-GXSJLCMTSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)[C@H]2CN(C)C(=O)N2)ccc1-c1nnn[n-]1 ZINC001581495527 1075767049 /nfs/dbraw/zinc/76/70/49/1075767049.db2.gz PQKYCWZJLBVCNQ-GXSJLCMTSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)[C@@H]2CN(C)C(=O)N2)ccc1-c1nn[n-]n1 ZINC001581495528 1075767175 /nfs/dbraw/zinc/76/71/75/1075767175.db2.gz PQKYCWZJLBVCNQ-KOLCDFICSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)[C@@H]2CN(C)C(=O)N2)ccc1-c1nnn[n-]1 ZINC001581495528 1075767173 /nfs/dbraw/zinc/76/71/73/1075767173.db2.gz PQKYCWZJLBVCNQ-KOLCDFICSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)[C@H]2CN(C)C(=O)N2)ccc1-c1nn[n-]n1 ZINC001581495529 1075767236 /nfs/dbraw/zinc/76/72/36/1075767236.db2.gz PQKYCWZJLBVCNQ-MWLCHTKSSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)[C@H]2CN(C)C(=O)N2)ccc1-c1nnn[n-]1 ZINC001581495529 1075767234 /nfs/dbraw/zinc/76/72/34/1075767234.db2.gz PQKYCWZJLBVCNQ-MWLCHTKSSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)[C@@H]2CN(C)C(=O)N2)ccc1-c1nn[n-]n1 ZINC001581495530 1075767202 /nfs/dbraw/zinc/76/72/02/1075767202.db2.gz PQKYCWZJLBVCNQ-ONGXEEELSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)[C@@H]2CN(C)C(=O)N2)ccc1-c1nnn[n-]1 ZINC001581495530 1075767198 /nfs/dbraw/zinc/76/71/98/1075767198.db2.gz PQKYCWZJLBVCNQ-ONGXEEELSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)CCS(C)(=O)=O)ccc1-c1nn[n-]n1 ZINC001581495919 1075767019 /nfs/dbraw/zinc/76/70/19/1075767019.db2.gz XUTOBSJMCNNMSY-JTQLQIEISA-N -1 3 383.434 -1.106 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)CCS(C)(=O)=O)ccc1-c1nnn[n-]1 ZINC001581495919 1075767014 /nfs/dbraw/zinc/76/70/14/1075767014.db2.gz XUTOBSJMCNNMSY-JTQLQIEISA-N -1 3 383.434 -1.106 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)CCS(C)(=O)=O)ccc1-c1nn[n-]n1 ZINC001581495920 1075767078 /nfs/dbraw/zinc/76/70/78/1075767078.db2.gz XUTOBSJMCNNMSY-SNVBAGLBSA-N -1 3 383.434 -1.106 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)CCS(C)(=O)=O)ccc1-c1nnn[n-]1 ZINC001581495920 1075767075 /nfs/dbraw/zinc/76/70/75/1075767075.db2.gz XUTOBSJMCNNMSY-SNVBAGLBSA-N -1 3 383.434 -1.106 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)CN2CCOCC2)ccc1-c1nn[n-]n1 ZINC001581496005 1075767189 /nfs/dbraw/zinc/76/71/89/1075767189.db2.gz ZOLFNQYRUIBBMP-GFCCVEGCSA-N -1 3 376.421 -1.209 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)CN2CCOCC2)ccc1-c1nnn[n-]1 ZINC001581496005 1075767186 /nfs/dbraw/zinc/76/71/86/1075767186.db2.gz ZOLFNQYRUIBBMP-GFCCVEGCSA-N -1 3 376.421 -1.209 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)CN2CCOCC2)ccc1-c1nn[n-]n1 ZINC001581496006 1075767002 /nfs/dbraw/zinc/76/70/02/1075767002.db2.gz ZOLFNQYRUIBBMP-LBPRGKRZSA-N -1 3 376.421 -1.209 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)CN2CCOCC2)ccc1-c1nnn[n-]1 ZINC001581496006 1075766998 /nfs/dbraw/zinc/76/69/98/1075766998.db2.gz ZOLFNQYRUIBBMP-LBPRGKRZSA-N -1 3 376.421 -1.209 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)c2ccc(=O)n(C)n2)ccc1-c1nn[n-]n1 ZINC001581496318 1075767068 /nfs/dbraw/zinc/76/70/68/1075767068.db2.gz GOEUQDNTQXVRKJ-JTQLQIEISA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)c2ccc(=O)n(C)n2)ccc1-c1nnn[n-]1 ZINC001581496318 1075767064 /nfs/dbraw/zinc/76/70/64/1075767064.db2.gz GOEUQDNTQXVRKJ-JTQLQIEISA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)c2ccc(=O)n(C)n2)ccc1-c1nn[n-]n1 ZINC001581496319 1075767115 /nfs/dbraw/zinc/76/71/15/1075767115.db2.gz GOEUQDNTQXVRKJ-SNVBAGLBSA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)c2ccc(=O)n(C)n2)ccc1-c1nnn[n-]1 ZINC001581496319 1075767111 /nfs/dbraw/zinc/76/71/11/1075767111.db2.gz GOEUQDNTQXVRKJ-SNVBAGLBSA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)c2cc(=O)n(C)cn2)ccc1-c1nn[n-]n1 ZINC001581497594 1075767212 /nfs/dbraw/zinc/76/72/12/1075767212.db2.gz YEFSYSDFUASEJQ-JTQLQIEISA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)c2cc(=O)n(C)cn2)ccc1-c1nnn[n-]1 ZINC001581497594 1075767210 /nfs/dbraw/zinc/76/72/10/1075767210.db2.gz YEFSYSDFUASEJQ-JTQLQIEISA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)c2cc(=O)n(C)cn2)ccc1-c1nn[n-]n1 ZINC001581497595 1075767430 /nfs/dbraw/zinc/76/74/30/1075767430.db2.gz YEFSYSDFUASEJQ-SNVBAGLBSA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)c2cc(=O)n(C)cn2)ccc1-c1nnn[n-]1 ZINC001581497595 1075767425 /nfs/dbraw/zinc/76/74/25/1075767425.db2.gz YEFSYSDFUASEJQ-SNVBAGLBSA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)c2cn(C)c(=O)n2C)ccc1-c1nn[n-]n1 ZINC001581497637 1075767411 /nfs/dbraw/zinc/76/74/11/1075767411.db2.gz ZPNVCZJDBSHAEN-JTQLQIEISA-N -1 3 387.404 -1.190 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)c2cn(C)c(=O)n2C)ccc1-c1nnn[n-]1 ZINC001581497637 1075767409 /nfs/dbraw/zinc/76/74/09/1075767409.db2.gz ZPNVCZJDBSHAEN-JTQLQIEISA-N -1 3 387.404 -1.190 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)c2cn(C)c(=O)n2C)ccc1-c1nn[n-]n1 ZINC001581497638 1075767363 /nfs/dbraw/zinc/76/73/63/1075767363.db2.gz ZPNVCZJDBSHAEN-SNVBAGLBSA-N -1 3 387.404 -1.190 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)c2cn(C)c(=O)n2C)ccc1-c1nnn[n-]1 ZINC001581497638 1075767359 /nfs/dbraw/zinc/76/73/59/1075767359.db2.gz ZPNVCZJDBSHAEN-SNVBAGLBSA-N -1 3 387.404 -1.190 20 0 GAADHM Cc1nc(NC[C@H](O)CN(C)C(=O)[C@H]2CN(C)C(=O)N2)ccc1-c1nn[n-]n1 ZINC001581510285 1075767575 /nfs/dbraw/zinc/76/75/75/1075767575.db2.gz GTUWCGJPSKGVPX-CMPLNLGQSA-N -1 3 389.420 -1.175 20 0 GAADHM Cc1nc(NC[C@H](O)CN(C)C(=O)[C@H]2CN(C)C(=O)N2)ccc1-c1nnn[n-]1 ZINC001581510285 1075767571 /nfs/dbraw/zinc/76/75/71/1075767571.db2.gz GTUWCGJPSKGVPX-CMPLNLGQSA-N -1 3 389.420 -1.175 20 0 GAADHM Cc1nc(NC[C@H](O)CN(C)C(=O)[C@@H]2CN(C)C(=O)N2)ccc1-c1nn[n-]n1 ZINC001581510286 1075767372 /nfs/dbraw/zinc/76/73/72/1075767372.db2.gz GTUWCGJPSKGVPX-JQWIXIFHSA-N -1 3 389.420 -1.175 20 0 GAADHM Cc1nc(NC[C@H](O)CN(C)C(=O)[C@@H]2CN(C)C(=O)N2)ccc1-c1nnn[n-]1 ZINC001581510286 1075767369 /nfs/dbraw/zinc/76/73/69/1075767369.db2.gz GTUWCGJPSKGVPX-JQWIXIFHSA-N -1 3 389.420 -1.175 20 0 GAADHM Cc1nc(NC[C@@H](O)CN(C)C(=O)[C@@H]2CN(C)C(=O)N2)ccc1-c1nn[n-]n1 ZINC001581510287 1075767530 /nfs/dbraw/zinc/76/75/30/1075767530.db2.gz GTUWCGJPSKGVPX-PWSUYJOCSA-N -1 3 389.420 -1.175 20 0 GAADHM Cc1nc(NC[C@@H](O)CN(C)C(=O)[C@@H]2CN(C)C(=O)N2)ccc1-c1nnn[n-]1 ZINC001581510287 1075767524 /nfs/dbraw/zinc/76/75/24/1075767524.db2.gz GTUWCGJPSKGVPX-PWSUYJOCSA-N -1 3 389.420 -1.175 20 0 GAADHM Cc1nc(NC[C@@H](O)CN(C)C(=O)[C@H]2CN(C)C(=O)N2)ccc1-c1nn[n-]n1 ZINC001581510288 1075767611 /nfs/dbraw/zinc/76/76/11/1075767611.db2.gz GTUWCGJPSKGVPX-ZYHUDNBSSA-N -1 3 389.420 -1.175 20 0 GAADHM Cc1nc(NC[C@@H](O)CN(C)C(=O)[C@H]2CN(C)C(=O)N2)ccc1-c1nnn[n-]1 ZINC001581510288 1075767606 /nfs/dbraw/zinc/76/76/06/1075767606.db2.gz GTUWCGJPSKGVPX-ZYHUDNBSSA-N -1 3 389.420 -1.175 20 0 GAADHM Cc1nc(NC[C@@H](O)CN(C)C(=O)CCn2cnnn2)ccc1-c1nn[n-]n1 ZINC001581511099 1075767593 /nfs/dbraw/zinc/76/75/93/1075767593.db2.gz LTGDSGLUVLYSBY-LLVKDONJSA-N -1 3 387.408 -1.122 20 0 GAADHM Cc1nc(NC[C@@H](O)CN(C)C(=O)CCn2cnnn2)ccc1-c1nnn[n-]1 ZINC001581511099 1075767586 /nfs/dbraw/zinc/76/75/86/1075767586.db2.gz LTGDSGLUVLYSBY-LLVKDONJSA-N -1 3 387.408 -1.122 20 0 GAADHM Cc1nc(NC[C@H](O)CN(C)C(=O)CCn2cnnn2)ccc1-c1nn[n-]n1 ZINC001581511101 1075767559 /nfs/dbraw/zinc/76/75/59/1075767559.db2.gz LTGDSGLUVLYSBY-NSHDSACASA-N -1 3 387.408 -1.122 20 0 GAADHM Cc1nc(NC[C@H](O)CN(C)C(=O)CCn2cnnn2)ccc1-c1nnn[n-]1 ZINC001581511101 1075767553 /nfs/dbraw/zinc/76/75/53/1075767553.db2.gz LTGDSGLUVLYSBY-NSHDSACASA-N -1 3 387.408 -1.122 20 0 GAADHM Cc1nc(NC[C@H](O)CN(C)C(=O)[C@H]2COC(=O)N2)ccc1-c1nn[n-]n1 ZINC001581511759 1075767353 /nfs/dbraw/zinc/76/73/53/1075767353.db2.gz XZCKJKOASZCEFB-GXSJLCMTSA-N -1 3 376.377 -1.090 20 0 GAADHM Cc1nc(NC[C@H](O)CN(C)C(=O)[C@H]2COC(=O)N2)ccc1-c1nnn[n-]1 ZINC001581511759 1075767349 /nfs/dbraw/zinc/76/73/49/1075767349.db2.gz XZCKJKOASZCEFB-GXSJLCMTSA-N -1 3 376.377 -1.090 20 0 GAADHM Cc1nc(NC[C@@H](O)CN(C)C(=O)[C@@H]2COC(=O)N2)ccc1-c1nn[n-]n1 ZINC001581511760 1075767486 /nfs/dbraw/zinc/76/74/86/1075767486.db2.gz XZCKJKOASZCEFB-KOLCDFICSA-N -1 3 376.377 -1.090 20 0 GAADHM Cc1nc(NC[C@@H](O)CN(C)C(=O)[C@@H]2COC(=O)N2)ccc1-c1nnn[n-]1 ZINC001581511760 1075767478 /nfs/dbraw/zinc/76/74/78/1075767478.db2.gz XZCKJKOASZCEFB-KOLCDFICSA-N -1 3 376.377 -1.090 20 0 GAADHM Cc1nc(NC[C@@H](O)CN(C)C(=O)[C@H]2COC(=O)N2)ccc1-c1nn[n-]n1 ZINC001581511761 1075767384 /nfs/dbraw/zinc/76/73/84/1075767384.db2.gz XZCKJKOASZCEFB-MWLCHTKSSA-N -1 3 376.377 -1.090 20 0 GAADHM Cc1nc(NC[C@@H](O)CN(C)C(=O)[C@H]2COC(=O)N2)ccc1-c1nnn[n-]1 ZINC001581511761 1075767380 /nfs/dbraw/zinc/76/73/80/1075767380.db2.gz XZCKJKOASZCEFB-MWLCHTKSSA-N -1 3 376.377 -1.090 20 0 GAADHM Cc1nc(NC[C@H](O)CN(C)C(=O)[C@@H]2COC(=O)N2)ccc1-c1nn[n-]n1 ZINC001581511762 1075767397 /nfs/dbraw/zinc/76/73/97/1075767397.db2.gz XZCKJKOASZCEFB-ONGXEEELSA-N -1 3 376.377 -1.090 20 0 GAADHM Cc1nc(NC[C@H](O)CN(C)C(=O)[C@@H]2COC(=O)N2)ccc1-c1nnn[n-]1 ZINC001581511762 1075767393 /nfs/dbraw/zinc/76/73/93/1075767393.db2.gz XZCKJKOASZCEFB-ONGXEEELSA-N -1 3 376.377 -1.090 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)c2cc(=O)n(C)cn2)ccc1-c1nn[n-]n1 ZINC001581511933 1075767467 /nfs/dbraw/zinc/76/74/67/1075767467.db2.gz BUMXRPWQYAUELL-JTQLQIEISA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)c2cc(=O)n(C)cn2)ccc1-c1nnn[n-]1 ZINC001581511933 1075767461 /nfs/dbraw/zinc/76/74/61/1075767461.db2.gz BUMXRPWQYAUELL-JTQLQIEISA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)c2cc(=O)n(C)cn2)ccc1-c1nn[n-]n1 ZINC001581511934 1075767505 /nfs/dbraw/zinc/76/75/05/1075767505.db2.gz BUMXRPWQYAUELL-SNVBAGLBSA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)c2cc(=O)n(C)cn2)ccc1-c1nnn[n-]1 ZINC001581511934 1075767498 /nfs/dbraw/zinc/76/74/98/1075767498.db2.gz BUMXRPWQYAUELL-SNVBAGLBSA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)CN2CCCNC2=O)ccc1-c1nn[n-]n1 ZINC001581512008 1075767448 /nfs/dbraw/zinc/76/74/48/1075767448.db2.gz DGZIFYYLYATSOW-LLVKDONJSA-N -1 3 389.420 -1.126 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)CN2CCCNC2=O)ccc1-c1nnn[n-]1 ZINC001581512008 1075767442 /nfs/dbraw/zinc/76/74/42/1075767442.db2.gz DGZIFYYLYATSOW-LLVKDONJSA-N -1 3 389.420 -1.126 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)CN2CCCNC2=O)ccc1-c1nn[n-]n1 ZINC001581512009 1075767543 /nfs/dbraw/zinc/76/75/43/1075767543.db2.gz DGZIFYYLYATSOW-NSHDSACASA-N -1 3 389.420 -1.126 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)CN2CCCNC2=O)ccc1-c1nnn[n-]1 ZINC001581512009 1075767540 /nfs/dbraw/zinc/76/75/40/1075767540.db2.gz DGZIFYYLYATSOW-NSHDSACASA-N -1 3 389.420 -1.126 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)[C@H]2CN(C)C(=O)N2)ccc1-c1nn[n-]n1 ZINC001581512070 1075767867 /nfs/dbraw/zinc/76/78/67/1075767867.db2.gz FSAOXCMTFNAVMU-GXSJLCMTSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)[C@H]2CN(C)C(=O)N2)ccc1-c1nnn[n-]1 ZINC001581512070 1075767864 /nfs/dbraw/zinc/76/78/64/1075767864.db2.gz FSAOXCMTFNAVMU-GXSJLCMTSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)[C@@H]2CN(C)C(=O)N2)ccc1-c1nn[n-]n1 ZINC001581512071 1075767881 /nfs/dbraw/zinc/76/78/81/1075767881.db2.gz FSAOXCMTFNAVMU-KOLCDFICSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)[C@@H]2CN(C)C(=O)N2)ccc1-c1nnn[n-]1 ZINC001581512071 1075767876 /nfs/dbraw/zinc/76/78/76/1075767876.db2.gz FSAOXCMTFNAVMU-KOLCDFICSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)[C@H]2CN(C)C(=O)N2)ccc1-c1nn[n-]n1 ZINC001581512072 1075767831 /nfs/dbraw/zinc/76/78/31/1075767831.db2.gz FSAOXCMTFNAVMU-MWLCHTKSSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)[C@H]2CN(C)C(=O)N2)ccc1-c1nnn[n-]1 ZINC001581512072 1075767825 /nfs/dbraw/zinc/76/78/25/1075767825.db2.gz FSAOXCMTFNAVMU-MWLCHTKSSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)[C@@H]2CN(C)C(=O)N2)ccc1-c1nn[n-]n1 ZINC001581512073 1075767931 /nfs/dbraw/zinc/76/79/31/1075767931.db2.gz FSAOXCMTFNAVMU-ONGXEEELSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)[C@@H]2CN(C)C(=O)N2)ccc1-c1nnn[n-]1 ZINC001581512073 1075767929 /nfs/dbraw/zinc/76/79/29/1075767929.db2.gz FSAOXCMTFNAVMU-ONGXEEELSA-N -1 3 375.393 -1.517 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)Cn2ncn(C)c2=O)ccc1-c1nn[n-]n1 ZINC001581512084 1075767914 /nfs/dbraw/zinc/76/79/14/1075767914.db2.gz FZPMXYYWFFVHDT-JTQLQIEISA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)Cn2ncn(C)c2=O)ccc1-c1nnn[n-]1 ZINC001581512084 1075767912 /nfs/dbraw/zinc/76/79/12/1075767912.db2.gz FZPMXYYWFFVHDT-JTQLQIEISA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)Cn2ncn(C)c2=O)ccc1-c1nn[n-]n1 ZINC001581512085 1075767922 /nfs/dbraw/zinc/76/79/22/1075767922.db2.gz FZPMXYYWFFVHDT-SNVBAGLBSA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)Cn2ncn(C)c2=O)ccc1-c1nnn[n-]1 ZINC001581512085 1075767919 /nfs/dbraw/zinc/76/79/19/1075767919.db2.gz FZPMXYYWFFVHDT-SNVBAGLBSA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)[C@@H]2CN(C)CCO2)ccc1-c1nn[n-]n1 ZINC001581512197 1075767905 /nfs/dbraw/zinc/76/79/05/1075767905.db2.gz IHPVKPMVCYUOGH-AAEUAGOBSA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)[C@H]2CN(C)CCO2)ccc1-c1nn[n-]n1 ZINC001581512198 1075767815 /nfs/dbraw/zinc/76/78/15/1075767815.db2.gz IHPVKPMVCYUOGH-DGCLKSJQSA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)[C@H]2CN(C)CCO2)ccc1-c1nn[n-]n1 ZINC001581512199 1075767757 /nfs/dbraw/zinc/76/77/57/1075767757.db2.gz IHPVKPMVCYUOGH-WCQYABFASA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)[C@@H]2CN(C)CCO2)ccc1-c1nn[n-]n1 ZINC001581512200 1075767771 /nfs/dbraw/zinc/76/77/71/1075767771.db2.gz IHPVKPMVCYUOGH-YPMHNXCESA-N -1 3 376.421 -1.210 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)c2ccc(=O)n(C)n2)ccc1-c1nn[n-]n1 ZINC001581512442 1075767854 /nfs/dbraw/zinc/76/78/54/1075767854.db2.gz NRWKJBDDTNQRNH-JTQLQIEISA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)c2ccc(=O)n(C)n2)ccc1-c1nnn[n-]1 ZINC001581512442 1075767847 /nfs/dbraw/zinc/76/78/47/1075767847.db2.gz NRWKJBDDTNQRNH-JTQLQIEISA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)c2ccc(=O)n(C)n2)ccc1-c1nn[n-]n1 ZINC001581512443 1075767744 /nfs/dbraw/zinc/76/77/44/1075767744.db2.gz NRWKJBDDTNQRNH-SNVBAGLBSA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)c2ccc(=O)n(C)n2)ccc1-c1nnn[n-]1 ZINC001581512443 1075767740 /nfs/dbraw/zinc/76/77/40/1075767740.db2.gz NRWKJBDDTNQRNH-SNVBAGLBSA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)c2cn(C)c(=O)n2C)ccc1-c1nn[n-]n1 ZINC001581512558 1075767733 /nfs/dbraw/zinc/76/77/33/1075767733.db2.gz NXJUDTVQGZYBIS-JTQLQIEISA-N -1 3 387.404 -1.190 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)c2cn(C)c(=O)n2C)ccc1-c1nnn[n-]1 ZINC001581512558 1075767732 /nfs/dbraw/zinc/76/77/32/1075767732.db2.gz NXJUDTVQGZYBIS-JTQLQIEISA-N -1 3 387.404 -1.190 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)c2cn(C)c(=O)n2C)ccc1-c1nn[n-]n1 ZINC001581512559 1075767792 /nfs/dbraw/zinc/76/77/92/1075767792.db2.gz NXJUDTVQGZYBIS-SNVBAGLBSA-N -1 3 387.404 -1.190 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)c2cn(C)c(=O)n2C)ccc1-c1nnn[n-]1 ZINC001581512559 1075767788 /nfs/dbraw/zinc/76/77/88/1075767788.db2.gz NXJUDTVQGZYBIS-SNVBAGLBSA-N -1 3 387.404 -1.190 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)CN2CCOCC2=O)ccc1-c1nn[n-]n1 ZINC001581512886 1075767780 /nfs/dbraw/zinc/76/77/80/1075767780.db2.gz SVJGOCNEVFDYMQ-LLVKDONJSA-N -1 3 390.404 -1.682 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)CN2CCOCC2=O)ccc1-c1nnn[n-]1 ZINC001581512886 1075767776 /nfs/dbraw/zinc/76/77/76/1075767776.db2.gz SVJGOCNEVFDYMQ-LLVKDONJSA-N -1 3 390.404 -1.682 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)CN2CCOCC2=O)ccc1-c1nn[n-]n1 ZINC001581512887 1075767802 /nfs/dbraw/zinc/76/78/02/1075767802.db2.gz SVJGOCNEVFDYMQ-NSHDSACASA-N -1 3 390.404 -1.682 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)CN2CCOCC2=O)ccc1-c1nnn[n-]1 ZINC001581512887 1075767797 /nfs/dbraw/zinc/76/77/97/1075767797.db2.gz SVJGOCNEVFDYMQ-NSHDSACASA-N -1 3 390.404 -1.682 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)[C@@H](C)S(C)(=O)=O)ccc1-c1nn[n-]n1 ZINC001581513104 1075767891 /nfs/dbraw/zinc/76/78/91/1075767891.db2.gz WEGKSNMTDPPUBO-NXEZZACHSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)[C@H](C)S(C)(=O)=O)ccc1-c1nn[n-]n1 ZINC001581513105 1075767721 /nfs/dbraw/zinc/76/77/21/1075767721.db2.gz WEGKSNMTDPPUBO-UWVGGRQHSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)[C@H](C)S(C)(=O)=O)ccc1-c1nn[n-]n1 ZINC001581513106 1075767727 /nfs/dbraw/zinc/76/77/27/1075767727.db2.gz WEGKSNMTDPPUBO-VHSXEESVSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)[C@@H](C)S(C)(=O)=O)ccc1-c1nn[n-]n1 ZINC001581513107 1075767717 /nfs/dbraw/zinc/76/77/17/1075767717.db2.gz WEGKSNMTDPPUBO-ZJUUUORDSA-N -1 3 383.434 -1.108 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)CN2CCNC(=O)C2)ccc1-c1nn[n-]n1 ZINC001581513426 1075768359 /nfs/dbraw/zinc/76/83/59/1075768359.db2.gz ZDYNZTTTXTXEGA-LLVKDONJSA-N -1 3 389.420 -2.109 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)CN2CCNC(=O)C2)ccc1-c1nnn[n-]1 ZINC001581513426 1075768355 /nfs/dbraw/zinc/76/83/55/1075768355.db2.gz ZDYNZTTTXTXEGA-LLVKDONJSA-N -1 3 389.420 -2.109 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)CN2CCNC(=O)C2)ccc1-c1nn[n-]n1 ZINC001581513428 1075768214 /nfs/dbraw/zinc/76/82/14/1075768214.db2.gz ZDYNZTTTXTXEGA-NSHDSACASA-N -1 3 389.420 -2.109 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)CN2CCNC(=O)C2)ccc1-c1nnn[n-]1 ZINC001581513428 1075768210 /nfs/dbraw/zinc/76/82/10/1075768210.db2.gz ZDYNZTTTXTXEGA-NSHDSACASA-N -1 3 389.420 -2.109 20 0 GAADHM Cc1nc(NC[C@H]2CN(C(=O)[C@H]3CNC(=O)N3)CCO2)ccc1-c1nn[n-]n1 ZINC001581517812 1075768110 /nfs/dbraw/zinc/76/81/10/1075768110.db2.gz HTLAFVSFMIAMLM-CMPLNLGQSA-N -1 3 387.404 -1.109 20 0 GAADHM Cc1nc(NC[C@H]2CN(C(=O)[C@H]3CNC(=O)N3)CCO2)ccc1-c1nnn[n-]1 ZINC001581517812 1075768099 /nfs/dbraw/zinc/76/80/99/1075768099.db2.gz HTLAFVSFMIAMLM-CMPLNLGQSA-N -1 3 387.404 -1.109 20 0 GAADHM Cc1nc(NC[C@H]2CN(C(=O)[C@@H]3CNC(=O)N3)CCO2)ccc1-c1nn[n-]n1 ZINC001581517813 1075768300 /nfs/dbraw/zinc/76/83/00/1075768300.db2.gz HTLAFVSFMIAMLM-JQWIXIFHSA-N -1 3 387.404 -1.109 20 0 GAADHM Cc1nc(NC[C@H]2CN(C(=O)[C@@H]3CNC(=O)N3)CCO2)ccc1-c1nnn[n-]1 ZINC001581517813 1075768297 /nfs/dbraw/zinc/76/82/97/1075768297.db2.gz HTLAFVSFMIAMLM-JQWIXIFHSA-N -1 3 387.404 -1.109 20 0 GAADHM Cc1nc(NC[C@@H]2CN(C(=O)[C@@H]3CNC(=O)N3)CCO2)ccc1-c1nn[n-]n1 ZINC001581517814 1075768195 /nfs/dbraw/zinc/76/81/95/1075768195.db2.gz HTLAFVSFMIAMLM-PWSUYJOCSA-N -1 3 387.404 -1.109 20 0 GAADHM Cc1nc(NC[C@@H]2CN(C(=O)[C@@H]3CNC(=O)N3)CCO2)ccc1-c1nnn[n-]1 ZINC001581517814 1075768188 /nfs/dbraw/zinc/76/81/88/1075768188.db2.gz HTLAFVSFMIAMLM-PWSUYJOCSA-N -1 3 387.404 -1.109 20 0 GAADHM Cc1nc(NC[C@@H]2CN(C(=O)[C@H]3CNC(=O)N3)CCO2)ccc1-c1nn[n-]n1 ZINC001581517815 1075768175 /nfs/dbraw/zinc/76/81/75/1075768175.db2.gz HTLAFVSFMIAMLM-ZYHUDNBSSA-N -1 3 387.404 -1.109 20 0 GAADHM Cc1nc(NC[C@@H]2CN(C(=O)[C@H]3CNC(=O)N3)CCO2)ccc1-c1nnn[n-]1 ZINC001581517815 1075768168 /nfs/dbraw/zinc/76/81/68/1075768168.db2.gz HTLAFVSFMIAMLM-ZYHUDNBSSA-N -1 3 387.404 -1.109 20 0 GAADHM Cc1nc(NC[C@@H]2CN(C(=O)Cn3cnnn3)CCO2)ccc1-c1nn[n-]n1 ZINC001581518167 1075768242 /nfs/dbraw/zinc/76/82/42/1075768242.db2.gz OYOLEVIBDNAKLP-LLVKDONJSA-N -1 3 385.392 -1.104 20 0 GAADHM Cc1nc(NC[C@@H]2CN(C(=O)Cn3cnnn3)CCO2)ccc1-c1nnn[n-]1 ZINC001581518167 1075768239 /nfs/dbraw/zinc/76/82/39/1075768239.db2.gz OYOLEVIBDNAKLP-LLVKDONJSA-N -1 3 385.392 -1.104 20 0 GAADHM Cc1nc(NC[C@H]2CN(C(=O)Cn3cnnn3)CCO2)ccc1-c1nn[n-]n1 ZINC001581518168 1075768253 /nfs/dbraw/zinc/76/82/53/1075768253.db2.gz OYOLEVIBDNAKLP-NSHDSACASA-N -1 3 385.392 -1.104 20 0 GAADHM Cc1nc(NC[C@H]2CN(C(=O)Cn3cnnn3)CCO2)ccc1-c1nnn[n-]1 ZINC001581518168 1075768250 /nfs/dbraw/zinc/76/82/50/1075768250.db2.gz OYOLEVIBDNAKLP-NSHDSACASA-N -1 3 385.392 -1.104 20 0 GAADHM Cc1nc(NCCN(CCO)C(=O)[C@H]2COC(=O)N2)ccc1-c1nn[n-]n1 ZINC001581522710 1075768351 /nfs/dbraw/zinc/76/83/51/1075768351.db2.gz BOMYNHZJSDJYST-LLVKDONJSA-N -1 3 376.377 -1.089 20 0 GAADHM Cc1nc(NCCN(CCO)C(=O)[C@H]2COC(=O)N2)ccc1-c1nnn[n-]1 ZINC001581522710 1075768348 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20 0 GAADHM Cc1nc(NCCN(CCO)C(=O)[C@H]2CN(C)C(=O)N2)ccc1-c1nnn[n-]1 ZINC001581523216 1075768148 /nfs/dbraw/zinc/76/81/48/1075768148.db2.gz WYNNZNPDKSAFLG-GFCCVEGCSA-N -1 3 389.420 -1.173 20 0 GAADHM Cc1nc(NCCN(CCO)C(=O)[C@@H]2CN(C)C(=O)N2)ccc1-c1nn[n-]n1 ZINC001581523217 1075768323 /nfs/dbraw/zinc/76/83/23/1075768323.db2.gz WYNNZNPDKSAFLG-LBPRGKRZSA-N -1 3 389.420 -1.173 20 0 GAADHM Cc1nc(NCCN(CCO)C(=O)[C@@H]2CN(C)C(=O)N2)ccc1-c1nnn[n-]1 ZINC001581523217 1075768319 /nfs/dbraw/zinc/76/83/19/1075768319.db2.gz WYNNZNPDKSAFLG-LBPRGKRZSA-N -1 3 389.420 -1.173 20 0 GAADHM Cc1nc(NCCN(CCO)C(=O)[C@H]2CNC(=O)N2)ccc1-c1nn[n-]n1 ZINC001581523303 1075768083 /nfs/dbraw/zinc/76/80/83/1075768083.db2.gz ZTGGKZHHUZKSMJ-LLVKDONJSA-N -1 3 375.393 -1.516 20 0 GAADHM Cc1nc(NCCN(CCO)C(=O)[C@H]2CNC(=O)N2)ccc1-c1nnn[n-]1 ZINC001581523303 1075768075 /nfs/dbraw/zinc/76/80/75/1075768075.db2.gz ZTGGKZHHUZKSMJ-LLVKDONJSA-N -1 3 375.393 -1.516 20 0 GAADHM Cc1nc(NCCN(CCO)C(=O)[C@@H]2CNC(=O)N2)ccc1-c1nn[n-]n1 ZINC001581523304 1075768134 /nfs/dbraw/zinc/76/81/34/1075768134.db2.gz ZTGGKZHHUZKSMJ-NSHDSACASA-N -1 3 375.393 -1.516 20 0 GAADHM Cc1nc(NCCN(CCO)C(=O)[C@@H]2CNC(=O)N2)ccc1-c1nnn[n-]1 ZINC001581523304 1075768126 /nfs/dbraw/zinc/76/81/26/1075768126.db2.gz ZTGGKZHHUZKSMJ-NSHDSACASA-N -1 3 375.393 -1.516 20 0 GAADHM Cc1nc(S(=O)(=O)NCC(=O)NCc2cncc(-c3nn[n-]n3)c2)cn1C ZINC001581530864 1075768333 /nfs/dbraw/zinc/76/83/33/1075768333.db2.gz NTIIEDHLYDEUSA-UHFFFAOYSA-N -1 3 391.417 -1.102 20 0 GAADHM Cc1nc(S(=O)(=O)NCC(=O)NCc2cncc(-c3nnn[n-]3)c2)cn1C ZINC001581530864 1075768329 /nfs/dbraw/zinc/76/83/29/1075768329.db2.gz NTIIEDHLYDEUSA-UHFFFAOYSA-N -1 3 391.417 -1.102 20 0 GAADHM Cc1ncc(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1C ZINC001581536652 1075768312 /nfs/dbraw/zinc/76/83/12/1075768312.db2.gz CPUOAGKNOHWMON-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1ncc(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1C ZINC001581536652 1075768308 /nfs/dbraw/zinc/76/83/08/1075768308.db2.gz 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385.388 -1.148 20 0 GAADHM Cc1ncc(C(=O)NCC2(O)CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1C ZINC001581539872 1075768454 /nfs/dbraw/zinc/76/84/54/1075768454.db2.gz APASTEWOOLPUKT-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1ncc(C(=O)NCC2(O)CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1C ZINC001581539872 1075768449 /nfs/dbraw/zinc/76/84/49/1075768449.db2.gz APASTEWOOLPUKT-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1ncc(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1C ZINC001581539976 1075768747 /nfs/dbraw/zinc/76/87/47/1075768747.db2.gz CPERMMRDLKSKIO-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1ncc(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1C ZINC001581539976 1075768743 /nfs/dbraw/zinc/76/87/43/1075768743.db2.gz CPERMMRDLKSKIO-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1ncc(C(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1C ZINC001581540427 1075768491 /nfs/dbraw/zinc/76/84/91/1075768491.db2.gz MAWMDGNBGUJWKZ-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1ncc(C(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1C ZINC001581540427 1075768487 /nfs/dbraw/zinc/76/84/87/1075768487.db2.gz MAWMDGNBGUJWKZ-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1ncc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)n1C ZINC001581541632 1075768602 /nfs/dbraw/zinc/76/86/02/1075768602.db2.gz CKCZIKMNHJOAIX-DGCLKSJQSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1ncc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)n1C ZINC001581541632 1075768596 /nfs/dbraw/zinc/76/85/96/1075768596.db2.gz CKCZIKMNHJOAIX-DGCLKSJQSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1ncc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)n1C ZINC001581541633 1075768679 /nfs/dbraw/zinc/76/86/79/1075768679.db2.gz CKCZIKMNHJOAIX-YPMHNXCESA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1ncc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)n1C ZINC001581541633 1075768674 /nfs/dbraw/zinc/76/86/74/1075768674.db2.gz CKCZIKMNHJOAIX-YPMHNXCESA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1ncc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)n1C ZINC001581541651 1075768733 /nfs/dbraw/zinc/76/87/33/1075768733.db2.gz DNKBOFNCEIKLPE-YPMHNXCESA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1ncc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)n1C ZINC001581541651 1075768728 /nfs/dbraw/zinc/76/87/28/1075768728.db2.gz DNKBOFNCEIKLPE-YPMHNXCESA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1nccc(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581551568 1075768561 /nfs/dbraw/zinc/76/85/61/1075768561.db2.gz IKHFRGZXOCHQNV-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1nccc(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581551568 1075768558 /nfs/dbraw/zinc/76/85/58/1075768558.db2.gz IKHFRGZXOCHQNV-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1nccc(C(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581551791 1075768503 /nfs/dbraw/zinc/76/85/03/1075768503.db2.gz MECYGHMDAUDFET-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1nccc(C(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581551791 1075768501 /nfs/dbraw/zinc/76/85/01/1075768501.db2.gz MECYGHMDAUDFET-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1nccc(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581552083 1075768666 /nfs/dbraw/zinc/76/86/66/1075768666.db2.gz QCOPEVYXFJNUQD-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1nccc(C(=O)N2CC(O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581552083 1075768661 /nfs/dbraw/zinc/76/86/61/1075768661.db2.gz QCOPEVYXFJNUQD-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1nccc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)n1 ZINC001581552438 1075768637 /nfs/dbraw/zinc/76/86/37/1075768637.db2.gz BYIDYFXUBJIPKZ-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1nccc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)n1 ZINC001581552438 1075768633 /nfs/dbraw/zinc/76/86/33/1075768633.db2.gz BYIDYFXUBJIPKZ-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1nccc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581552539 1075768517 /nfs/dbraw/zinc/76/85/17/1075768517.db2.gz DZWHLYYMZKFVSE-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1nccc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581552539 1075768512 /nfs/dbraw/zinc/76/85/12/1075768512.db2.gz DZWHLYYMZKFVSE-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1nccc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)n1 ZINC001581552540 1075768466 /nfs/dbraw/zinc/76/84/66/1075768466.db2.gz DZWHLYYMZKFVSE-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1nccc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)n1 ZINC001581552540 1075768462 /nfs/dbraw/zinc/76/84/62/1075768462.db2.gz DZWHLYYMZKFVSE-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1nccc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581553760 1075768531 /nfs/dbraw/zinc/76/85/31/1075768531.db2.gz QPSMPFOFIZHBSG-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1nccc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581553760 1075768527 /nfs/dbraw/zinc/76/85/27/1075768527.db2.gz QPSMPFOFIZHBSG-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1nccc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)n1 ZINC001581554206 1075768652 /nfs/dbraw/zinc/76/86/52/1075768652.db2.gz HNPQPSJXUAGSHZ-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1nccc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)n1 ZINC001581554206 1075768646 /nfs/dbraw/zinc/76/86/46/1075768646.db2.gz HNPQPSJXUAGSHZ-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1nccc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)n1 ZINC001581554247 1075769058 /nfs/dbraw/zinc/76/90/58/1075769058.db2.gz JZBBDBRIZFDJKH-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1nccc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)n1 ZINC001581554247 1075769053 /nfs/dbraw/zinc/76/90/53/1075769053.db2.gz JZBBDBRIZFDJKH-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1nccc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)n1 ZINC001581554248 1075768968 /nfs/dbraw/zinc/76/89/68/1075768968.db2.gz JZBBDBRIZFDJKH-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1nccc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)n1 ZINC001581554248 1075768963 /nfs/dbraw/zinc/76/89/63/1075768963.db2.gz JZBBDBRIZFDJKH-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1nccc(C(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581554346 1075768980 /nfs/dbraw/zinc/76/89/80/1075768980.db2.gz DCIUDYAWIQRSOA-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1nccc(C(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581554346 1075768976 /nfs/dbraw/zinc/76/89/76/1075768976.db2.gz DCIUDYAWIQRSOA-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1nccc(C(=O)NCC2(O)CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581555066 1075768992 /nfs/dbraw/zinc/76/89/92/1075768992.db2.gz PGRIOQJSQKKJCY-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1nccc(C(=O)NCC2(O)CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581555066 1075768989 /nfs/dbraw/zinc/76/89/89/1075768989.db2.gz PGRIOQJSQKKJCY-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1nccc(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581555239 1075769014 /nfs/dbraw/zinc/76/90/14/1075769014.db2.gz VLFYOUPUWBEZPQ-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1nccc(C(=O)NCC2(O)CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581555239 1075769005 /nfs/dbraw/zinc/76/90/05/1075769005.db2.gz VLFYOUPUWBEZPQ-UHFFFAOYSA-N -1 3 383.372 -1.090 20 0 GAADHM Cc1nccn1CC(=O)N1CC(O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581561960 1075768945 /nfs/dbraw/zinc/76/89/45/1075768945.db2.gz CTRDSYAPKDQPPY-UHFFFAOYSA-N -1 3 385.388 -1.297 20 0 GAADHM Cc1nccn1CC(=O)N1CC(O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581561960 1075768942 /nfs/dbraw/zinc/76/89/42/1075768942.db2.gz CTRDSYAPKDQPPY-UHFFFAOYSA-N -1 3 385.388 -1.297 20 0 GAADHM Cc1nccn1CC(=O)N(CCO)CCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581562026 1075769128 /nfs/dbraw/zinc/76/91/28/1075769128.db2.gz GACYJCXMAYMPJT-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1nccn1CC(=O)N(CCO)CCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581562026 1075769124 /nfs/dbraw/zinc/76/91/24/1075769124.db2.gz GACYJCXMAYMPJT-UHFFFAOYSA-N -1 3 387.404 -1.049 20 0 GAADHM Cc1nccn1CC(=O)NC[C@@]1(O)CCN(c2nccnc2-c2nn[n-]n2)C1 ZINC001581562884 1075769621 /nfs/dbraw/zinc/76/96/21/1075769621.db2.gz FOJHJVVYHNPWFD-INIZCTEOSA-N -1 3 384.404 -1.081 20 0 GAADHM Cc1nccn1CC(=O)NC[C@@]1(O)CCN(c2nccnc2-c2nnn[n-]2)C1 ZINC001581562884 1075769619 /nfs/dbraw/zinc/76/96/19/1075769619.db2.gz FOJHJVVYHNPWFD-INIZCTEOSA-N -1 3 384.404 -1.081 20 0 GAADHM Cc1nccn1CC(=O)NC[C@]1(O)CCN(c2nccnc2-c2nn[n-]n2)C1 ZINC001581562887 1075769383 /nfs/dbraw/zinc/76/93/83/1075769383.db2.gz FOJHJVVYHNPWFD-MRXNPFEDSA-N -1 3 384.404 -1.081 20 0 GAADHM Cc1nccn1CC(=O)NC[C@]1(O)CCN(c2nccnc2-c2nnn[n-]2)C1 ZINC001581562887 1075769378 /nfs/dbraw/zinc/76/93/78/1075769378.db2.gz FOJHJVVYHNPWFD-MRXNPFEDSA-N -1 3 384.404 -1.081 20 0 GAADHM Cc1nccn1CC(=O)N[C@H]1CCN(c2cncc(-c3nn[n-]n3)n2)C[C@@H]1O ZINC001581562943 1075769548 /nfs/dbraw/zinc/76/95/48/1075769548.db2.gz HGQNOUSJZGQGQX-AAEUAGOBSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1nccn1CC(=O)N[C@H]1CCN(c2cncc(-c3nnn[n-]3)n2)C[C@@H]1O ZINC001581562943 1075769544 /nfs/dbraw/zinc/76/95/44/1075769544.db2.gz HGQNOUSJZGQGQX-AAEUAGOBSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1nccn1CC(=O)N[C@@H]1CCN(c2cncc(-c3nn[n-]n3)n2)C[C@H]1O ZINC001581562945 1075769444 /nfs/dbraw/zinc/76/94/44/1075769444.db2.gz HGQNOUSJZGQGQX-DGCLKSJQSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1nccn1CC(=O)N[C@@H]1CCN(c2cncc(-c3nnn[n-]3)n2)C[C@H]1O ZINC001581562945 1075769438 /nfs/dbraw/zinc/76/94/38/1075769438.db2.gz HGQNOUSJZGQGQX-DGCLKSJQSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1nccn1CC(=O)N[C@H]1CCN(c2cncc(-c3nn[n-]n3)n2)C[C@H]1O ZINC001581562946 1075769530 /nfs/dbraw/zinc/76/95/30/1075769530.db2.gz HGQNOUSJZGQGQX-WCQYABFASA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1nccn1CC(=O)N[C@H]1CCN(c2cncc(-c3nnn[n-]3)n2)C[C@H]1O ZINC001581562946 1075769526 /nfs/dbraw/zinc/76/95/26/1075769526.db2.gz HGQNOUSJZGQGQX-WCQYABFASA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1nccn1CC(=O)N[C@@H]1CCN(c2cncc(-c3nn[n-]n3)n2)C[C@@H]1O ZINC001581562947 1075769614 /nfs/dbraw/zinc/76/96/14/1075769614.db2.gz HGQNOUSJZGQGQX-YPMHNXCESA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1nccn1CC(=O)N[C@@H]1CCN(c2cncc(-c3nnn[n-]3)n2)C[C@@H]1O ZINC001581562947 1075769613 /nfs/dbraw/zinc/76/96/13/1075769613.db2.gz HGQNOUSJZGQGQX-YPMHNXCESA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1nccn1CC(=O)N[C@@H]1CCN(c2nccnc2-c2nn[n-]n2)C[C@@H]1O ZINC001581562961 1075769576 /nfs/dbraw/zinc/76/95/76/1075769576.db2.gz HSPUDBLAWNVIAN-NEPJUHHUSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1nccn1CC(=O)N[C@@H]1CCN(c2nccnc2-c2nnn[n-]2)C[C@@H]1O ZINC001581562961 1075769573 /nfs/dbraw/zinc/76/95/73/1075769573.db2.gz HSPUDBLAWNVIAN-NEPJUHHUSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1nccn1CC(=O)N[C@H]1CCN(c2nccnc2-c2nn[n-]n2)C[C@H]1O ZINC001581562962 1075769607 /nfs/dbraw/zinc/76/96/07/1075769607.db2.gz HSPUDBLAWNVIAN-NWDGAFQWSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1nccn1CC(=O)N[C@H]1CCN(c2nccnc2-c2nnn[n-]2)C[C@H]1O ZINC001581562962 1075769604 /nfs/dbraw/zinc/76/96/04/1075769604.db2.gz HSPUDBLAWNVIAN-NWDGAFQWSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1nccn1CC(=O)N[C@H]1CCN(c2nccnc2-c2nn[n-]n2)C[C@@H]1O ZINC001581562964 1075769517 /nfs/dbraw/zinc/76/95/17/1075769517.db2.gz HSPUDBLAWNVIAN-RYUDHWBXSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1nccn1CC(=O)N[C@H]1CCN(c2nccnc2-c2nnn[n-]2)C[C@@H]1O ZINC001581562964 1075769516 /nfs/dbraw/zinc/76/95/16/1075769516.db2.gz HSPUDBLAWNVIAN-RYUDHWBXSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1nccn1CC(=O)N[C@@H]1CCN(c2nccnc2-c2nn[n-]n2)C[C@H]1O ZINC001581562965 1075769346 /nfs/dbraw/zinc/76/93/46/1075769346.db2.gz HSPUDBLAWNVIAN-VXGBXAGGSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1nccn1CC(=O)N[C@@H]1CCN(c2nccnc2-c2nnn[n-]2)C[C@H]1O ZINC001581562965 1075769341 /nfs/dbraw/zinc/76/93/41/1075769341.db2.gz HSPUDBLAWNVIAN-VXGBXAGGSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1nccn1CC(=O)NC[C@@H](O)CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581563079 1075769562 /nfs/dbraw/zinc/76/95/62/1075769562.db2.gz IPSMODZLHBSYHS-GFCCVEGCSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1nccn1CC(=O)NC[C@@H](O)CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581563079 1075769559 /nfs/dbraw/zinc/76/95/59/1075769559.db2.gz IPSMODZLHBSYHS-GFCCVEGCSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1nccn1CC(=O)NC[C@H](O)CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581563080 1075769595 /nfs/dbraw/zinc/76/95/95/1075769595.db2.gz IPSMODZLHBSYHS-LBPRGKRZSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1nccn1CC(=O)NC[C@H](O)CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581563080 1075769591 /nfs/dbraw/zinc/76/95/91/1075769591.db2.gz IPSMODZLHBSYHS-LBPRGKRZSA-N -1 3 387.404 -1.051 20 0 GAADHM Cc1nccn1CC(=O)NCC1(O)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581563312 1075769402 /nfs/dbraw/zinc/76/94/02/1075769402.db2.gz KREMQAMQSFPASA-UHFFFAOYSA-N -1 3 385.388 -1.297 20 0 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Cc1nn(C)c(F)c1C(=O)N[C@@H](CO)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581591634 1075770961 /nfs/dbraw/zinc/77/09/61/1075770961.db2.gz VIZDUUYZEOLPRR-MRVPVSSYSA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(F)c1C(=O)N[C@H](CO)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581591635 1075771086 /nfs/dbraw/zinc/77/10/86/1075771086.db2.gz VIZDUUYZEOLPRR-QMMMGPOBSA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(F)c1C(=O)N[C@H](CO)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581591635 1075771082 /nfs/dbraw/zinc/77/10/82/1075771082.db2.gz VIZDUUYZEOLPRR-QMMMGPOBSA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(F)c1C(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581591766 1075771094 /nfs/dbraw/zinc/77/10/94/1075771094.db2.gz YZJPQMCAAHDKKJ-SECBINFHSA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(F)c1C(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581591766 1075771091 /nfs/dbraw/zinc/77/10/91/1075771091.db2.gz YZJPQMCAAHDKKJ-SECBINFHSA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(F)c1C(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581591767 1075771073 /nfs/dbraw/zinc/77/10/73/1075771073.db2.gz YZJPQMCAAHDKKJ-VIFPVBQESA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(F)c1C(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581591767 1075771068 /nfs/dbraw/zinc/77/10/68/1075771068.db2.gz YZJPQMCAAHDKKJ-VIFPVBQESA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)CCNC(=O)CO)CC2)c1-c1nn[n-]n1 ZINC001581591823 1075771151 /nfs/dbraw/zinc/77/11/51/1075771151.db2.gz BMPFUNUFSKLFJA-UHFFFAOYSA-N -1 3 377.409 -1.944 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)CCNC(=O)CO)CC2)c1-c1nnn[n-]1 ZINC001581591823 1075771149 /nfs/dbraw/zinc/77/11/49/1075771149.db2.gz BMPFUNUFSKLFJA-UHFFFAOYSA-N -1 3 377.409 -1.944 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)[C@H]3CC[C@@H](C(N)=O)O3)CC2)c1-c1nn[n-]n1 ZINC001581591828 1075771121 /nfs/dbraw/zinc/77/11/21/1075771121.db2.gz BSKGDBTYDUJTJV-WDEREUQCSA-N -1 3 389.420 -1.410 20 0 GAADHM 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Cc1nn(C)c(F)c1C(=O)NC[C@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581591916 1075770980 /nfs/dbraw/zinc/77/09/80/1075770980.db2.gz GEHPXMNDXHJVMO-SECBINFHSA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(F)c1C(=O)NC[C@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581591916 1075770977 /nfs/dbraw/zinc/77/09/77/1075770977.db2.gz GEHPXMNDXHJVMO-SECBINFHSA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(F)c1C(=O)NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581591917 1075771163 /nfs/dbraw/zinc/77/11/63/1075771163.db2.gz GEHPXMNDXHJVMO-VIFPVBQESA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(F)c1C(=O)NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581591917 1075771162 /nfs/dbraw/zinc/77/11/62/1075771162.db2.gz GEHPXMNDXHJVMO-VIFPVBQESA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(F)c1C(=O)NC[C@H](CO)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581591940 1075771145 /nfs/dbraw/zinc/77/11/45/1075771145.db2.gz GUBRIBNZHDWYRP-SECBINFHSA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(F)c1C(=O)NC[C@H](CO)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581591940 1075771143 /nfs/dbraw/zinc/77/11/43/1075771143.db2.gz GUBRIBNZHDWYRP-SECBINFHSA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(F)c1C(=O)NC[C@@H](CO)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581591941 1075771058 /nfs/dbraw/zinc/77/10/58/1075771058.db2.gz GUBRIBNZHDWYRP-VIFPVBQESA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(F)c1C(=O)NC[C@@H](CO)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581591941 1075771052 /nfs/dbraw/zinc/77/10/52/1075771052.db2.gz GUBRIBNZHDWYRP-VIFPVBQESA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)c3cc(=O)n(C)cn3)CC2)c1-c1nn[n-]n1 ZINC001581591942 1075771130 /nfs/dbraw/zinc/77/11/30/1075771130.db2.gz GUHXRBBBJMCIGN-UHFFFAOYSA-N -1 3 384.404 -1.035 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)c3cc(=O)n(C)cn3)CC2)c1-c1nnn[n-]1 ZINC001581591942 1075771127 /nfs/dbraw/zinc/77/11/27/1075771127.db2.gz GUHXRBBBJMCIGN-UHFFFAOYSA-N -1 3 384.404 -1.035 20 0 GAADHM 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Cc1nn(C)c(F)c1C(=O)NC[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581592874 1075771455 /nfs/dbraw/zinc/77/14/55/1075771455.db2.gz RXPYWHPSUHPACP-SECBINFHSA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(F)c1C(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581592875 1075771416 /nfs/dbraw/zinc/77/14/16/1075771416.db2.gz RXPYWHPSUHPACP-VIFPVBQESA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(F)c1C(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581592875 1075771412 /nfs/dbraw/zinc/77/14/12/1075771412.db2.gz RXPYWHPSUHPACP-VIFPVBQESA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(F)c1C(=O)NC[C@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581593243 1075771498 /nfs/dbraw/zinc/77/14/98/1075771498.db2.gz XCKPVTBWYSVFPW-SECBINFHSA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(F)c1C(=O)NC[C@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581593243 1075771495 /nfs/dbraw/zinc/77/14/95/1075771495.db2.gz XCKPVTBWYSVFPW-SECBINFHSA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(F)c1C(=O)NC[C@@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581593244 1075771446 /nfs/dbraw/zinc/77/14/46/1075771446.db2.gz XCKPVTBWYSVFPW-VIFPVBQESA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)c(F)c1C(=O)NC[C@@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581593244 1075771439 /nfs/dbraw/zinc/77/14/39/1075771439.db2.gz XCKPVTBWYSVFPW-VIFPVBQESA-N -1 3 391.367 -1.103 20 0 GAADHM Cc1nn(C)cc1C(=O)N1CC(O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581595750 1075771281 /nfs/dbraw/zinc/77/12/81/1075771281.db2.gz DEXNPNOYVAYLRO-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1nn(C)cc1C(=O)N1CC(O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581595750 1075771278 /nfs/dbraw/zinc/77/12/78/1075771278.db2.gz DEXNPNOYVAYLRO-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1nn(C)cc1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581595948 1075771549 /nfs/dbraw/zinc/77/15/49/1075771549.db2.gz IHZVOCTVLSQIPU-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1nn(C)cc1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581595948 1075771546 /nfs/dbraw/zinc/77/15/46/1075771546.db2.gz IHZVOCTVLSQIPU-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1nn(C)cc1C(=O)N1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001581595949 1075771429 /nfs/dbraw/zinc/77/14/29/1075771429.db2.gz IHZVOCTVLSQIPU-OLZOCXBDSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1nn(C)cc1C(=O)N1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001581595949 1075771425 /nfs/dbraw/zinc/77/14/25/1075771425.db2.gz IHZVOCTVLSQIPU-OLZOCXBDSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1nn(C)cc1C(=O)N1CC(O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581596056 1075771313 /nfs/dbraw/zinc/77/13/13/1075771313.db2.gz LVUBQXXXQNFFNF-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1nn(C)cc1C(=O)N1CC(O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581596056 1075771307 /nfs/dbraw/zinc/77/13/07/1075771307.db2.gz LVUBQXXXQNFFNF-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1nn(C)cc1C(=O)N1CC(O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581596607 1075771378 /nfs/dbraw/zinc/77/13/78/1075771378.db2.gz XPYCAODHOPWKJU-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1nn(C)cc1C(=O)N1CC(O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581596607 1075771372 /nfs/dbraw/zinc/77/13/72/1075771372.db2.gz XPYCAODHOPWKJU-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1nn(C)cc1C(=O)NCC1(O)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581597920 1075771471 /nfs/dbraw/zinc/77/14/71/1075771471.db2.gz GSMSXLJSVNNIEV-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1nn(C)cc1C(=O)NCC1(O)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581597920 1075771467 /nfs/dbraw/zinc/77/14/67/1075771467.db2.gz GSMSXLJSVNNIEV-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1nn(C)cc1C(=O)NCC1(O)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581598392 1075771789 /nfs/dbraw/zinc/77/17/89/1075771789.db2.gz SZOJKNJUDRQEMM-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1nn(C)cc1C(=O)NCC1(O)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581598392 1075771787 /nfs/dbraw/zinc/77/17/87/1075771787.db2.gz SZOJKNJUDRQEMM-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1nn(C)cc1C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581598435 1075771824 /nfs/dbraw/zinc/77/18/24/1075771824.db2.gz USGUCCPPWGCKGH-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1nn(C)cc1C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581598435 1075771822 /nfs/dbraw/zinc/77/18/22/1075771822.db2.gz USGUCCPPWGCKGH-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM Cc1nn(C)cc1C(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O ZINC001581598771 1075771729 /nfs/dbraw/zinc/77/17/29/1075771729.db2.gz GUIIJDYUYKZFAE-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1nn(C)cc1C(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O ZINC001581598771 1075771726 /nfs/dbraw/zinc/77/17/26/1075771726.db2.gz GUIIJDYUYKZFAE-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1nn(C)cc1C(=O)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O ZINC001581598791 1075771836 /nfs/dbraw/zinc/77/18/36/1075771836.db2.gz HJIQVGVNNCDWRF-OLZOCXBDSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1nn(C)cc1C(=O)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O ZINC001581598791 1075771832 /nfs/dbraw/zinc/77/18/32/1075771832.db2.gz HJIQVGVNNCDWRF-OLZOCXBDSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1nn(C)cc1C(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O ZINC001581599170 1075771859 /nfs/dbraw/zinc/77/18/59/1075771859.db2.gz ZCRLPBXAPMBLAD-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1nn(C)cc1C(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O ZINC001581599170 1075771856 /nfs/dbraw/zinc/77/18/56/1075771856.db2.gz ZCRLPBXAPMBLAD-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1nn(C)cc1C(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O ZINC001581599171 1075771720 /nfs/dbraw/zinc/77/17/20/1075771720.db2.gz ZCRLPBXAPMBLAD-OLZOCXBDSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1nn(C)cc1C(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O ZINC001581599171 1075771716 /nfs/dbraw/zinc/77/17/16/1075771716.db2.gz ZCRLPBXAPMBLAD-OLZOCXBDSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1nn(C)cc1CC(=O)N[C@@H](CO)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581599908 1075771741 /nfs/dbraw/zinc/77/17/41/1075771741.db2.gz APYLTVDZNBOFMW-LLVKDONJSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)N[C@@H](CO)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581599908 1075771739 /nfs/dbraw/zinc/77/17/39/1075771739.db2.gz APYLTVDZNBOFMW-LLVKDONJSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)N[C@H](CO)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581599909 1075771816 /nfs/dbraw/zinc/77/18/16/1075771816.db2.gz APYLTVDZNBOFMW-NSHDSACASA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)N[C@H](CO)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581599909 1075771814 /nfs/dbraw/zinc/77/18/14/1075771814.db2.gz APYLTVDZNBOFMW-NSHDSACASA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581600106 1075771758 /nfs/dbraw/zinc/77/17/58/1075771758.db2.gz HZVVRKGIJMRTCV-GFCCVEGCSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581600106 1075771756 /nfs/dbraw/zinc/77/17/56/1075771756.db2.gz HZVVRKGIJMRTCV-GFCCVEGCSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581600107 1075771752 /nfs/dbraw/zinc/77/17/52/1075771752.db2.gz HZVVRKGIJMRTCV-LBPRGKRZSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581600107 1075771751 /nfs/dbraw/zinc/77/17/51/1075771751.db2.gz HZVVRKGIJMRTCV-LBPRGKRZSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581600458 1075771848 /nfs/dbraw/zinc/77/18/48/1075771848.db2.gz STCWKQDBDPZMOX-GFCCVEGCSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581600458 1075771845 /nfs/dbraw/zinc/77/18/45/1075771845.db2.gz STCWKQDBDPZMOX-GFCCVEGCSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)N[C@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581600459 1075771778 /nfs/dbraw/zinc/77/17/78/1075771778.db2.gz STCWKQDBDPZMOX-LBPRGKRZSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)N[C@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581600459 1075771776 /nfs/dbraw/zinc/77/17/76/1075771776.db2.gz STCWKQDBDPZMOX-LBPRGKRZSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581600839 1075771798 /nfs/dbraw/zinc/77/17/98/1075771798.db2.gz IGYHZHQYVKHXDX-GFCCVEGCSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581600839 1075771795 /nfs/dbraw/zinc/77/17/95/1075771795.db2.gz IGYHZHQYVKHXDX-GFCCVEGCSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581600840 1075771764 /nfs/dbraw/zinc/77/17/64/1075771764.db2.gz IGYHZHQYVKHXDX-LBPRGKRZSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581600840 1075771762 /nfs/dbraw/zinc/77/17/62/1075771762.db2.gz IGYHZHQYVKHXDX-LBPRGKRZSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@H](CO)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581601035 1075771785 /nfs/dbraw/zinc/77/17/85/1075771785.db2.gz NCSUNIWUWZCJKT-LLVKDONJSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@H](CO)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581601035 1075771783 /nfs/dbraw/zinc/77/17/83/1075771783.db2.gz NCSUNIWUWZCJKT-LLVKDONJSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@@H](CO)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581601036 1075771708 /nfs/dbraw/zinc/77/17/08/1075771708.db2.gz NCSUNIWUWZCJKT-NSHDSACASA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@@H](CO)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581601036 1075771705 /nfs/dbraw/zinc/77/17/05/1075771705.db2.gz NCSUNIWUWZCJKT-NSHDSACASA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581601239 1075772175 /nfs/dbraw/zinc/77/21/75/1075772175.db2.gz RZNIZHACOXCQBK-GFCCVEGCSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581601239 1075772172 /nfs/dbraw/zinc/77/21/72/1075772172.db2.gz RZNIZHACOXCQBK-GFCCVEGCSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581601240 1075772149 /nfs/dbraw/zinc/77/21/49/1075772149.db2.gz RZNIZHACOXCQBK-LBPRGKRZSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581601240 1075772144 /nfs/dbraw/zinc/77/21/44/1075772144.db2.gz RZNIZHACOXCQBK-LBPRGKRZSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581601249 1075772225 /nfs/dbraw/zinc/77/22/25/1075772225.db2.gz SGIUXPKIPWMHQT-GFCCVEGCSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581601249 1075772221 /nfs/dbraw/zinc/77/22/21/1075772221.db2.gz SGIUXPKIPWMHQT-GFCCVEGCSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581601250 1075772098 /nfs/dbraw/zinc/77/20/98/1075772098.db2.gz SGIUXPKIPWMHQT-LBPRGKRZSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581601250 1075772092 /nfs/dbraw/zinc/77/20/92/1075772092.db2.gz SGIUXPKIPWMHQT-LBPRGKRZSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581601256 1075772162 /nfs/dbraw/zinc/77/21/62/1075772162.db2.gz SMIFTBKDELGUSQ-LLVKDONJSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581601256 1075772156 /nfs/dbraw/zinc/77/21/56/1075772156.db2.gz SMIFTBKDELGUSQ-LLVKDONJSA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581601257 1075771999 /nfs/dbraw/zinc/77/19/99/1075771999.db2.gz SMIFTBKDELGUSQ-NSHDSACASA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(C)cc1CC(=O)NC[C@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581601257 1075771991 /nfs/dbraw/zinc/77/19/91/1075771991.db2.gz SMIFTBKDELGUSQ-NSHDSACASA-N -1 3 387.404 -1.314 20 0 GAADHM Cc1nn(CC(=O)NC[C@@H](C)NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)c(=O)n1C ZINC001581602948 1075772080 /nfs/dbraw/zinc/77/20/80/1075772080.db2.gz AEIDUEWSALYTDQ-MRVPVSSYSA-N -1 3 388.392 -1.667 20 0 GAADHM Cc1nn(CC(=O)NC[C@@H](C)NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)c(=O)n1C ZINC001581602948 1075772074 /nfs/dbraw/zinc/77/20/74/1075772074.db2.gz AEIDUEWSALYTDQ-MRVPVSSYSA-N -1 3 388.392 -1.667 20 0 GAADHM Cc1nn(CC(=O)NC[C@H](C)NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)c(=O)n1C ZINC001581602949 1075772038 /nfs/dbraw/zinc/77/20/38/1075772038.db2.gz AEIDUEWSALYTDQ-QMMMGPOBSA-N -1 3 388.392 -1.667 20 0 GAADHM Cc1nn(CC(=O)NC[C@H](C)NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)c(=O)n1C ZINC001581602949 1075772028 /nfs/dbraw/zinc/77/20/28/1075772028.db2.gz AEIDUEWSALYTDQ-QMMMGPOBSA-N -1 3 388.392 -1.667 20 0 GAADHM Cc1nn(CC(=O)N[C@H](C)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)c(=O)n1C ZINC001581602997 1075772550 /nfs/dbraw/zinc/77/25/50/1075772550.db2.gz CETJTWIAFVAEIX-MRVPVSSYSA-N -1 3 388.392 -1.667 20 0 GAADHM Cc1nn(CC(=O)N[C@H](C)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)c(=O)n1C ZINC001581602997 1075772545 /nfs/dbraw/zinc/77/25/45/1075772545.db2.gz CETJTWIAFVAEIX-MRVPVSSYSA-N -1 3 388.392 -1.667 20 0 GAADHM Cc1nn(CC(=O)N[C@@H](C)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)c(=O)n1C ZINC001581602998 1075772456 /nfs/dbraw/zinc/77/24/56/1075772456.db2.gz CETJTWIAFVAEIX-QMMMGPOBSA-N -1 3 388.392 -1.667 20 0 GAADHM Cc1nn(CC(=O)N[C@@H](C)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)c(=O)n1C ZINC001581602998 1075772452 /nfs/dbraw/zinc/77/24/52/1075772452.db2.gz CETJTWIAFVAEIX-QMMMGPOBSA-N -1 3 388.392 -1.667 20 0 GAADHM Cc1nn(CC(=O)NCCN(C)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)c(=O)n1C ZINC001581603003 1075772400 /nfs/dbraw/zinc/77/24/00/1075772400.db2.gz CLDJMPOHFLPBEG-UHFFFAOYSA-N -1 3 388.392 -1.713 20 0 GAADHM Cc1nn(CC(=O)NCCN(C)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)c(=O)n1C ZINC001581603003 1075772399 /nfs/dbraw/zinc/77/23/99/1075772399.db2.gz CLDJMPOHFLPBEG-UHFFFAOYSA-N -1 3 388.392 -1.713 20 0 GAADHM Cc1nn(CC(=O)NC2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)c(=O)n1C ZINC001581603007 1075772470 /nfs/dbraw/zinc/77/24/70/1075772470.db2.gz CNGWANLFZALBSD-UHFFFAOYSA-N -1 3 386.376 -1.961 20 0 GAADHM Cc1nn(CC(=O)NC2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)c(=O)n1C ZINC001581603007 1075772465 /nfs/dbraw/zinc/77/24/65/1075772465.db2.gz CNGWANLFZALBSD-UHFFFAOYSA-N -1 3 386.376 -1.961 20 0 GAADHM Cc1nn(CC(=O)N2CC(NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)c(=O)n1C ZINC001581603025 1075772980 /nfs/dbraw/zinc/77/29/80/1075772980.db2.gz DIVZZKMYOPMHAM-UHFFFAOYSA-N -1 3 386.376 -1.961 20 0 GAADHM Cc1nn(CC(=O)N2CC(NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)c(=O)n1C ZINC001581603025 1075772977 /nfs/dbraw/zinc/77/29/77/1075772977.db2.gz DIVZZKMYOPMHAM-UHFFFAOYSA-N -1 3 386.376 -1.961 20 0 GAADHM Cc1nn(CC(=O)N[C@@H]2CCN(c3ccc(-c4nn[n-]n4)cn3)C2)c(=O)n1C ZINC001581603032 1075772756 /nfs/dbraw/zinc/77/27/56/1075772756.db2.gz DQJBMTHVNOINRR-GFCCVEGCSA-N -1 3 384.404 -1.140 20 0 GAADHM Cc1nn(CC(=O)N[C@@H]2CCN(c3ccc(-c4nnn[n-]4)cn3)C2)c(=O)n1C ZINC001581603032 1075772751 /nfs/dbraw/zinc/77/27/51/1075772751.db2.gz DQJBMTHVNOINRR-GFCCVEGCSA-N -1 3 384.404 -1.140 20 0 GAADHM Cc1nn(CC(=O)N[C@H]2CCN(c3ccc(-c4nn[n-]n4)cn3)C2)c(=O)n1C ZINC001581603033 1075772914 /nfs/dbraw/zinc/77/29/14/1075772914.db2.gz DQJBMTHVNOINRR-LBPRGKRZSA-N -1 3 384.404 -1.140 20 0 GAADHM Cc1nn(CC(=O)N[C@H]2CCN(c3ccc(-c4nnn[n-]4)cn3)C2)c(=O)n1C ZINC001581603033 1075772907 /nfs/dbraw/zinc/77/29/07/1075772907.db2.gz DQJBMTHVNOINRR-LBPRGKRZSA-N -1 3 384.404 -1.140 20 0 GAADHM Cc1nn(CC(=O)NC[C@@H](C)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)c(=O)n1C ZINC001581603050 1075772927 /nfs/dbraw/zinc/77/29/27/1075772927.db2.gz FODUYCCIFPOUGL-MRVPVSSYSA-N -1 3 388.392 -1.667 20 0 GAADHM Cc1nn(CC(=O)NC[C@@H](C)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)c(=O)n1C ZINC001581603050 1075772923 /nfs/dbraw/zinc/77/29/23/1075772923.db2.gz FODUYCCIFPOUGL-MRVPVSSYSA-N -1 3 388.392 -1.667 20 0 GAADHM Cc1nn(CC(=O)NC[C@H](C)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)c(=O)n1C ZINC001581603051 1075772860 /nfs/dbraw/zinc/77/28/60/1075772860.db2.gz FODUYCCIFPOUGL-QMMMGPOBSA-N -1 3 388.392 -1.667 20 0 GAADHM Cc1nn(CC(=O)NC[C@H](C)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)c(=O)n1C ZINC001581603051 1075772857 /nfs/dbraw/zinc/77/28/57/1075772857.db2.gz FODUYCCIFPOUGL-QMMMGPOBSA-N -1 3 388.392 -1.667 20 0 GAADHM Cc1nn(CC(=O)N[C@H](C)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)c(=O)n1C ZINC001581603077 1075772818 /nfs/dbraw/zinc/77/28/18/1075772818.db2.gz HANLDAWMJSHIHO-MRVPVSSYSA-N -1 3 388.392 -1.667 20 0 GAADHM Cc1nn(CC(=O)N[C@H](C)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)c(=O)n1C ZINC001581603077 1075772813 /nfs/dbraw/zinc/77/28/13/1075772813.db2.gz HANLDAWMJSHIHO-MRVPVSSYSA-N -1 3 388.392 -1.667 20 0 GAADHM Cc1nn(CC(=O)N[C@@H](C)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)c(=O)n1C ZINC001581603078 1075772831 /nfs/dbraw/zinc/77/28/31/1075772831.db2.gz HANLDAWMJSHIHO-QMMMGPOBSA-N -1 3 388.392 -1.667 20 0 GAADHM Cc1nn(CC(=O)N[C@@H](C)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)c(=O)n1C ZINC001581603078 1075772827 /nfs/dbraw/zinc/77/28/27/1075772827.db2.gz HANLDAWMJSHIHO-QMMMGPOBSA-N -1 3 388.392 -1.667 20 0 GAADHM Cc1nn(CC(=O)N2CCN(c3ccc(-c4nn[n-]n4)cn3)CC2)c(=O)n1C ZINC001581603089 1075772844 /nfs/dbraw/zinc/77/28/44/1075772844.db2.gz HMYYMGHDLFSMSL-UHFFFAOYSA-N -1 3 384.404 -1.186 20 0 GAADHM Cc1nn(CC(=O)N2CCN(c3ccc(-c4nnn[n-]4)cn3)CC2)c(=O)n1C ZINC001581603089 1075772840 /nfs/dbraw/zinc/77/28/40/1075772840.db2.gz HMYYMGHDLFSMSL-UHFFFAOYSA-N -1 3 384.404 -1.186 20 0 GAADHM Cc1nn(CC(=O)N2CC(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)c(=O)n1C ZINC001581603097 1075772787 /nfs/dbraw/zinc/77/27/87/1075772787.db2.gz HWSRPHLWKDVETP-UHFFFAOYSA-N -1 3 386.376 -1.961 20 0 GAADHM Cc1nn(CC(=O)N2CC(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)c(=O)n1C ZINC001581603097 1075772781 /nfs/dbraw/zinc/77/27/81/1075772781.db2.gz HWSRPHLWKDVETP-UHFFFAOYSA-N -1 3 386.376 -1.961 20 0 GAADHM Cc1nn(CC(=O)NCCN(C)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)c(=O)n1C ZINC001581603119 1075773373 /nfs/dbraw/zinc/77/33/73/1075773373.db2.gz IYOLAQRLBZIGIA-UHFFFAOYSA-N -1 3 388.392 -1.713 20 0 GAADHM Cc1nn(CC(=O)NCCN(C)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)c(=O)n1C ZINC001581603119 1075773370 /nfs/dbraw/zinc/77/33/70/1075773370.db2.gz IYOLAQRLBZIGIA-UHFFFAOYSA-N -1 3 388.392 -1.713 20 0 GAADHM Cc1nn(CC(=O)NC[C@H](CO)Nc2ccc(-c3nn[n-]n3)nc2)c(=O)n1C ZINC001581603128 1075773355 /nfs/dbraw/zinc/77/33/55/1075773355.db2.gz JLORGUQEXZHFGR-LLVKDONJSA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1nn(CC(=O)NC[C@H](CO)Nc2ccc(-c3nnn[n-]3)nc2)c(=O)n1C ZINC001581603128 1075773352 /nfs/dbraw/zinc/77/33/52/1075773352.db2.gz JLORGUQEXZHFGR-LLVKDONJSA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1nn(CC(=O)NC[C@@H](CO)Nc2ccc(-c3nn[n-]n3)nc2)c(=O)n1C ZINC001581603129 1075773141 /nfs/dbraw/zinc/77/31/41/1075773141.db2.gz JLORGUQEXZHFGR-NSHDSACASA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1nn(CC(=O)NC[C@@H](CO)Nc2ccc(-c3nnn[n-]3)nc2)c(=O)n1C ZINC001581603129 1075773136 /nfs/dbraw/zinc/77/31/36/1075773136.db2.gz JLORGUQEXZHFGR-NSHDSACASA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1nn(CC(=O)N(C)CCNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)c(=O)n1C ZINC001581603159 1075773160 /nfs/dbraw/zinc/77/31/60/1075773160.db2.gz KRUUVGPKGIYGLU-UHFFFAOYSA-N -1 3 388.392 -1.713 20 0 GAADHM Cc1nn(CC(=O)N(C)CCNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)c(=O)n1C ZINC001581603159 1075773154 /nfs/dbraw/zinc/77/31/54/1075773154.db2.gz KRUUVGPKGIYGLU-UHFFFAOYSA-N -1 3 388.392 -1.713 20 0 GAADHM Cc1nn(CC(=O)NC[C@@H](CO)Nc2ncccc2-c2nn[n-]n2)c(=O)n1C ZINC001581603170 1075773190 /nfs/dbraw/zinc/77/31/90/1075773190.db2.gz LEUGEGYCTAQOGH-JTQLQIEISA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1nn(CC(=O)NC[C@@H](CO)Nc2ncccc2-c2nnn[n-]2)c(=O)n1C ZINC001581603170 1075773185 /nfs/dbraw/zinc/77/31/85/1075773185.db2.gz LEUGEGYCTAQOGH-JTQLQIEISA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1nn(CC(=O)NC[C@H](CO)Nc2ncccc2-c2nn[n-]n2)c(=O)n1C ZINC001581603171 1075773263 /nfs/dbraw/zinc/77/32/63/1075773263.db2.gz LEUGEGYCTAQOGH-SNVBAGLBSA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1nn(CC(=O)NC[C@H](CO)Nc2ncccc2-c2nnn[n-]2)c(=O)n1C ZINC001581603171 1075773259 /nfs/dbraw/zinc/77/32/59/1075773259.db2.gz LEUGEGYCTAQOGH-SNVBAGLBSA-N -1 3 388.392 -1.945 20 0 GAADHM Cc1nn(CC(=O)N[C@@H]2CCN(c3ccc(-c4nn[n-]n4)nc3)C2)c(=O)n1C ZINC001581603176 1075773122 /nfs/dbraw/zinc/77/31/22/1075773122.db2.gz LNQNFSCLNABWEL-LLVKDONJSA-N -1 3 384.404 -1.140 20 0 GAADHM Cc1nn(CC(=O)N[C@@H]2CCN(c3ccc(-c4nnn[n-]4)nc3)C2)c(=O)n1C ZINC001581603176 1075773114 /nfs/dbraw/zinc/77/31/14/1075773114.db2.gz LNQNFSCLNABWEL-LLVKDONJSA-N -1 3 384.404 -1.140 20 0 GAADHM Cc1nn(CC(=O)N[C@H]2CCN(c3ccc(-c4nn[n-]n4)nc3)C2)c(=O)n1C ZINC001581603177 1075773364 /nfs/dbraw/zinc/77/33/64/1075773364.db2.gz LNQNFSCLNABWEL-NSHDSACASA-N -1 3 384.404 -1.140 20 0 GAADHM Cc1nn(CC(=O)N[C@H]2CCN(c3ccc(-c4nnn[n-]4)nc3)C2)c(=O)n1C ZINC001581603177 1075773361 /nfs/dbraw/zinc/77/33/61/1075773361.db2.gz LNQNFSCLNABWEL-NSHDSACASA-N -1 3 384.404 -1.140 20 0 GAADHM Cc1nn(CC(=O)NC2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)c(=O)n1C ZINC001581603180 1075773309 /nfs/dbraw/zinc/77/33/09/1075773309.db2.gz LSEDLKRTHQKLJC-UHFFFAOYSA-N -1 3 386.376 -1.961 20 0 GAADHM Cc1nn(CC(=O)NC2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)c(=O)n1C ZINC001581603180 1075773304 /nfs/dbraw/zinc/77/33/04/1075773304.db2.gz LSEDLKRTHQKLJC-UHFFFAOYSA-N -1 3 386.376 -1.961 20 0 GAADHM 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/nfs/dbraw/zinc/77/77/77/1075777777.db2.gz PIIAQTAAKZOHPE-OPRDCNLKSA-N -1 3 392.445 -1.176 20 0 GAADHM Cc1nsc(N2C[C@@H](O)[C@H](NC(=O)C[C@@H]3CCNC3=O)C2)c1-c1nnn[n-]1 ZINC001581681562 1075778208 /nfs/dbraw/zinc/77/82/08/1075778208.db2.gz SGBNBNYNFNHURC-IVZWLZJFSA-N -1 3 392.445 -1.176 20 0 GAADHM Cc1nsc(N2C[C@@H](O)[C@H](NC(=O)C[C@H]3CCNC3=O)C2)c1-c1nnn[n-]1 ZINC001581681563 1075778002 /nfs/dbraw/zinc/77/80/02/1075778002.db2.gz SGBNBNYNFNHURC-OPRDCNLKSA-N -1 3 392.445 -1.176 20 0 GAADHM Cc1nsc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCNC3=O)C2)c1-c1nnn[n-]1 ZINC001581681598 1075778166 /nfs/dbraw/zinc/77/81/66/1075778166.db2.gz ULZSLZAFVXWTIJ-DJLDLDEBSA-N -1 3 378.418 -1.567 20 0 GAADHM Cc1nsc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCNC3=O)C2)c1-c1nnn[n-]1 ZINC001581681599 1075778016 /nfs/dbraw/zinc/77/80/16/1075778016.db2.gz ULZSLZAFVXWTIJ-IWSPIJDZSA-N -1 3 378.418 -1.567 20 0 GAADHM Cc1nsc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCNC(=O)C3)C2)c1-c1nnn[n-]1 ZINC001581681611 1075778137 /nfs/dbraw/zinc/77/81/37/1075778137.db2.gz VCUVGPFHALFOQU-IVZWLZJFSA-N -1 3 392.445 -1.176 20 0 GAADHM Cc1nsc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCNC(=O)C3)C2)c1-c1nnn[n-]1 ZINC001581681612 1075778097 /nfs/dbraw/zinc/77/80/97/1075778097.db2.gz VCUVGPFHALFOQU-OPRDCNLKSA-N -1 3 392.445 -1.176 20 0 GAADHM Cc1nsc(N2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@H]2CNC(=O)N2)c1-c1nnn[n-]1 ZINC001581681726 1075778242 /nfs/dbraw/zinc/77/82/42/1075778242.db2.gz ABWFKOBNXNFDNA-JIOCBJNQSA-N -1 3 375.418 -1.136 20 0 GAADHM Cc1nsc(N2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2CNC(=O)N2)c1-c1nnn[n-]1 ZINC001581681727 1075778157 /nfs/dbraw/zinc/77/81/57/1075778157.db2.gz ABWFKOBNXNFDNA-PYHGXSLLSA-N -1 3 375.418 -1.136 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@@H]3COC(=O)N3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581681731 1075778083 /nfs/dbraw/zinc/77/80/83/1075778083.db2.gz ADWCSDSNJXUNMU-CSMHCCOUSA-N -1 3 380.390 -1.594 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@H]3COC(=O)N3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581681732 1075778232 /nfs/dbraw/zinc/77/82/32/1075778232.db2.gz ADWCSDSNJXUNMU-PRJMDXOYSA-N -1 3 380.390 -1.594 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@H]3CCC(=O)N3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581681740 1075778149 /nfs/dbraw/zinc/77/81/49/1075778149.db2.gz AUQJGAHRRLMXOO-HLTSFMKQSA-N -1 3 378.418 -1.424 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@@H]3CCC(=O)N3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581681741 1075778221 /nfs/dbraw/zinc/77/82/21/1075778221.db2.gz AUQJGAHRRLMXOO-YIZRAAEISA-N -1 3 378.418 -1.424 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@H](C)CC(N)=O)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581681769 1075778198 /nfs/dbraw/zinc/77/81/98/1075778198.db2.gz BVYNXKARAFXIHY-VDAHYXPESA-N -1 3 380.434 -1.191 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@@H](C)CC(N)=O)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581681770 1075778033 /nfs/dbraw/zinc/77/80/33/1075778033.db2.gz BVYNXKARAFXIHY-ZQARSLAVSA-N -1 3 380.434 -1.191 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)CCCC(N)=O)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581681826 1075778186 /nfs/dbraw/zinc/77/81/86/1075778186.db2.gz FHJWHZGKSOYJLK-BDAKNGLRSA-N -1 3 380.434 -1.047 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@H]3CCC(=O)N3C)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581681899 1075778062 /nfs/dbraw/zinc/77/80/62/1075778062.db2.gz GBUVECAEJPRYAG-BBBLOLIVSA-N -1 3 392.445 -1.082 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@@H]3CCC(=O)N3C)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581681900 1075778174 /nfs/dbraw/zinc/77/81/74/1075778174.db2.gz GBUVECAEJPRYAG-UTLUCORTSA-N -1 3 392.445 -1.082 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@H]3CC(=O)N(C)C3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581681981 1075778047 /nfs/dbraw/zinc/77/80/47/1075778047.db2.gz HNDOHXWBFVVOBV-AEJSXWLSSA-N -1 3 392.445 -1.224 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@@H]3CC(=O)N(C)C3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581681982 1075778125 /nfs/dbraw/zinc/77/81/25/1075778125.db2.gz HNDOHXWBFVVOBV-BBBLOLIVSA-N -1 3 392.445 -1.224 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)c3cnn(C)c3N)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581682139 1075778114 /nfs/dbraw/zinc/77/81/14/1075778114.db2.gz JXFNTXIRJNRNIX-BDAKNGLRSA-N -1 3 390.433 -1.073 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@]3(C)CCC(=O)N3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581682174 1075778583 /nfs/dbraw/zinc/77/85/83/1075778583.db2.gz LMKWBYNLJQGEPW-OLBFVZFUSA-N -1 3 392.445 -1.034 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)CN3CCCC3=O)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581682179 1075778435 /nfs/dbraw/zinc/77/84/35/1075778435.db2.gz LONSUYPTZCRRKO-ZJUUUORDSA-N -1 3 392.445 -1.080 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@H]3CNC(=O)N3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581682184 1075778375 /nfs/dbraw/zinc/77/83/75/1075778375.db2.gz LTXSHWMJGKILES-PRJMDXOYSA-N -1 3 379.406 -2.021 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@@H]3CNC(=O)N3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581682185 1075778637 /nfs/dbraw/zinc/77/86/37/1075778637.db2.gz LTXSHWMJGKILES-RNJXMRFFSA-N -1 3 379.406 -2.021 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)C(=O)NCC3CC3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581682343 1075778607 /nfs/dbraw/zinc/77/86/07/1075778607.db2.gz NQLHDANHCIJSEK-ZJUUUORDSA-N -1 3 392.445 -1.176 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)CS(C)(=O)=O)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581682374 1075778621 /nfs/dbraw/zinc/77/86/21/1075778621.db2.gz PCCKZLAGJZGKAX-SFYZADRCSA-N -1 3 387.447 -1.658 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@H]3CCC(=O)NC3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581682381 1075778447 /nfs/dbraw/zinc/77/84/47/1075778447.db2.gz PIIAQTAAKZOHPE-AEJSXWLSSA-N -1 3 392.445 -1.176 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@@H]3CCC(=O)NC3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581682382 1075778557 /nfs/dbraw/zinc/77/85/57/1075778557.db2.gz PIIAQTAAKZOHPE-BBBLOLIVSA-N -1 3 392.445 -1.176 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)c3cnn(C)n3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581682545 1075778592 /nfs/dbraw/zinc/77/85/92/1075778592.db2.gz SLGGXXYLFNWTJE-BDAKNGLRSA-N -1 3 376.406 -1.260 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)c3c[nH]c(=O)cn3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581682588 1075778390 /nfs/dbraw/zinc/77/83/90/1075778390.db2.gz UZDKAFBMEQZANH-BDAKNGLRSA-N -1 3 389.401 -1.306 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@H]3CCNC(=O)C3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581682593 1075778418 /nfs/dbraw/zinc/77/84/18/1075778418.db2.gz VCUVGPFHALFOQU-AEJSXWLSSA-N -1 3 392.445 -1.176 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@@H]3CCNC(=O)C3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581682594 1075778403 /nfs/dbraw/zinc/77/84/03/1075778403.db2.gz VCUVGPFHALFOQU-BBBLOLIVSA-N -1 3 392.445 -1.176 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)c3cnnn3C)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581682727 1075778571 /nfs/dbraw/zinc/77/85/71/1075778571.db2.gz WQWXTPPSYKTIPV-APPZFPTMSA-N -1 3 376.406 -1.260 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)Cn3cncn3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001581682751 1075778528 /nfs/dbraw/zinc/77/85/28/1075778528.db2.gz XSBSHNBXGRTFAJ-BDAKNGLRSA-N -1 3 376.406 -1.411 20 0 GAADHM Cc1nsc(N2C[C@@H](O)[C@H](NC(=O)c3cnn(C)n3)C2)c1-c1nnn[n-]1 ZINC001581684409 1075778513 /nfs/dbraw/zinc/77/85/13/1075778513.db2.gz SLGGXXYLFNWTJE-RKDXNWHRSA-N -1 3 376.406 -1.260 20 0 GAADHM Cc1nsc(N2C[C@@H](O)[C@H](NC(=O)c3ncn(C)n3)C2)c1-c1nnn[n-]1 ZINC001581684411 1075778503 /nfs/dbraw/zinc/77/85/03/1075778503.db2.gz SNSGMPWNJOBSDY-HTQZYQBOSA-N -1 3 376.406 -1.260 20 0 GAADHM Cc1nsc(N2C[C@@H](O)[C@H](NC(=O)c3cnnn3C)C2)c1-c1nnn[n-]1 ZINC001581684507 1075778543 /nfs/dbraw/zinc/77/85/43/1075778543.db2.gz WQWXTPPSYKTIPV-VXNVDRBHSA-N -1 3 376.406 -1.260 20 0 GAADHM Cc1nsc(N[C@H](C)CNC(=O)CN2CCNC(=O)C2)c1-c1nnn[n-]1 ZINC001581690922 1075778487 /nfs/dbraw/zinc/77/84/87/1075778487.db2.gz ACSGBRMDVJGTOR-MRVPVSSYSA-N -1 3 379.450 -1.020 20 0 GAADHM Cc1nsc(N[C@@H](C)CNC(=O)CN2CCNC(=O)C2)c1-c1nnn[n-]1 ZINC001581690923 1075778916 /nfs/dbraw/zinc/77/89/16/1075778916.db2.gz ACSGBRMDVJGTOR-QMMMGPOBSA-N -1 3 379.450 -1.020 20 0 GAADHM Cc1nsc(N[C@@H](CO)CNC(=O)[C@H]2CN(C)CCO2)c1-c1nn[n-]n1 ZINC001581696177 1075778993 /nfs/dbraw/zinc/77/89/93/1075778993.db2.gz GYQPQAKVJWOJFP-NXEZZACHSA-N -1 3 382.450 -1.149 20 0 GAADHM Cc1nsc(N[C@@H](CO)CNC(=O)[C@H]2CN(C)CCO2)c1-c1nnn[n-]1 ZINC001581696177 1075778989 /nfs/dbraw/zinc/77/89/89/1075778989.db2.gz GYQPQAKVJWOJFP-NXEZZACHSA-N -1 3 382.450 -1.149 20 0 GAADHM Cc1nsc(N[C@H](CO)CNC(=O)[C@@H]2CN(C)CCO2)c1-c1nn[n-]n1 ZINC001581696178 1075778975 /nfs/dbraw/zinc/77/89/75/1075778975.db2.gz GYQPQAKVJWOJFP-UWVGGRQHSA-N -1 3 382.450 -1.149 20 0 GAADHM Cc1nsc(N[C@H](CO)CNC(=O)[C@@H]2CN(C)CCO2)c1-c1nnn[n-]1 ZINC001581696178 1075778969 /nfs/dbraw/zinc/77/89/69/1075778969.db2.gz GYQPQAKVJWOJFP-UWVGGRQHSA-N -1 3 382.450 -1.149 20 0 GAADHM Cc1nsc(N[C@H](CO)CNC(=O)[C@H]2CN(C)CCO2)c1-c1nn[n-]n1 ZINC001581696179 1075779012 /nfs/dbraw/zinc/77/90/12/1075779012.db2.gz GYQPQAKVJWOJFP-VHSXEESVSA-N -1 3 382.450 -1.149 20 0 GAADHM Cc1nsc(N[C@H](CO)CNC(=O)[C@H]2CN(C)CCO2)c1-c1nnn[n-]1 ZINC001581696179 1075779008 /nfs/dbraw/zinc/77/90/08/1075779008.db2.gz GYQPQAKVJWOJFP-VHSXEESVSA-N -1 3 382.450 -1.149 20 0 GAADHM Cc1nsc(N[C@@H](CO)CNC(=O)[C@@H]2CN(C)CCO2)c1-c1nn[n-]n1 ZINC001581696180 1075778825 /nfs/dbraw/zinc/77/88/25/1075778825.db2.gz GYQPQAKVJWOJFP-ZJUUUORDSA-N -1 3 382.450 -1.149 20 0 GAADHM Cc1nsc(N[C@@H](CO)CNC(=O)[C@@H]2CN(C)CCO2)c1-c1nnn[n-]1 ZINC001581696180 1075778819 /nfs/dbraw/zinc/77/88/19/1075778819.db2.gz GYQPQAKVJWOJFP-ZJUUUORDSA-N -1 3 382.450 -1.149 20 0 GAADHM Cc1nsc(N[C@@H](CO)CNC(=O)[C@@H](C)S(C)(=O)=O)c1-c1nnn[n-]1 ZINC001581696258 1075778906 /nfs/dbraw/zinc/77/89/06/1075778906.db2.gz IPDYSGGIMHAZOT-HTQZYQBOSA-N -1 3 389.463 -1.046 20 0 GAADHM Cc1nsc(N[C@@H](CO)CNC(=O)[C@H](C)S(C)(=O)=O)c1-c1nnn[n-]1 ZINC001581696259 1075778928 /nfs/dbraw/zinc/77/89/28/1075778928.db2.gz IPDYSGGIMHAZOT-JGVFFNPUSA-N -1 3 389.463 -1.046 20 0 GAADHM Cc1nsc(N[C@H](CO)CNC(=O)[C@@H](C)S(C)(=O)=O)c1-c1nnn[n-]1 ZINC001581696260 1075779035 /nfs/dbraw/zinc/77/90/35/1075779035.db2.gz IPDYSGGIMHAZOT-SFYZADRCSA-N -1 3 389.463 -1.046 20 0 GAADHM Cc1nsc(N[C@H](CO)CNC(=O)[C@H](C)S(C)(=O)=O)c1-c1nnn[n-]1 ZINC001581696261 1075778895 /nfs/dbraw/zinc/77/88/95/1075778895.db2.gz IPDYSGGIMHAZOT-YUMQZZPRSA-N -1 3 389.463 -1.046 20 0 GAADHM Cc1nsc(N[C@@H](CO)CNC(=O)CCS(C)(=O)=O)c1-c1nnn[n-]1 ZINC001581696310 1075779043 /nfs/dbraw/zinc/77/90/43/1075779043.db2.gz JPQJMWCRCLLVHT-MRVPVSSYSA-N -1 3 389.463 -1.045 20 0 GAADHM Cc1nsc(N[C@H](CO)CNC(=O)CCS(C)(=O)=O)c1-c1nnn[n-]1 ZINC001581696311 1075778874 /nfs/dbraw/zinc/77/88/74/1075778874.db2.gz JPQJMWCRCLLVHT-QMMMGPOBSA-N -1 3 389.463 -1.045 20 0 GAADHM Cc1nsc(N[C@@H](CO)CNC(=O)C2CS(=O)(=O)C2)c1-c1nnn[n-]1 ZINC001581696444 1075778859 /nfs/dbraw/zinc/77/88/59/1075778859.db2.gz MTMCZFJKWWQHBA-MRVPVSSYSA-N -1 3 387.447 -1.435 20 0 GAADHM Cc1nsc(N[C@H](CO)CNC(=O)C2CS(=O)(=O)C2)c1-c1nnn[n-]1 ZINC001581696445 1075779051 /nfs/dbraw/zinc/77/90/51/1075779051.db2.gz MTMCZFJKWWQHBA-QMMMGPOBSA-N -1 3 387.447 -1.435 20 0 GAADHM Cc1nsc(N[C@@H](CO)CNC(=O)[C@H]2CN(C)C(=O)N2)c1-c1nnn[n-]1 ZINC001581696660 1075779025 /nfs/dbraw/zinc/77/90/25/1075779025.db2.gz QSPBJTULUQBKFM-HTQZYQBOSA-N -1 3 381.422 -1.456 20 0 GAADHM Cc1nsc(N[C@H](CO)CNC(=O)[C@H]2CN(C)C(=O)N2)c1-c1nnn[n-]1 ZINC001581696661 1075778955 /nfs/dbraw/zinc/77/89/55/1075778955.db2.gz QSPBJTULUQBKFM-JGVFFNPUSA-N -1 3 381.422 -1.456 20 0 GAADHM Cc1nsc(N[C@@H](CO)CNC(=O)[C@@H]2CN(C)C(=O)N2)c1-c1nnn[n-]1 ZINC001581696662 1075778777 /nfs/dbraw/zinc/77/87/77/1075778777.db2.gz QSPBJTULUQBKFM-SFYZADRCSA-N -1 3 381.422 -1.456 20 0 GAADHM Cc1nsc(N[C@H](CO)CNC(=O)[C@@H]2CN(C)C(=O)N2)c1-c1nnn[n-]1 ZINC001581696663 1075778794 /nfs/dbraw/zinc/77/87/94/1075778794.db2.gz QSPBJTULUQBKFM-YUMQZZPRSA-N -1 3 381.422 -1.456 20 0 GAADHM Cc1nsc(N[C@@H](CO)CNC(=O)c2cc(=O)n(C)cn2)c1-c1nnn[n-]1 ZINC001581696703 1075778887 /nfs/dbraw/zinc/77/88/87/1075778887.db2.gz ROMIKULVMHGHNJ-MRVPVSSYSA-N -1 3 391.417 -1.072 20 0 GAADHM Cc1nsc(N[C@H](CO)CNC(=O)c2cc(=O)n(C)cn2)c1-c1nnn[n-]1 ZINC001581696704 1075778942 /nfs/dbraw/zinc/77/89/42/1075778942.db2.gz ROMIKULVMHGHNJ-QMMMGPOBSA-N -1 3 391.417 -1.072 20 0 GAADHM Cc1nsc(N[C@H](CO)CNC(=O)[C@@H]2CC(=O)N(C)C2)c1-c1nnn[n-]1 ZINC001581696809 1075778843 /nfs/dbraw/zinc/77/88/43/1075778843.db2.gz UUSNVXHTZUOIEZ-BDAKNGLRSA-N -1 3 380.434 -1.001 20 0 GAADHM Cc1nsc(N[C@@H](CO)CNC(=O)[C@H]2CC(=O)N(C)C2)c1-c1nnn[n-]1 ZINC001581696810 1075779408 /nfs/dbraw/zinc/77/94/08/1075779408.db2.gz UUSNVXHTZUOIEZ-DTWKUNHWSA-N -1 3 380.434 -1.001 20 0 GAADHM Cc1nsc(N[C@H](CO)CNC(=O)[C@H]2CC(=O)N(C)C2)c1-c1nnn[n-]1 ZINC001581696811 1075779356 /nfs/dbraw/zinc/77/93/56/1075779356.db2.gz UUSNVXHTZUOIEZ-IUCAKERBSA-N -1 3 380.434 -1.001 20 0 GAADHM Cc1nsc(N[C@@H](CO)CNC(=O)[C@@H]2CC(=O)N(C)C2)c1-c1nnn[n-]1 ZINC001581696812 1075779390 /nfs/dbraw/zinc/77/93/90/1075779390.db2.gz UUSNVXHTZUOIEZ-RKDXNWHRSA-N -1 3 380.434 -1.001 20 0 GAADHM Cc1nsc(N[C@@H](CO)CNC(=O)CS(C)(=O)=O)c1-c1nn[n-]n1 ZINC001581696917 1075779182 /nfs/dbraw/zinc/77/91/82/1075779182.db2.gz XBXPRRFCEUGQPI-SSDOTTSWSA-N -1 3 375.436 -1.435 20 0 GAADHM Cc1nsc(N[C@@H](CO)CNC(=O)CS(C)(=O)=O)c1-c1nnn[n-]1 ZINC001581696917 1075779177 /nfs/dbraw/zinc/77/91/77/1075779177.db2.gz XBXPRRFCEUGQPI-SSDOTTSWSA-N -1 3 375.436 -1.435 20 0 GAADHM Cc1nsc(N[C@H](CO)CNC(=O)CS(C)(=O)=O)c1-c1nn[n-]n1 ZINC001581696918 1075779343 /nfs/dbraw/zinc/77/93/43/1075779343.db2.gz XBXPRRFCEUGQPI-ZETCQYMHSA-N -1 3 375.436 -1.435 20 0 GAADHM Cc1nsc(N[C@H](CO)CNC(=O)CS(C)(=O)=O)c1-c1nnn[n-]1 ZINC001581696918 1075779338 /nfs/dbraw/zinc/77/93/38/1075779338.db2.gz XBXPRRFCEUGQPI-ZETCQYMHSA-N -1 3 375.436 -1.435 20 0 GAADHM Cc1nsc(NC[C@H](O)CNC(=O)[C@@H](C)S(C)(=O)=O)c1-c1nnn[n-]1 ZINC001581707077 1075779242 /nfs/dbraw/zinc/77/92/42/1075779242.db2.gz QNZLOKJBNQAPQG-HTQZYQBOSA-N -1 3 389.463 -1.046 20 0 GAADHM Cc1nsc(NC[C@H](O)CNC(=O)[C@H](C)S(C)(=O)=O)c1-c1nnn[n-]1 ZINC001581707078 1075779220 /nfs/dbraw/zinc/77/92/20/1075779220.db2.gz QNZLOKJBNQAPQG-JGVFFNPUSA-N -1 3 389.463 -1.046 20 0 GAADHM Cc1nsc(NC[C@@H](O)CNC(=O)[C@@H](C)S(C)(=O)=O)c1-c1nnn[n-]1 ZINC001581707079 1075779207 /nfs/dbraw/zinc/77/92/07/1075779207.db2.gz QNZLOKJBNQAPQG-SFYZADRCSA-N -1 3 389.463 -1.046 20 0 GAADHM Cc1nsc(NC[C@@H](O)CNC(=O)[C@H](C)S(C)(=O)=O)c1-c1nnn[n-]1 ZINC001581707080 1075779279 /nfs/dbraw/zinc/77/92/79/1075779279.db2.gz QNZLOKJBNQAPQG-YUMQZZPRSA-N -1 3 389.463 -1.046 20 0 GAADHM Cc1nsc(NC[C@@H](O)CN(C)C(=O)CS(C)(=O)=O)c1-c1nn[n-]n1 ZINC001581707143 1075779262 /nfs/dbraw/zinc/77/92/62/1075779262.db2.gz RSBWMGVAPBDYHH-MRVPVSSYSA-N -1 3 389.463 -1.093 20 0 GAADHM Cc1nsc(NC[C@@H](O)CN(C)C(=O)CS(C)(=O)=O)c1-c1nnn[n-]1 ZINC001581707143 1075779259 /nfs/dbraw/zinc/77/92/59/1075779259.db2.gz RSBWMGVAPBDYHH-MRVPVSSYSA-N -1 3 389.463 -1.093 20 0 GAADHM Cc1nsc(NC[C@H](O)CN(C)C(=O)CS(C)(=O)=O)c1-c1nn[n-]n1 ZINC001581707144 1075779194 /nfs/dbraw/zinc/77/91/94/1075779194.db2.gz RSBWMGVAPBDYHH-QMMMGPOBSA-N -1 3 389.463 -1.093 20 0 GAADHM Cc1nsc(NC[C@H](O)CN(C)C(=O)CS(C)(=O)=O)c1-c1nnn[n-]1 ZINC001581707144 1075779192 /nfs/dbraw/zinc/77/91/92/1075779192.db2.gz RSBWMGVAPBDYHH-QMMMGPOBSA-N -1 3 389.463 -1.093 20 0 GAADHM Cc1nsc(NC[C@@H](O)CN(C)C(=O)[C@H]2C[C@H]2C(N)=O)c1-c1nnn[n-]1 ZINC001581707577 1075779252 /nfs/dbraw/zinc/77/92/52/1075779252.db2.gz VULHFXYUFXINJS-HLTSFMKQSA-N -1 3 380.434 -1.016 20 0 GAADHM Cc1nsc(NC[C@H](O)CN(C)C(=O)[C@H]2C[C@H]2C(N)=O)c1-c1nnn[n-]1 ZINC001581707580 1075779328 /nfs/dbraw/zinc/77/93/28/1075779328.db2.gz VULHFXYUFXINJS-YIZRAAEISA-N -1 3 380.434 -1.016 20 0 GAADHM Cc1nsc(NC[C@@H](O)CN(C)C(=O)[C@H]2COC(=O)N2)c1-c1nnn[n-]1 ZINC001581707657 1075779373 /nfs/dbraw/zinc/77/93/73/1075779373.db2.gz WHNPHDCZNJUILR-HTQZYQBOSA-N -1 3 382.406 -1.029 20 0 GAADHM Cc1nsc(NC[C@H](O)CN(C)C(=O)[C@H]2COC(=O)N2)c1-c1nnn[n-]1 ZINC001581707658 1075779234 /nfs/dbraw/zinc/77/92/34/1075779234.db2.gz WHNPHDCZNJUILR-JGVFFNPUSA-N -1 3 382.406 -1.029 20 0 GAADHM Cc1nsc(NC[C@@H](O)CN(C)C(=O)[C@@H]2COC(=O)N2)c1-c1nnn[n-]1 ZINC001581707659 1075779289 /nfs/dbraw/zinc/77/92/89/1075779289.db2.gz WHNPHDCZNJUILR-SFYZADRCSA-N -1 3 382.406 -1.029 20 0 GAADHM Cc1nsc(NC[C@H](O)CN(C)C(=O)[C@@H]2COC(=O)N2)c1-c1nnn[n-]1 ZINC001581707660 1075779314 /nfs/dbraw/zinc/77/93/14/1075779314.db2.gz WHNPHDCZNJUILR-YUMQZZPRSA-N -1 3 382.406 -1.029 20 0 GAADHM Cc1nsc(NC[C@@H](O)CN(C)C(=O)[C@H]2CNC(=O)N2)c1-c1nnn[n-]1 ZINC001581707819 1075779427 /nfs/dbraw/zinc/77/94/27/1075779427.db2.gz YWKLHVVMHMNQHU-HTQZYQBOSA-N -1 3 381.422 -1.456 20 0 GAADHM Cc1nsc(NC[C@H](O)CN(C)C(=O)[C@H]2CNC(=O)N2)c1-c1nnn[n-]1 ZINC001581707820 1075779271 /nfs/dbraw/zinc/77/92/71/1075779271.db2.gz YWKLHVVMHMNQHU-JGVFFNPUSA-N -1 3 381.422 -1.456 20 0 GAADHM Cc1nsc(NC[C@@H](O)CN(C)C(=O)[C@@H]2CNC(=O)N2)c1-c1nnn[n-]1 ZINC001581707821 1075779301 /nfs/dbraw/zinc/77/93/01/1075779301.db2.gz YWKLHVVMHMNQHU-SFYZADRCSA-N -1 3 381.422 -1.456 20 0 GAADHM Cc1nsc(NC[C@H](O)CN(C)C(=O)[C@@H]2CNC(=O)N2)c1-c1nnn[n-]1 ZINC001581707822 1075779763 /nfs/dbraw/zinc/77/97/63/1075779763.db2.gz YWKLHVVMHMNQHU-YUMQZZPRSA-N -1 3 381.422 -1.456 20 0 GAADHM Cc1nsc(NC[C@H](O)CNC(=O)CS(C)(=O)=O)c1-c1nn[n-]n1 ZINC001581710015 1075779578 /nfs/dbraw/zinc/77/95/78/1075779578.db2.gz LNIUTJXLBGPBAV-SSDOTTSWSA-N -1 3 375.436 -1.435 20 0 GAADHM Cc1nsc(NC[C@H](O)CNC(=O)CS(C)(=O)=O)c1-c1nnn[n-]1 ZINC001581710015 1075779575 /nfs/dbraw/zinc/77/95/75/1075779575.db2.gz LNIUTJXLBGPBAV-SSDOTTSWSA-N -1 3 375.436 -1.435 20 0 GAADHM Cc1nsc(NC[C@@H](O)CNC(=O)CS(C)(=O)=O)c1-c1nn[n-]n1 ZINC001581710016 1075779622 /nfs/dbraw/zinc/77/96/22/1075779622.db2.gz LNIUTJXLBGPBAV-ZETCQYMHSA-N -1 3 375.436 -1.435 20 0 GAADHM Cc1nsc(NC[C@@H](O)CNC(=O)CS(C)(=O)=O)c1-c1nnn[n-]1 ZINC001581710016 1075779618 /nfs/dbraw/zinc/77/96/18/1075779618.db2.gz LNIUTJXLBGPBAV-ZETCQYMHSA-N -1 3 375.436 -1.435 20 0 GAADHM Cc1nsc(NC[C@H](O)CNC(=O)c2ccc(=O)n(C)n2)c1-c1nnn[n-]1 ZINC001581710228 1075779802 /nfs/dbraw/zinc/77/98/02/1075779802.db2.gz QQVAVTOYVXOERZ-MRVPVSSYSA-N -1 3 391.417 -1.072 20 0 GAADHM Cc1nsc(NC[C@@H](O)CNC(=O)c2ccc(=O)n(C)n2)c1-c1nnn[n-]1 ZINC001581710229 1075779569 /nfs/dbraw/zinc/77/95/69/1075779569.db2.gz QQVAVTOYVXOERZ-QMMMGPOBSA-N -1 3 391.417 -1.072 20 0 GAADHM Cc1nsc(NC[C@@H](O)CNC(=O)[C@@H]2CC(=O)N(C)C2)c1-c1nnn[n-]1 ZINC001581710244 1075779772 /nfs/dbraw/zinc/77/97/72/1075779772.db2.gz RHOYAMLHFVVXCU-BDAKNGLRSA-N -1 3 380.434 -1.001 20 0 GAADHM Cc1nsc(NC[C@H](O)CNC(=O)[C@H]2CC(=O)N(C)C2)c1-c1nnn[n-]1 ZINC001581710245 1075779783 /nfs/dbraw/zinc/77/97/83/1075779783.db2.gz RHOYAMLHFVVXCU-DTWKUNHWSA-N -1 3 380.434 -1.001 20 0 GAADHM Cc1nsc(NC[C@@H](O)CNC(=O)[C@H]2CC(=O)N(C)C2)c1-c1nnn[n-]1 ZINC001581710246 1075779633 /nfs/dbraw/zinc/77/96/33/1075779633.db2.gz RHOYAMLHFVVXCU-IUCAKERBSA-N -1 3 380.434 -1.001 20 0 GAADHM Cc1nsc(NC[C@H](O)CNC(=O)[C@@H]2CC(=O)N(C)C2)c1-c1nnn[n-]1 ZINC001581710247 1075779706 /nfs/dbraw/zinc/77/97/06/1075779706.db2.gz RHOYAMLHFVVXCU-RKDXNWHRSA-N -1 3 380.434 -1.001 20 0 GAADHM Cc1nsc(NC[C@H](O)CNC(=O)[C@H]2CN(C)CCO2)c1-c1nn[n-]n1 ZINC001581710488 1075779594 /nfs/dbraw/zinc/77/95/94/1075779594.db2.gz XTOVSLAJMPPAHF-NXEZZACHSA-N -1 3 382.450 -1.149 20 0 GAADHM Cc1nsc(NC[C@H](O)CNC(=O)[C@H]2CN(C)CCO2)c1-c1nnn[n-]1 ZINC001581710488 1075779592 /nfs/dbraw/zinc/77/95/92/1075779592.db2.gz XTOVSLAJMPPAHF-NXEZZACHSA-N -1 3 382.450 -1.149 20 0 GAADHM Cc1nsc(NC[C@@H](O)CNC(=O)[C@@H]2CN(C)CCO2)c1-c1nn[n-]n1 ZINC001581710489 1075779612 /nfs/dbraw/zinc/77/96/12/1075779612.db2.gz XTOVSLAJMPPAHF-UWVGGRQHSA-N -1 3 382.450 -1.149 20 0 GAADHM Cc1nsc(NC[C@@H](O)CNC(=O)[C@@H]2CN(C)CCO2)c1-c1nnn[n-]1 ZINC001581710489 1075779609 /nfs/dbraw/zinc/77/96/09/1075779609.db2.gz XTOVSLAJMPPAHF-UWVGGRQHSA-N -1 3 382.450 -1.149 20 0 GAADHM Cc1nsc(NC[C@@H](O)CNC(=O)[C@H]2CN(C)CCO2)c1-c1nn[n-]n1 ZINC001581710490 1075779669 /nfs/dbraw/zinc/77/96/69/1075779669.db2.gz XTOVSLAJMPPAHF-VHSXEESVSA-N -1 3 382.450 -1.149 20 0 GAADHM Cc1nsc(NC[C@@H](O)CNC(=O)[C@H]2CN(C)CCO2)c1-c1nnn[n-]1 ZINC001581710490 1075779666 /nfs/dbraw/zinc/77/96/66/1075779666.db2.gz XTOVSLAJMPPAHF-VHSXEESVSA-N -1 3 382.450 -1.149 20 0 GAADHM Cc1nsc(NC[C@H](O)CNC(=O)[C@@H]2CN(C)CCO2)c1-c1nn[n-]n1 ZINC001581710491 1075779651 /nfs/dbraw/zinc/77/96/51/1075779651.db2.gz XTOVSLAJMPPAHF-ZJUUUORDSA-N -1 3 382.450 -1.149 20 0 GAADHM Cc1nsc(NC[C@H](O)CNC(=O)[C@@H]2CN(C)CCO2)c1-c1nnn[n-]1 ZINC001581710491 1075779644 /nfs/dbraw/zinc/77/96/44/1075779644.db2.gz XTOVSLAJMPPAHF-ZJUUUORDSA-N -1 3 382.450 -1.149 20 0 GAADHM Cc1nsc(NC[C@H](O)CNC(=O)[C@H]2CN(C)C(=O)N2)c1-c1nnn[n-]1 ZINC001581710581 1075779738 /nfs/dbraw/zinc/77/97/38/1075779738.db2.gz YSBGOWCDEDQEKY-HTQZYQBOSA-N -1 3 381.422 -1.456 20 0 GAADHM Cc1nsc(NC[C@@H](O)CNC(=O)[C@H]2CN(C)C(=O)N2)c1-c1nnn[n-]1 ZINC001581710582 1075779557 /nfs/dbraw/zinc/77/95/57/1075779557.db2.gz YSBGOWCDEDQEKY-JGVFFNPUSA-N -1 3 381.422 -1.456 20 0 GAADHM Cc1nsc(NC[C@H](O)CNC(=O)[C@@H]2CN(C)C(=O)N2)c1-c1nnn[n-]1 ZINC001581710583 1075779751 /nfs/dbraw/zinc/77/97/51/1075779751.db2.gz YSBGOWCDEDQEKY-SFYZADRCSA-N -1 3 381.422 -1.456 20 0 GAADHM Cc1nsc(NC[C@@H](O)CNC(=O)[C@@H]2CN(C)C(=O)N2)c1-c1nnn[n-]1 ZINC001581710584 1075779695 /nfs/dbraw/zinc/77/96/95/1075779695.db2.gz YSBGOWCDEDQEKY-YUMQZZPRSA-N -1 3 381.422 -1.456 20 0 GAADHM Cc1nsc(NCCN(C)C(=O)CN2CCNC(=O)C2)c1-c1nnn[n-]1 ZINC001581715913 1075779682 /nfs/dbraw/zinc/77/96/82/1075779682.db2.gz BDGHGZHDULOKEJ-UHFFFAOYSA-N -1 3 379.450 -1.066 20 0 GAADHM Cc1nsc(NC[C@@H](C)NC(=O)CN2CCNC(=O)C2)c1-c1nnn[n-]1 ZINC001581718706 1075779791 /nfs/dbraw/zinc/77/97/91/1075779791.db2.gz ZHXQUAMUAQHREB-MRVPVSSYSA-N -1 3 379.450 -1.020 20 0 GAADHM Cc1nsc(NC[C@H](C)NC(=O)CN2CCNC(=O)C2)c1-c1nnn[n-]1 ZINC001581719199 1075779721 /nfs/dbraw/zinc/77/97/21/1075779721.db2.gz ZHXQUAMUAQHREB-QMMMGPOBSA-N -1 3 379.450 -1.020 20 0 GAADHM Cc1nsc(NCCNC(=O)CN2CCN(C)C(=O)C2)c1-c1nnn[n-]1 ZINC001581719270 1075780145 /nfs/dbraw/zinc/78/01/45/1075780145.db2.gz CJWRIXFAYXTSLP-UHFFFAOYSA-N -1 3 379.450 -1.066 20 0 GAADHM Cc1nsc(NCCN(CCO)C(=O)[C@H]2C[C@H]2C(N)=O)c1-c1nnn[n-]1 ZINC001581719287 1075780125 /nfs/dbraw/zinc/78/01/25/1075780125.db2.gz DBLVFMWLSFADFO-BDAKNGLRSA-N -1 3 380.434 -1.014 20 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YTTBPPUHARLBOH-BJOHPYRUSA-N -1 3 378.393 -1.696 20 0 GAADHM Cn1c(=O)[nH]c(N2CCN(C(=O)CN3CCCC3)CC2)c(-c2nnn[n-]2)c1=O ZINC001581748331 1075781156 /nfs/dbraw/zinc/78/11/56/1075781156.db2.gz XUVZFCDXZINQMU-UHFFFAOYSA-N -1 3 389.420 -2.002 20 0 GAADHM Cn1c(=O)[nH]c(N2CCN(C(=O)CN3CCCC3)CC2)c(-c2nn[n-]n2)c1=O ZINC001581748331 1075781153 /nfs/dbraw/zinc/78/11/53/1075781153.db2.gz XUVZFCDXZINQMU-UHFFFAOYSA-N -1 3 389.420 -2.002 20 0 GAADHM Cn1c(=O)ccn(CC(=O)Nc2ncc3c(c2-c2nnn[n-]2)COCC3)c1=O ZINC001581748737 1075781612 /nfs/dbraw/zinc/78/16/12/1075781612.db2.gz RUYPZIBUYPTORX-UHFFFAOYSA-N -1 3 384.356 -1.167 20 0 GAADHM Cn1c(C(=O)N2CCN(S(=O)(=O)c3nc[nH]n3)CC2)ccc1-c1nn[n-]n1 ZINC001581749637 1075781556 /nfs/dbraw/zinc/78/15/56/1075781556.db2.gz GCBNUNKNVAPXAB-UHFFFAOYSA-N -1 3 392.405 -1.530 20 0 GAADHM Cn1c(C(=O)N2CCN(S(=O)(=O)c3nc[nH]n3)CC2)ccc1-c1nnn[n-]1 ZINC001581749637 1075781551 /nfs/dbraw/zinc/78/15/51/1075781551.db2.gz GCBNUNKNVAPXAB-UHFFFAOYSA-N -1 3 392.405 -1.530 20 0 GAADHM Cn1c(=O)cccc1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581749804 1075781603 /nfs/dbraw/zinc/78/16/03/1075781603.db2.gz NZAHFJYJFSNVIM-DGCLKSJQSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1c(=O)cccc1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581749804 1075781598 /nfs/dbraw/zinc/78/15/98/1075781598.db2.gz NZAHFJYJFSNVIM-DGCLKSJQSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1c(C(=O)N2CCN(C(=O)CN3CCOCC3)CC2)ccc1-c1nn[n-]n1 ZINC001581749927 1075781527 /nfs/dbraw/zinc/78/15/27/1075781527.db2.gz SOYRYDXJPLLTLH-UHFFFAOYSA-N -1 3 388.432 -1.178 20 0 GAADHM Cn1c(C(=O)N2CCN(C(=O)CN3CCOCC3)CC2)ccc1-c1nnn[n-]1 ZINC001581749927 1075781523 /nfs/dbraw/zinc/78/15/23/1075781523.db2.gz SOYRYDXJPLLTLH-UHFFFAOYSA-N -1 3 388.432 -1.178 20 0 GAADHM Cn1c(C(=O)NCCC(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1-c1nn[n-]n1 ZINC001581750876 1075781868 /nfs/dbraw/zinc/78/18/68/1075781868.db2.gz AHWNXTSPJHJFSB-SECBINFHSA-N -1 3 381.418 -1.372 20 0 GAADHM Cn1c(C(=O)NCCC(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1-c1nnn[n-]1 ZINC001581750876 1075781865 /nfs/dbraw/zinc/78/18/65/1075781865.db2.gz AHWNXTSPJHJFSB-SECBINFHSA-N -1 3 381.418 -1.372 20 0 GAADHM Cn1c(C(=O)NCCC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1-c1nn[n-]n1 ZINC001581750877 1075781967 /nfs/dbraw/zinc/78/19/67/1075781967.db2.gz AHWNXTSPJHJFSB-VIFPVBQESA-N -1 3 381.418 -1.372 20 0 GAADHM Cn1c(C(=O)NCCC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1-c1nnn[n-]1 ZINC001581750877 1075781964 /nfs/dbraw/zinc/78/19/64/1075781964.db2.gz AHWNXTSPJHJFSB-VIFPVBQESA-N -1 3 381.418 -1.372 20 0 GAADHM Cn1c(C(=O)NCCS(=O)(=O)N=S(C)(C)=O)ccc1-c1nn[n-]n1 ZINC001581750894 1075781814 /nfs/dbraw/zinc/78/18/14/1075781814.db2.gz AVWXAYJVGSLNAU-UHFFFAOYSA-N -1 3 375.436 -1.008 20 0 GAADHM Cn1c(C(=O)NCCS(=O)(=O)N=S(C)(C)=O)ccc1-c1nnn[n-]1 ZINC001581750894 1075781811 /nfs/dbraw/zinc/78/18/11/1075781811.db2.gz AVWXAYJVGSLNAU-UHFFFAOYSA-N -1 3 375.436 -1.008 20 0 GAADHM Cn1c(=O)[nH]cc1C(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001581751997 1075782228 /nfs/dbraw/zinc/78/22/28/1075782228.db2.gz DEIVSZOJUHIBNQ-MWLCHTKSSA-N -1 3 389.351 -1.181 20 0 GAADHM Cn1c(=O)[nH]cc1C(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001581751997 1075782225 /nfs/dbraw/zinc/78/22/25/1075782225.db2.gz DEIVSZOJUHIBNQ-MWLCHTKSSA-N -1 3 389.351 -1.181 20 0 GAADHM Cn1c(=O)cccc1C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001581752179 1075782217 /nfs/dbraw/zinc/78/22/17/1075782217.db2.gz QJPVDXLXMDWSGW-OCCSQVGLSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1c(=O)cccc1C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001581752179 1075782214 /nfs/dbraw/zinc/78/22/14/1075782214.db2.gz QJPVDXLXMDWSGW-OCCSQVGLSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1c(=O)cccc1C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O ZINC001581752180 1075782349 /nfs/dbraw/zinc/78/23/49/1075782349.db2.gz QJPVDXLXMDWSGW-TZMCWYRMSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1c(=O)cccc1C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O ZINC001581752180 1075782344 /nfs/dbraw/zinc/78/23/44/1075782344.db2.gz QJPVDXLXMDWSGW-TZMCWYRMSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1c(=O)cccc1C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1O ZINC001581752272 1075782619 /nfs/dbraw/zinc/78/26/19/1075782619.db2.gz VTOBEASJBGMTBJ-DGCLKSJQSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1c(=O)cccc1C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@H]1O ZINC001581752272 1075782615 /nfs/dbraw/zinc/78/26/15/1075782615.db2.gz VTOBEASJBGMTBJ-DGCLKSJQSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1c(=O)cccc1C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001581752273 1075782700 /nfs/dbraw/zinc/78/27/00/1075782700.db2.gz VTOBEASJBGMTBJ-YPMHNXCESA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1c(=O)cccc1C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001581752273 1075782694 /nfs/dbraw/zinc/78/26/94/1075782694.db2.gz VTOBEASJBGMTBJ-YPMHNXCESA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1c(=O)cccc1C(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@H]1O ZINC001581752325 1075782723 /nfs/dbraw/zinc/78/27/23/1075782723.db2.gz YZNAJWFZGYKUNU-DGCLKSJQSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1c(=O)cccc1C(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@H]1O ZINC001581752325 1075782719 /nfs/dbraw/zinc/78/27/19/1075782719.db2.gz YZNAJWFZGYKUNU-DGCLKSJQSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1c(=O)cccc1C(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001581752326 1075782539 /nfs/dbraw/zinc/78/25/39/1075782539.db2.gz YZNAJWFZGYKUNU-YPMHNXCESA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1c(=O)cccc1C(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001581752326 1075782536 /nfs/dbraw/zinc/78/25/36/1075782536.db2.gz YZNAJWFZGYKUNU-YPMHNXCESA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1c(=O)cc(CN2CC(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n(C)c1=O ZINC001581752596 1075782687 /nfs/dbraw/zinc/78/26/87/1075782687.db2.gz OBGBQBCQOYANHW-UHFFFAOYSA-N -1 3 385.388 -1.794 20 0 GAADHM Cn1c(=O)cc(CN2CC(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n(C)c1=O ZINC001581752596 1075782684 /nfs/dbraw/zinc/78/26/84/1075782684.db2.gz OBGBQBCQOYANHW-UHFFFAOYSA-N -1 3 385.388 -1.794 20 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ZINC001581755071 1075783374 /nfs/dbraw/zinc/78/33/74/1075783374.db2.gz FJDKNNATBHYIMT-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)N2CC(CCO)(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)nn1 ZINC001581755071 1075783368 /nfs/dbraw/zinc/78/33/68/1075783368.db2.gz FJDKNNATBHYIMT-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)N2CC(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n(C)c1=O ZINC001581755183 1075783270 /nfs/dbraw/zinc/78/32/70/1075783270.db2.gz HNLQREMNRFZLCR-UHFFFAOYSA-N -1 3 385.388 -1.266 20 0 GAADHM Cn1cc(C(=O)N2CC(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n(C)c1=O ZINC001581755183 1075783267 /nfs/dbraw/zinc/78/32/67/1075783267.db2.gz HNLQREMNRFZLCR-UHFFFAOYSA-N -1 3 385.388 -1.266 20 0 GAADHM Cn1cc(C(=O)N2CC(CCO)(NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)nn1 ZINC001581755227 1075783316 /nfs/dbraw/zinc/78/33/16/1075783316.db2.gz ISKPVWKOENMENX-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)N2CC(CCO)(NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)nn1 ZINC001581755227 1075783312 /nfs/dbraw/zinc/78/33/12/1075783312.db2.gz ISKPVWKOENMENX-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)N(CCO)CCNc2ncccc2-c2nn[n-]n2)n(C)c1=O ZINC001581755231 1075783339 /nfs/dbraw/zinc/78/33/39/1075783339.db2.gz IYPCFOMPDDSQFA-UHFFFAOYSA-N -1 3 387.404 -1.155 20 0 GAADHM Cn1cc(C(=O)N(CCO)CCNc2ncccc2-c2nnn[n-]2)n(C)c1=O ZINC001581755231 1075783335 /nfs/dbraw/zinc/78/33/35/1075783335.db2.gz IYPCFOMPDDSQFA-UHFFFAOYSA-N -1 3 387.404 -1.155 20 0 GAADHM Cn1cc(C(=O)N2CC(CCO)(NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)nn1 ZINC001581755279 1075783439 /nfs/dbraw/zinc/78/34/39/1075783439.db2.gz KKOIYBBCEPDAFU-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)N2CC(CCO)(NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)nn1 ZINC001581755279 1075783435 /nfs/dbraw/zinc/78/34/35/1075783435.db2.gz KKOIYBBCEPDAFU-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)N2CC(CCO)(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)cn1 ZINC001581755293 1075783215 /nfs/dbraw/zinc/78/32/15/1075783215.db2.gz LPSYRCRKIPQLLP-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)N2CC(CCO)(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)cn1 ZINC001581755293 1075783213 /nfs/dbraw/zinc/78/32/13/1075783213.db2.gz LPSYRCRKIPQLLP-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)N2CC(CCO)(NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)cn1 ZINC001581755325 1075783232 /nfs/dbraw/zinc/78/32/32/1075783232.db2.gz MTEZSXGSIDYGLB-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)N2CC(CCO)(NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)cn1 ZINC001581755325 1075783226 /nfs/dbraw/zinc/78/32/26/1075783226.db2.gz MTEZSXGSIDYGLB-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)N2CC(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)ncc1=O ZINC001581755330 1075783327 /nfs/dbraw/zinc/78/33/27/1075783327.db2.gz MWROKDIRNCFMGH-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1cc(C(=O)N2CC(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)ncc1=O ZINC001581755330 1075783324 /nfs/dbraw/zinc/78/33/24/1075783324.db2.gz MWROKDIRNCFMGH-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1cc(C(=O)N(CCO)CCNc2ccc(-c3nn[n-]n3)nc2)n(C)c1=O ZINC001581755332 1075783794 /nfs/dbraw/zinc/78/37/94/1075783794.db2.gz MXNZFKLXRMIUPV-UHFFFAOYSA-N -1 3 387.404 -1.155 20 0 GAADHM Cn1cc(C(=O)N(CCO)CCNc2ccc(-c3nnn[n-]3)nc2)n(C)c1=O ZINC001581755332 1075783791 /nfs/dbraw/zinc/78/37/91/1075783791.db2.gz MXNZFKLXRMIUPV-UHFFFAOYSA-N -1 3 387.404 -1.155 20 0 GAADHM Cn1cc(C(=O)N2CC(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n(C)c1=O ZINC001581755375 1075783603 /nfs/dbraw/zinc/78/36/03/1075783603.db2.gz PEJIFRKGKKPPQO-UHFFFAOYSA-N -1 3 385.388 -1.266 20 0 GAADHM Cn1cc(C(=O)N2CC(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n(C)c1=O ZINC001581755375 1075783602 /nfs/dbraw/zinc/78/36/02/1075783602.db2.gz PEJIFRKGKKPPQO-UHFFFAOYSA-N -1 3 385.388 -1.266 20 0 GAADHM Cn1cc(C(=O)N2CC(=O)Nc3ccc(-c4nn[n-]n4)cc32)c(=O)n(C)c1=O ZINC001581755412 1075783599 /nfs/dbraw/zinc/78/35/99/1075783599.db2.gz QUTBKNFUMPRREM-UHFFFAOYSA-N -1 3 382.340 -1.137 20 0 GAADHM Cn1cc(C(=O)N2CC(=O)Nc3ccc(-c4nnn[n-]4)cc32)c(=O)n(C)c1=O ZINC001581755412 1075783597 /nfs/dbraw/zinc/78/35/97/1075783597.db2.gz QUTBKNFUMPRREM-UHFFFAOYSA-N -1 3 382.340 -1.137 20 0 GAADHM Cn1cc(C(=O)N2CC(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n(C)c1=O ZINC001581755500 1075783772 /nfs/dbraw/zinc/78/37/72/1075783772.db2.gz UXEAKRCHSLOLSA-UHFFFAOYSA-N -1 3 385.388 -1.266 20 0 GAADHM Cn1cc(C(=O)N2CC(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n(C)c1=O ZINC001581755500 1075783766 /nfs/dbraw/zinc/78/37/66/1075783766.db2.gz UXEAKRCHSLOLSA-UHFFFAOYSA-N -1 3 385.388 -1.266 20 0 GAADHM Cn1cc(C(=O)N2CC(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)ncc1=O ZINC001581755600 1075783667 /nfs/dbraw/zinc/78/36/67/1075783667.db2.gz YRRLTVYVSYVTHI-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1cc(C(=O)N2CC(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)ncc1=O ZINC001581755600 1075783664 /nfs/dbraw/zinc/78/36/64/1075783664.db2.gz YRRLTVYVSYVTHI-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@H](O)C2)nn1 ZINC001581756191 1075783646 /nfs/dbraw/zinc/78/36/46/1075783646.db2.gz AHSALXZYSUIINW-BXKDBHETSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@H](O)C2)nn1 ZINC001581756191 1075783643 /nfs/dbraw/zinc/78/36/43/1075783643.db2.gz AHSALXZYSUIINW-BXKDBHETSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)nn1 ZINC001581756192 1075783628 /nfs/dbraw/zinc/78/36/28/1075783628.db2.gz AHSALXZYSUIINW-CABZTGNLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)nn1 ZINC001581756192 1075783623 /nfs/dbraw/zinc/78/36/23/1075783623.db2.gz AHSALXZYSUIINW-CABZTGNLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@H](O)C2)nn1 ZINC001581756193 1075783756 /nfs/dbraw/zinc/78/37/56/1075783756.db2.gz AHSALXZYSUIINW-JOYOIKCWSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@H](O)C2)nn1 ZINC001581756193 1075783751 /nfs/dbraw/zinc/78/37/51/1075783751.db2.gz AHSALXZYSUIINW-JOYOIKCWSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)nn1 ZINC001581756194 1075784145 /nfs/dbraw/zinc/78/41/45/1075784145.db2.gz AHSALXZYSUIINW-SKDRFNHKSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)nn1 ZINC001581756194 1075784144 /nfs/dbraw/zinc/78/41/44/1075784144.db2.gz AHSALXZYSUIINW-SKDRFNHKSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)cn1 ZINC001581756223 1075784109 /nfs/dbraw/zinc/78/41/09/1075784109.db2.gz BEBWUYAEBUYRMF-AAEUAGOBSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)cn1 ZINC001581756223 1075784106 /nfs/dbraw/zinc/78/41/06/1075784106.db2.gz BEBWUYAEBUYRMF-AAEUAGOBSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@H](O)C2)cn1 ZINC001581756224 1075784035 /nfs/dbraw/zinc/78/40/35/1075784035.db2.gz BEBWUYAEBUYRMF-DGCLKSJQSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@H](O)C2)cn1 ZINC001581756224 1075784030 /nfs/dbraw/zinc/78/40/30/1075784030.db2.gz BEBWUYAEBUYRMF-DGCLKSJQSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@H](O)C2)cn1 ZINC001581756225 1075784149 /nfs/dbraw/zinc/78/41/49/1075784149.db2.gz BEBWUYAEBUYRMF-WCQYABFASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@H](O)C2)cn1 ZINC001581756225 1075784148 /nfs/dbraw/zinc/78/41/48/1075784148.db2.gz BEBWUYAEBUYRMF-WCQYABFASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)cn1 ZINC001581756226 1075784137 /nfs/dbraw/zinc/78/41/37/1075784137.db2.gz BEBWUYAEBUYRMF-YPMHNXCESA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)cn1 ZINC001581756226 1075784135 /nfs/dbraw/zinc/78/41/35/1075784135.db2.gz BEBWUYAEBUYRMF-YPMHNXCESA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@](O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)cn1 ZINC001581756253 1075784161 /nfs/dbraw/zinc/78/41/61/1075784161.db2.gz CKVNWMPJJVYZGN-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)N2CC[C@](O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)cn1 ZINC001581756253 1075784158 /nfs/dbraw/zinc/78/41/58/1075784158.db2.gz CKVNWMPJJVYZGN-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@](O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)cn1 ZINC001581756254 1075784128 /nfs/dbraw/zinc/78/41/28/1075784128.db2.gz CKVNWMPJJVYZGN-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@](O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)cn1 ZINC001581756254 1075784126 /nfs/dbraw/zinc/78/41/26/1075784126.db2.gz CKVNWMPJJVYZGN-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H]2CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n(C)c1=O ZINC001581756258 1075784119 /nfs/dbraw/zinc/78/41/19/1075784119.db2.gz CNIIWYWRRIXXTN-JTQLQIEISA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H]2CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n(C)c1=O ZINC001581756258 1075784116 /nfs/dbraw/zinc/78/41/16/1075784116.db2.gz CNIIWYWRRIXXTN-JTQLQIEISA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H]2CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n(C)c1=O ZINC001581756259 1075783968 /nfs/dbraw/zinc/78/39/68/1075783968.db2.gz CNIIWYWRRIXXTN-SNVBAGLBSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H]2CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n(C)c1=O ZINC001581756259 1075783962 /nfs/dbraw/zinc/78/39/62/1075783962.db2.gz CNIIWYWRRIXXTN-SNVBAGLBSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H]2CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)ncc1=O ZINC001581756347 1075784155 /nfs/dbraw/zinc/78/41/55/1075784155.db2.gz DTMNQCHSSOJIOJ-SECBINFHSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H]2CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)ncc1=O ZINC001581756347 1075784153 /nfs/dbraw/zinc/78/41/53/1075784153.db2.gz DTMNQCHSSOJIOJ-SECBINFHSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H]2CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)ncc1=O ZINC001581756348 1075783984 /nfs/dbraw/zinc/78/39/84/1075783984.db2.gz DTMNQCHSSOJIOJ-VIFPVBQESA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H]2CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)ncc1=O ZINC001581756348 1075783979 /nfs/dbraw/zinc/78/39/79/1075783979.db2.gz DTMNQCHSSOJIOJ-VIFPVBQESA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)cn1 ZINC001581756388 1075784002 /nfs/dbraw/zinc/78/40/02/1075784002.db2.gz GSBYHGGPHAFDKP-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)cn1 ZINC001581756388 1075783998 /nfs/dbraw/zinc/78/39/98/1075783998.db2.gz GSBYHGGPHAFDKP-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@H](O)C2)cn1 ZINC001581756389 1075784099 /nfs/dbraw/zinc/78/40/99/1075784099.db2.gz GSBYHGGPHAFDKP-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@H](O)C2)cn1 ZINC001581756389 1075784094 /nfs/dbraw/zinc/78/40/94/1075784094.db2.gz GSBYHGGPHAFDKP-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)cn1 ZINC001581756390 1075784167 /nfs/dbraw/zinc/78/41/67/1075784167.db2.gz GSBYHGGPHAFDKP-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)cn1 ZINC001581756390 1075784164 /nfs/dbraw/zinc/78/41/64/1075784164.db2.gz GSBYHGGPHAFDKP-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@H](O)C2)cn1 ZINC001581756391 1075784051 /nfs/dbraw/zinc/78/40/51/1075784051.db2.gz GSBYHGGPHAFDKP-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@H](O)C2)cn1 ZINC001581756391 1075784046 /nfs/dbraw/zinc/78/40/46/1075784046.db2.gz GSBYHGGPHAFDKP-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@H](O)C2)nn1 ZINC001581756645 1075784463 /nfs/dbraw/zinc/78/44/63/1075784463.db2.gz LVEDTBRGGWOUFH-BXKDBHETSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@H](O)C2)nn1 ZINC001581756645 1075784461 /nfs/dbraw/zinc/78/44/61/1075784461.db2.gz LVEDTBRGGWOUFH-BXKDBHETSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)nn1 ZINC001581756646 1075784390 /nfs/dbraw/zinc/78/43/90/1075784390.db2.gz LVEDTBRGGWOUFH-CABZTGNLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)nn1 ZINC001581756646 1075784387 /nfs/dbraw/zinc/78/43/87/1075784387.db2.gz LVEDTBRGGWOUFH-CABZTGNLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@H](O)C2)nn1 ZINC001581756647 1075784507 /nfs/dbraw/zinc/78/45/07/1075784507.db2.gz LVEDTBRGGWOUFH-JOYOIKCWSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@H](O)C2)nn1 ZINC001581756647 1075784504 /nfs/dbraw/zinc/78/45/04/1075784504.db2.gz LVEDTBRGGWOUFH-JOYOIKCWSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)nn1 ZINC001581756648 1075784480 /nfs/dbraw/zinc/78/44/80/1075784480.db2.gz LVEDTBRGGWOUFH-SKDRFNHKSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)nn1 ZINC001581756648 1075784477 /nfs/dbraw/zinc/78/44/77/1075784477.db2.gz LVEDTBRGGWOUFH-SKDRFNHKSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H]2CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)ncc1=O ZINC001581756649 1075784287 /nfs/dbraw/zinc/78/42/87/1075784287.db2.gz LVVGZYBUSYMZLO-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H]2CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)ncc1=O ZINC001581756649 1075784283 /nfs/dbraw/zinc/78/42/83/1075784283.db2.gz LVVGZYBUSYMZLO-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H]2CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)ncc1=O ZINC001581756650 1075784378 /nfs/dbraw/zinc/78/43/78/1075784378.db2.gz LVVGZYBUSYMZLO-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H]2CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)ncc1=O ZINC001581756650 1075784373 /nfs/dbraw/zinc/78/43/73/1075784373.db2.gz LVVGZYBUSYMZLO-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n(C)c1=O ZINC001581756668 1075784519 /nfs/dbraw/zinc/78/45/19/1075784519.db2.gz MMOAPXCZOCIOMB-JTQLQIEISA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n(C)c1=O ZINC001581756668 1075784515 /nfs/dbraw/zinc/78/45/15/1075784515.db2.gz MMOAPXCZOCIOMB-JTQLQIEISA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n(C)c1=O ZINC001581756669 1075784471 /nfs/dbraw/zinc/78/44/71/1075784471.db2.gz MMOAPXCZOCIOMB-SNVBAGLBSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n(C)c1=O ZINC001581756669 1075784468 /nfs/dbraw/zinc/78/44/68/1075784468.db2.gz MMOAPXCZOCIOMB-SNVBAGLBSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)ncc1=O ZINC001581756782 1075784351 /nfs/dbraw/zinc/78/43/51/1075784351.db2.gz ONQIPBAETKMPHJ-SECBINFHSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)ncc1=O ZINC001581756782 1075784346 /nfs/dbraw/zinc/78/43/46/1075784346.db2.gz ONQIPBAETKMPHJ-SECBINFHSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)ncc1=O ZINC001581756783 1075784420 /nfs/dbraw/zinc/78/44/20/1075784420.db2.gz ONQIPBAETKMPHJ-VIFPVBQESA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)ncc1=O ZINC001581756783 1075784416 /nfs/dbraw/zinc/78/44/16/1075784416.db2.gz ONQIPBAETKMPHJ-VIFPVBQESA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N2CC[C@](O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)cn1 ZINC001581756841 1075784529 /nfs/dbraw/zinc/78/45/29/1075784529.db2.gz QBLXRFMIVDVFEZ-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)N2CC[C@](O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)cn1 ZINC001581756841 1075784525 /nfs/dbraw/zinc/78/45/25/1075784525.db2.gz QBLXRFMIVDVFEZ-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@](O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)cn1 ZINC001581756842 1075784305 /nfs/dbraw/zinc/78/43/05/1075784305.db2.gz QBLXRFMIVDVFEZ-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@](O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)cn1 ZINC001581756842 1075784298 /nfs/dbraw/zinc/78/42/98/1075784298.db2.gz QBLXRFMIVDVFEZ-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H]2CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n(C)c1=O ZINC001581756845 1075784447 /nfs/dbraw/zinc/78/44/47/1075784447.db2.gz QICREWZEWZSOTQ-SECBINFHSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H]2CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n(C)c1=O ZINC001581756845 1075784441 /nfs/dbraw/zinc/78/44/41/1075784441.db2.gz QICREWZEWZSOTQ-SECBINFHSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H]2CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n(C)c1=O ZINC001581756846 1075784319 /nfs/dbraw/zinc/78/43/19/1075784319.db2.gz QICREWZEWZSOTQ-VIFPVBQESA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H]2CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n(C)c1=O ZINC001581756846 1075784316 /nfs/dbraw/zinc/78/43/16/1075784316.db2.gz QICREWZEWZSOTQ-VIFPVBQESA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@](O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)nn1 ZINC001581756880 1075784826 /nfs/dbraw/zinc/78/48/26/1075784826.db2.gz QRYBPIZOUNZHRN-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)N2CC[C@](O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)nn1 ZINC001581756880 1075784819 /nfs/dbraw/zinc/78/48/19/1075784819.db2.gz QRYBPIZOUNZHRN-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@](O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)nn1 ZINC001581756881 1075784738 /nfs/dbraw/zinc/78/47/38/1075784738.db2.gz QRYBPIZOUNZHRN-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@](O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)nn1 ZINC001581756881 1075784737 /nfs/dbraw/zinc/78/47/37/1075784737.db2.gz QRYBPIZOUNZHRN-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H]2CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n(C)c1=O ZINC001581756912 1075784782 /nfs/dbraw/zinc/78/47/82/1075784782.db2.gz RMSRAFXWCCBICX-JTQLQIEISA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H]2CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n(C)c1=O ZINC001581756912 1075784778 /nfs/dbraw/zinc/78/47/78/1075784778.db2.gz RMSRAFXWCCBICX-JTQLQIEISA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H]2CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n(C)c1=O ZINC001581756913 1075784729 /nfs/dbraw/zinc/78/47/29/1075784729.db2.gz RMSRAFXWCCBICX-SNVBAGLBSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H]2CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n(C)c1=O ZINC001581756913 1075784728 /nfs/dbraw/zinc/78/47/28/1075784728.db2.gz RMSRAFXWCCBICX-SNVBAGLBSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@](O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)nn1 ZINC001581756920 1075784837 /nfs/dbraw/zinc/78/48/37/1075784837.db2.gz RRZAMQVRBHZHHZ-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)N2CC[C@](O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)nn1 ZINC001581756920 1075784834 /nfs/dbraw/zinc/78/48/34/1075784834.db2.gz RRZAMQVRBHZHHZ-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@](O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)nn1 ZINC001581756921 1075784751 /nfs/dbraw/zinc/78/47/51/1075784751.db2.gz RRZAMQVRBHZHHZ-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@](O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)nn1 ZINC001581756921 1075784749 /nfs/dbraw/zinc/78/47/49/1075784749.db2.gz RRZAMQVRBHZHHZ-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)nn1 ZINC001581756947 1075784742 /nfs/dbraw/zinc/78/47/42/1075784742.db2.gz SORUJDFGXYSMCV-PELKAZGASA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)nn1 ZINC001581756947 1075784741 /nfs/dbraw/zinc/78/47/41/1075784741.db2.gz SORUJDFGXYSMCV-PELKAZGASA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@H](O)C2)nn1 ZINC001581756948 1075784709 /nfs/dbraw/zinc/78/47/09/1075784709.db2.gz SORUJDFGXYSMCV-PRHODGIISA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@H](O)C2)nn1 ZINC001581756948 1075784708 /nfs/dbraw/zinc/78/47/08/1075784708.db2.gz SORUJDFGXYSMCV-PRHODGIISA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@H](O)C2)nn1 ZINC001581756949 1075784810 /nfs/dbraw/zinc/78/48/10/1075784810.db2.gz SORUJDFGXYSMCV-QPUJVOFHSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@H](O)C2)nn1 ZINC001581756949 1075784806 /nfs/dbraw/zinc/78/48/06/1075784806.db2.gz SORUJDFGXYSMCV-QPUJVOFHSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)nn1 ZINC001581756950 1075784851 /nfs/dbraw/zinc/78/48/51/1075784851.db2.gz SORUJDFGXYSMCV-UFBFGSQYSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)nn1 ZINC001581756950 1075784847 /nfs/dbraw/zinc/78/48/47/1075784847.db2.gz SORUJDFGXYSMCV-UFBFGSQYSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)cn1 ZINC001581756973 1075784756 /nfs/dbraw/zinc/78/47/56/1075784756.db2.gz TZWACMKCIJPBQW-AAEUAGOBSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)cn1 ZINC001581756973 1075784755 /nfs/dbraw/zinc/78/47/55/1075784755.db2.gz TZWACMKCIJPBQW-AAEUAGOBSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@H](O)C2)cn1 ZINC001581756974 1075784695 /nfs/dbraw/zinc/78/46/95/1075784695.db2.gz TZWACMKCIJPBQW-DGCLKSJQSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@H](O)C2)cn1 ZINC001581756974 1075784693 /nfs/dbraw/zinc/78/46/93/1075784693.db2.gz TZWACMKCIJPBQW-DGCLKSJQSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@H](O)C2)cn1 ZINC001581756975 1075784797 /nfs/dbraw/zinc/78/47/97/1075784797.db2.gz TZWACMKCIJPBQW-WCQYABFASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@H](O)C2)cn1 ZINC001581756975 1075784790 /nfs/dbraw/zinc/78/47/90/1075784790.db2.gz TZWACMKCIJPBQW-WCQYABFASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)cn1 ZINC001581756976 1075784770 /nfs/dbraw/zinc/78/47/70/1075784770.db2.gz TZWACMKCIJPBQW-YPMHNXCESA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)cn1 ZINC001581756976 1075784769 /nfs/dbraw/zinc/78/47/69/1075784769.db2.gz TZWACMKCIJPBQW-YPMHNXCESA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N2CC[C@](O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)nn1 ZINC001581757145 1075785277 /nfs/dbraw/zinc/78/52/77/1075785277.db2.gz XDKRBNITRGNYAZ-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)N2CC[C@](O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)nn1 ZINC001581757145 1075785275 /nfs/dbraw/zinc/78/52/75/1075785275.db2.gz XDKRBNITRGNYAZ-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@](O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)nn1 ZINC001581757146 1075785260 /nfs/dbraw/zinc/78/52/60/1075785260.db2.gz XDKRBNITRGNYAZ-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)N2CC[C@@](O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)nn1 ZINC001581757146 1075785257 /nfs/dbraw/zinc/78/52/57/1075785257.db2.gz XDKRBNITRGNYAZ-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)N2CCOC[C@@H]2CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)nn1 ZINC001581757282 1075785122 /nfs/dbraw/zinc/78/51/22/1075785122.db2.gz GBQOTWQTVQERAL-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)N2CCOC[C@@H]2CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)nn1 ZINC001581757282 1075785117 /nfs/dbraw/zinc/78/51/17/1075785117.db2.gz GBQOTWQTVQERAL-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)N2CCOC[C@H]2CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)nn1 ZINC001581757283 1075785073 /nfs/dbraw/zinc/78/50/73/1075785073.db2.gz GBQOTWQTVQERAL-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)N2CCOC[C@H]2CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)nn1 ZINC001581757283 1075785070 /nfs/dbraw/zinc/78/50/70/1075785070.db2.gz GBQOTWQTVQERAL-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)N2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2)n(C)c1=O ZINC001581757353 1075785023 /nfs/dbraw/zinc/78/50/23/1075785023.db2.gz LYCRKLRHUXBMPT-UHFFFAOYSA-N -1 3 385.388 -1.170 20 0 GAADHM Cn1cc(C(=O)N2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2)n(C)c1=O ZINC001581757353 1075785020 /nfs/dbraw/zinc/78/50/20/1075785020.db2.gz LYCRKLRHUXBMPT-UHFFFAOYSA-N -1 3 385.388 -1.170 20 0 GAADHM Cn1cc(C(=O)N2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)n(C)c1=O ZINC001581757369 1075785224 /nfs/dbraw/zinc/78/52/24/1075785224.db2.gz NCMXGFVNZYRYRC-UHFFFAOYSA-N -1 3 385.388 -1.170 20 0 GAADHM Cn1cc(C(=O)N2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)n(C)c1=O ZINC001581757369 1075785216 /nfs/dbraw/zinc/78/52/16/1075785216.db2.gz NCMXGFVNZYRYRC-UHFFFAOYSA-N -1 3 385.388 -1.170 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n(C)c1=O ZINC001581757374 1075785048 /nfs/dbraw/zinc/78/50/48/1075785048.db2.gz NJVXIIDFLSJISF-JTQLQIEISA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n(C)c1=O ZINC001581757374 1075785044 /nfs/dbraw/zinc/78/50/44/1075785044.db2.gz NJVXIIDFLSJISF-JTQLQIEISA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)CC2)ncc1=O ZINC001581757414 1075785012 /nfs/dbraw/zinc/78/50/12/1075785012.db2.gz RMWIIQMEMGNVOT-UHFFFAOYSA-N -1 3 383.372 -1.113 20 0 GAADHM Cn1cc(C(=O)N2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)CC2)ncc1=O ZINC001581757414 1075785009 /nfs/dbraw/zinc/78/50/09/1075785009.db2.gz RMWIIQMEMGNVOT-UHFFFAOYSA-N -1 3 383.372 -1.113 20 0 GAADHM Cn1cc(C(=O)N2CCO[C@@H](CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)nn1 ZINC001581757428 1075785252 /nfs/dbraw/zinc/78/52/52/1075785252.db2.gz SKQOYQKBUYRLER-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)N2CCO[C@@H](CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)nn1 ZINC001581757428 1075785249 /nfs/dbraw/zinc/78/52/49/1075785249.db2.gz SKQOYQKBUYRLER-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)N2CCO[C@H](CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)nn1 ZINC001581757429 1075785036 /nfs/dbraw/zinc/78/50/36/1075785036.db2.gz SKQOYQKBUYRLER-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)N2CCO[C@H](CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)nn1 ZINC001581757429 1075785032 /nfs/dbraw/zinc/78/50/32/1075785032.db2.gz SKQOYQKBUYRLER-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)N2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)ncc1=O ZINC001581757445 1075785269 /nfs/dbraw/zinc/78/52/69/1075785269.db2.gz UMTLVOYHDGHDPD-UHFFFAOYSA-N -1 3 383.372 -1.113 20 0 GAADHM Cn1cc(C(=O)N2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)ncc1=O ZINC001581757445 1075785267 /nfs/dbraw/zinc/78/52/67/1075785267.db2.gz UMTLVOYHDGHDPD-UHFFFAOYSA-N -1 3 383.372 -1.113 20 0 GAADHM Cn1cc(C(=O)N2CCO[C@H](CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)nn1 ZINC001581757447 1075785241 /nfs/dbraw/zinc/78/52/41/1075785241.db2.gz UQAMISVZPBOXPV-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)N2CCO[C@H](CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)nn1 ZINC001581757447 1075785237 /nfs/dbraw/zinc/78/52/37/1075785237.db2.gz UQAMISVZPBOXPV-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)N2CCO[C@@H](CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)nn1 ZINC001581757448 1075785201 /nfs/dbraw/zinc/78/52/01/1075785201.db2.gz UQAMISVZPBOXPV-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)N2CCO[C@@H](CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)nn1 ZINC001581757448 1075785196 /nfs/dbraw/zinc/78/51/96/1075785196.db2.gz UQAMISVZPBOXPV-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)N2CCOC[C@@H]2CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)nn1 ZINC001581757471 1075785184 /nfs/dbraw/zinc/78/51/84/1075785184.db2.gz XBSAPJXHULMCKG-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)N2CCOC[C@@H]2CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)nn1 ZINC001581757471 1075785177 /nfs/dbraw/zinc/78/51/77/1075785177.db2.gz XBSAPJXHULMCKG-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)N2CCOC[C@H]2CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)nn1 ZINC001581757472 1075785476 /nfs/dbraw/zinc/78/54/76/1075785476.db2.gz XBSAPJXHULMCKG-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)N2CCOC[C@H]2CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)nn1 ZINC001581757472 1075785469 /nfs/dbraw/zinc/78/54/69/1075785469.db2.gz XBSAPJXHULMCKG-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)N2CCOC[C@H]2CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)nn1 ZINC001581757497 1075785540 /nfs/dbraw/zinc/78/55/40/1075785540.db2.gz ZUBJXZVVYVWSMG-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)N2CCOC[C@H]2CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)nn1 ZINC001581757497 1075785537 /nfs/dbraw/zinc/78/55/37/1075785537.db2.gz ZUBJXZVVYVWSMG-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)N2CCOC[C@@H]2CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)nn1 ZINC001581757498 1075785581 /nfs/dbraw/zinc/78/55/81/1075785581.db2.gz ZUBJXZVVYVWSMG-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)N2CCOC[C@@H]2CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)nn1 ZINC001581757498 1075785575 /nfs/dbraw/zinc/78/55/75/1075785575.db2.gz ZUBJXZVVYVWSMG-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC2(CCO)CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)nn1 ZINC001581758244 1075785424 /nfs/dbraw/zinc/78/54/24/1075785424.db2.gz CQCOWDKLPXKNHI-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)NC2(CCO)CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)nn1 ZINC001581758244 1075785420 /nfs/dbraw/zinc/78/54/20/1075785420.db2.gz CQCOWDKLPXKNHI-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)NC2(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2)n(C)c1=O ZINC001581758293 1075785567 /nfs/dbraw/zinc/78/55/67/1075785567.db2.gz DHTZGLSKIULOFW-UHFFFAOYSA-N -1 3 385.388 -1.076 20 0 GAADHM Cn1cc(C(=O)NC2(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2)n(C)c1=O ZINC001581758293 1075785561 /nfs/dbraw/zinc/78/55/61/1075785561.db2.gz DHTZGLSKIULOFW-UHFFFAOYSA-N -1 3 385.388 -1.076 20 0 GAADHM Cn1cc(C(=O)NC2(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)CC2)n(C)c1=O ZINC001581758492 1075785505 /nfs/dbraw/zinc/78/55/05/1075785505.db2.gz KDUBSVDYGPEKBA-UHFFFAOYSA-N -1 3 385.388 -1.076 20 0 GAADHM Cn1cc(C(=O)NC2(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)CC2)n(C)c1=O ZINC001581758492 1075785500 /nfs/dbraw/zinc/78/55/00/1075785500.db2.gz KDUBSVDYGPEKBA-UHFFFAOYSA-N -1 3 385.388 -1.076 20 0 GAADHM Cn1cc(C(=O)NC2(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2)ncc1=O ZINC001581758535 1075785820 /nfs/dbraw/zinc/78/58/20/1075785820.db2.gz LIQCSRODDUWXCC-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1cc(C(=O)NC2(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2)ncc1=O ZINC001581758535 1075785817 /nfs/dbraw/zinc/78/58/17/1075785817.db2.gz LIQCSRODDUWXCC-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1cc(C(=O)NC2(CCO)CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)cn1 ZINC001581758606 1075785825 /nfs/dbraw/zinc/78/58/25/1075785825.db2.gz NIPFDMKXVPNPAA-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)NC2(CCO)CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)cn1 ZINC001581758606 1075785824 /nfs/dbraw/zinc/78/58/24/1075785824.db2.gz NIPFDMKXVPNPAA-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)NC2(CCO)CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)nn1 ZINC001581758717 1075785831 /nfs/dbraw/zinc/78/58/31/1075785831.db2.gz RVDDCDKGNZEBCA-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)NC2(CCO)CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)nn1 ZINC001581758717 1075785830 /nfs/dbraw/zinc/78/58/30/1075785830.db2.gz RVDDCDKGNZEBCA-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)NC2(CCO)CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)nn1 ZINC001581758778 1075785808 /nfs/dbraw/zinc/78/58/08/1075785808.db2.gz UEGSYPVJICEQAE-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)NC2(CCO)CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)nn1 ZINC001581758778 1075785802 /nfs/dbraw/zinc/78/58/02/1075785802.db2.gz UEGSYPVJICEQAE-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)NC2(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)n(C)c1=O ZINC001581758840 1075785855 /nfs/dbraw/zinc/78/58/55/1075785855.db2.gz WDFNPZMTTNKLCS-UHFFFAOYSA-N -1 3 385.388 -1.076 20 0 GAADHM Cn1cc(C(=O)NC2(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)n(C)c1=O ZINC001581758840 1075785853 /nfs/dbraw/zinc/78/58/53/1075785853.db2.gz WDFNPZMTTNKLCS-UHFFFAOYSA-N -1 3 385.388 -1.076 20 0 GAADHM Cn1cc(C(=O)NC2(CCO)CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)cn1 ZINC001581758865 1075785861 /nfs/dbraw/zinc/78/58/61/1075785861.db2.gz WQVVKSWZUADALJ-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)NC2(CCO)CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)cn1 ZINC001581758865 1075785859 /nfs/dbraw/zinc/78/58/59/1075785859.db2.gz WQVVKSWZUADALJ-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)NC2(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)CC2)ncc1=O ZINC001581758868 1075785843 /nfs/dbraw/zinc/78/58/43/1075785843.db2.gz WTRWBPZJSUDLMP-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1cc(C(=O)NC2(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)CC2)ncc1=O ZINC001581758868 1075785842 /nfs/dbraw/zinc/78/58/42/1075785842.db2.gz WTRWBPZJSUDLMP-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1cc(C(=O)NC[C@H](O)CNc2ncc(-c3nn[n-]n3)cc2F)n(C)c1=O ZINC001581759037 1075786131 /nfs/dbraw/zinc/78/61/31/1075786131.db2.gz CQCOHKQKARGQFW-SECBINFHSA-N -1 3 391.367 -1.359 20 0 GAADHM Cn1cc(C(=O)NC[C@H](O)CNc2ncc(-c3nnn[n-]3)cc2F)n(C)c1=O ZINC001581759037 1075786126 /nfs/dbraw/zinc/78/61/26/1075786126.db2.gz CQCOHKQKARGQFW-SECBINFHSA-N -1 3 391.367 -1.359 20 0 GAADHM Cn1cc(C(=O)NC[C@@H](O)CNc2ncc(-c3nn[n-]n3)cc2F)n(C)c1=O ZINC001581759038 1075786259 /nfs/dbraw/zinc/78/62/59/1075786259.db2.gz CQCOHKQKARGQFW-VIFPVBQESA-N -1 3 391.367 -1.359 20 0 GAADHM Cn1cc(C(=O)NC[C@@H](O)CNc2ncc(-c3nnn[n-]3)cc2F)n(C)c1=O ZINC001581759038 1075786254 /nfs/dbraw/zinc/78/62/54/1075786254.db2.gz CQCOHKQKARGQFW-VIFPVBQESA-N -1 3 391.367 -1.359 20 0 GAADHM Cn1cc(C(=O)NCC2(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2)n(C)c1=O ZINC001581759202 1075786159 /nfs/dbraw/zinc/78/61/59/1075786159.db2.gz HDMINJYPCXROTG-UHFFFAOYSA-N -1 3 385.388 -1.076 20 0 GAADHM Cn1cc(C(=O)NCC2(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2)n(C)c1=O ZINC001581759202 1075786154 /nfs/dbraw/zinc/78/61/54/1075786154.db2.gz HDMINJYPCXROTG-UHFFFAOYSA-N -1 3 385.388 -1.076 20 0 GAADHM Cn1cc(C(=O)NCC2(NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)n(C)c1=O ZINC001581759243 1075786109 /nfs/dbraw/zinc/78/61/09/1075786109.db2.gz IMSVFZVYYUNUKB-UHFFFAOYSA-N -1 3 385.388 -1.076 20 0 GAADHM Cn1cc(C(=O)NCC2(NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)n(C)c1=O ZINC001581759243 1075786104 /nfs/dbraw/zinc/78/61/04/1075786104.db2.gz IMSVFZVYYUNUKB-UHFFFAOYSA-N -1 3 385.388 -1.076 20 0 GAADHM Cn1cc(C(=O)NC[C@H](CO)Nc2ncc(-c3nn[n-]n3)cc2F)n(C)c1=O ZINC001581759630 1075786518 /nfs/dbraw/zinc/78/65/18/1075786518.db2.gz UXXKYNPRTQJCCB-SECBINFHSA-N -1 3 391.367 -1.359 20 0 GAADHM Cn1cc(C(=O)NC[C@H](CO)Nc2ncc(-c3nnn[n-]3)cc2F)n(C)c1=O ZINC001581759630 1075786512 /nfs/dbraw/zinc/78/65/12/1075786512.db2.gz UXXKYNPRTQJCCB-SECBINFHSA-N -1 3 391.367 -1.359 20 0 GAADHM Cn1cc(C(=O)NC[C@@H](CO)Nc2ncc(-c3nn[n-]n3)cc2F)n(C)c1=O ZINC001581759631 1075786504 /nfs/dbraw/zinc/78/65/04/1075786504.db2.gz UXXKYNPRTQJCCB-VIFPVBQESA-N -1 3 391.367 -1.359 20 0 GAADHM Cn1cc(C(=O)NC[C@@H](CO)Nc2ncc(-c3nnn[n-]3)cc2F)n(C)c1=O ZINC001581759631 1075786500 /nfs/dbraw/zinc/78/65/00/1075786500.db2.gz UXXKYNPRTQJCCB-VIFPVBQESA-N -1 3 391.367 -1.359 20 0 GAADHM Cn1cc(C(=O)NCC2(NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)CC2)n(C)c1=O ZINC001581759774 1075786459 /nfs/dbraw/zinc/78/64/59/1075786459.db2.gz ZFDKYVZOHJQAOQ-UHFFFAOYSA-N -1 3 385.388 -1.076 20 0 GAADHM Cn1cc(C(=O)NCC2(NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)CC2)n(C)c1=O ZINC001581759774 1075786457 /nfs/dbraw/zinc/78/64/57/1075786457.db2.gz ZFDKYVZOHJQAOQ-UHFFFAOYSA-N -1 3 385.388 -1.076 20 0 GAADHM Cn1cc(C(=O)NC[C@@]2(O)CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)cn1 ZINC001581759812 1075786605 /nfs/dbraw/zinc/78/66/05/1075786605.db2.gz AFXCMBDAHCOAOI-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)NC[C@@]2(O)CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)cn1 ZINC001581759812 1075786599 /nfs/dbraw/zinc/78/65/99/1075786599.db2.gz AFXCMBDAHCOAOI-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)NC[C@]2(O)CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)cn1 ZINC001581759813 1075786564 /nfs/dbraw/zinc/78/65/64/1075786564.db2.gz AFXCMBDAHCOAOI-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)NC[C@]2(O)CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)cn1 ZINC001581759813 1075786559 /nfs/dbraw/zinc/78/65/59/1075786559.db2.gz AFXCMBDAHCOAOI-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)NC[C@@]2(O)CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)cn1 ZINC001581759986 1075786467 /nfs/dbraw/zinc/78/64/67/1075786467.db2.gz HHUPHEKEQHWLOS-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)NC[C@@]2(O)CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)cn1 ZINC001581759986 1075786464 /nfs/dbraw/zinc/78/64/64/1075786464.db2.gz HHUPHEKEQHWLOS-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)NC[C@]2(O)CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)cn1 ZINC001581759987 1075786643 /nfs/dbraw/zinc/78/66/43/1075786643.db2.gz HHUPHEKEQHWLOS-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)NC[C@]2(O)CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)cn1 ZINC001581759987 1075786636 /nfs/dbraw/zinc/78/66/36/1075786636.db2.gz HHUPHEKEQHWLOS-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)NC[C@@]2(O)CCN(c3cnc(-c4nnn[n-]4)cn3)C2)[nH]c1=O ZINC001581760182 1075786895 /nfs/dbraw/zinc/78/68/95/1075786895.db2.gz NDIQURQVFLESPY-HNNXBMFYSA-N -1 3 386.376 -1.533 20 0 GAADHM Cn1cc(C(=O)NC[C@]2(O)CCN(c3cnc(-c4nnn[n-]4)cn3)C2)[nH]c1=O ZINC001581760183 1075787095 /nfs/dbraw/zinc/78/70/95/1075787095.db2.gz NDIQURQVFLESPY-OAHLLOKOSA-N -1 3 386.376 -1.533 20 0 GAADHM Cn1cc(C(=O)NC[C@@]2(O)CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)nn1 ZINC001581760192 1075787070 /nfs/dbraw/zinc/78/70/70/1075787070.db2.gz NLUHNVVOXFPNRI-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)NC[C@@]2(O)CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)nn1 ZINC001581760192 1075787066 /nfs/dbraw/zinc/78/70/66/1075787066.db2.gz NLUHNVVOXFPNRI-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)NC[C@]2(O)CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)nn1 ZINC001581760193 1075786981 /nfs/dbraw/zinc/78/69/81/1075786981.db2.gz NLUHNVVOXFPNRI-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)NC[C@]2(O)CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)nn1 ZINC001581760193 1075786973 /nfs/dbraw/zinc/78/69/73/1075786973.db2.gz NLUHNVVOXFPNRI-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)NC[C@@]2(O)CCN(c3cncc(-c4nnn[n-]4)n3)C2)[nH]c1=O ZINC001581760207 1075787104 /nfs/dbraw/zinc/78/71/04/1075787104.db2.gz NXDMCMXJTAXOQH-HNNXBMFYSA-N -1 3 386.376 -1.533 20 0 GAADHM Cn1cc(C(=O)NC[C@]2(O)CCN(c3cncc(-c4nnn[n-]4)n3)C2)[nH]c1=O ZINC001581760208 1075787114 /nfs/dbraw/zinc/78/71/14/1075787114.db2.gz NXDMCMXJTAXOQH-OAHLLOKOSA-N -1 3 386.376 -1.533 20 0 GAADHM Cn1cc(C(=O)NC[C@@]2(O)CCN(c3nccnc3-c3nnn[n-]3)C2)[nH]c1=O ZINC001581760237 1075786816 /nfs/dbraw/zinc/78/68/16/1075786816.db2.gz OVAJVYIPNWPTDR-HNNXBMFYSA-N -1 3 386.376 -1.533 20 0 GAADHM Cn1cc(C(=O)NC[C@]2(O)CCN(c3nccnc3-c3nnn[n-]3)C2)[nH]c1=O ZINC001581760238 1075786939 /nfs/dbraw/zinc/78/69/39/1075786939.db2.gz OVAJVYIPNWPTDR-OAHLLOKOSA-N -1 3 386.376 -1.533 20 0 GAADHM Cn1cc(C(=O)NC[C@@]2(O)CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)cn1 ZINC001581760315 1075786853 /nfs/dbraw/zinc/78/68/53/1075786853.db2.gz RAPJKRLSSMEVBF-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)NC[C@@]2(O)CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)cn1 ZINC001581760315 1075786849 /nfs/dbraw/zinc/78/68/49/1075786849.db2.gz RAPJKRLSSMEVBF-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)NC[C@]2(O)CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)cn1 ZINC001581760316 1075786960 /nfs/dbraw/zinc/78/69/60/1075786960.db2.gz RAPJKRLSSMEVBF-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)NC[C@]2(O)CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)cn1 ZINC001581760316 1075786954 /nfs/dbraw/zinc/78/69/54/1075786954.db2.gz RAPJKRLSSMEVBF-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cc(C(=O)NC[C@@]2(O)CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)nn1 ZINC001581760336 1075787056 /nfs/dbraw/zinc/78/70/56/1075787056.db2.gz RODDPZZXSTVNHY-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)NC[C@@]2(O)CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)nn1 ZINC001581760336 1075787052 /nfs/dbraw/zinc/78/70/52/1075787052.db2.gz RODDPZZXSTVNHY-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)NC[C@]2(O)CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)nn1 ZINC001581760337 1075787084 /nfs/dbraw/zinc/78/70/84/1075787084.db2.gz RODDPZZXSTVNHY-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)NC[C@]2(O)CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)nn1 ZINC001581760337 1075787080 /nfs/dbraw/zinc/78/70/80/1075787080.db2.gz RODDPZZXSTVNHY-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)NC[C@@]2(O)CCN(c3ncc(-c4nn[n-]n4)cc3F)C2)nn1 ZINC001581760439 1075787004 /nfs/dbraw/zinc/78/70/04/1075787004.db2.gz WUSNTKZAQLVCEI-HNNXBMFYSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1cc(C(=O)NC[C@@]2(O)CCN(c3ncc(-c4nnn[n-]4)cc3F)C2)nn1 ZINC001581760439 1075786998 /nfs/dbraw/zinc/78/69/98/1075786998.db2.gz WUSNTKZAQLVCEI-HNNXBMFYSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1cc(C(=O)NC[C@]2(O)CCN(c3ncc(-c4nn[n-]n4)cc3F)C2)nn1 ZINC001581760440 1075786802 /nfs/dbraw/zinc/78/68/02/1075786802.db2.gz WUSNTKZAQLVCEI-OAHLLOKOSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1cc(C(=O)NC[C@]2(O)CCN(c3ncc(-c4nnn[n-]4)cc3F)C2)nn1 ZINC001581760440 1075786798 /nfs/dbraw/zinc/78/67/98/1075786798.db2.gz WUSNTKZAQLVCEI-OAHLLOKOSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1cc(C(=O)NC[C@@]2(O)CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)nn1 ZINC001581760454 1075786838 /nfs/dbraw/zinc/78/68/38/1075786838.db2.gz XETCPWQCDKFBGF-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)NC[C@@]2(O)CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)nn1 ZINC001581760454 1075786835 /nfs/dbraw/zinc/78/68/35/1075786835.db2.gz XETCPWQCDKFBGF-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)NC[C@]2(O)CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)nn1 ZINC001581760455 1075786872 /nfs/dbraw/zinc/78/68/72/1075786872.db2.gz XETCPWQCDKFBGF-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)NC[C@]2(O)CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)nn1 ZINC001581760455 1075786867 /nfs/dbraw/zinc/78/68/67/1075786867.db2.gz XETCPWQCDKFBGF-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2COCCN2C(=O)c2c[nH]c(-c3nn[n-]n3)c2)nn1 ZINC001581760602 1075787040 /nfs/dbraw/zinc/78/70/40/1075787040.db2.gz BTBPSSDYVXWCLK-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2COCCN2C(=O)c2c[nH]c(-c3nnn[n-]3)c2)nn1 ZINC001581760602 1075787034 /nfs/dbraw/zinc/78/70/34/1075787034.db2.gz BTBPSSDYVXWCLK-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2COCCN2C(=O)c2c[nH]c(-c3nn[n-]n3)c2)nn1 ZINC001581760603 1075787024 /nfs/dbraw/zinc/78/70/24/1075787024.db2.gz BTBPSSDYVXWCLK-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2COCCN2C(=O)c2c[nH]c(-c3nnn[n-]3)c2)nn1 ZINC001581760603 1075787017 /nfs/dbraw/zinc/78/70/17/1075787017.db2.gz BTBPSSDYVXWCLK-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CCO2)nn1 ZINC001581760620 1075787178 /nfs/dbraw/zinc/78/71/78/1075787178.db2.gz CHJDVUPJKDICRN-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CCO2)nn1 ZINC001581760620 1075787171 /nfs/dbraw/zinc/78/71/71/1075787171.db2.gz CHJDVUPJKDICRN-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CCO2)nn1 ZINC001581760621 1075787398 /nfs/dbraw/zinc/78/73/98/1075787398.db2.gz CHJDVUPJKDICRN-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CCO2)nn1 ZINC001581760621 1075787395 /nfs/dbraw/zinc/78/73/95/1075787395.db2.gz CHJDVUPJKDICRN-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NCC2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n(C)c1=O ZINC001581760638 1075787369 /nfs/dbraw/zinc/78/73/69/1075787369.db2.gz CZBGAJPMLSBHBM-UHFFFAOYSA-N -1 3 385.388 -1.266 20 0 GAADHM Cn1cc(C(=O)NCC2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n(C)c1=O ZINC001581760638 1075787366 /nfs/dbraw/zinc/78/73/66/1075787366.db2.gz CZBGAJPMLSBHBM-UHFFFAOYSA-N -1 3 385.388 -1.266 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2COCCN2C(=O)c2ccc(-c3nn[n-]n3)[nH]2)nn1 ZINC001581760654 1075787357 /nfs/dbraw/zinc/78/73/57/1075787357.db2.gz DOSDMJMGPSOGSN-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2COCCN2C(=O)c2ccc(-c3nnn[n-]3)[nH]2)nn1 ZINC001581760654 1075787354 /nfs/dbraw/zinc/78/73/54/1075787354.db2.gz DOSDMJMGPSOGSN-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2COCCN2C(=O)c2ccc(-c3nn[n-]n3)[nH]2)nn1 ZINC001581760655 1075787418 /nfs/dbraw/zinc/78/74/18/1075787418.db2.gz DOSDMJMGPSOGSN-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2COCCN2C(=O)c2ccc(-c3nnn[n-]3)[nH]2)nn1 ZINC001581760655 1075787414 /nfs/dbraw/zinc/78/74/14/1075787414.db2.gz DOSDMJMGPSOGSN-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)CCO2)nn1 ZINC001581760738 1075787305 /nfs/dbraw/zinc/78/73/05/1075787305.db2.gz HHRRZPHSVPGVTA-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)CCO2)nn1 ZINC001581760738 1075787301 /nfs/dbraw/zinc/78/73/01/1075787301.db2.gz HHRRZPHSVPGVTA-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)CCO2)nn1 ZINC001581760739 1075787199 /nfs/dbraw/zinc/78/71/99/1075787199.db2.gz HHRRZPHSVPGVTA-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)CCO2)nn1 ZINC001581760739 1075787193 /nfs/dbraw/zinc/78/71/93/1075787193.db2.gz HHRRZPHSVPGVTA-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NCC2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n(C)c1=O ZINC001581760740 1075787220 /nfs/dbraw/zinc/78/72/20/1075787220.db2.gz HHVQABRWXHNOII-UHFFFAOYSA-N -1 3 385.388 -1.266 20 0 GAADHM Cn1cc(C(=O)NCC2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n(C)c1=O ZINC001581760740 1075787213 /nfs/dbraw/zinc/78/72/13/1075787213.db2.gz HHVQABRWXHNOII-UHFFFAOYSA-N -1 3 385.388 -1.266 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)CCO2)nn1 ZINC001581760796 1075787333 /nfs/dbraw/zinc/78/73/33/1075787333.db2.gz JGAKDFQPAZVBNZ-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)CCO2)nn1 ZINC001581760796 1075787329 /nfs/dbraw/zinc/78/73/29/1075787329.db2.gz JGAKDFQPAZVBNZ-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)CCO2)nn1 ZINC001581760797 1075787241 /nfs/dbraw/zinc/78/72/41/1075787241.db2.gz JGAKDFQPAZVBNZ-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)CCO2)nn1 ZINC001581760797 1075787236 /nfs/dbraw/zinc/78/72/36/1075787236.db2.gz JGAKDFQPAZVBNZ-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2CCN2C(=O)c2cc(-c3nn[n-]n3)c[nH]2)n(C)c1=O ZINC001581760798 1075787277 /nfs/dbraw/zinc/78/72/77/1075787277.db2.gz JGIMOFXSYWLQDA-JTQLQIEISA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2CCN2C(=O)c2cc(-c3nnn[n-]3)c[nH]2)n(C)c1=O ZINC001581760798 1075787273 /nfs/dbraw/zinc/78/72/73/1075787273.db2.gz JGIMOFXSYWLQDA-JTQLQIEISA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2CCN2C(=O)c2cc(-c3nn[n-]n3)c[nH]2)n(C)c1=O ZINC001581760799 1075787389 /nfs/dbraw/zinc/78/73/89/1075787389.db2.gz JGIMOFXSYWLQDA-SNVBAGLBSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2CCN2C(=O)c2cc(-c3nnn[n-]3)c[nH]2)n(C)c1=O ZINC001581760799 1075787386 /nfs/dbraw/zinc/78/73/86/1075787386.db2.gz JGIMOFXSYWLQDA-SNVBAGLBSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2CCN2C(=O)c2c[nH]c(-c3nn[n-]n3)c2)n(C)c1=O ZINC001581760855 1075787321 /nfs/dbraw/zinc/78/73/21/1075787321.db2.gz KXKRSYQSOSEIJX-JTQLQIEISA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2CCN2C(=O)c2c[nH]c(-c3nnn[n-]3)c2)n(C)c1=O ZINC001581760855 1075787315 /nfs/dbraw/zinc/78/73/15/1075787315.db2.gz KXKRSYQSOSEIJX-JTQLQIEISA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2CCN2C(=O)c2c[nH]c(-c3nn[n-]n3)c2)n(C)c1=O ZINC001581760856 1075787428 /nfs/dbraw/zinc/78/74/28/1075787428.db2.gz KXKRSYQSOSEIJX-SNVBAGLBSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2CCN2C(=O)c2c[nH]c(-c3nnn[n-]3)c2)n(C)c1=O ZINC001581760856 1075787425 /nfs/dbraw/zinc/78/74/25/1075787425.db2.gz KXKRSYQSOSEIJX-SNVBAGLBSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2CN(c3ccc(-c4nnn[n-]4)nn3)CCO2)[nH]c1=O ZINC001581760865 1075787845 /nfs/dbraw/zinc/78/78/45/1075787845.db2.gz LDABXOVVHJQBHL-SECBINFHSA-N -1 3 386.376 -1.269 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2CN(c3ccc(-c4nnn[n-]4)nn3)CCO2)[nH]c1=O ZINC001581760866 1075787621 /nfs/dbraw/zinc/78/76/21/1075787621.db2.gz LDABXOVVHJQBHL-VIFPVBQESA-N -1 3 386.376 -1.269 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2COCCN2C(=O)c2cc(-c3nn[n-]n3)c[nH]2)nn1 ZINC001581760916 1075787711 /nfs/dbraw/zinc/78/77/11/1075787711.db2.gz MXVLCGBUBITZAJ-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2COCCN2C(=O)c2cc(-c3nnn[n-]3)c[nH]2)nn1 ZINC001581760916 1075787707 /nfs/dbraw/zinc/78/77/07/1075787707.db2.gz MXVLCGBUBITZAJ-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2COCCN2C(=O)c2cc(-c3nn[n-]n3)c[nH]2)nn1 ZINC001581760917 1075787764 /nfs/dbraw/zinc/78/77/64/1075787764.db2.gz MXVLCGBUBITZAJ-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2COCCN2C(=O)c2cc(-c3nnn[n-]3)c[nH]2)nn1 ZINC001581760917 1075787759 /nfs/dbraw/zinc/78/77/59/1075787759.db2.gz MXVLCGBUBITZAJ-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2COCCN2c2ccc(-c3nnn[n-]3)nn2)[nH]c1=O ZINC001581761059 1075787862 /nfs/dbraw/zinc/78/78/62/1075787862.db2.gz OCFHPWLHGVOXNA-SECBINFHSA-N -1 3 386.376 -1.269 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2COCCN2c2ccc(-c3nnn[n-]3)nn2)[nH]c1=O ZINC001581761060 1075787616 /nfs/dbraw/zinc/78/76/16/1075787616.db2.gz OCFHPWLHGVOXNA-VIFPVBQESA-N -1 3 386.376 -1.269 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2COCCN2c2cncc(-c3nnn[n-]3)n2)[nH]c1=O ZINC001581761090 1075787789 /nfs/dbraw/zinc/78/77/89/1075787789.db2.gz PAASZOPRVJQJSW-SECBINFHSA-N -1 3 386.376 -1.269 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2COCCN2c2cncc(-c3nnn[n-]3)n2)[nH]c1=O ZINC001581761091 1075787627 /nfs/dbraw/zinc/78/76/27/1075787627.db2.gz PAASZOPRVJQJSW-VIFPVBQESA-N -1 3 386.376 -1.269 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2CN(c3cncc(-c4nnn[n-]4)n3)CCO2)[nH]c1=O ZINC001581761494 1075787677 /nfs/dbraw/zinc/78/76/77/1075787677.db2.gz YEORYGSDNKCWAO-SECBINFHSA-N -1 3 386.376 -1.269 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2CN(c3cncc(-c4nnn[n-]4)n3)CCO2)[nH]c1=O ZINC001581761495 1075787634 /nfs/dbraw/zinc/78/76/34/1075787634.db2.gz YEORYGSDNKCWAO-VIFPVBQESA-N -1 3 386.376 -1.269 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2CCN2C(=O)c2ccc(-c3nn[n-]n3)[nH]2)n(C)c1=O ZINC001581761509 1075787833 /nfs/dbraw/zinc/78/78/33/1075787833.db2.gz YMBCWBVPEFTICS-SECBINFHSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)NC[C@H]2CCN2C(=O)c2ccc(-c3nnn[n-]3)[nH]2)n(C)c1=O ZINC001581761509 1075787828 /nfs/dbraw/zinc/78/78/28/1075787828.db2.gz YMBCWBVPEFTICS-SECBINFHSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2CCN2C(=O)c2ccc(-c3nn[n-]n3)[nH]2)n(C)c1=O ZINC001581761510 1075787646 /nfs/dbraw/zinc/78/76/46/1075787646.db2.gz YMBCWBVPEFTICS-VIFPVBQESA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)NC[C@@H]2CCN2C(=O)c2ccc(-c3nnn[n-]3)[nH]2)n(C)c1=O ZINC001581761510 1075787644 /nfs/dbraw/zinc/78/76/44/1075787644.db2.gz YMBCWBVPEFTICS-VIFPVBQESA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)NCCN2CCN(c3ccc(-c4nn[n-]n4)cn3)CC2)nn1 ZINC001581762003 1075787748 /nfs/dbraw/zinc/78/77/48/1075787748.db2.gz BKWSQMPPMBPNDL-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1cc(C(=O)NCCN2CCN(c3ccc(-c4nnn[n-]4)cn3)CC2)nn1 ZINC001581762003 1075787743 /nfs/dbraw/zinc/78/77/43/1075787743.db2.gz BKWSQMPPMBPNDL-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1cc(C(=O)NCCN2CCN(c3cnc(-c4nnn[n-]4)cn3)CC2)cn1 ZINC001581762016 1075787731 /nfs/dbraw/zinc/78/77/31/1075787731.db2.gz CLEZKBWPRKUVFI-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n(C)c1=O ZINC001581762089 1075788158 /nfs/dbraw/zinc/78/81/58/1075788158.db2.gz HQRFSPSKYIXSRL-SNVBAGLBSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n(C)c1=O ZINC001581762089 1075788156 /nfs/dbraw/zinc/78/81/56/1075788156.db2.gz HQRFSPSKYIXSRL-SNVBAGLBSA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)NCCN2CCN(c3ccc(-c4nn[n-]n4)nc3)CC2)nn1 ZINC001581762340 1075788141 /nfs/dbraw/zinc/78/81/41/1075788141.db2.gz UUEVJUPAPBQSCS-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1cc(C(=O)NCCN2CCN(c3ccc(-c4nnn[n-]4)nc3)CC2)nn1 ZINC001581762340 1075788139 /nfs/dbraw/zinc/78/81/39/1075788139.db2.gz UUEVJUPAPBQSCS-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1cc(C(=O)NCCN2CCN(c3ncccc3-c3nn[n-]n3)CC2)nn1 ZINC001581762345 1075788193 /nfs/dbraw/zinc/78/81/93/1075788193.db2.gz VSBJDRFGABGWFQ-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1cc(C(=O)NCCN2CCN(c3ncccc3-c3nnn[n-]3)CC2)nn1 ZINC001581762345 1075788191 /nfs/dbraw/zinc/78/81/91/1075788191.db2.gz VSBJDRFGABGWFQ-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)ncc1=O ZINC001581762378 1075788205 /nfs/dbraw/zinc/78/82/05/1075788205.db2.gz XIJXAJCTIMETMY-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)ncc1=O ZINC001581762378 1075788201 /nfs/dbraw/zinc/78/82/01/1075788201.db2.gz XIJXAJCTIMETMY-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@@H]2O)n(C)c1=O ZINC001581762444 1075788126 /nfs/dbraw/zinc/78/81/26/1075788126.db2.gz ATWFVNYHEVBNBR-PWSUYJOCSA-N -1 3 385.388 -1.722 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@@H]2O)n(C)c1=O ZINC001581762444 1075788124 /nfs/dbraw/zinc/78/81/24/1075788124.db2.gz ATWFVNYHEVBNBR-PWSUYJOCSA-N -1 3 385.388 -1.722 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]2O)n(C)c1=O ZINC001581762445 1075788060 /nfs/dbraw/zinc/78/80/60/1075788060.db2.gz ATWFVNYHEVBNBR-ZYHUDNBSSA-N -1 3 385.388 -1.722 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]2O)n(C)c1=O ZINC001581762445 1075788052 /nfs/dbraw/zinc/78/80/52/1075788052.db2.gz ATWFVNYHEVBNBR-ZYHUDNBSSA-N -1 3 385.388 -1.722 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]2O)[nH]c1=O ZINC001581762451 1075788105 /nfs/dbraw/zinc/78/81/05/1075788105.db2.gz BEYXAOCPXLNGOY-MWLCHTKSSA-N -1 3 389.351 -1.181 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]2O)ccc1=O ZINC001581762474 1075788039 /nfs/dbraw/zinc/78/80/39/1075788039.db2.gz CYGVDPHHUDACID-CHWSQXEVSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@H]2O)ccc1=O ZINC001581762474 1075788034 /nfs/dbraw/zinc/78/80/34/1075788034.db2.gz CYGVDPHHUDACID-CHWSQXEVSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@@H]2O)ccc1=O ZINC001581762475 1075788086 /nfs/dbraw/zinc/78/80/86/1075788086.db2.gz CYGVDPHHUDACID-OLZOCXBDSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@@H]2O)ccc1=O ZINC001581762475 1075788083 /nfs/dbraw/zinc/78/80/83/1075788083.db2.gz CYGVDPHHUDACID-OLZOCXBDSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@@H]2O)ccc1=O ZINC001581762493 1075788152 /nfs/dbraw/zinc/78/81/52/1075788152.db2.gz DVSWNXAIEDGPLN-KGLIPLIRSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@@H]2O)ccc1=O ZINC001581762493 1075788151 /nfs/dbraw/zinc/78/81/51/1075788151.db2.gz DVSWNXAIEDGPLN-KGLIPLIRSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]2O)ccc1=O ZINC001581762494 1075788581 /nfs/dbraw/zinc/78/85/81/1075788581.db2.gz DVSWNXAIEDGPLN-ZIAGYGMSSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]2O)ccc1=O ZINC001581762494 1075788575 /nfs/dbraw/zinc/78/85/75/1075788575.db2.gz DVSWNXAIEDGPLN-ZIAGYGMSSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)ncc1=O ZINC001581762498 1075788517 /nfs/dbraw/zinc/78/85/17/1075788517.db2.gz FDRQUMLITBVZOT-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)ncc1=O ZINC001581762498 1075788512 /nfs/dbraw/zinc/78/85/12/1075788512.db2.gz FDRQUMLITBVZOT-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)ncc1=O ZINC001581762499 1075788500 /nfs/dbraw/zinc/78/85/00/1075788500.db2.gz FDRQUMLITBVZOT-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)ncc1=O ZINC001581762499 1075788496 /nfs/dbraw/zinc/78/84/96/1075788496.db2.gz FDRQUMLITBVZOT-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n(C)c1=O ZINC001581762532 1075788617 /nfs/dbraw/zinc/78/86/17/1075788617.db2.gz HQRFSPSKYIXSRL-JTQLQIEISA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n(C)c1=O ZINC001581762532 1075788613 /nfs/dbraw/zinc/78/86/13/1075788613.db2.gz HQRFSPSKYIXSRL-JTQLQIEISA-N -1 3 385.388 -1.124 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)ncc1=O ZINC001581762662 1075788390 /nfs/dbraw/zinc/78/83/90/1075788390.db2.gz PBHIBPSZDNLXRK-SECBINFHSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)ncc1=O ZINC001581762662 1075788384 /nfs/dbraw/zinc/78/83/84/1075788384.db2.gz PBHIBPSZDNLXRK-SECBINFHSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)ncc1=O ZINC001581762663 1075788562 /nfs/dbraw/zinc/78/85/62/1075788562.db2.gz PBHIBPSZDNLXRK-VIFPVBQESA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)ncc1=O ZINC001581762663 1075788555 /nfs/dbraw/zinc/78/85/55/1075788555.db2.gz PBHIBPSZDNLXRK-VIFPVBQESA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@@H]2O)n(C)c1=O ZINC001581762682 1075788419 /nfs/dbraw/zinc/78/84/19/1075788419.db2.gz QAEZOQUIUNMNLB-YPMHNXCESA-N -1 3 385.388 -1.722 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@@H]2O)n(C)c1=O ZINC001581762682 1075788414 /nfs/dbraw/zinc/78/84/14/1075788414.db2.gz QAEZOQUIUNMNLB-YPMHNXCESA-N -1 3 385.388 -1.722 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]2O)ccc1=O ZINC001581762724 1075788450 /nfs/dbraw/zinc/78/84/50/1075788450.db2.gz RWYYZFBAEWGLJX-CHWSQXEVSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]2O)ccc1=O ZINC001581762724 1075788447 /nfs/dbraw/zinc/78/84/47/1075788447.db2.gz RWYYZFBAEWGLJX-CHWSQXEVSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)ncc1=O ZINC001581762792 1075788864 /nfs/dbraw/zinc/78/88/64/1075788864.db2.gz XIJXAJCTIMETMY-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)ncc1=O ZINC001581762792 1075788860 /nfs/dbraw/zinc/78/88/60/1075788860.db2.gz XIJXAJCTIMETMY-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)ccc1=O ZINC001581762799 1075788779 /nfs/dbraw/zinc/78/87/79/1075788779.db2.gz XXQABYRFAYGPFQ-CHWSQXEVSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)ccc1=O ZINC001581762799 1075788772 /nfs/dbraw/zinc/78/87/72/1075788772.db2.gz XXQABYRFAYGPFQ-CHWSQXEVSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)cn1 ZINC001581763771 1075788939 /nfs/dbraw/zinc/78/89/39/1075788939.db2.gz FWSIYQOMDHNBAE-AAEUAGOBSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)cn1 ZINC001581763771 1075788935 /nfs/dbraw/zinc/78/89/35/1075788935.db2.gz FWSIYQOMDHNBAE-AAEUAGOBSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)cn1 ZINC001581763772 1075788963 /nfs/dbraw/zinc/78/89/63/1075788963.db2.gz FWSIYQOMDHNBAE-DGCLKSJQSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)cn1 ZINC001581763772 1075788960 /nfs/dbraw/zinc/78/89/60/1075788960.db2.gz FWSIYQOMDHNBAE-DGCLKSJQSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)cn1 ZINC001581763773 1075788750 /nfs/dbraw/zinc/78/87/50/1075788750.db2.gz FWSIYQOMDHNBAE-WCQYABFASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)cn1 ZINC001581763773 1075788745 /nfs/dbraw/zinc/78/87/45/1075788745.db2.gz FWSIYQOMDHNBAE-WCQYABFASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)cn1 ZINC001581763774 1075788928 /nfs/dbraw/zinc/78/89/28/1075788928.db2.gz FWSIYQOMDHNBAE-YPMHNXCESA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)cn1 ZINC001581763774 1075788925 /nfs/dbraw/zinc/78/89/25/1075788925.db2.gz FWSIYQOMDHNBAE-YPMHNXCESA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)nn1 ZINC001581763872 1075788895 /nfs/dbraw/zinc/78/88/95/1075788895.db2.gz JMZBZMWJUHOSRO-PELKAZGASA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)nn1 ZINC001581763872 1075788893 /nfs/dbraw/zinc/78/88/93/1075788893.db2.gz JMZBZMWJUHOSRO-PELKAZGASA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)nn1 ZINC001581763873 1075788844 /nfs/dbraw/zinc/78/88/44/1075788844.db2.gz JMZBZMWJUHOSRO-PRHODGIISA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)nn1 ZINC001581763873 1075788838 /nfs/dbraw/zinc/78/88/38/1075788838.db2.gz JMZBZMWJUHOSRO-PRHODGIISA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)nn1 ZINC001581763874 1075788819 /nfs/dbraw/zinc/78/88/19/1075788819.db2.gz JMZBZMWJUHOSRO-QPUJVOFHSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)nn1 ZINC001581763874 1075788812 /nfs/dbraw/zinc/78/88/12/1075788812.db2.gz JMZBZMWJUHOSRO-QPUJVOFHSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)nn1 ZINC001581763875 1075789172 /nfs/dbraw/zinc/78/91/72/1075789172.db2.gz JMZBZMWJUHOSRO-UFBFGSQYSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)nn1 ZINC001581763875 1075789167 /nfs/dbraw/zinc/78/91/67/1075789167.db2.gz JMZBZMWJUHOSRO-UFBFGSQYSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(c3ccc(-c4nnn[n-]4)nn3)C[C@H]2O)[nH]c1=O ZINC001581763918 1075789186 /nfs/dbraw/zinc/78/91/86/1075789186.db2.gz KNQJQXMJMQLUAV-GZMMTYOYSA-N -1 3 386.376 -1.535 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(c3ccc(-c4nnn[n-]4)nn3)C[C@@H]2O)[nH]c1=O ZINC001581763919 1075789251 /nfs/dbraw/zinc/78/92/51/1075789251.db2.gz KNQJQXMJMQLUAV-KCJUWKMLSA-N -1 3 386.376 -1.535 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(c3ccc(-c4nnn[n-]4)nn3)C[C@@H]2O)[nH]c1=O ZINC001581763920 1075789307 /nfs/dbraw/zinc/78/93/07/1075789307.db2.gz KNQJQXMJMQLUAV-KWQFWETISA-N -1 3 386.376 -1.535 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(c3ccc(-c4nnn[n-]4)nn3)C[C@H]2O)[nH]c1=O ZINC001581763921 1075789339 /nfs/dbraw/zinc/78/93/39/1075789339.db2.gz KNQJQXMJMQLUAV-LDYMZIIASA-N -1 3 386.376 -1.535 20 0 GAADHM Cn1cc(C(=O)N[C@H]2C[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n(C)c1=O ZINC001581763954 1075789373 /nfs/dbraw/zinc/78/93/73/1075789373.db2.gz AFBVPJAMBGXNFR-AOOOYVTPSA-N -1 3 385.388 -1.077 20 0 GAADHM Cn1cc(C(=O)N[C@H]2C[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n(C)c1=O ZINC001581763954 1075789370 /nfs/dbraw/zinc/78/93/70/1075789370.db2.gz AFBVPJAMBGXNFR-AOOOYVTPSA-N -1 3 385.388 -1.077 20 0 GAADHM Cn1cc(C(=O)N[C@H]2C[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n(C)c1=O ZINC001581763956 1075789321 /nfs/dbraw/zinc/78/93/21/1075789321.db2.gz AFBVPJAMBGXNFR-MGCOHNPYSA-N -1 3 385.388 -1.077 20 0 GAADHM Cn1cc(C(=O)N[C@H]2C[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n(C)c1=O ZINC001581763956 1075789317 /nfs/dbraw/zinc/78/93/17/1075789317.db2.gz AFBVPJAMBGXNFR-MGCOHNPYSA-N -1 3 385.388 -1.077 20 0 GAADHM Cn1cc(C(=O)N[C@H]2C[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n(C)c1=O ZINC001581764019 1075789260 /nfs/dbraw/zinc/78/92/60/1075789260.db2.gz BVSGYJUDFMKXSA-MGCOHNPYSA-N -1 3 385.388 -1.077 20 0 GAADHM Cn1cc(C(=O)N[C@H]2C[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n(C)c1=O ZINC001581764019 1075789257 /nfs/dbraw/zinc/78/92/57/1075789257.db2.gz BVSGYJUDFMKXSA-MGCOHNPYSA-N -1 3 385.388 -1.077 20 0 GAADHM Cn1cc(C(=O)N[C@H]2C[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n(C)c1=O ZINC001581764088 1075789278 /nfs/dbraw/zinc/78/92/78/1075789278.db2.gz FADSVHMCNKRIBR-KYZUINATSA-N -1 3 385.388 -1.077 20 0 GAADHM Cn1cc(C(=O)N[C@H]2C[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n(C)c1=O ZINC001581764088 1075789275 /nfs/dbraw/zinc/78/92/75/1075789275.db2.gz FADSVHMCNKRIBR-KYZUINATSA-N -1 3 385.388 -1.077 20 0 GAADHM Cn1cc(C(=O)N[C@H]2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)ncc1=O ZINC001581764290 1075789364 /nfs/dbraw/zinc/78/93/64/1075789364.db2.gz LCFDVRNDWUUXOS-AOOOYVTPSA-N -1 3 383.372 -1.021 20 0 GAADHM Cn1cc(C(=O)N[C@H]2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)ncc1=O ZINC001581764290 1075789361 /nfs/dbraw/zinc/78/93/61/1075789361.db2.gz LCFDVRNDWUUXOS-AOOOYVTPSA-N -1 3 383.372 -1.021 20 0 GAADHM Cn1cc(C(=O)N[C@H]2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)ncc1=O ZINC001581764299 1075789235 /nfs/dbraw/zinc/78/92/35/1075789235.db2.gz LFCACIIAOKBQQS-DTORHVGOSA-N -1 3 383.372 -1.021 20 0 GAADHM Cn1cc(C(=O)N[C@H]2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)ncc1=O ZINC001581764299 1075789232 /nfs/dbraw/zinc/78/92/32/1075789232.db2.gz LFCACIIAOKBQQS-DTORHVGOSA-N -1 3 383.372 -1.021 20 0 GAADHM Cn1cc(C(=O)N[C@H]2C[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)ncc1=O ZINC001581764300 1075789296 /nfs/dbraw/zinc/78/92/96/1075789296.db2.gz LFCACIIAOKBQQS-KYZUINATSA-N -1 3 383.372 -1.021 20 0 GAADHM Cn1cc(C(=O)N[C@H]2C[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)ncc1=O ZINC001581764300 1075789291 /nfs/dbraw/zinc/78/92/91/1075789291.db2.gz LFCACIIAOKBQQS-KYZUINATSA-N -1 3 383.372 -1.021 20 0 GAADHM Cn1cc(C(=O)N[C@H]2C[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)ncc1=O ZINC001581764490 1075789225 /nfs/dbraw/zinc/78/92/25/1075789225.db2.gz QCZFWRQWYOJYBT-AOOOYVTPSA-N -1 3 383.372 -1.021 20 0 GAADHM Cn1cc(C(=O)N[C@H]2C[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)ncc1=O ZINC001581764490 1075789223 /nfs/dbraw/zinc/78/92/23/1075789223.db2.gz QCZFWRQWYOJYBT-AOOOYVTPSA-N -1 3 383.372 -1.021 20 0 GAADHM Cn1cc(C(=O)N[C@H]2C[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)ncc1=O ZINC001581764491 1075789352 /nfs/dbraw/zinc/78/93/52/1075789352.db2.gz QCZFWRQWYOJYBT-MGCOHNPYSA-N -1 3 383.372 -1.021 20 0 GAADHM Cn1cc(C(=O)N[C@H]2C[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)ncc1=O ZINC001581764491 1075789346 /nfs/dbraw/zinc/78/93/46/1075789346.db2.gz QCZFWRQWYOJYBT-MGCOHNPYSA-N -1 3 383.372 -1.021 20 0 GAADHM Cn1cc(C(N)=O)cc1C(=O)N1CC(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581764620 1075789725 /nfs/dbraw/zinc/78/97/25/1075789725.db2.gz MDNWEPKOBANASF-UHFFFAOYSA-N -1 3 383.372 -1.113 20 0 GAADHM Cn1cc(C(N)=O)cc1C(=O)N1CC(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581764620 1075789719 /nfs/dbraw/zinc/78/97/19/1075789719.db2.gz MDNWEPKOBANASF-UHFFFAOYSA-N -1 3 383.372 -1.113 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(c3cncc(-c4nnn[n-]4)n3)C[C@H]2O)[nH]c1=O ZINC001581764973 1075789767 /nfs/dbraw/zinc/78/97/67/1075789767.db2.gz ORDDVLFOHVHUCS-GZMMTYOYSA-N -1 3 386.376 -1.535 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(c3cncc(-c4nnn[n-]4)n3)C[C@@H]2O)[nH]c1=O ZINC001581764974 1075789623 /nfs/dbraw/zinc/78/96/23/1075789623.db2.gz ORDDVLFOHVHUCS-KCJUWKMLSA-N -1 3 386.376 -1.535 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(c3cncc(-c4nnn[n-]4)n3)C[C@@H]2O)[nH]c1=O ZINC001581764975 1075789794 /nfs/dbraw/zinc/78/97/94/1075789794.db2.gz ORDDVLFOHVHUCS-KWQFWETISA-N -1 3 386.376 -1.535 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(c3cncc(-c4nnn[n-]4)n3)C[C@H]2O)[nH]c1=O ZINC001581764976 1075789600 /nfs/dbraw/zinc/78/96/00/1075789600.db2.gz ORDDVLFOHVHUCS-LDYMZIIASA-N -1 3 386.376 -1.535 20 0 GAADHM Cn1cc(C(N)=O)cc1C(=O)N1CC(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581765061 1075789654 /nfs/dbraw/zinc/78/96/54/1075789654.db2.gz VUONYVVWURYCBL-UHFFFAOYSA-N -1 3 383.372 -1.113 20 0 GAADHM Cn1cc(C(N)=O)cc1C(=O)N1CC(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581765061 1075789650 /nfs/dbraw/zinc/78/96/50/1075789650.db2.gz VUONYVVWURYCBL-UHFFFAOYSA-N -1 3 383.372 -1.113 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)cn1 ZINC001581765302 1075789578 /nfs/dbraw/zinc/78/95/78/1075789578.db2.gz SSMBILOIDVNPTJ-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)cn1 ZINC001581765302 1075789575 /nfs/dbraw/zinc/78/95/75/1075789575.db2.gz SSMBILOIDVNPTJ-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)cn1 ZINC001581765303 1075789642 /nfs/dbraw/zinc/78/96/42/1075789642.db2.gz SSMBILOIDVNPTJ-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)cn1 ZINC001581765303 1075789640 /nfs/dbraw/zinc/78/96/40/1075789640.db2.gz SSMBILOIDVNPTJ-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)cn1 ZINC001581765304 1075789608 /nfs/dbraw/zinc/78/96/08/1075789608.db2.gz SSMBILOIDVNPTJ-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)cn1 ZINC001581765304 1075789605 /nfs/dbraw/zinc/78/96/05/1075789605.db2.gz SSMBILOIDVNPTJ-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)cn1 ZINC001581765305 1075789614 /nfs/dbraw/zinc/78/96/14/1075789614.db2.gz SSMBILOIDVNPTJ-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)cn1 ZINC001581765305 1075789612 /nfs/dbraw/zinc/78/96/12/1075789612.db2.gz SSMBILOIDVNPTJ-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(c3cnc(-c4nnn[n-]4)cn3)C[C@H]2O)[nH]c1=O ZINC001581765328 1075789703 /nfs/dbraw/zinc/78/97/03/1075789703.db2.gz UOZJKBJHJORJNS-GZMMTYOYSA-N -1 3 386.376 -1.535 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(c3cnc(-c4nnn[n-]4)cn3)C[C@@H]2O)[nH]c1=O ZINC001581765329 1075789686 /nfs/dbraw/zinc/78/96/86/1075789686.db2.gz UOZJKBJHJORJNS-KCJUWKMLSA-N -1 3 386.376 -1.535 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(c3cnc(-c4nnn[n-]4)cn3)C[C@@H]2O)[nH]c1=O ZINC001581765330 1075789745 /nfs/dbraw/zinc/78/97/45/1075789745.db2.gz UOZJKBJHJORJNS-KWQFWETISA-N -1 3 386.376 -1.535 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(c3cnc(-c4nnn[n-]4)cn3)C[C@H]2O)[nH]c1=O ZINC001581765331 1075789592 /nfs/dbraw/zinc/78/95/92/1075789592.db2.gz UOZJKBJHJORJNS-LDYMZIIASA-N -1 3 386.376 -1.535 20 0 GAADHM Cn1cc(CC(=O)NCC2(O)CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)cn1 ZINC001581766211 1075790183 /nfs/dbraw/zinc/79/01/83/1075790183.db2.gz BTYZFZSVOWOWEF-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1cc(CC(=O)NCC2(O)CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)cn1 ZINC001581766211 1075790178 /nfs/dbraw/zinc/79/01/78/1075790178.db2.gz BTYZFZSVOWOWEF-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1cc(CC(=O)NCC2(O)CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)cn1 ZINC001581766241 1075790228 /nfs/dbraw/zinc/79/02/28/1075790228.db2.gz CVFATOCPVAACMC-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1cc(CC(=O)NCC2(O)CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)cn1 ZINC001581766241 1075790225 /nfs/dbraw/zinc/79/02/25/1075790225.db2.gz CVFATOCPVAACMC-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1cc(CC(=O)NCCN(CCO)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)cn1 ZINC001581766296 1075790247 /nfs/dbraw/zinc/79/02/47/1075790247.db2.gz GGRJAHCEBUABEC-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1cc(CC(=O)NCCN(CCO)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)cn1 ZINC001581766296 1075790244 /nfs/dbraw/zinc/79/02/44/1075790244.db2.gz GGRJAHCEBUABEC-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1cc(CC(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)cn1 ZINC001581766558 1075790442 /nfs/dbraw/zinc/79/04/42/1075790442.db2.gz CTCZIAOSWBKXNF-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1cc(CC(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)cn1 ZINC001581766558 1075790437 /nfs/dbraw/zinc/79/04/37/1075790437.db2.gz CTCZIAOSWBKXNF-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1cc(CC(=O)N2CC(O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)cn1 ZINC001581766810 1075790588 /nfs/dbraw/zinc/79/05/88/1075790588.db2.gz HAIIFQSGNRRPEV-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1cc(CC(=O)N2CC(O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)cn1 ZINC001581766810 1075790583 /nfs/dbraw/zinc/79/05/83/1075790583.db2.gz HAIIFQSGNRRPEV-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1cc(CC(=O)N(CCO)CCNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)cn1 ZINC001581766845 1075790408 /nfs/dbraw/zinc/79/04/08/1075790408.db2.gz IQBCXUUNXGAHGS-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1cc(CC(=O)N(CCO)CCNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cn1 ZINC001581766845 1075790404 /nfs/dbraw/zinc/79/04/04/1075790404.db2.gz IQBCXUUNXGAHGS-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1cc(CC(=O)N2CC(O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)cn1 ZINC001581766849 1075790380 /nfs/dbraw/zinc/79/03/80/1075790380.db2.gz IUCGSTRGLMATRY-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1cc(CC(=O)N2CC(O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)cn1 ZINC001581766849 1075790374 /nfs/dbraw/zinc/79/03/74/1075790374.db2.gz IUCGSTRGLMATRY-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1cc(CC(=O)NCCN(CCO)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)cn1 ZINC001581766883 1075790519 /nfs/dbraw/zinc/79/05/19/1075790519.db2.gz RVMITAVHVULZPS-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1cc(CC(=O)NCCN(CCO)C(=O)c2c[nH]c(-c3nnn[n-]3)c2)cn1 ZINC001581766883 1075790514 /nfs/dbraw/zinc/79/05/14/1075790514.db2.gz RVMITAVHVULZPS-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1cc(CC(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)cn1 ZINC001581766926 1075790960 /nfs/dbraw/zinc/79/09/60/1075790960.db2.gz UGTVNOVNFOPGJH-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1cc(CC(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)cn1 ZINC001581766926 1075790956 /nfs/dbraw/zinc/79/09/56/1075790956.db2.gz UGTVNOVNFOPGJH-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1cc(CC(=O)N(CCO)CCNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)cn1 ZINC001581766973 1075790993 /nfs/dbraw/zinc/79/09/93/1075790993.db2.gz KAKDIVGESHFFKB-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1cc(CC(=O)N(CCO)CCNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)cn1 ZINC001581766973 1075790990 /nfs/dbraw/zinc/79/09/90/1075790990.db2.gz KAKDIVGESHFFKB-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1cc(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)cn1 ZINC001581767022 1075790884 /nfs/dbraw/zinc/79/08/84/1075790884.db2.gz LZVFBKHKZMHWQF-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1cc(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)cn1 ZINC001581767022 1075790876 /nfs/dbraw/zinc/79/08/76/1075790876.db2.gz LZVFBKHKZMHWQF-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1cc(CC(=O)NCCN(CCO)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)cn1 ZINC001581767082 1075791023 /nfs/dbraw/zinc/79/10/23/1075791023.db2.gz VYQGSNCXJVNKJE-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1cc(CC(=O)NCCN(CCO)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)cn1 ZINC001581767082 1075791022 /nfs/dbraw/zinc/79/10/22/1075791022.db2.gz VYQGSNCXJVNKJE-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1cc(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)cn1 ZINC001581767198 1075790948 /nfs/dbraw/zinc/79/09/48/1075790948.db2.gz PEXRLFAMWNXODL-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1cc(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)cn1 ZINC001581767198 1075790943 /nfs/dbraw/zinc/79/09/43/1075790943.db2.gz PEXRLFAMWNXODL-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1cc(CC(=O)N2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)cn1 ZINC001581767199 1075790932 /nfs/dbraw/zinc/79/09/32/1075790932.db2.gz PEXRLFAMWNXODL-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1cc(CC(=O)N2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)cn1 ZINC001581767199 1075790931 /nfs/dbraw/zinc/79/09/31/1075790931.db2.gz PEXRLFAMWNXODL-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1cc(CC(=O)N(CCO)CCNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)cn1 ZINC001581767320 1075790980 /nfs/dbraw/zinc/79/09/80/1075790980.db2.gz RWRKTSQAHDPTJB-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1cc(CC(=O)N(CCO)CCNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cn1 ZINC001581767320 1075790976 /nfs/dbraw/zinc/79/09/76/1075790976.db2.gz RWRKTSQAHDPTJB-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1cc(CC(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)cn1 ZINC001581767997 1075791026 /nfs/dbraw/zinc/79/10/26/1075791026.db2.gz ATVJKHOZEBUNLU-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1cc(CC(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)cn1 ZINC001581767997 1075791025 /nfs/dbraw/zinc/79/10/25/1075791025.db2.gz ATVJKHOZEBUNLU-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1cc(CC(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)cn1 ZINC001581768000 1075790922 /nfs/dbraw/zinc/79/09/22/1075790922.db2.gz ATVJKHOZEBUNLU-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1cc(CC(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)cn1 ZINC001581768000 1075790918 /nfs/dbraw/zinc/79/09/18/1075790918.db2.gz ATVJKHOZEBUNLU-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1cc(CC(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)cn1 ZINC001581768416 1075791221 /nfs/dbraw/zinc/79/12/21/1075791221.db2.gz HZTMNQFKHMGSKU-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1cc(CC(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)cn1 ZINC001581768416 1075791218 /nfs/dbraw/zinc/79/12/18/1075791218.db2.gz HZTMNQFKHMGSKU-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1cc(CCC(=O)N[C@@H](CO)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)cn1 ZINC001581768441 1075791254 /nfs/dbraw/zinc/79/12/54/1075791254.db2.gz GTUBXYJOTCZDRU-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)N[C@@H](CO)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cn1 ZINC001581768441 1075791251 /nfs/dbraw/zinc/79/12/51/1075791251.db2.gz GTUBXYJOTCZDRU-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)N[C@H](CO)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)cn1 ZINC001581768443 1075791244 /nfs/dbraw/zinc/79/12/44/1075791244.db2.gz GTUBXYJOTCZDRU-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)N[C@H](CO)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cn1 ZINC001581768443 1075791240 /nfs/dbraw/zinc/79/12/40/1075791240.db2.gz GTUBXYJOTCZDRU-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]2O)nn1 ZINC001581768518 1075791190 /nfs/dbraw/zinc/79/11/90/1075791190.db2.gz ILTXOXVGXZMCOE-CHWSQXEVSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1cc(CCC(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@H]2O)nn1 ZINC001581768518 1075791187 /nfs/dbraw/zinc/79/11/87/1075791187.db2.gz ILTXOXVGXZMCOE-CHWSQXEVSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1cc(CCC(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@@H]2O)nn1 ZINC001581768519 1075791208 /nfs/dbraw/zinc/79/12/08/1075791208.db2.gz ILTXOXVGXZMCOE-OLZOCXBDSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1cc(CCC(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@@H]2O)nn1 ZINC001581768519 1075791202 /nfs/dbraw/zinc/79/12/02/1075791202.db2.gz ILTXOXVGXZMCOE-OLZOCXBDSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1cc(CCC(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@@H]2O)nn1 ZINC001581768664 1075791339 /nfs/dbraw/zinc/79/13/39/1075791339.db2.gz JDMDLTQYJRAVRQ-OLZOCXBDSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1cc(CCC(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@@H]2O)nn1 ZINC001581768664 1075791335 /nfs/dbraw/zinc/79/13/35/1075791335.db2.gz JDMDLTQYJRAVRQ-OLZOCXBDSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1cc(CCC(=O)NC[C@H](CO)NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)cn1 ZINC001581769043 1075791272 /nfs/dbraw/zinc/79/12/72/1075791272.db2.gz PXQJYIRATKAMOF-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)NC[C@H](CO)NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)cn1 ZINC001581769043 1075791269 /nfs/dbraw/zinc/79/12/69/1075791269.db2.gz PXQJYIRATKAMOF-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)NC[C@@H](CO)NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)cn1 ZINC001581769044 1075791357 /nfs/dbraw/zinc/79/13/57/1075791357.db2.gz PXQJYIRATKAMOF-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)NC[C@@H](CO)NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)cn1 ZINC001581769044 1075791354 /nfs/dbraw/zinc/79/13/54/1075791354.db2.gz PXQJYIRATKAMOF-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)N[C@@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)cn1 ZINC001581769049 1075791754 /nfs/dbraw/zinc/79/17/54/1075791754.db2.gz QFYKWJSILQROGX-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)N[C@@H](CO)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cn1 ZINC001581769049 1075791748 /nfs/dbraw/zinc/79/17/48/1075791748.db2.gz QFYKWJSILQROGX-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)N[C@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)cn1 ZINC001581769050 1075791679 /nfs/dbraw/zinc/79/16/79/1075791679.db2.gz QFYKWJSILQROGX-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)N[C@H](CO)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cn1 ZINC001581769050 1075791673 /nfs/dbraw/zinc/79/16/73/1075791673.db2.gz QFYKWJSILQROGX-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)NC[C@@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)cn1 ZINC001581769299 1075791773 /nfs/dbraw/zinc/79/17/73/1075791773.db2.gz VYMCIHULQNUKCB-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)NC[C@@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cn1 ZINC001581769299 1075791768 /nfs/dbraw/zinc/79/17/68/1075791768.db2.gz VYMCIHULQNUKCB-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)NC[C@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)cn1 ZINC001581769300 1075791584 /nfs/dbraw/zinc/79/15/84/1075791584.db2.gz VYMCIHULQNUKCB-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)NC[C@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cn1 ZINC001581769300 1075791581 /nfs/dbraw/zinc/79/15/81/1075791581.db2.gz VYMCIHULQNUKCB-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)NC[C@H](CO)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)cn1 ZINC001581769316 1075791667 /nfs/dbraw/zinc/79/16/67/1075791667.db2.gz WMDWXBRJBWJKJV-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)NC[C@H](CO)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cn1 ZINC001581769316 1075791665 /nfs/dbraw/zinc/79/16/65/1075791665.db2.gz WMDWXBRJBWJKJV-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)NC[C@@H](CO)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)cn1 ZINC001581769317 1075791728 /nfs/dbraw/zinc/79/17/28/1075791728.db2.gz WMDWXBRJBWJKJV-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)NC[C@@H](CO)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cn1 ZINC001581769317 1075791722 /nfs/dbraw/zinc/79/17/22/1075791722.db2.gz WMDWXBRJBWJKJV-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1cc(CCC(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@@H]2O)nn1 ZINC001581769360 1075791615 /nfs/dbraw/zinc/79/16/15/1075791615.db2.gz YJZHTSJABDDLDH-KGLIPLIRSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1cc(CCC(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@@H]2O)nn1 ZINC001581769360 1075791613 /nfs/dbraw/zinc/79/16/13/1075791613.db2.gz YJZHTSJABDDLDH-KGLIPLIRSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1cc(CCC(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]2O)nn1 ZINC001581769361 1075791602 /nfs/dbraw/zinc/79/16/02/1075791602.db2.gz YJZHTSJABDDLDH-ZIAGYGMSSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1cc(CCC(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]2O)nn1 ZINC001581769361 1075791600 /nfs/dbraw/zinc/79/16/00/1075791600.db2.gz YJZHTSJABDDLDH-ZIAGYGMSSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1cc(CCC(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)cn1 ZINC001581769473 1075791649 /nfs/dbraw/zinc/79/16/49/1075791649.db2.gz WXIYRSSHCGVVLY-ZIAGYGMSSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1cc(CCC(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)cn1 ZINC001581769473 1075791646 /nfs/dbraw/zinc/79/16/46/1075791646.db2.gz WXIYRSSHCGVVLY-ZIAGYGMSSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1cc(CC(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)cn1 ZINC001581769532 1075791693 /nfs/dbraw/zinc/79/16/93/1075791693.db2.gz YUMWWGDPKAHAAS-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1cc(CC(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)cn1 ZINC001581769532 1075791688 /nfs/dbraw/zinc/79/16/88/1075791688.db2.gz YUMWWGDPKAHAAS-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1cc(CNC(=O)CNC(=O)c2ccc(-c3nn[n-]n3)cc2)c(=O)[nH]c1=O ZINC001581772357 1075792131 /nfs/dbraw/zinc/79/21/31/1075792131.db2.gz CGMDZBKEPIMDMA-UHFFFAOYSA-N -1 3 384.356 -1.288 20 0 GAADHM Cn1cc(CNC(=O)CNC(=O)c2ccc(-c3nnn[n-]3)cc2)c(=O)[nH]c1=O ZINC001581772357 1075792124 /nfs/dbraw/zinc/79/21/24/1075792124.db2.gz CGMDZBKEPIMDMA-UHFFFAOYSA-N -1 3 384.356 -1.288 20 0 GAADHM Cn1cc(CN2CCN(CCNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)nn1 ZINC001581772876 1075792046 /nfs/dbraw/zinc/79/20/46/1075792046.db2.gz KXRJGASQTQKWOR-UHFFFAOYSA-N -1 3 385.436 -1.129 20 0 GAADHM Cn1cc(CN2CCN(CCNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)nn1 ZINC001581772876 1075792040 /nfs/dbraw/zinc/79/20/40/1075792040.db2.gz KXRJGASQTQKWOR-UHFFFAOYSA-N -1 3 385.436 -1.129 20 0 GAADHM Cn1cc(CN2CCN(CCNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2)nn1 ZINC001581772897 1075791966 /nfs/dbraw/zinc/79/19/66/1075791966.db2.gz LNTWHALFIWUQKX-UHFFFAOYSA-N -1 3 385.436 -1.129 20 0 GAADHM Cn1cc(CN2CCN(CCNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2)nn1 ZINC001581772897 1075791963 /nfs/dbraw/zinc/79/19/63/1075791963.db2.gz LNTWHALFIWUQKX-UHFFFAOYSA-N -1 3 385.436 -1.129 20 0 GAADHM Cn1cc(CN2CCN(CCNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)CC2)nn1 ZINC001581772943 1075792014 /nfs/dbraw/zinc/79/20/14/1075792014.db2.gz MRJABDRGKCSLLI-UHFFFAOYSA-N -1 3 385.436 -1.129 20 0 GAADHM Cn1cc(CN2CCN(CCNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)CC2)nn1 ZINC001581772943 1075792006 /nfs/dbraw/zinc/79/20/06/1075792006.db2.gz MRJABDRGKCSLLI-UHFFFAOYSA-N -1 3 385.436 -1.129 20 0 GAADHM Cn1cc(S(=O)(=O)NCC(=O)NCc2cncc(-c3nn[n-]n3)c2)cn1 ZINC001581774676 1075792221 /nfs/dbraw/zinc/79/22/21/1075792221.db2.gz HKIWNMWTUFQMMZ-UHFFFAOYSA-N -1 3 377.390 -1.410 20 0 GAADHM Cn1cc(S(=O)(=O)NCC(=O)NCc2cncc(-c3nnn[n-]3)c2)cn1 ZINC001581774676 1075792217 /nfs/dbraw/zinc/79/22/17/1075792217.db2.gz HKIWNMWTUFQMMZ-UHFFFAOYSA-N -1 3 377.390 -1.410 20 0 GAADHM Cn1ccc(=O)c(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)c1 ZINC001581776473 1075792550 /nfs/dbraw/zinc/79/25/50/1075792550.db2.gz GVGPWLGQDYNEFQ-OCCSQVGLSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(=O)c(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)c1 ZINC001581776473 1075792547 /nfs/dbraw/zinc/79/25/47/1075792547.db2.gz GVGPWLGQDYNEFQ-OCCSQVGLSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(=O)c(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)c1 ZINC001581776755 1075792453 /nfs/dbraw/zinc/79/24/53/1075792453.db2.gz UWDAXMIIONQHJG-OCCSQVGLSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(=O)c(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)c1 ZINC001581776755 1075792447 /nfs/dbraw/zinc/79/24/47/1075792447.db2.gz UWDAXMIIONQHJG-OCCSQVGLSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(=O)c(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@@H]2O)c1 ZINC001581776943 1075792561 /nfs/dbraw/zinc/79/25/61/1075792561.db2.gz CXCUUCZQOCPKLX-OCCSQVGLSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(=O)c(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@@H]2O)c1 ZINC001581776943 1075792556 /nfs/dbraw/zinc/79/25/56/1075792556.db2.gz CXCUUCZQOCPKLX-OCCSQVGLSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(C(=O)N2CC(CCO)(NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581777058 1075792385 /nfs/dbraw/zinc/79/23/85/1075792385.db2.gz JXYIJTBGCYVIGR-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)N2CC(CCO)(NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581777058 1075792380 /nfs/dbraw/zinc/79/23/80/1075792380.db2.gz JXYIJTBGCYVIGR-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)N2CC(CCO)(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581777080 1075792529 /nfs/dbraw/zinc/79/25/29/1075792529.db2.gz KYCFRPUAIKOSDD-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)N2CC(CCO)(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581777080 1075792526 /nfs/dbraw/zinc/79/25/26/1075792526.db2.gz KYCFRPUAIKOSDD-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(=O)c(C(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@@H]2O)c1 ZINC001581777112 1075792539 /nfs/dbraw/zinc/79/25/39/1075792539.db2.gz LZPBLXDABUAPDK-OCCSQVGLSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(=O)c(C(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@@H]2O)c1 ZINC001581777112 1075792537 /nfs/dbraw/zinc/79/25/37/1075792537.db2.gz LZPBLXDABUAPDK-OCCSQVGLSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(=O)c(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@@H]2O)c1 ZINC001581777293 1075792786 /nfs/dbraw/zinc/79/27/86/1075792786.db2.gz VEESEYKZYQJWJQ-HIFRSBDPSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(=O)c(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@@H]2O)c1 ZINC001581777293 1075792779 /nfs/dbraw/zinc/79/27/79/1075792779.db2.gz VEESEYKZYQJWJQ-HIFRSBDPSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(=O)c(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]2O)c1 ZINC001581777295 1075792881 /nfs/dbraw/zinc/79/28/81/1075792881.db2.gz VEESEYKZYQJWJQ-UKRRQHHQSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(=O)c(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]2O)c1 ZINC001581777295 1075792879 /nfs/dbraw/zinc/79/28/79/1075792879.db2.gz VEESEYKZYQJWJQ-UKRRQHHQSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(=O)c(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)c1 ZINC001581777544 1075792916 /nfs/dbraw/zinc/79/29/16/1075792916.db2.gz XMDTYVUEJDXWSD-OCCSQVGLSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(=O)c(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)c1 ZINC001581777544 1075792911 /nfs/dbraw/zinc/79/29/11/1075792911.db2.gz XMDTYVUEJDXWSD-OCCSQVGLSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)n1 ZINC001581777936 1075792868 /nfs/dbraw/zinc/79/28/68/1075792868.db2.gz IVMHGFGVJKVXAY-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)n1 ZINC001581777936 1075792866 /nfs/dbraw/zinc/79/28/66/1075792866.db2.gz IVMHGFGVJKVXAY-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@H](O)C2)n1 ZINC001581777938 1075792893 /nfs/dbraw/zinc/79/28/93/1075792893.db2.gz IVMHGFGVJKVXAY-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@H](O)C2)n1 ZINC001581777938 1075792892 /nfs/dbraw/zinc/79/28/92/1075792892.db2.gz IVMHGFGVJKVXAY-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)n1 ZINC001581777940 1075792903 /nfs/dbraw/zinc/79/29/03/1075792903.db2.gz IVMHGFGVJKVXAY-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)n1 ZINC001581777940 1075792901 /nfs/dbraw/zinc/79/29/01/1075792901.db2.gz IVMHGFGVJKVXAY-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@H](O)C2)n1 ZINC001581777942 1075792861 /nfs/dbraw/zinc/79/28/61/1075792861.db2.gz IVMHGFGVJKVXAY-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@H](O)C2)n1 ZINC001581777942 1075792859 /nfs/dbraw/zinc/79/28/59/1075792859.db2.gz IVMHGFGVJKVXAY-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@H](O)C2)n1 ZINC001581777979 1075792888 /nfs/dbraw/zinc/79/28/88/1075792888.db2.gz KTSOHDNWCUFHHA-NOZJJQNGSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@H](O)C2)n1 ZINC001581777979 1075792887 /nfs/dbraw/zinc/79/28/87/1075792887.db2.gz KTSOHDNWCUFHHA-NOZJJQNGSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)n1 ZINC001581777980 1075792833 /nfs/dbraw/zinc/79/28/33/1075792833.db2.gz KTSOHDNWCUFHHA-RNCFNFMXSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)n1 ZINC001581777980 1075792829 /nfs/dbraw/zinc/79/28/29/1075792829.db2.gz KTSOHDNWCUFHHA-RNCFNFMXSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@H](O)C2)n1 ZINC001581777981 1075792801 /nfs/dbraw/zinc/79/28/01/1075792801.db2.gz KTSOHDNWCUFHHA-TVQRCGJNSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@H](O)C2)n1 ZINC001581777981 1075792796 /nfs/dbraw/zinc/79/27/96/1075792796.db2.gz KTSOHDNWCUFHHA-TVQRCGJNSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)n1 ZINC001581777982 1075792854 /nfs/dbraw/zinc/79/28/54/1075792854.db2.gz KTSOHDNWCUFHHA-ZANVPECISA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)n1 ZINC001581777982 1075792852 /nfs/dbraw/zinc/79/28/52/1075792852.db2.gz KTSOHDNWCUFHHA-ZANVPECISA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)n1 ZINC001581778127 1075792814 /nfs/dbraw/zinc/79/28/14/1075792814.db2.gz LMGRAASQIQYUNX-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)n1 ZINC001581778127 1075792810 /nfs/dbraw/zinc/79/28/10/1075792810.db2.gz LMGRAASQIQYUNX-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@H](O)C2)n1 ZINC001581778128 1075792934 /nfs/dbraw/zinc/79/29/34/1075792934.db2.gz LMGRAASQIQYUNX-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@H](O)C2)n1 ZINC001581778128 1075792929 /nfs/dbraw/zinc/79/29/29/1075792929.db2.gz LMGRAASQIQYUNX-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)n1 ZINC001581778129 1075793172 /nfs/dbraw/zinc/79/31/72/1075793172.db2.gz LMGRAASQIQYUNX-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)n1 ZINC001581778129 1075793169 /nfs/dbraw/zinc/79/31/69/1075793169.db2.gz LMGRAASQIQYUNX-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@H](O)C2)n1 ZINC001581778130 1075793255 /nfs/dbraw/zinc/79/32/55/1075793255.db2.gz LMGRAASQIQYUNX-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@H](O)C2)n1 ZINC001581778130 1075793249 /nfs/dbraw/zinc/79/32/49/1075793249.db2.gz LMGRAASQIQYUNX-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@](O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581778469 1075793239 /nfs/dbraw/zinc/79/32/39/1075793239.db2.gz PWKPRPSWRNAXFT-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@](O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581778469 1075793234 /nfs/dbraw/zinc/79/32/34/1075793234.db2.gz PWKPRPSWRNAXFT-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@@](O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581778470 1075793380 /nfs/dbraw/zinc/79/33/80/1075793380.db2.gz PWKPRPSWRNAXFT-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@@](O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581778470 1075793377 /nfs/dbraw/zinc/79/33/77/1075793377.db2.gz PWKPRPSWRNAXFT-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@](O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581779113 1075793135 /nfs/dbraw/zinc/79/31/35/1075793135.db2.gz XSVVGQMHNOKAPJ-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@](O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581779113 1075793131 /nfs/dbraw/zinc/79/31/31/1075793131.db2.gz XSVVGQMHNOKAPJ-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@@](O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581779114 1075793369 /nfs/dbraw/zinc/79/33/69/1075793369.db2.gz XSVVGQMHNOKAPJ-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)N2CC[C@@](O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581779114 1075793363 /nfs/dbraw/zinc/79/33/63/1075793363.db2.gz XSVVGQMHNOKAPJ-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)NC2(CCO)CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581780733 1075793354 /nfs/dbraw/zinc/79/33/54/1075793354.db2.gz OJVJMRKTYLTTDS-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)NC2(CCO)CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581780733 1075793348 /nfs/dbraw/zinc/79/33/48/1075793348.db2.gz OJVJMRKTYLTTDS-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)n1 ZINC001581780896 1075793291 /nfs/dbraw/zinc/79/32/91/1075793291.db2.gz LCMJCSDRJPSULJ-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)n1 ZINC001581780896 1075793288 /nfs/dbraw/zinc/79/32/88/1075793288.db2.gz LCMJCSDRJPSULJ-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)n1 ZINC001581780897 1075793313 /nfs/dbraw/zinc/79/33/13/1075793313.db2.gz LCMJCSDRJPSULJ-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)n1 ZINC001581780897 1075793307 /nfs/dbraw/zinc/79/33/07/1075793307.db2.gz LCMJCSDRJPSULJ-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)n1 ZINC001581780898 1075793303 /nfs/dbraw/zinc/79/33/03/1075793303.db2.gz LCMJCSDRJPSULJ-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)n1 ZINC001581780898 1075793299 /nfs/dbraw/zinc/79/32/99/1075793299.db2.gz LCMJCSDRJPSULJ-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)n1 ZINC001581780999 1075793267 /nfs/dbraw/zinc/79/32/67/1075793267.db2.gz LCMJCSDRJPSULJ-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)n1 ZINC001581780999 1075793264 /nfs/dbraw/zinc/79/32/64/1075793264.db2.gz LCMJCSDRJPSULJ-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)NC2(CCO)CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581781059 1075793326 /nfs/dbraw/zinc/79/33/26/1075793326.db2.gz SDMLEAUBQHPCGZ-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)NC2(CCO)CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581781059 1075793322 /nfs/dbraw/zinc/79/33/22/1075793322.db2.gz SDMLEAUBQHPCGZ-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)n1 ZINC001581781795 1075793221 /nfs/dbraw/zinc/79/32/21/1075793221.db2.gz RYGRHOSGUNTSCO-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)n1 ZINC001581781795 1075793216 /nfs/dbraw/zinc/79/32/16/1075793216.db2.gz RYGRHOSGUNTSCO-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)n1 ZINC001581781796 1075793150 /nfs/dbraw/zinc/79/31/50/1075793150.db2.gz RYGRHOSGUNTSCO-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)n1 ZINC001581781796 1075793145 /nfs/dbraw/zinc/79/31/45/1075793145.db2.gz RYGRHOSGUNTSCO-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)n1 ZINC001581781797 1075793204 /nfs/dbraw/zinc/79/32/04/1075793204.db2.gz RYGRHOSGUNTSCO-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)n1 ZINC001581781797 1075793200 /nfs/dbraw/zinc/79/32/00/1075793200.db2.gz RYGRHOSGUNTSCO-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)n1 ZINC001581781798 1075793187 /nfs/dbraw/zinc/79/31/87/1075793187.db2.gz RYGRHOSGUNTSCO-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)n1 ZINC001581781798 1075793183 /nfs/dbraw/zinc/79/31/83/1075793183.db2.gz RYGRHOSGUNTSCO-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)n1 ZINC001581782403 1075793338 /nfs/dbraw/zinc/79/33/38/1075793338.db2.gz YKGDFOYNQICQKA-NOZJJQNGSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)n1 ZINC001581782403 1075793335 /nfs/dbraw/zinc/79/33/35/1075793335.db2.gz YKGDFOYNQICQKA-NOZJJQNGSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)n1 ZINC001581782405 1075793161 /nfs/dbraw/zinc/79/31/61/1075793161.db2.gz YKGDFOYNQICQKA-RNCFNFMXSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)n1 ZINC001581782405 1075793157 /nfs/dbraw/zinc/79/31/57/1075793157.db2.gz YKGDFOYNQICQKA-RNCFNFMXSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)n1 ZINC001581782407 1075793123 /nfs/dbraw/zinc/79/31/23/1075793123.db2.gz YKGDFOYNQICQKA-TVQRCGJNSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)n1 ZINC001581782407 1075793118 /nfs/dbraw/zinc/79/31/18/1075793118.db2.gz YKGDFOYNQICQKA-TVQRCGJNSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)n1 ZINC001581782408 1075793280 /nfs/dbraw/zinc/79/32/80/1075793280.db2.gz YKGDFOYNQICQKA-ZANVPECISA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)n1 ZINC001581782408 1075793276 /nfs/dbraw/zinc/79/32/76/1075793276.db2.gz YKGDFOYNQICQKA-ZANVPECISA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1ccc(C(=O)NC[C@@]2(O)CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581784206 1075793591 /nfs/dbraw/zinc/79/35/91/1075793591.db2.gz KOPZWDUFTWBKLT-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)NC[C@@]2(O)CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581784206 1075793588 /nfs/dbraw/zinc/79/35/88/1075793588.db2.gz KOPZWDUFTWBKLT-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)NC[C@]2(O)CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581784207 1075793689 /nfs/dbraw/zinc/79/36/89/1075793689.db2.gz KOPZWDUFTWBKLT-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)NC[C@]2(O)CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581784207 1075793684 /nfs/dbraw/zinc/79/36/84/1075793684.db2.gz KOPZWDUFTWBKLT-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)NC[C@@]2(O)CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581784310 1075793559 /nfs/dbraw/zinc/79/35/59/1075793559.db2.gz OLYPKYNDQPNITE-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)NC[C@@]2(O)CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581784310 1075793555 /nfs/dbraw/zinc/79/35/55/1075793555.db2.gz OLYPKYNDQPNITE-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)NC[C@]2(O)CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581784311 1075793662 /nfs/dbraw/zinc/79/36/62/1075793662.db2.gz OLYPKYNDQPNITE-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)NC[C@]2(O)CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581784311 1075793658 /nfs/dbraw/zinc/79/36/58/1075793658.db2.gz OLYPKYNDQPNITE-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)NC[C@@]2(O)CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581784736 1075793540 /nfs/dbraw/zinc/79/35/40/1075793540.db2.gz ZZUAOHBPSGHGJG-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)NC[C@@]2(O)CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581784736 1075793538 /nfs/dbraw/zinc/79/35/38/1075793538.db2.gz ZZUAOHBPSGHGJG-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)NC[C@]2(O)CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581784738 1075793583 /nfs/dbraw/zinc/79/35/83/1075793583.db2.gz ZZUAOHBPSGHGJG-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)NC[C@]2(O)CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581784738 1075793582 /nfs/dbraw/zinc/79/35/82/1075793582.db2.gz ZZUAOHBPSGHGJG-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]2O)cc1=O ZINC001581786802 1075793531 /nfs/dbraw/zinc/79/35/31/1075793531.db2.gz PYCGOAMNGDXPED-CHWSQXEVSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]2O)cc1=O ZINC001581786802 1075793528 /nfs/dbraw/zinc/79/35/28/1075793528.db2.gz PYCGOAMNGDXPED-CHWSQXEVSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@@H]2O)cc1=O ZINC001581786813 1075793650 /nfs/dbraw/zinc/79/36/50/1075793650.db2.gz QLCYLTBJRVHTRH-KGLIPLIRSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@@H]2O)cc1=O ZINC001581786813 1075793646 /nfs/dbraw/zinc/79/36/46/1075793646.db2.gz QLCYLTBJRVHTRH-KGLIPLIRSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]2O)cc1=O ZINC001581786814 1075793614 /nfs/dbraw/zinc/79/36/14/1075793614.db2.gz QLCYLTBJRVHTRH-ZIAGYGMSSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]2O)cc1=O ZINC001581786814 1075793610 /nfs/dbraw/zinc/79/36/10/1075793610.db2.gz QLCYLTBJRVHTRH-ZIAGYGMSSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]2O)cc1=O ZINC001581786887 1075793705 /nfs/dbraw/zinc/79/37/05/1075793705.db2.gz VZAQSEAWMIFBBZ-CHWSQXEVSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@H]2O)cc1=O ZINC001581786887 1075793701 /nfs/dbraw/zinc/79/37/01/1075793701.db2.gz VZAQSEAWMIFBBZ-CHWSQXEVSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@@H]2O)cc1=O ZINC001581786888 1075794116 /nfs/dbraw/zinc/79/41/16/1075794116.db2.gz VZAQSEAWMIFBBZ-OLZOCXBDSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@@H]2O)cc1=O ZINC001581786888 1075794114 /nfs/dbraw/zinc/79/41/14/1075794114.db2.gz VZAQSEAWMIFBBZ-OLZOCXBDSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)cc1=O ZINC001581786925 1075793967 /nfs/dbraw/zinc/79/39/67/1075793967.db2.gz XUFMKDFZWCNFNS-CHWSQXEVSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)cc1=O ZINC001581786925 1075793963 /nfs/dbraw/zinc/79/39/63/1075793963.db2.gz XUFMKDFZWCNFNS-CHWSQXEVSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(CC(=O)N2CC(O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581786996 1075793980 /nfs/dbraw/zinc/79/39/80/1075793980.db2.gz CIZZAADFMIBUNV-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1ccc(CC(=O)N2CC(O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581786996 1075793975 /nfs/dbraw/zinc/79/39/75/1075793975.db2.gz CIZZAADFMIBUNV-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1ccc(CC(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581787106 1075793902 /nfs/dbraw/zinc/79/39/02/1075793902.db2.gz ILTLSZFYKGGSQP-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1ccc(CC(=O)N2CC(O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581787106 1075793900 /nfs/dbraw/zinc/79/39/00/1075793900.db2.gz ILTLSZFYKGGSQP-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1ccc(CC(=O)N(CCO)CCNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581787200 1075794071 /nfs/dbraw/zinc/79/40/71/1075794071.db2.gz NFBTZRCTLOOEEV-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1ccc(CC(=O)N(CCO)CCNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581787200 1075794068 /nfs/dbraw/zinc/79/40/68/1075794068.db2.gz NFBTZRCTLOOEEV-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1ccc(CC(=O)N(CCO)CCNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581787236 1075794085 /nfs/dbraw/zinc/79/40/85/1075794085.db2.gz OPSQHQPIAYECEC-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1ccc(CC(=O)N(CCO)CCNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581787236 1075794079 /nfs/dbraw/zinc/79/40/79/1075794079.db2.gz OPSQHQPIAYECEC-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1ccc(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581787270 1075794107 /nfs/dbraw/zinc/79/41/07/1075794107.db2.gz PWBZVFNTIJWRJZ-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581787270 1075794103 /nfs/dbraw/zinc/79/41/03/1075794103.db2.gz PWBZVFNTIJWRJZ-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)n1 ZINC001581787271 1075793910 /nfs/dbraw/zinc/79/39/10/1075793910.db2.gz PWBZVFNTIJWRJZ-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)n1 ZINC001581787271 1075793907 /nfs/dbraw/zinc/79/39/07/1075793907.db2.gz PWBZVFNTIJWRJZ-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)N(CCO)CCNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581787304 1075793896 /nfs/dbraw/zinc/79/38/96/1075793896.db2.gz RGPSEMDPZGSGFQ-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1ccc(CC(=O)N(CCO)CCNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581787304 1075793894 /nfs/dbraw/zinc/79/38/94/1075793894.db2.gz RGPSEMDPZGSGFQ-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1ccc(CC(=O)N2CC(O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581787317 1075794136 /nfs/dbraw/zinc/79/41/36/1075794136.db2.gz RPVVRXVPWZLWHQ-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1ccc(CC(=O)N2CC(O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581787317 1075794133 /nfs/dbraw/zinc/79/41/33/1075794133.db2.gz RPVVRXVPWZLWHQ-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1ccc(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581787358 1075793955 /nfs/dbraw/zinc/79/39/55/1075793955.db2.gz UFCUASRERIKAGD-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581787358 1075793949 /nfs/dbraw/zinc/79/39/49/1075793949.db2.gz UFCUASRERIKAGD-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)N2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)n1 ZINC001581787359 1075794010 /nfs/dbraw/zinc/79/40/10/1075794010.db2.gz UFCUASRERIKAGD-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)N2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)n1 ZINC001581787359 1075794005 /nfs/dbraw/zinc/79/40/05/1075794005.db2.gz UFCUASRERIKAGD-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)n1 ZINC001581787412 1075794027 /nfs/dbraw/zinc/79/40/27/1075794027.db2.gz WNHCTKIEQZJKNT-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)n1 ZINC001581787412 1075794021 /nfs/dbraw/zinc/79/40/21/1075794021.db2.gz WNHCTKIEQZJKNT-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)n1 ZINC001581787597 1075794095 /nfs/dbraw/zinc/79/40/95/1075794095.db2.gz DIUXLUUVXXDKIJ-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)n1 ZINC001581787597 1075794092 /nfs/dbraw/zinc/79/40/92/1075794092.db2.gz DIUXLUUVXXDKIJ-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)n1 ZINC001581787598 1075794128 /nfs/dbraw/zinc/79/41/28/1075794128.db2.gz DIUXLUUVXXDKIJ-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)n1 ZINC001581787598 1075794124 /nfs/dbraw/zinc/79/41/24/1075794124.db2.gz DIUXLUUVXXDKIJ-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)n1 ZINC001581787809 1075794395 /nfs/dbraw/zinc/79/43/95/1075794395.db2.gz HPHJGGAGJWQDBP-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)n1 ZINC001581787809 1075794388 /nfs/dbraw/zinc/79/43/88/1075794388.db2.gz HPHJGGAGJWQDBP-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581787977 1075794449 /nfs/dbraw/zinc/79/44/49/1075794449.db2.gz JYSIAVLULUBKJZ-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1ccc(CC(=O)NCC2(O)CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581787977 1075794447 /nfs/dbraw/zinc/79/44/47/1075794447.db2.gz JYSIAVLULUBKJZ-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1ccc(CC(=O)NCCN(CCO)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581788140 1075794378 /nfs/dbraw/zinc/79/43/78/1075794378.db2.gz LEPFGHZHEGRSFO-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1ccc(CC(=O)NCCN(CCO)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581788140 1075794370 /nfs/dbraw/zinc/79/43/70/1075794370.db2.gz LEPFGHZHEGRSFO-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1ccc(CC(=O)NCC2(O)CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581788644 1075794616 /nfs/dbraw/zinc/79/46/16/1075794616.db2.gz SNAQEVSCEJLKRA-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1ccc(CC(=O)NCC2(O)CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581788644 1075794611 /nfs/dbraw/zinc/79/46/11/1075794611.db2.gz SNAQEVSCEJLKRA-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1ccc(CC(=O)NCCN(CCO)C(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581788917 1075794724 /nfs/dbraw/zinc/79/47/24/1075794724.db2.gz VTVQXOOVRJCBOJ-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1ccc(CC(=O)NCCN(CCO)C(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581788917 1075794722 /nfs/dbraw/zinc/79/47/22/1075794722.db2.gz VTVQXOOVRJCBOJ-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1ccc(CC(=O)NCCN(CCO)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581788947 1075794772 /nfs/dbraw/zinc/79/47/72/1075794772.db2.gz WQZVWKMRUXJQLP-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1ccc(CC(=O)NCCN(CCO)C(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581788947 1075794768 /nfs/dbraw/zinc/79/47/68/1075794768.db2.gz WQZVWKMRUXJQLP-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1ccc(CC(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)n1 ZINC001581789005 1075795052 /nfs/dbraw/zinc/79/50/52/1075795052.db2.gz YXAASNFQOWEQKT-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)n1 ZINC001581789005 1075795048 /nfs/dbraw/zinc/79/50/48/1075795048.db2.gz YXAASNFQOWEQKT-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CCC(=O)N[C@@H](CO)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581789609 1075795077 /nfs/dbraw/zinc/79/50/77/1075795077.db2.gz AJVPYVIZMRTVLP-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)N[C@@H](CO)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581789609 1075795074 /nfs/dbraw/zinc/79/50/74/1075795074.db2.gz AJVPYVIZMRTVLP-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)N[C@H](CO)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581789610 1075795026 /nfs/dbraw/zinc/79/50/26/1075795026.db2.gz AJVPYVIZMRTVLP-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)N[C@H](CO)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581789610 1075795023 /nfs/dbraw/zinc/79/50/23/1075795023.db2.gz AJVPYVIZMRTVLP-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)N[C@@H](CO)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581789670 1075795160 /nfs/dbraw/zinc/79/51/60/1075795160.db2.gz CTQZXWANNLQDQR-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)N[C@@H](CO)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581789670 1075795155 /nfs/dbraw/zinc/79/51/55/1075795155.db2.gz CTQZXWANNLQDQR-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)N[C@H](CO)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581789671 1075795247 /nfs/dbraw/zinc/79/52/47/1075795247.db2.gz CTQZXWANNLQDQR-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)N[C@H](CO)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581789671 1075795240 /nfs/dbraw/zinc/79/52/40/1075795240.db2.gz CTQZXWANNLQDQR-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@@H](O)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581789675 1075795008 /nfs/dbraw/zinc/79/50/08/1075795008.db2.gz CYDVQTHKPZTILF-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@@H](O)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581789675 1075795005 /nfs/dbraw/zinc/79/50/05/1075795005.db2.gz CYDVQTHKPZTILF-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@H](O)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581789676 1075795143 /nfs/dbraw/zinc/79/51/43/1075795143.db2.gz CYDVQTHKPZTILF-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@H](O)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581789676 1075795136 /nfs/dbraw/zinc/79/51/36/1075795136.db2.gz CYDVQTHKPZTILF-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@H](CO)NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581789711 1075795001 /nfs/dbraw/zinc/79/50/01/1075795001.db2.gz FMCHZKDQMNQDKX-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@H](CO)NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581789711 1075794999 /nfs/dbraw/zinc/79/49/99/1075794999.db2.gz FMCHZKDQMNQDKX-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@@H](CO)NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581789712 1075795110 /nfs/dbraw/zinc/79/51/10/1075795110.db2.gz FMCHZKDQMNQDKX-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@@H](CO)NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581789712 1075795105 /nfs/dbraw/zinc/79/51/05/1075795105.db2.gz FMCHZKDQMNQDKX-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)n1 ZINC001581789738 1075794993 /nfs/dbraw/zinc/79/49/93/1075794993.db2.gz GLUPNLBLFXCYIL-ZIAGYGMSSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccc(CCC(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)n1 ZINC001581789738 1075794988 /nfs/dbraw/zinc/79/49/88/1075794988.db2.gz GLUPNLBLFXCYIL-ZIAGYGMSSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@H](CO)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581789779 1075795230 /nfs/dbraw/zinc/79/52/30/1075795230.db2.gz HUOTTWJOSYZBJP-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@H](CO)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581789779 1075795223 /nfs/dbraw/zinc/79/52/23/1075795223.db2.gz HUOTTWJOSYZBJP-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@@H](CO)NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581789780 1075795039 /nfs/dbraw/zinc/79/50/39/1075795039.db2.gz HUOTTWJOSYZBJP-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@@H](CO)NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581789780 1075795035 /nfs/dbraw/zinc/79/50/35/1075795035.db2.gz HUOTTWJOSYZBJP-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)n1 ZINC001581789875 1075795213 /nfs/dbraw/zinc/79/52/13/1075795213.db2.gz LWFVGYFOFQBQTM-ZIAGYGMSSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccc(CCC(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)n1 ZINC001581789875 1075795207 /nfs/dbraw/zinc/79/52/07/1075795207.db2.gz LWFVGYFOFQBQTM-ZIAGYGMSSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581789907 1075795065 /nfs/dbraw/zinc/79/50/65/1075795065.db2.gz NRJFLMBEYACSNL-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581789907 1075795061 /nfs/dbraw/zinc/79/50/61/1075795061.db2.gz NRJFLMBEYACSNL-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@H](O)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581789908 1075794983 /nfs/dbraw/zinc/79/49/83/1075794983.db2.gz NRJFLMBEYACSNL-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@H](O)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581789908 1075794979 /nfs/dbraw/zinc/79/49/79/1075794979.db2.gz NRJFLMBEYACSNL-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@@H](O)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581789926 1075795095 /nfs/dbraw/zinc/79/50/95/1075795095.db2.gz ORNSZNNIENLIID-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@@H](O)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581789926 1075795088 /nfs/dbraw/zinc/79/50/88/1075795088.db2.gz ORNSZNNIENLIID-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@H](O)CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581789927 1075795179 /nfs/dbraw/zinc/79/51/79/1075795179.db2.gz ORNSZNNIENLIID-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@H](O)CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581789927 1075795174 /nfs/dbraw/zinc/79/51/74/1075795174.db2.gz ORNSZNNIENLIID-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@H](CO)NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581790071 1075795618 /nfs/dbraw/zinc/79/56/18/1075795618.db2.gz WLKNDARFIUZYEY-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@H](CO)NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581790071 1075795613 /nfs/dbraw/zinc/79/56/13/1075795613.db2.gz WLKNDARFIUZYEY-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@@H](CO)NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581790072 1075795462 /nfs/dbraw/zinc/79/54/62/1075795462.db2.gz WLKNDARFIUZYEY-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)NC[C@@H](CO)NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581790072 1075795457 /nfs/dbraw/zinc/79/54/57/1075795457.db2.gz WLKNDARFIUZYEY-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)N[C@@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581790125 1075795604 /nfs/dbraw/zinc/79/56/04/1075795604.db2.gz YTNYWNMSOZNPRQ-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)N[C@@H](CO)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581790125 1075795603 /nfs/dbraw/zinc/79/56/03/1075795603.db2.gz YTNYWNMSOZNPRQ-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)N[C@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581790126 1075795449 /nfs/dbraw/zinc/79/54/49/1075795449.db2.gz YTNYWNMSOZNPRQ-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CCC(=O)N[C@H](CO)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581790126 1075795443 /nfs/dbraw/zinc/79/54/43/1075795443.db2.gz YTNYWNMSOZNPRQ-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccc(CN2CC(O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)cc1=O ZINC001581790229 1075795395 /nfs/dbraw/zinc/79/53/95/1075795395.db2.gz CIWLKFLPPXCCLD-UHFFFAOYSA-N -1 3 384.400 -1.130 20 0 GAADHM Cn1ccc(CN2CC(O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)cc1=O ZINC001581790229 1075795390 /nfs/dbraw/zinc/79/53/90/1075795390.db2.gz CIWLKFLPPXCCLD-UHFFFAOYSA-N -1 3 384.400 -1.130 20 0 GAADHM Cn1ccc(CN2CC(O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)cc1=O ZINC001581790421 1075795515 /nfs/dbraw/zinc/79/55/15/1075795515.db2.gz JSRRBLRVKONYFO-UHFFFAOYSA-N -1 3 384.400 -1.130 20 0 GAADHM Cn1ccc(CN2CC(O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)cc1=O ZINC001581790421 1075795511 /nfs/dbraw/zinc/79/55/11/1075795511.db2.gz JSRRBLRVKONYFO-UHFFFAOYSA-N -1 3 384.400 -1.130 20 0 GAADHM Cn1ccc(CN2CC(O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)cc1=O ZINC001581790823 1075795420 /nfs/dbraw/zinc/79/54/20/1075795420.db2.gz YULYTIRCJGZXNY-UHFFFAOYSA-N -1 3 384.400 -1.130 20 0 GAADHM Cn1ccc(CN2CC(O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)cc1=O ZINC001581790823 1075795416 /nfs/dbraw/zinc/79/54/16/1075795416.db2.gz YULYTIRCJGZXNY-UHFFFAOYSA-N -1 3 384.400 -1.130 20 0 GAADHM Cn1ccc(NC(=O)CNS(=O)(=O)c2cccc(-c3nn[n-]n3)c2)nc1=O ZINC001581791107 1075795504 /nfs/dbraw/zinc/79/55/04/1075795504.db2.gz BPADYUVBIMDJKH-UHFFFAOYSA-N -1 3 390.385 -1.288 20 0 GAADHM Cn1ccc(NC(=O)CNS(=O)(=O)c2cccc(-c3nnn[n-]3)c2)nc1=O ZINC001581791107 1075795501 /nfs/dbraw/zinc/79/55/01/1075795501.db2.gz BPADYUVBIMDJKH-UHFFFAOYSA-N -1 3 390.385 -1.288 20 0 GAADHM Cn1cccc(C(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@@H]2O)c1=O ZINC001581793127 1075795988 /nfs/dbraw/zinc/79/59/88/1075795988.db2.gz BZUBXIXHZKLSTL-OLZOCXBDSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cccc(C(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@@H]2O)c1=O ZINC001581793127 1075795981 /nfs/dbraw/zinc/79/59/81/1075795981.db2.gz BZUBXIXHZKLSTL-OLZOCXBDSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cccc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@@H]2O)c1=O ZINC001581793164 1075795967 /nfs/dbraw/zinc/79/59/67/1075795967.db2.gz DIUXSXJBNVTTKZ-KGLIPLIRSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cccc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@@H]2O)c1=O ZINC001581793164 1075795960 /nfs/dbraw/zinc/79/59/60/1075795960.db2.gz DIUXSXJBNVTTKZ-KGLIPLIRSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cccc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]2O)c1=O ZINC001581793165 1075795848 /nfs/dbraw/zinc/79/58/48/1075795848.db2.gz DIUXSXJBNVTTKZ-ZIAGYGMSSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cccc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]2O)c1=O ZINC001581793165 1075795845 /nfs/dbraw/zinc/79/58/45/1075795845.db2.gz DIUXSXJBNVTTKZ-ZIAGYGMSSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cccc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]2O)c1=O ZINC001581793559 1075795771 /nfs/dbraw/zinc/79/57/71/1075795771.db2.gz MWIPKCVTBYJPNI-CHWSQXEVSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cccc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@H]2O)c1=O ZINC001581793559 1075795768 /nfs/dbraw/zinc/79/57/68/1075795768.db2.gz MWIPKCVTBYJPNI-CHWSQXEVSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cccc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@@H]2O)c1=O ZINC001581793560 1075795879 /nfs/dbraw/zinc/79/58/79/1075795879.db2.gz MWIPKCVTBYJPNI-OLZOCXBDSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cccc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@@H]2O)c1=O ZINC001581793560 1075795874 /nfs/dbraw/zinc/79/58/74/1075795874.db2.gz MWIPKCVTBYJPNI-OLZOCXBDSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccnc1CCC(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581797351 1075795838 /nfs/dbraw/zinc/79/58/38/1075795838.db2.gz AAGZQICQOOMOPN-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581797351 1075795833 /nfs/dbraw/zinc/79/58/33/1075795833.db2.gz AAGZQICQOOMOPN-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581797352 1075796309 /nfs/dbraw/zinc/79/63/09/1075796309.db2.gz AAGZQICQOOMOPN-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581797352 1075796306 /nfs/dbraw/zinc/79/63/06/1075796306.db2.gz AAGZQICQOOMOPN-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581797430 1075796147 /nfs/dbraw/zinc/79/61/47/1075796147.db2.gz CCXLEPBFYQAAKY-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581797430 1075796141 /nfs/dbraw/zinc/79/61/41/1075796141.db2.gz CCXLEPBFYQAAKY-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581797431 1075796349 /nfs/dbraw/zinc/79/63/49/1075796349.db2.gz CCXLEPBFYQAAKY-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581797431 1075796341 /nfs/dbraw/zinc/79/63/41/1075796341.db2.gz CCXLEPBFYQAAKY-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@@H](CO)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581797500 1075796166 /nfs/dbraw/zinc/79/61/66/1075796166.db2.gz FHMQJHAOZDTXSM-JTQLQIEISA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@@H](CO)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581797500 1075796161 /nfs/dbraw/zinc/79/61/61/1075796161.db2.gz FHMQJHAOZDTXSM-JTQLQIEISA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@H](CO)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581797501 1075796255 /nfs/dbraw/zinc/79/62/55/1075796255.db2.gz FHMQJHAOZDTXSM-SNVBAGLBSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@H](CO)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581797501 1075796251 /nfs/dbraw/zinc/79/62/51/1075796251.db2.gz FHMQJHAOZDTXSM-SNVBAGLBSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581797562 1075796237 /nfs/dbraw/zinc/79/62/37/1075796237.db2.gz HNKJAOLCADOUAL-CHWSQXEVSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccnc1CCC(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581797562 1075796234 /nfs/dbraw/zinc/79/62/34/1075796234.db2.gz HNKJAOLCADOUAL-CHWSQXEVSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581797564 1075796446 /nfs/dbraw/zinc/79/64/46/1075796446.db2.gz HQJMVSVKQUCDFQ-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581797564 1075796442 /nfs/dbraw/zinc/79/64/42/1075796442.db2.gz HQJMVSVKQUCDFQ-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581797565 1075796188 /nfs/dbraw/zinc/79/61/88/1075796188.db2.gz HQJMVSVKQUCDFQ-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581797565 1075796184 /nfs/dbraw/zinc/79/61/84/1075796184.db2.gz HQJMVSVKQUCDFQ-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581797569 1075796407 /nfs/dbraw/zinc/79/64/07/1075796407.db2.gz HUYAEOXNHPCUAZ-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581797569 1075796403 /nfs/dbraw/zinc/79/64/03/1075796403.db2.gz HUYAEOXNHPCUAZ-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581797570 1075796206 /nfs/dbraw/zinc/79/62/06/1075796206.db2.gz HUYAEOXNHPCUAZ-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581797570 1075796203 /nfs/dbraw/zinc/79/62/03/1075796203.db2.gz HUYAEOXNHPCUAZ-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)N[C@H](CO)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581797694 1075796395 /nfs/dbraw/zinc/79/63/95/1075796395.db2.gz LWDUQWGBYPFNRF-JTQLQIEISA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)N[C@H](CO)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581797694 1075796393 /nfs/dbraw/zinc/79/63/93/1075796393.db2.gz LWDUQWGBYPFNRF-JTQLQIEISA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)N[C@@H](CO)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581797695 1075796270 /nfs/dbraw/zinc/79/62/70/1075796270.db2.gz LWDUQWGBYPFNRF-SNVBAGLBSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)N[C@@H](CO)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581797695 1075796267 /nfs/dbraw/zinc/79/62/67/1075796267.db2.gz LWDUQWGBYPFNRF-SNVBAGLBSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581797920 1075796281 /nfs/dbraw/zinc/79/62/81/1075796281.db2.gz SKBBBSIPJZGLJJ-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581797920 1075796278 /nfs/dbraw/zinc/79/62/78/1075796278.db2.gz SKBBBSIPJZGLJJ-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)N[C@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581797921 1075796328 /nfs/dbraw/zinc/79/63/28/1075796328.db2.gz SKBBBSIPJZGLJJ-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)N[C@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581797921 1075796324 /nfs/dbraw/zinc/79/63/24/1075796324.db2.gz SKBBBSIPJZGLJJ-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581797987 1075796370 /nfs/dbraw/zinc/79/63/70/1075796370.db2.gz VOXXLNJRJLAJGB-JTQLQIEISA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581797987 1075796366 /nfs/dbraw/zinc/79/63/66/1075796366.db2.gz VOXXLNJRJLAJGB-JTQLQIEISA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581797988 1075796431 /nfs/dbraw/zinc/79/64/31/1075796431.db2.gz VOXXLNJRJLAJGB-SNVBAGLBSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)NC[C@@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581797988 1075796427 /nfs/dbraw/zinc/79/64/27/1075796427.db2.gz VOXXLNJRJLAJGB-SNVBAGLBSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1ccnc1CCC(=O)N[C@@H]1CN(c2cnc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001581799823 1075796642 /nfs/dbraw/zinc/79/66/42/1075796642.db2.gz ULLMOMJOQMCZJF-NEPJUHHUSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1ccnc1CCC(=O)N[C@@H]1CN(c2cnc(-c3nnn[n-]3)cn2)C[C@H]1O ZINC001581799824 1075796816 /nfs/dbraw/zinc/79/68/16/1075796816.db2.gz ULLMOMJOQMCZJF-VXGBXAGGSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1cnc(C(=O)N2CC(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)cc1=O ZINC001581799973 1075796707 /nfs/dbraw/zinc/79/67/07/1075796707.db2.gz CEAPTLJVKFCECB-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1cnc(C(=O)N2CC(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)cc1=O ZINC001581799973 1075796701 /nfs/dbraw/zinc/79/67/01/1075796701.db2.gz CEAPTLJVKFCECB-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1cnc(C(=O)N2CC(CCO)(NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)c1 ZINC001581799997 1075796833 /nfs/dbraw/zinc/79/68/33/1075796833.db2.gz DIYANLFLBGBYOP-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)N2CC(CCO)(NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)c1 ZINC001581799997 1075796828 /nfs/dbraw/zinc/79/68/28/1075796828.db2.gz DIYANLFLBGBYOP-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)N2CC(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)cc1=O ZINC001581800065 1075796733 /nfs/dbraw/zinc/79/67/33/1075796733.db2.gz FZMZCJVOFVZROS-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1cnc(C(=O)N2CC(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)cc1=O ZINC001581800065 1075796731 /nfs/dbraw/zinc/79/67/31/1075796731.db2.gz FZMZCJVOFVZROS-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1cnc(C(=O)N2CC(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)cc1=O ZINC001581800110 1075797197 /nfs/dbraw/zinc/79/71/97/1075797197.db2.gz HSCULBPYFYMNEQ-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1cnc(C(=O)N2CC(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)cc1=O ZINC001581800110 1075797195 /nfs/dbraw/zinc/79/71/95/1075797195.db2.gz HSCULBPYFYMNEQ-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1cnc(C(=O)N(CCO)CCNc2ncccc2-c2nn[n-]n2)cc1=O ZINC001581800111 1075797207 /nfs/dbraw/zinc/79/72/07/1075797207.db2.gz HTQHABCNTSAMAM-UHFFFAOYSA-N -1 3 385.388 -1.098 20 0 GAADHM Cn1cnc(C(=O)N(CCO)CCNc2ncccc2-c2nnn[n-]2)cc1=O ZINC001581800111 1075797206 /nfs/dbraw/zinc/79/72/06/1075797206.db2.gz HTQHABCNTSAMAM-UHFFFAOYSA-N -1 3 385.388 -1.098 20 0 GAADHM Cn1cnc(C(=O)N(CCO)CCNc2ccc(-c3nn[n-]n3)cn2)cc1=O ZINC001581800113 1075797055 /nfs/dbraw/zinc/79/70/55/1075797055.db2.gz HWSPZPITELPESN-UHFFFAOYSA-N -1 3 385.388 -1.098 20 0 GAADHM Cn1cnc(C(=O)N(CCO)CCNc2ccc(-c3nnn[n-]3)cn2)cc1=O ZINC001581800113 1075797049 /nfs/dbraw/zinc/79/70/49/1075797049.db2.gz HWSPZPITELPESN-UHFFFAOYSA-N -1 3 385.388 -1.098 20 0 GAADHM Cn1ccnc1COCC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O ZINC001581800263 1075797147 /nfs/dbraw/zinc/79/71/47/1075797147.db2.gz MWUGCHVNAGLFEW-ZIAGYGMSSA-N -1 3 399.415 -1.122 20 0 GAADHM Cn1ccnc1COCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O ZINC001581800263 1075797142 /nfs/dbraw/zinc/79/71/42/1075797142.db2.gz MWUGCHVNAGLFEW-ZIAGYGMSSA-N -1 3 399.415 -1.122 20 0 GAADHM Cn1cnc(C(=O)N2CC(CCO)(NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)c1 ZINC001581800483 1075797571 /nfs/dbraw/zinc/79/75/71/1075797571.db2.gz UALZSNRTMVOXSZ-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)N2CC(CCO)(NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)c1 ZINC001581800483 1075797564 /nfs/dbraw/zinc/79/75/64/1075797564.db2.gz UALZSNRTMVOXSZ-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)N2CC(CCO)(NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581800517 1075797482 /nfs/dbraw/zinc/79/74/82/1075797482.db2.gz VASSCUXLNNCSFQ-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)N2CC(CCO)(NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581800517 1075797478 /nfs/dbraw/zinc/79/74/78/1075797478.db2.gz VASSCUXLNNCSFQ-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)N2CC(CCO)(NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581800619 1075797505 /nfs/dbraw/zinc/79/75/05/1075797505.db2.gz XCTSXUNHFYHNPI-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)N2CC(CCO)(NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581800619 1075797500 /nfs/dbraw/zinc/79/75/00/1075797500.db2.gz XCTSXUNHFYHNPI-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)N2CC(CCO)(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581800622 1075797389 /nfs/dbraw/zinc/79/73/89/1075797389.db2.gz XETPDQCMFIALJD-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)N2CC(CCO)(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581800622 1075797386 /nfs/dbraw/zinc/79/73/86/1075797386.db2.gz XETPDQCMFIALJD-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)N2CC(CCO)(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)c1 ZINC001581800665 1075797555 /nfs/dbraw/zinc/79/75/55/1075797555.db2.gz ZKWUTSDTXWJNMM-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)N2CC(CCO)(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)c1 ZINC001581800665 1075797550 /nfs/dbraw/zinc/79/75/50/1075797550.db2.gz ZKWUTSDTXWJNMM-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@](O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581800782 1075797494 /nfs/dbraw/zinc/79/74/94/1075797494.db2.gz DBOKGLIWFXCSFC-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@](O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581800782 1075797489 /nfs/dbraw/zinc/79/74/89/1075797489.db2.gz DBOKGLIWFXCSFC-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@](O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581800783 1075797441 /nfs/dbraw/zinc/79/74/41/1075797441.db2.gz DBOKGLIWFXCSFC-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@](O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581800783 1075797436 /nfs/dbraw/zinc/79/74/36/1075797436.db2.gz DBOKGLIWFXCSFC-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@](O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)c1 ZINC001581800784 1075797345 /nfs/dbraw/zinc/79/73/45/1075797345.db2.gz DDHBMOSXWIROTN-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@](O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)c1 ZINC001581800784 1075797342 /nfs/dbraw/zinc/79/73/42/1075797342.db2.gz DDHBMOSXWIROTN-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@](O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)c1 ZINC001581800785 1075797454 /nfs/dbraw/zinc/79/74/54/1075797454.db2.gz DDHBMOSXWIROTN-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@](O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)c1 ZINC001581800785 1075797450 /nfs/dbraw/zinc/79/74/50/1075797450.db2.gz DDHBMOSXWIROTN-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@](O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)c1 ZINC001581800979 1075797889 /nfs/dbraw/zinc/79/78/89/1075797889.db2.gz JPKILGCDTFXMNR-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@](O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)c1 ZINC001581800979 1075797885 /nfs/dbraw/zinc/79/78/85/1075797885.db2.gz JPKILGCDTFXMNR-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@](O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)c1 ZINC001581800980 1075797861 /nfs/dbraw/zinc/79/78/61/1075797861.db2.gz JPKILGCDTFXMNR-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@](O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)c1 ZINC001581800980 1075797854 /nfs/dbraw/zinc/79/78/54/1075797854.db2.gz JPKILGCDTFXMNR-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)c1 ZINC001581800983 1075797827 /nfs/dbraw/zinc/79/78/27/1075797827.db2.gz JTTWLYJHGZXBDH-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)c1 ZINC001581800983 1075797824 /nfs/dbraw/zinc/79/78/24/1075797824.db2.gz JTTWLYJHGZXBDH-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@H](O)C2)c1 ZINC001581800984 1075797815 /nfs/dbraw/zinc/79/78/15/1075797815.db2.gz JTTWLYJHGZXBDH-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@H](O)C2)c1 ZINC001581800984 1075797812 /nfs/dbraw/zinc/79/78/12/1075797812.db2.gz JTTWLYJHGZXBDH-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)c1 ZINC001581800985 1075797922 /nfs/dbraw/zinc/79/79/22/1075797922.db2.gz JTTWLYJHGZXBDH-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)c1 ZINC001581800985 1075797918 /nfs/dbraw/zinc/79/79/18/1075797918.db2.gz JTTWLYJHGZXBDH-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@H](O)C2)c1 ZINC001581800986 1075797873 /nfs/dbraw/zinc/79/78/73/1075797873.db2.gz JTTWLYJHGZXBDH-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@H](O)C2)c1 ZINC001581800986 1075797869 /nfs/dbraw/zinc/79/78/69/1075797869.db2.gz JTTWLYJHGZXBDH-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)cc1=O ZINC001581801033 1075797788 /nfs/dbraw/zinc/79/77/88/1075797788.db2.gz LJEQQLJIXMEEKV-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)cc1=O ZINC001581801033 1075797784 /nfs/dbraw/zinc/79/77/84/1075797784.db2.gz LJEQQLJIXMEEKV-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)cc1=O ZINC001581801034 1075797750 /nfs/dbraw/zinc/79/77/50/1075797750.db2.gz LJEQQLJIXMEEKV-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)cc1=O ZINC001581801034 1075797748 /nfs/dbraw/zinc/79/77/48/1075797748.db2.gz LJEQQLJIXMEEKV-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@H](O)C2)n1 ZINC001581801081 1075797947 /nfs/dbraw/zinc/79/79/47/1075797947.db2.gz MVSYQKHNARJGHN-GXSJLCMTSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@H](O)C2)n1 ZINC001581801081 1075797942 /nfs/dbraw/zinc/79/79/42/1075797942.db2.gz MVSYQKHNARJGHN-GXSJLCMTSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)n1 ZINC001581801082 1075797935 /nfs/dbraw/zinc/79/79/35/1075797935.db2.gz MVSYQKHNARJGHN-KOLCDFICSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)n1 ZINC001581801082 1075797930 /nfs/dbraw/zinc/79/79/30/1075797930.db2.gz MVSYQKHNARJGHN-KOLCDFICSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@H](O)C2)n1 ZINC001581801083 1075797802 /nfs/dbraw/zinc/79/78/02/1075797802.db2.gz MVSYQKHNARJGHN-MWLCHTKSSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@H](O)C2)n1 ZINC001581801083 1075797799 /nfs/dbraw/zinc/79/77/99/1075797799.db2.gz MVSYQKHNARJGHN-MWLCHTKSSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)n1 ZINC001581801084 1075798238 /nfs/dbraw/zinc/79/82/38/1075798238.db2.gz MVSYQKHNARJGHN-ONGXEEELSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)n1 ZINC001581801084 1075798237 /nfs/dbraw/zinc/79/82/37/1075798237.db2.gz MVSYQKHNARJGHN-ONGXEEELSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H]2CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)cc1=O ZINC001581801112 1075798226 /nfs/dbraw/zinc/79/82/26/1075798226.db2.gz NJTJZGUSDIWAKK-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H]2CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cc1=O ZINC001581801112 1075798224 /nfs/dbraw/zinc/79/82/24/1075798224.db2.gz NJTJZGUSDIWAKK-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H]2CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)cc1=O ZINC001581801113 1075798243 /nfs/dbraw/zinc/79/82/43/1075798243.db2.gz NJTJZGUSDIWAKK-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H]2CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cc1=O ZINC001581801113 1075798242 /nfs/dbraw/zinc/79/82/42/1075798242.db2.gz NJTJZGUSDIWAKK-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)cc1=O ZINC001581801127 1075798272 /nfs/dbraw/zinc/79/82/72/1075798272.db2.gz NWLSFBKBYPMFAI-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)cc1=O ZINC001581801127 1075798270 /nfs/dbraw/zinc/79/82/70/1075798270.db2.gz NWLSFBKBYPMFAI-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)cc1=O ZINC001581801128 1075798219 /nfs/dbraw/zinc/79/82/19/1075798219.db2.gz NWLSFBKBYPMFAI-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)cc1=O ZINC001581801128 1075798217 /nfs/dbraw/zinc/79/82/17/1075798217.db2.gz NWLSFBKBYPMFAI-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@H](O)C2)c1 ZINC001581801188 1075798299 /nfs/dbraw/zinc/79/82/99/1075798299.db2.gz PDVGWMORLGKUBN-NOZJJQNGSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@H](O)C2)c1 ZINC001581801188 1075798296 /nfs/dbraw/zinc/79/82/96/1075798296.db2.gz PDVGWMORLGKUBN-NOZJJQNGSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)c1 ZINC001581801189 1075798233 /nfs/dbraw/zinc/79/82/33/1075798233.db2.gz PDVGWMORLGKUBN-RNCFNFMXSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)c1 ZINC001581801189 1075798231 /nfs/dbraw/zinc/79/82/31/1075798231.db2.gz PDVGWMORLGKUBN-RNCFNFMXSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@H](O)C2)c1 ZINC001581801190 1075798262 /nfs/dbraw/zinc/79/82/62/1075798262.db2.gz PDVGWMORLGKUBN-TVQRCGJNSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@H](O)C2)c1 ZINC001581801190 1075798261 /nfs/dbraw/zinc/79/82/61/1075798261.db2.gz PDVGWMORLGKUBN-TVQRCGJNSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)c1 ZINC001581801191 1075798267 /nfs/dbraw/zinc/79/82/67/1075798267.db2.gz PDVGWMORLGKUBN-ZANVPECISA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)c1 ZINC001581801191 1075798265 /nfs/dbraw/zinc/79/82/65/1075798265.db2.gz PDVGWMORLGKUBN-ZANVPECISA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H]2CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)cc1=O ZINC001581801254 1075798248 /nfs/dbraw/zinc/79/82/48/1075798248.db2.gz QUZGYQLHYXJACV-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H]2CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)cc1=O ZINC001581801254 1075798246 /nfs/dbraw/zinc/79/82/46/1075798246.db2.gz QUZGYQLHYXJACV-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H]2CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)cc1=O ZINC001581801255 1075798257 /nfs/dbraw/zinc/79/82/57/1075798257.db2.gz QUZGYQLHYXJACV-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H]2CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)cc1=O ZINC001581801255 1075798256 /nfs/dbraw/zinc/79/82/56/1075798256.db2.gz QUZGYQLHYXJACV-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@](O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)c1 ZINC001581801302 1075798207 /nfs/dbraw/zinc/79/82/07/1075798207.db2.gz SYZYCUCRGWWTOC-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@](O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)c1 ZINC001581801302 1075798205 /nfs/dbraw/zinc/79/82/05/1075798205.db2.gz SYZYCUCRGWWTOC-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@](O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)c1 ZINC001581801303 1075798202 /nfs/dbraw/zinc/79/82/02/1075798202.db2.gz SYZYCUCRGWWTOC-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@](O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)c1 ZINC001581801303 1075798200 /nfs/dbraw/zinc/79/82/00/1075798200.db2.gz SYZYCUCRGWWTOC-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)cc1=O ZINC001581801314 1075798292 /nfs/dbraw/zinc/79/82/92/1075798292.db2.gz UGQKIQQHOHYHBQ-SECBINFHSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)cc1=O ZINC001581801314 1075798290 /nfs/dbraw/zinc/79/82/90/1075798290.db2.gz UGQKIQQHOHYHBQ-SECBINFHSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H]2CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)cc1=O ZINC001581801340 1075798196 /nfs/dbraw/zinc/79/81/96/1075798196.db2.gz UZXFMRQLNYMCON-SECBINFHSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@H]2CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cc1=O ZINC001581801340 1075798193 /nfs/dbraw/zinc/79/81/93/1075798193.db2.gz UZXFMRQLNYMCON-SECBINFHSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H]2CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)cc1=O ZINC001581801341 1075798277 /nfs/dbraw/zinc/79/82/77/1075798277.db2.gz UZXFMRQLNYMCON-VIFPVBQESA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@H]2CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cc1=O ZINC001581801341 1075798275 /nfs/dbraw/zinc/79/82/75/1075798275.db2.gz UZXFMRQLNYMCON-VIFPVBQESA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@](O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581801362 1075798529 /nfs/dbraw/zinc/79/85/29/1075798529.db2.gz VYTYUBQQTIMXPX-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@](O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581801362 1075798527 /nfs/dbraw/zinc/79/85/27/1075798527.db2.gz VYTYUBQQTIMXPX-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@](O)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581801363 1075798674 /nfs/dbraw/zinc/79/86/74/1075798674.db2.gz VYTYUBQQTIMXPX-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@](O)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581801363 1075798668 /nfs/dbraw/zinc/79/86/68/1075798668.db2.gz VYTYUBQQTIMXPX-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@](O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581801453 1075798661 /nfs/dbraw/zinc/79/86/61/1075798661.db2.gz YUOQVZDMGUQCCQ-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@](O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581801453 1075798657 /nfs/dbraw/zinc/79/86/57/1075798657.db2.gz YUOQVZDMGUQCCQ-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@](O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581801454 1075798502 /nfs/dbraw/zinc/79/85/02/1075798502.db2.gz YUOQVZDMGUQCCQ-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)N2CC[C@@](O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581801454 1075798499 /nfs/dbraw/zinc/79/84/99/1075798499.db2.gz YUOQVZDMGUQCCQ-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)NC2(CCO)CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)c1 ZINC001581802834 1075798625 /nfs/dbraw/zinc/79/86/25/1075798625.db2.gz AOFJXDVGYIJRKM-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)NC2(CCO)CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)c1 ZINC001581802834 1075798620 /nfs/dbraw/zinc/79/86/20/1075798620.db2.gz AOFJXDVGYIJRKM-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)N2CCO[C@@H](CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581803217 1075798840 /nfs/dbraw/zinc/79/88/40/1075798840.db2.gz AQDSOABMDCTZDS-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCO[C@@H](CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581803217 1075798837 /nfs/dbraw/zinc/79/88/37/1075798837.db2.gz AQDSOABMDCTZDS-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCO[C@H](CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581803219 1075798854 /nfs/dbraw/zinc/79/88/54/1075798854.db2.gz AQDSOABMDCTZDS-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCO[C@H](CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581803219 1075798851 /nfs/dbraw/zinc/79/88/51/1075798851.db2.gz AQDSOABMDCTZDS-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCO[C@@H](CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581803235 1075798828 /nfs/dbraw/zinc/79/88/28/1075798828.db2.gz BKEJJOJDNKYKHX-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCO[C@@H](CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581803235 1075798826 /nfs/dbraw/zinc/79/88/26/1075798826.db2.gz BKEJJOJDNKYKHX-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCO[C@H](CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581803236 1075798928 /nfs/dbraw/zinc/79/89/28/1075798928.db2.gz BKEJJOJDNKYKHX-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCO[C@H](CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581803236 1075798922 /nfs/dbraw/zinc/79/89/22/1075798922.db2.gz BKEJJOJDNKYKHX-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)cc1=O ZINC001581803243 1075798869 /nfs/dbraw/zinc/79/88/69/1075798869.db2.gz BZGNVJMJTMDDLT-UHFFFAOYSA-N -1 3 383.372 -1.113 20 0 GAADHM Cn1cnc(C(=O)N2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)cc1=O ZINC001581803243 1075798864 /nfs/dbraw/zinc/79/88/64/1075798864.db2.gz BZGNVJMJTMDDLT-UHFFFAOYSA-N -1 3 383.372 -1.113 20 0 GAADHM Cn1cnc(C(=O)N2CCOC[C@H]2CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581803249 1075798801 /nfs/dbraw/zinc/79/88/01/1075798801.db2.gz DIUGLHDBOIPDTN-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCOC[C@H]2CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581803249 1075798799 /nfs/dbraw/zinc/79/87/99/1075798799.db2.gz DIUGLHDBOIPDTN-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCOC[C@@H]2CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581803250 1075798805 /nfs/dbraw/zinc/79/88/05/1075798805.db2.gz DIUGLHDBOIPDTN-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCOC[C@@H]2CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581803250 1075798804 /nfs/dbraw/zinc/79/88/04/1075798804.db2.gz DIUGLHDBOIPDTN-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2)cc1=O ZINC001581803290 1075798887 /nfs/dbraw/zinc/79/88/87/1075798887.db2.gz GUMTXLXRTFWSAW-UHFFFAOYSA-N -1 3 383.372 -1.113 20 0 GAADHM Cn1cnc(C(=O)N2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2)cc1=O ZINC001581803290 1075798878 /nfs/dbraw/zinc/79/88/78/1075798878.db2.gz GUMTXLXRTFWSAW-UHFFFAOYSA-N -1 3 383.372 -1.113 20 0 GAADHM Cn1cnc(C(=O)NC2(CCO)CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581803533 1075798995 /nfs/dbraw/zinc/79/89/95/1075798995.db2.gz RNCOMAATTROZGA-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)NC2(CCO)CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581803533 1075798990 /nfs/dbraw/zinc/79/89/90/1075798990.db2.gz RNCOMAATTROZGA-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)N2CCO[C@H](CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581803612 1075798980 /nfs/dbraw/zinc/79/89/80/1075798980.db2.gz RIKGASWTJAVBKI-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCO[C@H](CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581803612 1075798975 /nfs/dbraw/zinc/79/89/75/1075798975.db2.gz RIKGASWTJAVBKI-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCO[C@@H](CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581803613 1075798813 /nfs/dbraw/zinc/79/88/13/1075798813.db2.gz RIKGASWTJAVBKI-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCO[C@@H](CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581803613 1075798809 /nfs/dbraw/zinc/79/88/09/1075798809.db2.gz RIKGASWTJAVBKI-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCOC[C@@H]2CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581803666 1075798909 /nfs/dbraw/zinc/79/89/09/1075798909.db2.gz VNONOQSSECWTLC-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCOC[C@@H]2CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581803666 1075798906 /nfs/dbraw/zinc/79/89/06/1075798906.db2.gz VNONOQSSECWTLC-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCOC[C@H]2CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581803667 1075799310 /nfs/dbraw/zinc/79/93/10/1075799310.db2.gz VNONOQSSECWTLC-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCOC[C@H]2CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581803667 1075799309 /nfs/dbraw/zinc/79/93/09/1075799309.db2.gz VNONOQSSECWTLC-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCOC[C@@H]2CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581803671 1075799291 /nfs/dbraw/zinc/79/92/91/1075799291.db2.gz VWTVCJAPUZIRBI-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCOC[C@@H]2CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581803671 1075799288 /nfs/dbraw/zinc/79/92/88/1075799288.db2.gz VWTVCJAPUZIRBI-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCOC[C@H]2CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581803672 1075799320 /nfs/dbraw/zinc/79/93/20/1075799320.db2.gz VWTVCJAPUZIRBI-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)N2CCOC[C@H]2CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581803672 1075799318 /nfs/dbraw/zinc/79/93/18/1075799318.db2.gz VWTVCJAPUZIRBI-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)NC2(CCO)CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)c1 ZINC001581803716 1075799010 /nfs/dbraw/zinc/79/90/10/1075799010.db2.gz VGRFIAYCTAIMCR-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)NC2(CCO)CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)c1 ZINC001581803716 1075799009 /nfs/dbraw/zinc/79/90/09/1075799009.db2.gz VGRFIAYCTAIMCR-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)NC2(CCO)CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)c1 ZINC001581803742 1075799315 /nfs/dbraw/zinc/79/93/15/1075799315.db2.gz VVWGBLQVGFRQJO-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)NC2(CCO)CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)c1 ZINC001581803742 1075799314 /nfs/dbraw/zinc/79/93/14/1075799314.db2.gz VVWGBLQVGFRQJO-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)NC2(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2)cc1=O ZINC001581803746 1075799325 /nfs/dbraw/zinc/79/93/25/1075799325.db2.gz WDYCRAYCNADOTJ-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1cnc(C(=O)NC2(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2)cc1=O ZINC001581803746 1075799324 /nfs/dbraw/zinc/79/93/24/1075799324.db2.gz WDYCRAYCNADOTJ-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1cnc(C(=O)N2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)CC2)cc1=O ZINC001581803758 1075799300 /nfs/dbraw/zinc/79/93/00/1075799300.db2.gz ZRMLNXUKOBGGHA-UHFFFAOYSA-N -1 3 383.372 -1.113 20 0 GAADHM Cn1cnc(C(=O)N2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)CC2)cc1=O ZINC001581803758 1075799298 /nfs/dbraw/zinc/79/92/98/1075799298.db2.gz ZRMLNXUKOBGGHA-UHFFFAOYSA-N -1 3 383.372 -1.113 20 0 GAADHM Cn1cnc(C(=O)NC2(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)cc1=O ZINC001581803779 1075799245 /nfs/dbraw/zinc/79/92/45/1075799245.db2.gz WVSKGHAOGFTUAC-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1cnc(C(=O)NC2(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)cc1=O ZINC001581803779 1075799241 /nfs/dbraw/zinc/79/92/41/1075799241.db2.gz WVSKGHAOGFTUAC-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1cnc(C(=O)NC2(CCO)CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581803800 1075799274 /nfs/dbraw/zinc/79/92/74/1075799274.db2.gz XWSRXCQLUZQFRK-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)NC2(CCO)CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581803800 1075799273 /nfs/dbraw/zinc/79/92/73/1075799273.db2.gz XWSRXCQLUZQFRK-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)NC2(CCO)CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581803824 1075799334 /nfs/dbraw/zinc/79/93/34/1075799334.db2.gz YDHUVFDBJUESSJ-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)NC2(CCO)CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581803824 1075799333 /nfs/dbraw/zinc/79/93/33/1075799333.db2.gz YDHUVFDBJUESSJ-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)cc1=O ZINC001581804008 1075799269 /nfs/dbraw/zinc/79/92/69/1075799269.db2.gz FFWCJNSMLVHYQE-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)cc1=O ZINC001581804008 1075799267 /nfs/dbraw/zinc/79/92/67/1075799267.db2.gz FFWCJNSMLVHYQE-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)cc1=O ZINC001581804009 1075799305 /nfs/dbraw/zinc/79/93/05/1075799305.db2.gz FFWCJNSMLVHYQE-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)cc1=O ZINC001581804009 1075799303 /nfs/dbraw/zinc/79/93/03/1075799303.db2.gz FFWCJNSMLVHYQE-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)n1 ZINC001581804411 1075799331 /nfs/dbraw/zinc/79/93/31/1075799331.db2.gz QHYYJKZVQLZWLH-GXSJLCMTSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)n1 ZINC001581804411 1075799330 /nfs/dbraw/zinc/79/93/30/1075799330.db2.gz QHYYJKZVQLZWLH-GXSJLCMTSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)n1 ZINC001581804412 1075799682 /nfs/dbraw/zinc/79/96/82/1075799682.db2.gz QHYYJKZVQLZWLH-KOLCDFICSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)n1 ZINC001581804412 1075799678 /nfs/dbraw/zinc/79/96/78/1075799678.db2.gz QHYYJKZVQLZWLH-KOLCDFICSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)n1 ZINC001581804413 1075799554 /nfs/dbraw/zinc/79/95/54/1075799554.db2.gz QHYYJKZVQLZWLH-MWLCHTKSSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)n1 ZINC001581804413 1075799550 /nfs/dbraw/zinc/79/95/50/1075799550.db2.gz QHYYJKZVQLZWLH-MWLCHTKSSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)n1 ZINC001581804414 1075799485 /nfs/dbraw/zinc/79/94/85/1075799485.db2.gz QHYYJKZVQLZWLH-ONGXEEELSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)n1 ZINC001581804414 1075799479 /nfs/dbraw/zinc/79/94/79/1075799479.db2.gz QHYYJKZVQLZWLH-ONGXEEELSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)n1 ZINC001581804609 1075799591 /nfs/dbraw/zinc/79/95/91/1075799591.db2.gz VKLBHAGUSCQBCJ-GXSJLCMTSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)n1 ZINC001581804609 1075799585 /nfs/dbraw/zinc/79/95/85/1075799585.db2.gz VKLBHAGUSCQBCJ-GXSJLCMTSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)n1 ZINC001581804610 1075799651 /nfs/dbraw/zinc/79/96/51/1075799651.db2.gz VKLBHAGUSCQBCJ-KOLCDFICSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)n1 ZINC001581804610 1075799647 /nfs/dbraw/zinc/79/96/47/1075799647.db2.gz VKLBHAGUSCQBCJ-KOLCDFICSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)n1 ZINC001581804611 1075799605 /nfs/dbraw/zinc/79/96/05/1075799605.db2.gz VKLBHAGUSCQBCJ-MWLCHTKSSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)n1 ZINC001581804611 1075799601 /nfs/dbraw/zinc/79/96/01/1075799601.db2.gz VKLBHAGUSCQBCJ-MWLCHTKSSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)n1 ZINC001581804612 1075799633 /nfs/dbraw/zinc/79/96/33/1075799633.db2.gz VKLBHAGUSCQBCJ-ONGXEEELSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)n1 ZINC001581804612 1075799630 /nfs/dbraw/zinc/79/96/30/1075799630.db2.gz VKLBHAGUSCQBCJ-ONGXEEELSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)cc1=O ZINC001581804653 1075799671 /nfs/dbraw/zinc/79/96/71/1075799671.db2.gz WDWMVDKXGMTGEO-SECBINFHSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)cc1=O ZINC001581804653 1075799667 /nfs/dbraw/zinc/79/96/67/1075799667.db2.gz WDWMVDKXGMTGEO-SECBINFHSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)cc1=O ZINC001581804654 1075799641 /nfs/dbraw/zinc/79/96/41/1075799641.db2.gz WDWMVDKXGMTGEO-VIFPVBQESA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)cc1=O ZINC001581804654 1075799639 /nfs/dbraw/zinc/79/96/39/1075799639.db2.gz WDWMVDKXGMTGEO-VIFPVBQESA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)n1 ZINC001581804675 1075799614 /nfs/dbraw/zinc/79/96/14/1075799614.db2.gz WQMAAIVHJLUDQA-GZMMTYOYSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)n1 ZINC001581804675 1075799612 /nfs/dbraw/zinc/79/96/12/1075799612.db2.gz WQMAAIVHJLUDQA-GZMMTYOYSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)n1 ZINC001581804676 1075799624 /nfs/dbraw/zinc/79/96/24/1075799624.db2.gz WQMAAIVHJLUDQA-KCJUWKMLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)n1 ZINC001581804676 1075799622 /nfs/dbraw/zinc/79/96/22/1075799622.db2.gz WQMAAIVHJLUDQA-KCJUWKMLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)n1 ZINC001581804677 1075799661 /nfs/dbraw/zinc/79/96/61/1075799661.db2.gz WQMAAIVHJLUDQA-KWQFWETISA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)n1 ZINC001581804677 1075799658 /nfs/dbraw/zinc/79/96/58/1075799658.db2.gz WQMAAIVHJLUDQA-KWQFWETISA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)n1 ZINC001581804678 1075799501 /nfs/dbraw/zinc/79/95/01/1075799501.db2.gz WQMAAIVHJLUDQA-LDYMZIIASA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)n1 ZINC001581804678 1075799498 /nfs/dbraw/zinc/79/94/98/1075799498.db2.gz WQMAAIVHJLUDQA-LDYMZIIASA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)c1 ZINC001581804739 1075799694 /nfs/dbraw/zinc/79/96/94/1075799694.db2.gz XVRXHMSCHDAMHL-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)c1 ZINC001581804739 1075799691 /nfs/dbraw/zinc/79/96/91/1075799691.db2.gz XVRXHMSCHDAMHL-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)c1 ZINC001581804740 1075799702 /nfs/dbraw/zinc/79/97/02/1075799702.db2.gz XVRXHMSCHDAMHL-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)c1 ZINC001581804740 1075799701 /nfs/dbraw/zinc/79/97/01/1075799701.db2.gz XVRXHMSCHDAMHL-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)c1 ZINC001581804741 1075799573 /nfs/dbraw/zinc/79/95/73/1075799573.db2.gz XVRXHMSCHDAMHL-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)c1 ZINC001581804741 1075799567 /nfs/dbraw/zinc/79/95/67/1075799567.db2.gz XVRXHMSCHDAMHL-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)c1 ZINC001581804742 1075799522 /nfs/dbraw/zinc/79/95/22/1075799522.db2.gz XVRXHMSCHDAMHL-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)c1 ZINC001581804742 1075799516 /nfs/dbraw/zinc/79/95/16/1075799516.db2.gz XVRXHMSCHDAMHL-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)c1 ZINC001581804777 1075799876 /nfs/dbraw/zinc/79/98/76/1075799876.db2.gz YKPSQISYBYNOPA-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)c1 ZINC001581804777 1075799873 /nfs/dbraw/zinc/79/98/73/1075799873.db2.gz YKPSQISYBYNOPA-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)c1 ZINC001581804778 1075799857 /nfs/dbraw/zinc/79/98/57/1075799857.db2.gz YKPSQISYBYNOPA-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)c1 ZINC001581804778 1075799855 /nfs/dbraw/zinc/79/98/55/1075799855.db2.gz YKPSQISYBYNOPA-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)c1 ZINC001581804779 1075799895 /nfs/dbraw/zinc/79/98/95/1075799895.db2.gz YKPSQISYBYNOPA-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)c1 ZINC001581804779 1075799893 /nfs/dbraw/zinc/79/98/93/1075799893.db2.gz YKPSQISYBYNOPA-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)c1 ZINC001581804780 1075799910 /nfs/dbraw/zinc/79/99/10/1075799910.db2.gz YKPSQISYBYNOPA-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)c1 ZINC001581804780 1075799907 /nfs/dbraw/zinc/79/99/07/1075799907.db2.gz YKPSQISYBYNOPA-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1cnc(C(=O)NC[C@@]2(O)CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581804919 1075799916 /nfs/dbraw/zinc/79/99/16/1075799916.db2.gz CEDSGYKBOFBWJL-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)NC[C@@]2(O)CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581804919 1075799915 /nfs/dbraw/zinc/79/99/15/1075799915.db2.gz CEDSGYKBOFBWJL-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)NC[C@]2(O)CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581804920 1075799920 /nfs/dbraw/zinc/79/99/20/1075799920.db2.gz CEDSGYKBOFBWJL-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)NC[C@]2(O)CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581804920 1075799918 /nfs/dbraw/zinc/79/99/18/1075799918.db2.gz CEDSGYKBOFBWJL-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)NCC2(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2)cc1=O ZINC001581804962 1075799996 /nfs/dbraw/zinc/79/99/96/1075799996.db2.gz DOAYMXUJWCFWGC-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1cnc(C(=O)NCC2(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2)cc1=O ZINC001581804962 1075799992 /nfs/dbraw/zinc/79/99/92/1075799992.db2.gz DOAYMXUJWCFWGC-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1cnc(C(=O)NC[C@@]2(O)CCN(c3ncc(-c4nn[n-]n4)cc3F)C2)n1 ZINC001581805017 1075800209 /nfs/dbraw/zinc/80/02/09/1075800209.db2.gz GIOGOUGAHWRXHN-HNNXBMFYSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1cnc(C(=O)NC[C@@]2(O)CCN(c3ncc(-c4nnn[n-]4)cc3F)C2)n1 ZINC001581805017 1075800203 /nfs/dbraw/zinc/80/02/03/1075800203.db2.gz GIOGOUGAHWRXHN-HNNXBMFYSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1cnc(C(=O)NC[C@]2(O)CCN(c3ncc(-c4nn[n-]n4)cc3F)C2)n1 ZINC001581805018 1075800271 /nfs/dbraw/zinc/80/02/71/1075800271.db2.gz GIOGOUGAHWRXHN-OAHLLOKOSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1cnc(C(=O)NC[C@]2(O)CCN(c3ncc(-c4nnn[n-]4)cc3F)C2)n1 ZINC001581805018 1075800266 /nfs/dbraw/zinc/80/02/66/1075800266.db2.gz GIOGOUGAHWRXHN-OAHLLOKOSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1cnc(C(=O)NC[C@H](CO)Nc2ncc(-c3nn[n-]n3)cc2F)cc1=O ZINC001581805104 1075800254 /nfs/dbraw/zinc/80/02/54/1075800254.db2.gz IJGWFNFKTSYDET-SECBINFHSA-N -1 3 389.351 -1.303 20 0 GAADHM Cn1cnc(C(=O)NC[C@H](CO)Nc2ncc(-c3nnn[n-]3)cc2F)cc1=O ZINC001581805104 1075800252 /nfs/dbraw/zinc/80/02/52/1075800252.db2.gz IJGWFNFKTSYDET-SECBINFHSA-N -1 3 389.351 -1.303 20 0 GAADHM Cn1cnc(C(=O)NC[C@@H](CO)Nc2ncc(-c3nn[n-]n3)cc2F)cc1=O ZINC001581805105 1075800326 /nfs/dbraw/zinc/80/03/26/1075800326.db2.gz IJGWFNFKTSYDET-VIFPVBQESA-N -1 3 389.351 -1.303 20 0 GAADHM Cn1cnc(C(=O)NC[C@@H](CO)Nc2ncc(-c3nnn[n-]3)cc2F)cc1=O ZINC001581805105 1075800323 /nfs/dbraw/zinc/80/03/23/1075800323.db2.gz IJGWFNFKTSYDET-VIFPVBQESA-N -1 3 389.351 -1.303 20 0 GAADHM Cn1cnc(C(=O)NCC2(NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)CC2)cc1=O ZINC001581805356 1075800344 /nfs/dbraw/zinc/80/03/44/1075800344.db2.gz MNJKMZLSFCHWDT-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1cnc(C(=O)NCC2(NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)CC2)cc1=O ZINC001581805356 1075800342 /nfs/dbraw/zinc/80/03/42/1075800342.db2.gz MNJKMZLSFCHWDT-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1cnc(C(=O)NC[C@H](O)CNc2ncc(-c3nn[n-]n3)cc2F)cc1=O ZINC001581805417 1075800160 /nfs/dbraw/zinc/80/01/60/1075800160.db2.gz PBHCGCBZNYDDRW-SECBINFHSA-N -1 3 389.351 -1.303 20 0 GAADHM Cn1cnc(C(=O)NC[C@H](O)CNc2ncc(-c3nnn[n-]3)cc2F)cc1=O ZINC001581805417 1075800155 /nfs/dbraw/zinc/80/01/55/1075800155.db2.gz PBHCGCBZNYDDRW-SECBINFHSA-N -1 3 389.351 -1.303 20 0 GAADHM Cn1cnc(C(=O)NC[C@@H](O)CNc2ncc(-c3nn[n-]n3)cc2F)cc1=O ZINC001581805418 1075800243 /nfs/dbraw/zinc/80/02/43/1075800243.db2.gz PBHCGCBZNYDDRW-VIFPVBQESA-N -1 3 389.351 -1.303 20 0 GAADHM Cn1cnc(C(=O)NC[C@@H](O)CNc2ncc(-c3nnn[n-]3)cc2F)cc1=O ZINC001581805418 1075800237 /nfs/dbraw/zinc/80/02/37/1075800237.db2.gz PBHCGCBZNYDDRW-VIFPVBQESA-N -1 3 389.351 -1.303 20 0 GAADHM Cn1cnc(C(=O)NC[C@@]2(O)CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)c1 ZINC001581805430 1075800355 /nfs/dbraw/zinc/80/03/55/1075800355.db2.gz PNSFJVSGWUWCPE-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)NC[C@@]2(O)CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)c1 ZINC001581805430 1075800352 /nfs/dbraw/zinc/80/03/52/1075800352.db2.gz PNSFJVSGWUWCPE-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)NC[C@]2(O)CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)c1 ZINC001581805431 1075800194 /nfs/dbraw/zinc/80/01/94/1075800194.db2.gz PNSFJVSGWUWCPE-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)NC[C@]2(O)CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)c1 ZINC001581805431 1075800188 /nfs/dbraw/zinc/80/01/88/1075800188.db2.gz PNSFJVSGWUWCPE-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)NC[C@@]2(O)CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581805540 1075800283 /nfs/dbraw/zinc/80/02/83/1075800283.db2.gz PSHXMDBDBYPUPU-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)NC[C@@]2(O)CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581805540 1075800280 /nfs/dbraw/zinc/80/02/80/1075800280.db2.gz PSHXMDBDBYPUPU-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)NC[C@]2(O)CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581805541 1075800350 /nfs/dbraw/zinc/80/03/50/1075800350.db2.gz PSHXMDBDBYPUPU-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)NC[C@]2(O)CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581805541 1075800348 /nfs/dbraw/zinc/80/03/48/1075800348.db2.gz PSHXMDBDBYPUPU-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)NC[C@@]2(O)CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581805575 1075800294 /nfs/dbraw/zinc/80/02/94/1075800294.db2.gz RDXPQADVYLEOSD-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)NC[C@@]2(O)CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581805575 1075800291 /nfs/dbraw/zinc/80/02/91/1075800291.db2.gz RDXPQADVYLEOSD-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)NC[C@]2(O)CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581805576 1075800797 /nfs/dbraw/zinc/80/07/97/1075800797.db2.gz RDXPQADVYLEOSD-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)NC[C@]2(O)CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581805576 1075800792 /nfs/dbraw/zinc/80/07/92/1075800792.db2.gz RDXPQADVYLEOSD-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1cnc(C(=O)NC[C@@]2(O)CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)c1 ZINC001581805596 1075800613 /nfs/dbraw/zinc/80/06/13/1075800613.db2.gz RSVKKUCGKYSXSB-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)NC[C@@]2(O)CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)c1 ZINC001581805596 1075800611 /nfs/dbraw/zinc/80/06/11/1075800611.db2.gz RSVKKUCGKYSXSB-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)NC[C@]2(O)CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)c1 ZINC001581805597 1075800604 /nfs/dbraw/zinc/80/06/04/1075800604.db2.gz RSVKKUCGKYSXSB-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)NC[C@]2(O)CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)c1 ZINC001581805597 1075800601 /nfs/dbraw/zinc/80/06/01/1075800601.db2.gz RSVKKUCGKYSXSB-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)NCC2(NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)cc1=O ZINC001581805785 1075800536 /nfs/dbraw/zinc/80/05/36/1075800536.db2.gz VKXWYTGEONJLHE-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1cnc(C(=O)NCC2(NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)cc1=O ZINC001581805785 1075800531 /nfs/dbraw/zinc/80/05/31/1075800531.db2.gz VKXWYTGEONJLHE-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1cnc(C(=O)NC[C@@]2(O)CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)c1 ZINC001581805911 1075800580 /nfs/dbraw/zinc/80/05/80/1075800580.db2.gz YUWMNEWJJOIEBI-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)NC[C@@]2(O)CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)c1 ZINC001581805911 1075800576 /nfs/dbraw/zinc/80/05/76/1075800576.db2.gz YUWMNEWJJOIEBI-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)NC[C@]2(O)CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)c1 ZINC001581805913 1075800783 /nfs/dbraw/zinc/80/07/83/1075800783.db2.gz YUWMNEWJJOIEBI-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)NC[C@]2(O)CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)c1 ZINC001581805913 1075800776 /nfs/dbraw/zinc/80/07/76/1075800776.db2.gz YUWMNEWJJOIEBI-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cnc(C(=O)NCCN2CCN(c3ncccc3-c3nn[n-]n3)CC2)n1 ZINC001581806248 1075800595 /nfs/dbraw/zinc/80/05/95/1075800595.db2.gz BEGUMFCMCHMHFN-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1cnc(C(=O)NCCN2CCN(c3ncccc3-c3nnn[n-]3)CC2)n1 ZINC001581806248 1075800590 /nfs/dbraw/zinc/80/05/90/1075800590.db2.gz BEGUMFCMCHMHFN-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1cnc(C(=O)NC[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CCO2)n1 ZINC001581806593 1075800556 /nfs/dbraw/zinc/80/05/56/1075800556.db2.gz HPMZBXYLNXZFNS-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)NC[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CCO2)n1 ZINC001581806593 1075800554 /nfs/dbraw/zinc/80/05/54/1075800554.db2.gz HPMZBXYLNXZFNS-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)NC[C@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CCO2)n1 ZINC001581806594 1075800725 /nfs/dbraw/zinc/80/07/25/1075800725.db2.gz HPMZBXYLNXZFNS-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)NC[C@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CCO2)n1 ZINC001581806594 1075800720 /nfs/dbraw/zinc/80/07/20/1075800720.db2.gz HPMZBXYLNXZFNS-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)NCC2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)cc1=O ZINC001581806740 1075800647 /nfs/dbraw/zinc/80/06/47/1075800647.db2.gz IVACISZPANACSM-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1cnc(C(=O)NCC2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)cc1=O ZINC001581806740 1075800640 /nfs/dbraw/zinc/80/06/40/1075800640.db2.gz IVACISZPANACSM-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1cnc(C(=O)NCCN2CCN(c3cnc(-c4nnn[n-]4)cn3)CC2)c1 ZINC001581806746 1075800743 /nfs/dbraw/zinc/80/07/43/1075800743.db2.gz IYWJJZXYWYXWDS-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1cnc(C(=O)NC[C@@H]2CCN2C(=O)c2c[nH]c(-c3nn[n-]n3)c2)cc1=O ZINC001581806794 1075800907 /nfs/dbraw/zinc/80/09/07/1075800907.db2.gz KGSWDGPEZDQABN-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1cnc(C(=O)NC[C@@H]2CCN2C(=O)c2c[nH]c(-c3nnn[n-]3)c2)cc1=O ZINC001581806794 1075800905 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Cn1cnc(C(=O)NC[C@@H]2COCCN2C(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581807233 1075801056 /nfs/dbraw/zinc/80/10/56/1075801056.db2.gz OQQDMYCYUKBVEE-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)NC[C@@H]2COCCN2C(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581807233 1075801051 /nfs/dbraw/zinc/80/10/51/1075801051.db2.gz OQQDMYCYUKBVEE-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)NCC2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)cc1=O ZINC001581807382 1075800925 /nfs/dbraw/zinc/80/09/25/1075800925.db2.gz RYEHBZYSWFCPIK-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1cnc(C(=O)NCC2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)cc1=O ZINC001581807382 1075800922 /nfs/dbraw/zinc/80/09/22/1075800922.db2.gz RYEHBZYSWFCPIK-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1cnc(C(=O)NCCN2CCN(c3ccc(-c4nn[n-]n4)cn3)CC2)n1 ZINC001581807504 1075801145 /nfs/dbraw/zinc/80/11/45/1075801145.db2.gz WSOAGAJXWPMDST-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1cnc(C(=O)NCCN2CCN(c3ccc(-c4nnn[n-]4)cn3)CC2)n1 ZINC001581807504 1075801141 /nfs/dbraw/zinc/80/11/41/1075801141.db2.gz WSOAGAJXWPMDST-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1cnc(C(=O)NC[C@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)CCO2)n1 ZINC001581807570 1075800914 /nfs/dbraw/zinc/80/09/14/1075800914.db2.gz ZADOYICMWRQYPH-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)NC[C@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)CCO2)n1 ZINC001581807570 1075800911 /nfs/dbraw/zinc/80/09/11/1075800911.db2.gz ZADOYICMWRQYPH-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)NC[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)CCO2)n1 ZINC001581807571 1075800937 /nfs/dbraw/zinc/80/09/37/1075800937.db2.gz ZADOYICMWRQYPH-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)NC[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)CCO2)n1 ZINC001581807571 1075800932 /nfs/dbraw/zinc/80/09/32/1075800932.db2.gz ZADOYICMWRQYPH-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1cnc(C(=O)NC[C@@H]2CCN2C(=O)c2cc(-c3nn[n-]n3)c[nH]2)cc1=O ZINC001581807572 1075801550 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Cn1cncc1C(=O)NC[C@@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581810373 1075802326 /nfs/dbraw/zinc/80/23/26/1075802326.db2.gz DBMZEBOIADZKNB-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cncc1C(=O)NC[C@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581810374 1075802278 /nfs/dbraw/zinc/80/22/78/1075802278.db2.gz DBMZEBOIADZKNB-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cncc1C(=O)NC[C@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581810374 1075802275 /nfs/dbraw/zinc/80/22/75/1075802275.db2.gz DBMZEBOIADZKNB-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cncc1C(=O)NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581810491 1075802232 /nfs/dbraw/zinc/80/22/32/1075802232.db2.gz IFPRRJLWHVVSAN-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cncc1C(=O)NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581810491 1075802226 /nfs/dbraw/zinc/80/22/26/1075802226.db2.gz IFPRRJLWHVVSAN-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM 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Cn1cncc1C(=O)NC1(CCO)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581811534 1075802594 /nfs/dbraw/zinc/80/25/94/1075802594.db2.gz KPYNSCDQMRQITP-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cncc1C(=O)N1CC[C@](O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581811767 1075802716 /nfs/dbraw/zinc/80/27/16/1075802716.db2.gz IYXFBSKJRPBSKM-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cncc1C(=O)N1CC[C@](O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581811767 1075802710 /nfs/dbraw/zinc/80/27/10/1075802710.db2.gz IYXFBSKJRPBSKM-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cncc1C(=O)N1CC[C@@](O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581811768 1075802624 /nfs/dbraw/zinc/80/26/24/1075802624.db2.gz IYXFBSKJRPBSKM-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1cncc1C(=O)N1CC[C@@](O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581811768 1075802620 /nfs/dbraw/zinc/80/26/20/1075802620.db2.gz IYXFBSKJRPBSKM-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM 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Cn1cnn(CC(=O)NCCN(c2ccc(-c3nnn[n-]3)cn2)C2CC2)c1=O ZINC001581819287 1075809474 /nfs/dbraw/zinc/80/94/74/1075809474.db2.gz QRHPCVOAOYHIHN-UHFFFAOYSA-N -1 3 384.404 -1.058 20 0 GAADHM Cn1cnnc1COCC(=O)NC[C@@H](CO)Nc1ncccc1-c1nn[n-]n1 ZINC001581819348 1075809549 /nfs/dbraw/zinc/80/95/49/1075809549.db2.gz PQBSKGZDTJCNEN-JTQLQIEISA-N -1 3 388.392 -1.504 20 0 GAADHM Cn1cnnc1COCC(=O)NC[C@@H](CO)Nc1ncccc1-c1nnn[n-]1 ZINC001581819348 1075809544 /nfs/dbraw/zinc/80/95/44/1075809544.db2.gz PQBSKGZDTJCNEN-JTQLQIEISA-N -1 3 388.392 -1.504 20 0 GAADHM Cn1cnnc1COCC(=O)NC[C@H](CO)Nc1ncccc1-c1nn[n-]n1 ZINC001581819349 1075809624 /nfs/dbraw/zinc/80/96/24/1075809624.db2.gz PQBSKGZDTJCNEN-SNVBAGLBSA-N -1 3 388.392 -1.504 20 0 GAADHM Cn1cnnc1COCC(=O)NC[C@H](CO)Nc1ncccc1-c1nnn[n-]1 ZINC001581819349 1075809621 /nfs/dbraw/zinc/80/96/21/1075809621.db2.gz PQBSKGZDTJCNEN-SNVBAGLBSA-N -1 3 388.392 -1.504 20 0 GAADHM Cn1cnn(CC(=O)NC[C@H]2CCN(c3ncccc3-c3nn[n-]n3)C2)c1=O ZINC001581819366 1075809688 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376.406 -1.099 20 0 GAADHM Cn1cnnc1S(=O)(=O)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001581821302 1075811916 /nfs/dbraw/zinc/81/19/16/1075811916.db2.gz LHWKFQVTQMIKMV-UHFFFAOYSA-N -1 3 376.406 -1.099 20 0 GAADHM Cn1cnnc1S(=O)(=O)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1 ZINC001581821310 1075811752 /nfs/dbraw/zinc/81/17/52/1075811752.db2.gz LPXKYGOWBWZCQW-UHFFFAOYSA-N -1 3 376.406 -1.099 20 0 GAADHM Cn1cnnc1S(=O)(=O)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1 ZINC001581821310 1075811747 /nfs/dbraw/zinc/81/17/47/1075811747.db2.gz LPXKYGOWBWZCQW-UHFFFAOYSA-N -1 3 376.406 -1.099 20 0 GAADHM Cn1nc(C(=O)N(CCO)CCNc2ccc(-c3nn[n-]n3)cn2)ccc1=O ZINC001581821329 1075811739 /nfs/dbraw/zinc/81/17/39/1075811739.db2.gz MNINOLJHICVMAN-UHFFFAOYSA-N -1 3 385.388 -1.098 20 0 GAADHM Cn1nc(C(=O)N(CCO)CCNc2ccc(-c3nnn[n-]3)cn2)ccc1=O ZINC001581821329 1075811737 /nfs/dbraw/zinc/81/17/37/1075811737.db2.gz MNINOLJHICVMAN-UHFFFAOYSA-N -1 3 385.388 -1.098 20 0 GAADHM Cn1cnnc1S(=O)(=O)N1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001581821336 1075811859 /nfs/dbraw/zinc/81/18/59/1075811859.db2.gz NBKZROOUUTVHPD-UHFFFAOYSA-N -1 3 376.406 -1.099 20 0 GAADHM Cn1cnnc1S(=O)(=O)N1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001581821336 1075811854 /nfs/dbraw/zinc/81/18/54/1075811854.db2.gz NBKZROOUUTVHPD-UHFFFAOYSA-N -1 3 376.406 -1.099 20 0 GAADHM Cn1nc(C(=O)N2CC(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)ccc1=O ZINC001581821348 1075811846 /nfs/dbraw/zinc/81/18/46/1075811846.db2.gz NNZXZZMTWVLDJH-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1nc(C(=O)N2CC(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)ccc1=O ZINC001581821348 1075811842 /nfs/dbraw/zinc/81/18/42/1075811842.db2.gz NNZXZZMTWVLDJH-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1cnnc1N1CCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001581821352 1075811779 /nfs/dbraw/zinc/81/17/79/1075811779.db2.gz OBSPNXOAAISIOD-UHFFFAOYSA-N -1 3 376.406 -1.099 20 0 GAADHM Cn1cnnc1N1CCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001581821352 1075811776 /nfs/dbraw/zinc/81/17/76/1075811776.db2.gz OBSPNXOAAISIOD-UHFFFAOYSA-N -1 3 376.406 -1.099 20 0 GAADHM Cn1cnnc1S(=O)(=O)N1CCN(c2cnccc2-c2nn[n-]n2)CC1 ZINC001581821388 1075811929 /nfs/dbraw/zinc/81/19/29/1075811929.db2.gz QMOBRAABGAABQP-UHFFFAOYSA-N -1 3 376.406 -1.099 20 0 GAADHM Cn1cnnc1S(=O)(=O)N1CCN(c2cnccc2-c2nnn[n-]2)CC1 ZINC001581821388 1075811926 /nfs/dbraw/zinc/81/19/26/1075811926.db2.gz QMOBRAABGAABQP-UHFFFAOYSA-N -1 3 376.406 -1.099 20 0 GAADHM Cn1nc(C(=O)N2CC(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)ccc1=O ZINC001581821394 1075811805 /nfs/dbraw/zinc/81/18/05/1075811805.db2.gz QSSYFMGRBYNXND-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1nc(C(=O)N2CC(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)ccc1=O ZINC001581821394 1075811803 /nfs/dbraw/zinc/81/18/03/1075811803.db2.gz QSSYFMGRBYNXND-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1nc(C(=O)N2CC[C@@H]2CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)ccc1=O ZINC001581821413 1075811835 /nfs/dbraw/zinc/81/18/35/1075811835.db2.gz RHFFMFCPDCPMSX-SECBINFHSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N2CC[C@@H]2CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)ccc1=O ZINC001581821413 1075811829 /nfs/dbraw/zinc/81/18/29/1075811829.db2.gz RHFFMFCPDCPMSX-SECBINFHSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N2CC[C@H]2CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)ccc1=O ZINC001581821414 1075811887 /nfs/dbraw/zinc/81/18/87/1075811887.db2.gz RHFFMFCPDCPMSX-VIFPVBQESA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N2CC[C@H]2CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)ccc1=O ZINC001581821414 1075811882 /nfs/dbraw/zinc/81/18/82/1075811882.db2.gz RHFFMFCPDCPMSX-VIFPVBQESA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N2CC[C@H]2CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)ccc1=O ZINC001581821456 1075812303 /nfs/dbraw/zinc/81/23/03/1075812303.db2.gz TTXSXCDKLWPDBV-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N2CC[C@H]2CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)ccc1=O ZINC001581821456 1075812299 /nfs/dbraw/zinc/81/22/99/1075812299.db2.gz TTXSXCDKLWPDBV-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N2CC[C@@H]2CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)ccc1=O ZINC001581821457 1075812052 /nfs/dbraw/zinc/81/20/52/1075812052.db2.gz TTXSXCDKLWPDBV-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N2CC[C@@H]2CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)ccc1=O ZINC001581821457 1075812047 /nfs/dbraw/zinc/81/20/47/1075812047.db2.gz TTXSXCDKLWPDBV-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)ccc1=O ZINC001581821467 1075812058 /nfs/dbraw/zinc/81/20/58/1075812058.db2.gz UNFAOHOMHRTENF-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)ccc1=O ZINC001581821467 1075812056 /nfs/dbraw/zinc/81/20/56/1075812056.db2.gz UNFAOHOMHRTENF-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)ccc1=O ZINC001581821468 1075812149 /nfs/dbraw/zinc/81/21/49/1075812149.db2.gz UNFAOHOMHRTENF-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)ccc1=O ZINC001581821468 1075812143 /nfs/dbraw/zinc/81/21/43/1075812143.db2.gz UNFAOHOMHRTENF-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N(CCO)CCNc2ccc(-c3nn[n-]n3)nc2)ccc1=O ZINC001581821543 1075812291 /nfs/dbraw/zinc/81/22/91/1075812291.db2.gz YDZKYDTTZALHLY-UHFFFAOYSA-N -1 3 385.388 -1.098 20 0 GAADHM Cn1nc(C(=O)N(CCO)CCNc2ccc(-c3nnn[n-]3)nc2)ccc1=O ZINC001581821543 1075812286 /nfs/dbraw/zinc/81/22/86/1075812286.db2.gz YDZKYDTTZALHLY-UHFFFAOYSA-N -1 3 385.388 -1.098 20 0 GAADHM Cn1nc(C(=O)N[C@H]2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)ccc1=O ZINC001581821640 1075812276 /nfs/dbraw/zinc/81/22/76/1075812276.db2.gz DVRZWADVPWVNNJ-AOOOYVTPSA-N -1 3 383.372 -1.021 20 0 GAADHM Cn1nc(C(=O)N[C@H]2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)ccc1=O ZINC001581821640 1075812271 /nfs/dbraw/zinc/81/22/71/1075812271.db2.gz DVRZWADVPWVNNJ-AOOOYVTPSA-N -1 3 383.372 -1.021 20 0 GAADHM Cn1nc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)ccc1=O ZINC001581821699 1075812126 /nfs/dbraw/zinc/81/21/26/1075812126.db2.gz IKRGJAMVEYJVFJ-VIFPVBQESA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)ccc1=O ZINC001581821699 1075812121 /nfs/dbraw/zinc/81/21/21/1075812121.db2.gz IKRGJAMVEYJVFJ-VIFPVBQESA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N[C@H]2C[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)ccc1=O ZINC001581821742 1075812260 /nfs/dbraw/zinc/81/22/60/1075812260.db2.gz KMNBHGBVYMAEOX-AOOOYVTPSA-N -1 3 383.372 -1.021 20 0 GAADHM Cn1nc(C(=O)N[C@H]2C[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)ccc1=O ZINC001581821742 1075812255 /nfs/dbraw/zinc/81/22/55/1075812255.db2.gz KMNBHGBVYMAEOX-AOOOYVTPSA-N -1 3 383.372 -1.021 20 0 GAADHM Cn1nc(C(=O)N[C@H]2C[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)ccc1=O ZINC001581821743 1075812321 /nfs/dbraw/zinc/81/23/21/1075812321.db2.gz KMNBHGBVYMAEOX-MGCOHNPYSA-N -1 3 383.372 -1.021 20 0 GAADHM Cn1nc(C(=O)N[C@H]2C[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)ccc1=O ZINC001581821743 1075812314 /nfs/dbraw/zinc/81/23/14/1075812314.db2.gz KMNBHGBVYMAEOX-MGCOHNPYSA-N -1 3 383.372 -1.021 20 0 GAADHM Cn1nc(C(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@@H]2O)ccc1=O ZINC001581821780 1075812069 /nfs/dbraw/zinc/81/20/69/1075812069.db2.gz NCRUTSQYLXUKKL-NEPJUHHUSA-N -1 3 383.372 -1.665 20 0 GAADHM Cn1nc(C(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@@H]2O)ccc1=O ZINC001581821780 1075812068 /nfs/dbraw/zinc/81/20/68/1075812068.db2.gz NCRUTSQYLXUKKL-NEPJUHHUSA-N -1 3 383.372 -1.665 20 0 GAADHM Cn1nc(C(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]2O)ccc1=O ZINC001581821781 1075812495 /nfs/dbraw/zinc/81/24/95/1075812495.db2.gz NCRUTSQYLXUKKL-VXGBXAGGSA-N -1 3 383.372 -1.665 20 0 GAADHM Cn1nc(C(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]2O)ccc1=O ZINC001581821781 1075812489 /nfs/dbraw/zinc/81/24/89/1075812489.db2.gz NCRUTSQYLXUKKL-VXGBXAGGSA-N -1 3 383.372 -1.665 20 0 GAADHM Cn1nc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)ccc1=O ZINC001581821784 1075812468 /nfs/dbraw/zinc/81/24/68/1075812468.db2.gz NKJWAWABIJHYPD-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)ccc1=O ZINC001581821784 1075812464 /nfs/dbraw/zinc/81/24/64/1075812464.db2.gz NKJWAWABIJHYPD-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)ccc1=O ZINC001581821785 1075812644 /nfs/dbraw/zinc/81/26/44/1075812644.db2.gz NKJWAWABIJHYPD-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)ccc1=O ZINC001581821785 1075812637 /nfs/dbraw/zinc/81/26/37/1075812637.db2.gz NKJWAWABIJHYPD-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)ccc1=O ZINC001581821822 1075812577 /nfs/dbraw/zinc/81/25/77/1075812577.db2.gz PKVUBRQJYGGOIF-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)ccc1=O ZINC001581821822 1075812571 /nfs/dbraw/zinc/81/25/71/1075812571.db2.gz PKVUBRQJYGGOIF-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)ccc1=O ZINC001581821823 1075812701 /nfs/dbraw/zinc/81/27/01/1075812701.db2.gz PKVUBRQJYGGOIF-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)ccc1=O ZINC001581821823 1075812696 /nfs/dbraw/zinc/81/26/96/1075812696.db2.gz PKVUBRQJYGGOIF-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)N[C@H]2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)ccc1=O ZINC001581821908 1075812726 /nfs/dbraw/zinc/81/27/26/1075812726.db2.gz VHPBUJVEAMDSFH-DTORHVGOSA-N -1 3 383.372 -1.021 20 0 GAADHM Cn1nc(C(=O)N[C@H]2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)ccc1=O ZINC001581821908 1075812723 /nfs/dbraw/zinc/81/27/23/1075812723.db2.gz VHPBUJVEAMDSFH-DTORHVGOSA-N -1 3 383.372 -1.021 20 0 GAADHM Cn1nc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]2O)ccc1=O ZINC001581821931 1075812734 /nfs/dbraw/zinc/81/27/34/1075812734.db2.gz WPMAJFJUNBGLLS-CHWSQXEVSA-N -1 3 383.372 -1.665 20 0 GAADHM Cn1nc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]2O)ccc1=O ZINC001581821931 1075812731 /nfs/dbraw/zinc/81/27/31/1075812731.db2.gz WPMAJFJUNBGLLS-CHWSQXEVSA-N -1 3 383.372 -1.665 20 0 GAADHM Cn1nc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@@H]2O)ccc1=O ZINC001581821932 1075812688 /nfs/dbraw/zinc/81/26/88/1075812688.db2.gz WPMAJFJUNBGLLS-OLZOCXBDSA-N -1 3 383.372 -1.665 20 0 GAADHM Cn1nc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@@H]2O)ccc1=O ZINC001581821932 1075812683 /nfs/dbraw/zinc/81/26/83/1075812683.db2.gz WPMAJFJUNBGLLS-OLZOCXBDSA-N -1 3 383.372 -1.665 20 0 GAADHM Cn1nc(C(=O)NC2(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)CC2)ccc1=O ZINC001581822055 1075812740 /nfs/dbraw/zinc/81/27/40/1075812740.db2.gz ASIDDQGBLKXSRR-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1nc(C(=O)NC2(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)CC2)ccc1=O ZINC001581822055 1075812738 /nfs/dbraw/zinc/81/27/38/1075812738.db2.gz ASIDDQGBLKXSRR-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1nc(C(=O)NC[C@H](O)CNc2ncc(-c3nn[n-]n3)cc2F)ccc1=O ZINC001581822281 1075812897 /nfs/dbraw/zinc/81/28/97/1075812897.db2.gz LADGGDYPVMIACB-SECBINFHSA-N -1 3 389.351 -1.303 20 0 GAADHM Cn1nc(C(=O)NC[C@H](O)CNc2ncc(-c3nnn[n-]3)cc2F)ccc1=O ZINC001581822281 1075812893 /nfs/dbraw/zinc/81/28/93/1075812893.db2.gz LADGGDYPVMIACB-SECBINFHSA-N -1 3 389.351 -1.303 20 0 GAADHM Cn1nc(C(=O)NC[C@@H](O)CNc2ncc(-c3nn[n-]n3)cc2F)ccc1=O ZINC001581822282 1075812989 /nfs/dbraw/zinc/81/29/89/1075812989.db2.gz LADGGDYPVMIACB-VIFPVBQESA-N -1 3 389.351 -1.303 20 0 GAADHM Cn1nc(C(=O)NC[C@@H](O)CNc2ncc(-c3nnn[n-]3)cc2F)ccc1=O ZINC001581822282 1075812987 /nfs/dbraw/zinc/81/29/87/1075812987.db2.gz LADGGDYPVMIACB-VIFPVBQESA-N -1 3 389.351 -1.303 20 0 GAADHM Cn1nc(C(=O)NCC2(NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)CC2)ccc1=O ZINC001581822283 1075812980 /nfs/dbraw/zinc/81/29/80/1075812980.db2.gz LAWBXGNNIXAUTF-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1nc(C(=O)NCC2(NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)CC2)ccc1=O ZINC001581822283 1075812976 /nfs/dbraw/zinc/81/29/76/1075812976.db2.gz LAWBXGNNIXAUTF-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1nc(C(=O)NC[C@H](CO)Nc2ncc(-c3nn[n-]n3)cc2F)ccc1=O ZINC001581822363 1075813023 /nfs/dbraw/zinc/81/30/23/1075813023.db2.gz NLRCFHMAAUDIJC-SECBINFHSA-N -1 3 389.351 -1.303 20 0 GAADHM Cn1nc(C(=O)NC[C@H](CO)Nc2ncc(-c3nnn[n-]3)cc2F)ccc1=O ZINC001581822363 1075813019 /nfs/dbraw/zinc/81/30/19/1075813019.db2.gz NLRCFHMAAUDIJC-SECBINFHSA-N -1 3 389.351 -1.303 20 0 GAADHM Cn1nc(C(=O)NC[C@@H](CO)Nc2ncc(-c3nn[n-]n3)cc2F)ccc1=O ZINC001581822364 1075812940 /nfs/dbraw/zinc/81/29/40/1075812940.db2.gz NLRCFHMAAUDIJC-VIFPVBQESA-N -1 3 389.351 -1.303 20 0 GAADHM Cn1nc(C(=O)NC[C@@H](CO)Nc2ncc(-c3nnn[n-]3)cc2F)ccc1=O ZINC001581822364 1075812935 /nfs/dbraw/zinc/81/29/35/1075812935.db2.gz NLRCFHMAAUDIJC-VIFPVBQESA-N -1 3 389.351 -1.303 20 0 GAADHM Cn1nc(C(=O)NCC2(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2)ccc1=O ZINC001581822375 1075812954 /nfs/dbraw/zinc/81/29/54/1075812954.db2.gz NWTXEYPFQKNQBN-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1nc(C(=O)NCC2(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2)ccc1=O ZINC001581822375 1075812949 /nfs/dbraw/zinc/81/29/49/1075812949.db2.gz NWTXEYPFQKNQBN-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1nc(C(=O)NCC2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)ccc1=O ZINC001581822417 1075813323 /nfs/dbraw/zinc/81/33/23/1075813323.db2.gz PNVKPKMUXPHAGM-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1nc(C(=O)NCC2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)ccc1=O ZINC001581822417 1075813320 /nfs/dbraw/zinc/81/33/20/1075813320.db2.gz PNVKPKMUXPHAGM-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1nc(C(=O)NC[C@@H]2CCN2C(=O)c2cc(-c3nn[n-]n3)c[nH]2)ccc1=O ZINC001581822441 1075813292 /nfs/dbraw/zinc/81/32/92/1075813292.db2.gz QBZTTZHNRNFYCS-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)NC[C@@H]2CCN2C(=O)c2cc(-c3nnn[n-]3)c[nH]2)ccc1=O ZINC001581822441 1075813289 /nfs/dbraw/zinc/81/32/89/1075813289.db2.gz QBZTTZHNRNFYCS-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)NC[C@H]2CCN2C(=O)c2cc(-c3nn[n-]n3)c[nH]2)ccc1=O ZINC001581822442 1075813172 /nfs/dbraw/zinc/81/31/72/1075813172.db2.gz QBZTTZHNRNFYCS-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)NC[C@H]2CCN2C(=O)c2cc(-c3nnn[n-]3)c[nH]2)ccc1=O ZINC001581822442 1075813169 /nfs/dbraw/zinc/81/31/69/1075813169.db2.gz QBZTTZHNRNFYCS-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)NCC2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)ccc1=O ZINC001581822564 1075813232 /nfs/dbraw/zinc/81/32/32/1075813232.db2.gz UMGLMKQHTZBVSE-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1nc(C(=O)NCC2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)ccc1=O ZINC001581822564 1075813227 /nfs/dbraw/zinc/81/32/27/1075813227.db2.gz UMGLMKQHTZBVSE-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1nc(C(=O)NC2(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)ccc1=O ZINC001581822618 1075813332 /nfs/dbraw/zinc/81/33/32/1075813332.db2.gz WRLXUJYBNGBFKG-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1nc(C(=O)NC2(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)ccc1=O ZINC001581822618 1075813329 /nfs/dbraw/zinc/81/33/29/1075813329.db2.gz WRLXUJYBNGBFKG-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1nc(C(=O)NC[C@H]2CCN2C(=O)c2ccc(-c3nn[n-]n3)[nH]2)ccc1=O ZINC001581822668 1075813714 /nfs/dbraw/zinc/81/37/14/1075813714.db2.gz YZZPNJGMCYALQB-SECBINFHSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)NC[C@H]2CCN2C(=O)c2ccc(-c3nnn[n-]3)[nH]2)ccc1=O ZINC001581822668 1075813709 /nfs/dbraw/zinc/81/37/09/1075813709.db2.gz YZZPNJGMCYALQB-SECBINFHSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)NC[C@@H]2CCN2C(=O)c2ccc(-c3nn[n-]n3)[nH]2)ccc1=O ZINC001581822669 1075813636 /nfs/dbraw/zinc/81/36/36/1075813636.db2.gz YZZPNJGMCYALQB-VIFPVBQESA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)NC[C@@H]2CCN2C(=O)c2ccc(-c3nnn[n-]3)[nH]2)ccc1=O ZINC001581822669 1075813633 /nfs/dbraw/zinc/81/36/33/1075813633.db2.gz YZZPNJGMCYALQB-VIFPVBQESA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)NC[C@@H]2CCN2C(=O)c2c[nH]c(-c3nn[n-]n3)c2)ccc1=O ZINC001581822679 1075813658 /nfs/dbraw/zinc/81/36/58/1075813658.db2.gz ZHYUOIFJWBLSND-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)NC[C@@H]2CCN2C(=O)c2c[nH]c(-c3nnn[n-]3)c2)ccc1=O ZINC001581822679 1075813656 /nfs/dbraw/zinc/81/36/56/1075813656.db2.gz ZHYUOIFJWBLSND-JTQLQIEISA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)NC[C@H]2CCN2C(=O)c2c[nH]c(-c3nn[n-]n3)c2)ccc1=O ZINC001581822680 1075813575 /nfs/dbraw/zinc/81/35/75/1075813575.db2.gz ZHYUOIFJWBLSND-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)NC[C@H]2CCN2C(=O)c2c[nH]c(-c3nnn[n-]3)c2)ccc1=O ZINC001581822680 1075813570 /nfs/dbraw/zinc/81/35/70/1075813570.db2.gz ZHYUOIFJWBLSND-SNVBAGLBSA-N -1 3 383.372 -1.067 20 0 GAADHM Cn1nc(C(=O)NCC2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)ccc1=O ZINC001581822687 1075813627 /nfs/dbraw/zinc/81/36/27/1075813627.db2.gz ZRUFNLXDQHUDGI-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1nc(C(=O)NCC2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)ccc1=O ZINC001581822687 1075813624 /nfs/dbraw/zinc/81/36/24/1075813624.db2.gz ZRUFNLXDQHUDGI-UHFFFAOYSA-N -1 3 383.372 -1.210 20 0 GAADHM Cn1nc(C(=O)NCC2(NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)ccc1=O ZINC001581822694 1075813598 /nfs/dbraw/zinc/81/35/98/1075813598.db2.gz ZYPSKOHLKYGAJW-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1nc(C(=O)NCC2(NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)ccc1=O ZINC001581822694 1075813595 /nfs/dbraw/zinc/81/35/95/1075813595.db2.gz ZYPSKOHLKYGAJW-UHFFFAOYSA-N -1 3 383.372 -1.019 20 0 GAADHM Cn1ncc(C(=O)N2CC(CCO)(NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581824563 1075814037 /nfs/dbraw/zinc/81/40/37/1075814037.db2.gz DYZZTQYIUHZOFG-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)N2CC(CCO)(NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581824563 1075814034 /nfs/dbraw/zinc/81/40/34/1075814034.db2.gz DYZZTQYIUHZOFG-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1[n-]c(CN2C[C@@H]3CN(C(=O)c4c[nH]c(-c5nn[nH]n5)c4)C[C@@H]3C2)nc1=O ZINC001581824699 1075814081 /nfs/dbraw/zinc/81/40/81/1075814081.db2.gz YYKUJWLGNHJRDA-PHIMTYICSA-N -1 3 384.404 -1.179 20 0 GAADHM Cn1ncc(C(=O)N2CC(CCO)(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581824729 1075814162 /nfs/dbraw/zinc/81/41/62/1075814162.db2.gz IJOPZAZERAKFRE-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)N2CC(CCO)(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581824729 1075814153 /nfs/dbraw/zinc/81/41/53/1075814153.db2.gz IJOPZAZERAKFRE-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)N2CC(CCO)(NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581824959 1075814415 /nfs/dbraw/zinc/81/44/15/1075814415.db2.gz RERHSYXGENKSCC-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)N2CC(CCO)(NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581824959 1075814408 /nfs/dbraw/zinc/81/44/08/1075814408.db2.gz RERHSYXGENKSCC-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@H](O)C2)n1 ZINC001581825437 1075814602 /nfs/dbraw/zinc/81/46/02/1075814602.db2.gz MSCRRAJZIWXVEU-BXKDBHETSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@H](O)C2)n1 ZINC001581825437 1075814597 /nfs/dbraw/zinc/81/45/97/1075814597.db2.gz MSCRRAJZIWXVEU-BXKDBHETSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)n1 ZINC001581825438 1075814616 /nfs/dbraw/zinc/81/46/16/1075814616.db2.gz MSCRRAJZIWXVEU-CABZTGNLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)n1 ZINC001581825438 1075814610 /nfs/dbraw/zinc/81/46/10/1075814610.db2.gz MSCRRAJZIWXVEU-CABZTGNLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@H](O)C2)n1 ZINC001581825439 1075814339 /nfs/dbraw/zinc/81/43/39/1075814339.db2.gz MSCRRAJZIWXVEU-JOYOIKCWSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@H](O)C2)n1 ZINC001581825439 1075814334 /nfs/dbraw/zinc/81/43/34/1075814334.db2.gz MSCRRAJZIWXVEU-JOYOIKCWSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)n1 ZINC001581825440 1075814525 /nfs/dbraw/zinc/81/45/25/1075814525.db2.gz MSCRRAJZIWXVEU-SKDRFNHKSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)n1 ZINC001581825440 1075814519 /nfs/dbraw/zinc/81/45/19/1075814519.db2.gz MSCRRAJZIWXVEU-SKDRFNHKSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@](O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581825476 1075814435 /nfs/dbraw/zinc/81/44/35/1075814435.db2.gz NTOLGQWBQOMWPH-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@](O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581825476 1075814428 /nfs/dbraw/zinc/81/44/28/1075814428.db2.gz NTOLGQWBQOMWPH-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@@](O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581825477 1075814308 /nfs/dbraw/zinc/81/43/08/1075814308.db2.gz NTOLGQWBQOMWPH-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@@](O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581825477 1075814304 /nfs/dbraw/zinc/81/43/04/1075814304.db2.gz NTOLGQWBQOMWPH-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@](O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581825520 1075814326 /nfs/dbraw/zinc/81/43/26/1075814326.db2.gz PMQXUIVWOJKXOI-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@](O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581825520 1075814320 /nfs/dbraw/zinc/81/43/20/1075814320.db2.gz PMQXUIVWOJKXOI-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@@](O)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581825521 1075814538 /nfs/dbraw/zinc/81/45/38/1075814538.db2.gz PMQXUIVWOJKXOI-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@@](O)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581825521 1075814535 /nfs/dbraw/zinc/81/45/35/1075814535.db2.gz PMQXUIVWOJKXOI-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)n1 ZINC001581825606 1075814901 /nfs/dbraw/zinc/81/49/01/1075814901.db2.gz UCKFZBASHASXGZ-PELKAZGASA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)n1 ZINC001581825606 1075814894 /nfs/dbraw/zinc/81/48/94/1075814894.db2.gz UCKFZBASHASXGZ-PELKAZGASA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@H](O)C2)n1 ZINC001581825607 1075814859 /nfs/dbraw/zinc/81/48/59/1075814859.db2.gz UCKFZBASHASXGZ-PRHODGIISA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@H](O)C2)n1 ZINC001581825607 1075814855 /nfs/dbraw/zinc/81/48/55/1075814855.db2.gz UCKFZBASHASXGZ-PRHODGIISA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@H](O)C2)n1 ZINC001581825608 1075814811 /nfs/dbraw/zinc/81/48/11/1075814811.db2.gz UCKFZBASHASXGZ-QPUJVOFHSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@H](O)C2)n1 ZINC001581825608 1075814810 /nfs/dbraw/zinc/81/48/10/1075814810.db2.gz UCKFZBASHASXGZ-QPUJVOFHSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)n1 ZINC001581825609 1075814801 /nfs/dbraw/zinc/81/48/01/1075814801.db2.gz UCKFZBASHASXGZ-UFBFGSQYSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N2CC[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)n1 ZINC001581825609 1075814800 /nfs/dbraw/zinc/81/48/00/1075814800.db2.gz UCKFZBASHASXGZ-UFBFGSQYSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(c3ccc(-c4nn[n-]n4)cn3)C[C@@H]2O)c1N ZINC001581826891 1075814788 /nfs/dbraw/zinc/81/47/88/1075814788.db2.gz MFNDXNGAYKRPDP-NEPJUHHUSA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(c3ccc(-c4nnn[n-]4)cn3)C[C@@H]2O)c1N ZINC001581826891 1075814785 /nfs/dbraw/zinc/81/47/85/1075814785.db2.gz MFNDXNGAYKRPDP-NEPJUHHUSA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]2O)c1N ZINC001581826892 1075815269 /nfs/dbraw/zinc/81/52/69/1075815269.db2.gz MFNDXNGAYKRPDP-NWDGAFQWSA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(c3ccc(-c4nnn[n-]4)cn3)C[C@H]2O)c1N ZINC001581826892 1075815265 /nfs/dbraw/zinc/81/52/65/1075815265.db2.gz MFNDXNGAYKRPDP-NWDGAFQWSA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(c3ccc(-c4nn[n-]n4)cn3)C[C@@H]2O)c1N ZINC001581826893 1075815312 /nfs/dbraw/zinc/81/53/12/1075815312.db2.gz MFNDXNGAYKRPDP-RYUDHWBXSA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(c3ccc(-c4nnn[n-]4)cn3)C[C@@H]2O)c1N ZINC001581826893 1075815306 /nfs/dbraw/zinc/81/53/06/1075815306.db2.gz MFNDXNGAYKRPDP-RYUDHWBXSA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]2O)c1N ZINC001581826894 1075815242 /nfs/dbraw/zinc/81/52/42/1075815242.db2.gz MFNDXNGAYKRPDP-VXGBXAGGSA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(c3ccc(-c4nnn[n-]4)cn3)C[C@H]2O)c1N ZINC001581826894 1075815239 /nfs/dbraw/zinc/81/52/39/1075815239.db2.gz MFNDXNGAYKRPDP-VXGBXAGGSA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)n1 ZINC001581826992 1075815298 /nfs/dbraw/zinc/81/52/98/1075815298.db2.gz OHEJZSWZSPRRSV-PELKAZGASA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)n1 ZINC001581826992 1075815294 /nfs/dbraw/zinc/81/52/94/1075815294.db2.gz OHEJZSWZSPRRSV-PELKAZGASA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)n1 ZINC001581826993 1075815255 /nfs/dbraw/zinc/81/52/55/1075815255.db2.gz OHEJZSWZSPRRSV-PRHODGIISA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)n1 ZINC001581826993 1075815252 /nfs/dbraw/zinc/81/52/52/1075815252.db2.gz OHEJZSWZSPRRSV-PRHODGIISA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)n1 ZINC001581826994 1075815217 /nfs/dbraw/zinc/81/52/17/1075815217.db2.gz OHEJZSWZSPRRSV-QPUJVOFHSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)n1 ZINC001581826994 1075815214 /nfs/dbraw/zinc/81/52/14/1075815214.db2.gz OHEJZSWZSPRRSV-QPUJVOFHSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)n1 ZINC001581826996 1075815139 /nfs/dbraw/zinc/81/51/39/1075815139.db2.gz OHEJZSWZSPRRSV-UFBFGSQYSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)n1 ZINC001581826996 1075815131 /nfs/dbraw/zinc/81/51/31/1075815131.db2.gz OHEJZSWZSPRRSV-UFBFGSQYSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N2CCOC[C@@H]2CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581827106 1075815175 /nfs/dbraw/zinc/81/51/75/1075815175.db2.gz FKEAQYYGKGGTGV-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCOC[C@@H]2CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581827106 1075815172 /nfs/dbraw/zinc/81/51/72/1075815172.db2.gz FKEAQYYGKGGTGV-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCOC[C@H]2CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581827107 1075815234 /nfs/dbraw/zinc/81/52/34/1075815234.db2.gz FKEAQYYGKGGTGV-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCOC[C@H]2CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581827107 1075815228 /nfs/dbraw/zinc/81/52/28/1075815228.db2.gz FKEAQYYGKGGTGV-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC2(CCO)CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581827116 1075815115 /nfs/dbraw/zinc/81/51/15/1075815115.db2.gz OZATYJYCJLRVRC-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)NC2(CCO)CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581827116 1075815109 /nfs/dbraw/zinc/81/51/09/1075815109.db2.gz OZATYJYCJLRVRC-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)NC2(CCO)CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581827164 1075815185 /nfs/dbraw/zinc/81/51/85/1075815185.db2.gz QLNQRYJEQBNOSD-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)NC2(CCO)CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581827164 1075815182 /nfs/dbraw/zinc/81/51/82/1075815182.db2.gz QLNQRYJEQBNOSD-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)N2CCO[C@@H](CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581827254 1075815330 /nfs/dbraw/zinc/81/53/30/1075815330.db2.gz IOWBBHRINLSZSX-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCO[C@@H](CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581827254 1075815325 /nfs/dbraw/zinc/81/53/25/1075815325.db2.gz IOWBBHRINLSZSX-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCO[C@H](CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581827255 1075815700 /nfs/dbraw/zinc/81/57/00/1075815700.db2.gz IOWBBHRINLSZSX-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCO[C@H](CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581827255 1075815697 /nfs/dbraw/zinc/81/56/97/1075815697.db2.gz IOWBBHRINLSZSX-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCO[C@@H](CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581827266 1075815728 /nfs/dbraw/zinc/81/57/28/1075815728.db2.gz IVPQQTNABZNIJM-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCO[C@@H](CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581827266 1075815724 /nfs/dbraw/zinc/81/57/24/1075815724.db2.gz IVPQQTNABZNIJM-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCO[C@H](CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581827267 1075815687 /nfs/dbraw/zinc/81/56/87/1075815687.db2.gz IVPQQTNABZNIJM-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCO[C@H](CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581827267 1075815682 /nfs/dbraw/zinc/81/56/82/1075815682.db2.gz IVPQQTNABZNIJM-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCO[C@H](CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581827287 1075815671 /nfs/dbraw/zinc/81/56/71/1075815671.db2.gz JZQJSGWJGSQTBT-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCO[C@H](CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581827287 1075815667 /nfs/dbraw/zinc/81/56/67/1075815667.db2.gz JZQJSGWJGSQTBT-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCO[C@@H](CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581827288 1075815487 /nfs/dbraw/zinc/81/54/87/1075815487.db2.gz JZQJSGWJGSQTBT-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCO[C@@H](CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581827288 1075815482 /nfs/dbraw/zinc/81/54/82/1075815482.db2.gz JZQJSGWJGSQTBT-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC2(CCO)CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581827389 1075815646 /nfs/dbraw/zinc/81/56/46/1075815646.db2.gz UMHMGCIFAKCHPQ-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)NC2(CCO)CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581827389 1075815641 /nfs/dbraw/zinc/81/56/41/1075815641.db2.gz UMHMGCIFAKCHPQ-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)N2CCOC[C@H]2CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581827416 1075815516 /nfs/dbraw/zinc/81/55/16/1075815516.db2.gz LKYUIXMWWMHRLM-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCOC[C@H]2CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581827416 1075815512 /nfs/dbraw/zinc/81/55/12/1075815512.db2.gz LKYUIXMWWMHRLM-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCOC[C@@H]2CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581827417 1075815567 /nfs/dbraw/zinc/81/55/67/1075815567.db2.gz LKYUIXMWWMHRLM-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCOC[C@@H]2CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581827417 1075815563 /nfs/dbraw/zinc/81/55/63/1075815563.db2.gz LKYUIXMWWMHRLM-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCOC[C@@H]2CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581827619 1075815764 /nfs/dbraw/zinc/81/57/64/1075815764.db2.gz RTAUWMUWOHYODR-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCOC[C@@H]2CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581827619 1075815759 /nfs/dbraw/zinc/81/57/59/1075815759.db2.gz RTAUWMUWOHYODR-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCOC[C@H]2CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581827620 1075815533 /nfs/dbraw/zinc/81/55/33/1075815533.db2.gz RTAUWMUWOHYODR-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N2CCOC[C@H]2CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581827620 1075815529 /nfs/dbraw/zinc/81/55/29/1075815529.db2.gz RTAUWMUWOHYODR-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)n1 ZINC001581827733 1075816081 /nfs/dbraw/zinc/81/60/81/1075816081.db2.gz YVNWLJKLNNVSKY-BXKDBHETSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)n1 ZINC001581827733 1075816078 /nfs/dbraw/zinc/81/60/78/1075816078.db2.gz YVNWLJKLNNVSKY-BXKDBHETSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)n1 ZINC001581827734 1075815885 /nfs/dbraw/zinc/81/58/85/1075815885.db2.gz YVNWLJKLNNVSKY-CABZTGNLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)n1 ZINC001581827734 1075815883 /nfs/dbraw/zinc/81/58/83/1075815883.db2.gz YVNWLJKLNNVSKY-CABZTGNLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)n1 ZINC001581827735 1075815931 /nfs/dbraw/zinc/81/59/31/1075815931.db2.gz YVNWLJKLNNVSKY-JOYOIKCWSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)n1 ZINC001581827735 1075815924 /nfs/dbraw/zinc/81/59/24/1075815924.db2.gz YVNWLJKLNNVSKY-JOYOIKCWSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)n1 ZINC001581827736 1075816008 /nfs/dbraw/zinc/81/60/08/1075816008.db2.gz YVNWLJKLNNVSKY-SKDRFNHKSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)n1 ZINC001581827736 1075816005 /nfs/dbraw/zinc/81/60/05/1075816005.db2.gz YVNWLJKLNNVSKY-SKDRFNHKSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(c3ccc(-c4nn[n-]n4)nc3)C[C@@H]2O)c1N ZINC001581827743 1075815917 /nfs/dbraw/zinc/81/59/17/1075815917.db2.gz YYRDHJBLRDXOOU-AAEUAGOBSA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(c3ccc(-c4nnn[n-]4)nc3)C[C@@H]2O)c1N ZINC001581827743 1075815915 /nfs/dbraw/zinc/81/59/15/1075815915.db2.gz YYRDHJBLRDXOOU-AAEUAGOBSA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]2O)c1N ZINC001581827744 1075815997 /nfs/dbraw/zinc/81/59/97/1075815997.db2.gz YYRDHJBLRDXOOU-DGCLKSJQSA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]2O)c1N ZINC001581827744 1075815994 /nfs/dbraw/zinc/81/59/94/1075815994.db2.gz YYRDHJBLRDXOOU-DGCLKSJQSA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]2O)c1N ZINC001581827745 1075815894 /nfs/dbraw/zinc/81/58/94/1075815894.db2.gz YYRDHJBLRDXOOU-WCQYABFASA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]2O)c1N ZINC001581827745 1075815893 /nfs/dbraw/zinc/81/58/93/1075815893.db2.gz YYRDHJBLRDXOOU-WCQYABFASA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(c3ccc(-c4nn[n-]n4)nc3)C[C@@H]2O)c1N ZINC001581827746 1075816018 /nfs/dbraw/zinc/81/60/18/1075816018.db2.gz YYRDHJBLRDXOOU-YPMHNXCESA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(c3ccc(-c4nnn[n-]4)nc3)C[C@@H]2O)c1N ZINC001581827746 1075816015 /nfs/dbraw/zinc/81/60/15/1075816015.db2.gz YYRDHJBLRDXOOU-YPMHNXCESA-N -1 3 384.404 -1.053 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)n1 ZINC001581827774 1075815976 /nfs/dbraw/zinc/81/59/76/1075815976.db2.gz ZRNWYAOBOZWSQV-BXKDBHETSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)n1 ZINC001581827774 1075815971 /nfs/dbraw/zinc/81/59/71/1075815971.db2.gz ZRNWYAOBOZWSQV-BXKDBHETSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)n1 ZINC001581827775 1075815901 /nfs/dbraw/zinc/81/59/01/1075815901.db2.gz ZRNWYAOBOZWSQV-CABZTGNLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)n1 ZINC001581827775 1075815898 /nfs/dbraw/zinc/81/58/98/1075815898.db2.gz ZRNWYAOBOZWSQV-CABZTGNLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)n1 ZINC001581827776 1075815908 /nfs/dbraw/zinc/81/59/08/1075815908.db2.gz ZRNWYAOBOZWSQV-JOYOIKCWSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)n1 ZINC001581827776 1075815907 /nfs/dbraw/zinc/81/59/07/1075815907.db2.gz ZRNWYAOBOZWSQV-JOYOIKCWSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)n1 ZINC001581827777 1075816070 /nfs/dbraw/zinc/81/60/70/1075816070.db2.gz ZRNWYAOBOZWSQV-SKDRFNHKSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)n1 ZINC001581827777 1075816068 /nfs/dbraw/zinc/81/60/68/1075816068.db2.gz ZRNWYAOBOZWSQV-SKDRFNHKSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1ncc(C(=O)NC[C@@]2(O)CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581827917 1075815941 /nfs/dbraw/zinc/81/59/41/1075815941.db2.gz CFQNTUCOVGPRQQ-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)NC[C@@]2(O)CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581827917 1075815937 /nfs/dbraw/zinc/81/59/37/1075815937.db2.gz CFQNTUCOVGPRQQ-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)NC[C@]2(O)CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581827918 1075816309 /nfs/dbraw/zinc/81/63/09/1075816309.db2.gz CFQNTUCOVGPRQQ-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)NC[C@]2(O)CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581827918 1075816304 /nfs/dbraw/zinc/81/63/04/1075816304.db2.gz CFQNTUCOVGPRQQ-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)NC[C@@]2(O)CCN(c3ccc(-c4nn[n-]n4)cn3)C2)c1N ZINC001581828054 1075816428 /nfs/dbraw/zinc/81/64/28/1075816428.db2.gz GZQRFVNLHGYJTE-INIZCTEOSA-N -1 3 384.404 -1.051 20 0 GAADHM Cn1ncc(C(=O)NC[C@@]2(O)CCN(c3ccc(-c4nnn[n-]4)cn3)C2)c1N ZINC001581828054 1075816426 /nfs/dbraw/zinc/81/64/26/1075816426.db2.gz GZQRFVNLHGYJTE-INIZCTEOSA-N -1 3 384.404 -1.051 20 0 GAADHM Cn1ncc(C(=O)NC[C@]2(O)CCN(c3ccc(-c4nn[n-]n4)cn3)C2)c1N ZINC001581828055 1075816399 /nfs/dbraw/zinc/81/63/99/1075816399.db2.gz GZQRFVNLHGYJTE-MRXNPFEDSA-N -1 3 384.404 -1.051 20 0 GAADHM Cn1ncc(C(=O)NC[C@]2(O)CCN(c3ccc(-c4nnn[n-]4)cn3)C2)c1N ZINC001581828055 1075816396 /nfs/dbraw/zinc/81/63/96/1075816396.db2.gz GZQRFVNLHGYJTE-MRXNPFEDSA-N -1 3 384.404 -1.051 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]2O)n1 ZINC001581828059 1075816465 /nfs/dbraw/zinc/81/64/65/1075816465.db2.gz HEFQUSLCDKUEJO-CMPLNLGQSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]2O)n1 ZINC001581828059 1075816461 /nfs/dbraw/zinc/81/64/61/1075816461.db2.gz HEFQUSLCDKUEJO-CMPLNLGQSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(c3ncc(-c4nn[n-]n4)cc3F)C[C@@H]2O)n1 ZINC001581828060 1075816381 /nfs/dbraw/zinc/81/63/81/1075816381.db2.gz HEFQUSLCDKUEJO-JQWIXIFHSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1ncc(C(=O)N[C@H]2CCN(c3ncc(-c4nnn[n-]4)cc3F)C[C@@H]2O)n1 ZINC001581828060 1075816377 /nfs/dbraw/zinc/81/63/77/1075816377.db2.gz HEFQUSLCDKUEJO-JQWIXIFHSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(c3ncc(-c4nn[n-]n4)cc3F)C[C@@H]2O)n1 ZINC001581828061 1075816343 /nfs/dbraw/zinc/81/63/43/1075816343.db2.gz HEFQUSLCDKUEJO-PWSUYJOCSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(c3ncc(-c4nnn[n-]4)cc3F)C[C@@H]2O)n1 ZINC001581828061 1075816341 /nfs/dbraw/zinc/81/63/41/1075816341.db2.gz HEFQUSLCDKUEJO-PWSUYJOCSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]2O)n1 ZINC001581828062 1075816273 /nfs/dbraw/zinc/81/62/73/1075816273.db2.gz HEFQUSLCDKUEJO-ZYHUDNBSSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1ncc(C(=O)N[C@@H]2CCN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]2O)n1 ZINC001581828062 1075816270 /nfs/dbraw/zinc/81/62/70/1075816270.db2.gz HEFQUSLCDKUEJO-ZYHUDNBSSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1ncc(C(=O)NC[C@@]2(O)CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581828132 1075816455 /nfs/dbraw/zinc/81/64/55/1075816455.db2.gz JKLYRLRNTLNKBY-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)NC[C@@]2(O)CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581828132 1075816453 /nfs/dbraw/zinc/81/64/53/1075816453.db2.gz JKLYRLRNTLNKBY-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)NC[C@]2(O)CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581828133 1075816282 /nfs/dbraw/zinc/81/62/82/1075816282.db2.gz JKLYRLRNTLNKBY-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)NC[C@]2(O)CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581828133 1075816280 /nfs/dbraw/zinc/81/62/80/1075816280.db2.gz JKLYRLRNTLNKBY-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1ncc(C(=O)NC[C@@]2(O)CCN(c3ncc(-c4nn[n-]n4)cc3F)C2)n1 ZINC001581828203 1075816319 /nfs/dbraw/zinc/81/63/19/1075816319.db2.gz LSUTVLWHVRNSHZ-HNNXBMFYSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1ncc(C(=O)NC[C@@]2(O)CCN(c3ncc(-c4nnn[n-]4)cc3F)C2)n1 ZINC001581828203 1075816316 /nfs/dbraw/zinc/81/63/16/1075816316.db2.gz LSUTVLWHVRNSHZ-HNNXBMFYSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1ncc(C(=O)NC[C@]2(O)CCN(c3ncc(-c4nn[n-]n4)cc3F)C2)n1 ZINC001581828204 1075816337 /nfs/dbraw/zinc/81/63/37/1075816337.db2.gz LSUTVLWHVRNSHZ-OAHLLOKOSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1ncc(C(=O)NC[C@]2(O)CCN(c3ncc(-c4nnn[n-]4)cc3F)C2)n1 ZINC001581828204 1075816336 /nfs/dbraw/zinc/81/63/36/1075816336.db2.gz LSUTVLWHVRNSHZ-OAHLLOKOSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1ncc(C(=O)NC[C@@]2(O)CCN(c3ncccc3-c3nn[n-]n3)C2)c1N ZINC001581828365 1075816436 /nfs/dbraw/zinc/81/64/36/1075816436.db2.gz RHGUFOSFEWXTGZ-INIZCTEOSA-N -1 3 384.404 -1.051 20 0 GAADHM Cn1ncc(C(=O)NC[C@@]2(O)CCN(c3ncccc3-c3nnn[n-]3)C2)c1N ZINC001581828365 1075816434 /nfs/dbraw/zinc/81/64/34/1075816434.db2.gz RHGUFOSFEWXTGZ-INIZCTEOSA-N -1 3 384.404 -1.051 20 0 GAADHM Cn1ncc(C(=O)NC[C@]2(O)CCN(c3ncccc3-c3nn[n-]n3)C2)c1N ZINC001581828366 1075816295 /nfs/dbraw/zinc/81/62/95/1075816295.db2.gz RHGUFOSFEWXTGZ-MRXNPFEDSA-N -1 3 384.404 -1.051 20 0 GAADHM Cn1ncc(C(=O)NC[C@]2(O)CCN(c3ncccc3-c3nnn[n-]3)C2)c1N ZINC001581828366 1075816290 /nfs/dbraw/zinc/81/62/90/1075816290.db2.gz RHGUFOSFEWXTGZ-MRXNPFEDSA-N -1 3 384.404 -1.051 20 0 GAADHM Cn1ncc(C(=O)NC[C@@]2(O)CCN(c3ccc(-c4nn[n-]n4)nc3)C2)c1N ZINC001581828434 1075816665 /nfs/dbraw/zinc/81/66/65/1075816665.db2.gz USVSBSOCVRINIJ-INIZCTEOSA-N -1 3 384.404 -1.051 20 0 GAADHM Cn1ncc(C(=O)NC[C@@]2(O)CCN(c3ccc(-c4nnn[n-]4)nc3)C2)c1N ZINC001581828434 1075816658 /nfs/dbraw/zinc/81/66/58/1075816658.db2.gz USVSBSOCVRINIJ-INIZCTEOSA-N -1 3 384.404 -1.051 20 0 GAADHM Cn1ncc(C(=O)NC[C@]2(O)CCN(c3ccc(-c4nn[n-]n4)nc3)C2)c1N ZINC001581828435 1075816852 /nfs/dbraw/zinc/81/68/52/1075816852.db2.gz USVSBSOCVRINIJ-MRXNPFEDSA-N -1 3 384.404 -1.051 20 0 GAADHM Cn1ncc(C(=O)NC[C@]2(O)CCN(c3ccc(-c4nnn[n-]4)nc3)C2)c1N ZINC001581828435 1075816849 /nfs/dbraw/zinc/81/68/49/1075816849.db2.gz USVSBSOCVRINIJ-MRXNPFEDSA-N -1 3 384.404 -1.051 20 0 GAADHM Cn1ncc(C(=O)NCCN2CCN(c3ccc(-c4nn[n-]n4)cn3)CC2)n1 ZINC001581829472 1075816837 /nfs/dbraw/zinc/81/68/37/1075816837.db2.gz FOBDWCXEWJNMPN-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1ncc(C(=O)NCCN2CCN(c3ccc(-c4nnn[n-]4)cn3)CC2)n1 ZINC001581829472 1075816835 /nfs/dbraw/zinc/81/68/35/1075816835.db2.gz FOBDWCXEWJNMPN-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1ncc(C(=O)NCCCOCCNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581829658 1075817132 /nfs/dbraw/zinc/81/71/32/1075817132.db2.gz LMHOMTYXPPPDPV-UHFFFAOYSA-N -1 3 388.392 -1.110 20 0 GAADHM Cn1ncc(C(=O)NCCCOCCNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581829658 1075817128 /nfs/dbraw/zinc/81/71/28/1075817128.db2.gz LMHOMTYXPPPDPV-UHFFFAOYSA-N -1 3 388.392 -1.110 20 0 GAADHM Cn1ncc(C(=O)NCCN2CCN(c3ccc(-c4nn[n-]n4)nc3)CC2)n1 ZINC001581829764 1075817182 /nfs/dbraw/zinc/81/71/82/1075817182.db2.gz PGYZHEGRHZDYJH-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1ncc(C(=O)NCCN2CCN(c3ccc(-c4nnn[n-]4)nc3)CC2)n1 ZINC001581829764 1075817177 /nfs/dbraw/zinc/81/71/77/1075817177.db2.gz PGYZHEGRHZDYJH-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1ncc(C(=O)NC[C@H]2COCCN2C(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581829794 1075817108 /nfs/dbraw/zinc/81/71/08/1075817108.db2.gz QTIKNGXSDXNBPO-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@H]2COCCN2C(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581829794 1075817104 /nfs/dbraw/zinc/81/71/04/1075817104.db2.gz QTIKNGXSDXNBPO-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@@H]2COCCN2C(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581829795 1075817171 /nfs/dbraw/zinc/81/71/71/1075817171.db2.gz QTIKNGXSDXNBPO-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@@H]2COCCN2C(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581829795 1075817168 /nfs/dbraw/zinc/81/71/68/1075817168.db2.gz QTIKNGXSDXNBPO-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@@H]2COCCN2C(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581829868 1075816997 /nfs/dbraw/zinc/81/69/97/1075816997.db2.gz UIFWSWPGRVBKSI-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@@H]2COCCN2C(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581829868 1075816993 /nfs/dbraw/zinc/81/69/93/1075816993.db2.gz UIFWSWPGRVBKSI-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@H]2COCCN2C(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581829869 1075817026 /nfs/dbraw/zinc/81/70/26/1075817026.db2.gz UIFWSWPGRVBKSI-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@H]2COCCN2C(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581829869 1075817024 /nfs/dbraw/zinc/81/70/24/1075817024.db2.gz UIFWSWPGRVBKSI-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)CCO2)n1 ZINC001581829877 1075816980 /nfs/dbraw/zinc/81/69/80/1075816980.db2.gz URWATXKAXGJXQL-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)CCO2)n1 ZINC001581829877 1075816978 /nfs/dbraw/zinc/81/69/78/1075816978.db2.gz URWATXKAXGJXQL-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)CCO2)n1 ZINC001581829878 1075817067 /nfs/dbraw/zinc/81/70/67/1075817067.db2.gz URWATXKAXGJXQL-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)CCO2)n1 ZINC001581829878 1075817061 /nfs/dbraw/zinc/81/70/61/1075817061.db2.gz URWATXKAXGJXQL-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@H]2COCCN2C(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581829881 1075817089 /nfs/dbraw/zinc/81/70/89/1075817089.db2.gz UWGJRMGQYNOGNN-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@H]2COCCN2C(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581829881 1075817086 /nfs/dbraw/zinc/81/70/86/1075817086.db2.gz UWGJRMGQYNOGNN-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@@H]2COCCN2C(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581829882 1075817036 /nfs/dbraw/zinc/81/70/36/1075817036.db2.gz UWGJRMGQYNOGNN-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@@H]2COCCN2C(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581829882 1075817033 /nfs/dbraw/zinc/81/70/33/1075817033.db2.gz UWGJRMGQYNOGNN-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CCO2)n1 ZINC001581829883 1075817162 /nfs/dbraw/zinc/81/71/62/1075817162.db2.gz UWHCBIIZRQSDNC-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CCO2)n1 ZINC001581829883 1075817157 /nfs/dbraw/zinc/81/71/57/1075817157.db2.gz UWHCBIIZRQSDNC-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CCO2)n1 ZINC001581829884 1075817015 /nfs/dbraw/zinc/81/70/15/1075817015.db2.gz UWHCBIIZRQSDNC-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CCO2)n1 ZINC001581829884 1075817012 /nfs/dbraw/zinc/81/70/12/1075817012.db2.gz UWHCBIIZRQSDNC-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)CCO2)n1 ZINC001581829886 1075817121 /nfs/dbraw/zinc/81/71/21/1075817121.db2.gz UWTZIUMPDIDRSQ-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)CCO2)n1 ZINC001581829886 1075817117 /nfs/dbraw/zinc/81/71/17/1075817117.db2.gz UWTZIUMPDIDRSQ-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)CCO2)n1 ZINC001581829887 1075817427 /nfs/dbraw/zinc/81/74/27/1075817427.db2.gz UWTZIUMPDIDRSQ-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(C(=O)NC[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)CCO2)n1 ZINC001581829887 1075817426 /nfs/dbraw/zinc/81/74/26/1075817426.db2.gz UWTZIUMPDIDRSQ-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1ncc(CCC(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@@H]2O)n1 ZINC001581831652 1075817819 /nfs/dbraw/zinc/81/78/19/1075817819.db2.gz DQTWGWUXXGRDGZ-OLZOCXBDSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1ncc(CCC(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@@H]2O)n1 ZINC001581831652 1075817814 /nfs/dbraw/zinc/81/78/14/1075817814.db2.gz DQTWGWUXXGRDGZ-OLZOCXBDSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1ncc(CCC(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]2O)n1 ZINC001581831682 1075818009 /nfs/dbraw/zinc/81/80/09/1075818009.db2.gz FVNBKUYOMYEXSU-CHWSQXEVSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1ncc(CCC(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@H]2O)n1 ZINC001581831682 1075818005 /nfs/dbraw/zinc/81/80/05/1075818005.db2.gz FVNBKUYOMYEXSU-CHWSQXEVSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1ncc(CCC(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@@H]2O)n1 ZINC001581831683 1075817764 /nfs/dbraw/zinc/81/77/64/1075817764.db2.gz FVNBKUYOMYEXSU-OLZOCXBDSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1ncc(CCC(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@@H]2O)n1 ZINC001581831683 1075817758 /nfs/dbraw/zinc/81/77/58/1075817758.db2.gz FVNBKUYOMYEXSU-OLZOCXBDSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1ncc(CCC(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@@H]2O)n1 ZINC001581831936 1075817744 /nfs/dbraw/zinc/81/77/44/1075817744.db2.gz OHDCJOZFZVXOHH-KGLIPLIRSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1ncc(CCC(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@@H]2O)n1 ZINC001581831936 1075817740 /nfs/dbraw/zinc/81/77/40/1075817740.db2.gz OHDCJOZFZVXOHH-KGLIPLIRSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1ncc(CCC(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]2O)n1 ZINC001581831937 1075817907 /nfs/dbraw/zinc/81/79/07/1075817907.db2.gz OHDCJOZFZVXOHH-ZIAGYGMSSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1ncc(CCC(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]2O)n1 ZINC001581831937 1075817900 /nfs/dbraw/zinc/81/79/00/1075817900.db2.gz OHDCJOZFZVXOHH-ZIAGYGMSSA-N -1 3 384.404 -1.311 20 0 GAADHM Cn1ncc(CN2CCN(CCNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)n1 ZINC001581832214 1075817984 /nfs/dbraw/zinc/81/79/84/1075817984.db2.gz AJPALWXIHUZWDS-UHFFFAOYSA-N -1 3 385.436 -1.129 20 0 GAADHM Cn1ncc(CN2CCN(CCNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)n1 ZINC001581832214 1075817979 /nfs/dbraw/zinc/81/79/79/1075817979.db2.gz AJPALWXIHUZWDS-UHFFFAOYSA-N -1 3 385.436 -1.129 20 0 GAADHM Cn1ncc(CN2CCN(CCNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)CC2)n1 ZINC001581832263 1075818161 /nfs/dbraw/zinc/81/81/61/1075818161.db2.gz CVOAVCKFHQBZAQ-UHFFFAOYSA-N -1 3 385.436 -1.129 20 0 GAADHM Cn1ncc(CN2CCN(CCNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)CC2)n1 ZINC001581832263 1075818155 /nfs/dbraw/zinc/81/81/55/1075818155.db2.gz CVOAVCKFHQBZAQ-UHFFFAOYSA-N -1 3 385.436 -1.129 20 0 GAADHM Cn1ncc(CN2CCN(CCNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2)n1 ZINC001581833325 1075818253 /nfs/dbraw/zinc/81/82/53/1075818253.db2.gz WVAJMPFHRPYPPB-UHFFFAOYSA-N -1 3 385.436 -1.129 20 0 GAADHM Cn1ncc(CN2CCN(CCNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2)n1 ZINC001581833325 1075818248 /nfs/dbraw/zinc/81/82/48/1075818248.db2.gz WVAJMPFHRPYPPB-UHFFFAOYSA-N -1 3 385.436 -1.129 20 0 GAADHM Cn1nccc1C(=O)N1CC(CCO)(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581833818 1075818353 /nfs/dbraw/zinc/81/83/53/1075818353.db2.gz GPFJKUBBYIFKBS-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)N1CC(CCO)(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581833818 1075818347 /nfs/dbraw/zinc/81/83/47/1075818347.db2.gz GPFJKUBBYIFKBS-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)N1CC(CCO)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581833959 1075818206 /nfs/dbraw/zinc/81/82/06/1075818206.db2.gz NHGGTDZDZUOMQJ-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)N1CC(CCO)(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581833959 1075818203 /nfs/dbraw/zinc/81/82/03/1075818203.db2.gz NHGGTDZDZUOMQJ-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)N1CC(CCO)(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581834247 1075818428 /nfs/dbraw/zinc/81/84/28/1075818428.db2.gz ZDRQCCOCCFPVRJ-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)N1CC(CCO)(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581834247 1075818423 /nfs/dbraw/zinc/81/84/23/1075818423.db2.gz ZDRQCCOCCFPVRJ-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)N[C@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O ZINC001581834331 1075818143 /nfs/dbraw/zinc/81/81/43/1075818143.db2.gz BIHNNJLYCFHICI-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N[C@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O ZINC001581834331 1075818140 /nfs/dbraw/zinc/81/81/40/1075818140.db2.gz BIHNNJLYCFHICI-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N[C@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1O ZINC001581834332 1075818178 /nfs/dbraw/zinc/81/81/78/1075818178.db2.gz BIHNNJLYCFHICI-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N[C@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1O ZINC001581834332 1075818172 /nfs/dbraw/zinc/81/81/72/1075818172.db2.gz BIHNNJLYCFHICI-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O ZINC001581834333 1075818383 /nfs/dbraw/zinc/81/83/83/1075818383.db2.gz BIHNNJLYCFHICI-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O ZINC001581834333 1075818378 /nfs/dbraw/zinc/81/83/78/1075818378.db2.gz BIHNNJLYCFHICI-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1O ZINC001581834334 1075818412 /nfs/dbraw/zinc/81/84/12/1075818412.db2.gz BIHNNJLYCFHICI-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1O ZINC001581834334 1075818409 /nfs/dbraw/zinc/81/84/09/1075818409.db2.gz BIHNNJLYCFHICI-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)NC1(CCO)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581834568 1075818219 /nfs/dbraw/zinc/81/82/19/1075818219.db2.gz JUCYFFVQUHTKGX-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)NC1(CCO)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581834568 1075818215 /nfs/dbraw/zinc/81/82/15/1075818215.db2.gz JUCYFFVQUHTKGX-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O ZINC001581834700 1075818235 /nfs/dbraw/zinc/81/82/35/1075818235.db2.gz MAOHIKFCJZZPFP-NOZJJQNGSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O ZINC001581834700 1075818231 /nfs/dbraw/zinc/81/82/31/1075818231.db2.gz MAOHIKFCJZZPFP-NOZJJQNGSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O ZINC001581834702 1075818309 /nfs/dbraw/zinc/81/83/09/1075818309.db2.gz MAOHIKFCJZZPFP-RNCFNFMXSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O ZINC001581834702 1075818303 /nfs/dbraw/zinc/81/83/03/1075818303.db2.gz MAOHIKFCJZZPFP-RNCFNFMXSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O ZINC001581834704 1075818368 /nfs/dbraw/zinc/81/83/68/1075818368.db2.gz MAOHIKFCJZZPFP-TVQRCGJNSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O ZINC001581834704 1075818363 /nfs/dbraw/zinc/81/83/63/1075818363.db2.gz MAOHIKFCJZZPFP-TVQRCGJNSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O ZINC001581834706 1075818674 /nfs/dbraw/zinc/81/86/74/1075818674.db2.gz MAOHIKFCJZZPFP-ZANVPECISA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O ZINC001581834706 1075818670 /nfs/dbraw/zinc/81/86/70/1075818670.db2.gz MAOHIKFCJZZPFP-ZANVPECISA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)NCCN1CCN(c2cnc(-c3nnn[n-]3)cn2)CC1 ZINC001581834949 1075818592 /nfs/dbraw/zinc/81/85/92/1075818592.db2.gz GPKNWWXZEPQKQY-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1nccc1C(=O)NC1(CCO)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581835293 1075818614 /nfs/dbraw/zinc/81/86/14/1075818614.db2.gz QLWWZMLTEIMLLD-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)NC1(CCO)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581835293 1075818612 /nfs/dbraw/zinc/81/86/12/1075818612.db2.gz QLWWZMLTEIMLLD-UHFFFAOYSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581835635 1075818633 /nfs/dbraw/zinc/81/86/33/1075818633.db2.gz LHWORDWQUOHLHX-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581835635 1075818631 /nfs/dbraw/zinc/81/86/31/1075818631.db2.gz LHWORDWQUOHLHX-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)NC[C@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581835637 1075818687 /nfs/dbraw/zinc/81/86/87/1075818687.db2.gz LHWORDWQUOHLHX-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)NC[C@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581835637 1075818685 /nfs/dbraw/zinc/81/86/85/1075818685.db2.gz LHWORDWQUOHLHX-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581836739 1075818651 /nfs/dbraw/zinc/81/86/51/1075818651.db2.gz XFCDJOWGAPFYIK-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581836739 1075818648 /nfs/dbraw/zinc/81/86/48/1075818648.db2.gz XFCDJOWGAPFYIK-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581836740 1075818723 /nfs/dbraw/zinc/81/87/23/1075818723.db2.gz XFCDJOWGAPFYIK-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581836740 1075818720 /nfs/dbraw/zinc/81/87/20/1075818720.db2.gz XFCDJOWGAPFYIK-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001581836937 1075818622 /nfs/dbraw/zinc/81/86/22/1075818622.db2.gz MBGXQBWJBORZQA-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001581836937 1075818620 /nfs/dbraw/zinc/81/86/20/1075818620.db2.gz MBGXQBWJBORZQA-GWCFXTLKSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@H](O)C1 ZINC001581836938 1075818775 /nfs/dbraw/zinc/81/87/75/1075818775.db2.gz MBGXQBWJBORZQA-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@H](O)C1 ZINC001581836938 1075818770 /nfs/dbraw/zinc/81/87/70/1075818770.db2.gz MBGXQBWJBORZQA-GXFFZTMASA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001581836939 1075818784 /nfs/dbraw/zinc/81/87/84/1075818784.db2.gz MBGXQBWJBORZQA-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001581836939 1075818780 /nfs/dbraw/zinc/81/87/80/1075818780.db2.gz MBGXQBWJBORZQA-MFKMUULPSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@H](O)C1 ZINC001581836940 1075818642 /nfs/dbraw/zinc/81/86/42/1075818642.db2.gz MBGXQBWJBORZQA-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@H](O)C1 ZINC001581836940 1075818639 /nfs/dbraw/zinc/81/86/39/1075818639.db2.gz MBGXQBWJBORZQA-ZWNOBZJWSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@](O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581837099 1075818568 /nfs/dbraw/zinc/81/85/68/1075818568.db2.gz RXBMJWJSPRSCML-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@](O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581837099 1075818564 /nfs/dbraw/zinc/81/85/64/1075818564.db2.gz RXBMJWJSPRSCML-INIZCTEOSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@@](O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581837100 1075818581 /nfs/dbraw/zinc/81/85/81/1075818581.db2.gz RXBMJWJSPRSCML-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@@](O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581837100 1075818577 /nfs/dbraw/zinc/81/85/77/1075818577.db2.gz RXBMJWJSPRSCML-MRXNPFEDSA-N -1 3 385.388 -1.065 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1 ZINC001581837242 1075818606 /nfs/dbraw/zinc/81/86/06/1075818606.db2.gz XQUXQJRFSXIYMO-NOZJJQNGSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H](O)C1 ZINC001581837242 1075818602 /nfs/dbraw/zinc/81/86/02/1075818602.db2.gz XQUXQJRFSXIYMO-NOZJJQNGSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001581837243 1075818628 /nfs/dbraw/zinc/81/86/28/1075818628.db2.gz XQUXQJRFSXIYMO-RNCFNFMXSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001581837243 1075818626 /nfs/dbraw/zinc/81/86/26/1075818626.db2.gz XQUXQJRFSXIYMO-RNCFNFMXSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1 ZINC001581837244 1075818709 /nfs/dbraw/zinc/81/87/09/1075818709.db2.gz XQUXQJRFSXIYMO-TVQRCGJNSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H](O)C1 ZINC001581837244 1075818707 /nfs/dbraw/zinc/81/87/07/1075818707.db2.gz XQUXQJRFSXIYMO-TVQRCGJNSA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001581837245 1075818926 /nfs/dbraw/zinc/81/89/26/1075818926.db2.gz XQUXQJRFSXIYMO-ZANVPECISA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1C(=O)N1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001581837245 1075818921 /nfs/dbraw/zinc/81/89/21/1075818921.db2.gz XQUXQJRFSXIYMO-ZANVPECISA-N -1 3 385.388 -1.066 20 0 GAADHM Cn1nccc1CC(=O)NCCN(CCO)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581837813 1075818995 /nfs/dbraw/zinc/81/89/95/1075818995.db2.gz APOHRSWRCPCXGY-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1nccc1CC(=O)NCCN(CCO)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581837813 1075818992 /nfs/dbraw/zinc/81/89/92/1075818992.db2.gz APOHRSWRCPCXGY-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581837823 1075819151 /nfs/dbraw/zinc/81/91/51/1075819151.db2.gz BFCJMVFBMHDQAY-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581837823 1075819146 /nfs/dbraw/zinc/81/91/46/1075819146.db2.gz BFCJMVFBMHDQAY-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581837824 1075819043 /nfs/dbraw/zinc/81/90/43/1075819043.db2.gz BFCJMVFBMHDQAY-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581837824 1075819039 /nfs/dbraw/zinc/81/90/39/1075819039.db2.gz BFCJMVFBMHDQAY-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CC(=O)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581838006 1075819055 /nfs/dbraw/zinc/81/90/55/1075819055.db2.gz IASUMFXGVNKYDM-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1nccc1CC(=O)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581838006 1075819051 /nfs/dbraw/zinc/81/90/51/1075819051.db2.gz IASUMFXGVNKYDM-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1nccc1CC(=O)N1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001581838007 1075819125 /nfs/dbraw/zinc/81/91/25/1075819125.db2.gz IASUMFXGVNKYDM-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1nccc1CC(=O)N1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001581838007 1075819121 /nfs/dbraw/zinc/81/91/21/1075819121.db2.gz IASUMFXGVNKYDM-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@H](CO)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581838118 1075819016 /nfs/dbraw/zinc/81/90/16/1075819016.db2.gz LDCUTRNEFDGFEZ-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@H](CO)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581838118 1075819015 /nfs/dbraw/zinc/81/90/15/1075819015.db2.gz LDCUTRNEFDGFEZ-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@@H](CO)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581838119 1075819169 /nfs/dbraw/zinc/81/91/69/1075819169.db2.gz LDCUTRNEFDGFEZ-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@@H](CO)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581838119 1075819163 /nfs/dbraw/zinc/81/91/63/1075819163.db2.gz LDCUTRNEFDGFEZ-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CC(=O)N1CC(O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581838136 1075819008 /nfs/dbraw/zinc/81/90/08/1075819008.db2.gz LVGLKUPOQXDPOI-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1nccc1CC(=O)N1CC(O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581838136 1075819004 /nfs/dbraw/zinc/81/90/04/1075819004.db2.gz LVGLKUPOQXDPOI-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@@H](CO)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581838153 1075819138 /nfs/dbraw/zinc/81/91/38/1075819138.db2.gz MHGBKVQXGKEIHQ-JTQLQIEISA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@@H](CO)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581838153 1075819134 /nfs/dbraw/zinc/81/91/34/1075819134.db2.gz MHGBKVQXGKEIHQ-JTQLQIEISA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@H](CO)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581838154 1075819030 /nfs/dbraw/zinc/81/90/30/1075819030.db2.gz MHGBKVQXGKEIHQ-SNVBAGLBSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@H](CO)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581838154 1075819025 /nfs/dbraw/zinc/81/90/25/1075819025.db2.gz MHGBKVQXGKEIHQ-SNVBAGLBSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CC(=O)NCCN(CCO)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581838252 1075818976 /nfs/dbraw/zinc/81/89/76/1075818976.db2.gz PRTWVSYWJCQZLG-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1nccc1CC(=O)NCCN(CCO)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581838252 1075818972 /nfs/dbraw/zinc/81/89/72/1075818972.db2.gz PRTWVSYWJCQZLG-UHFFFAOYSA-N -1 3 387.404 -1.278 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581838261 1075818952 /nfs/dbraw/zinc/81/89/52/1075818952.db2.gz QAYBVRFDTURDAW-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581838261 1075818949 /nfs/dbraw/zinc/81/89/49/1075818949.db2.gz QAYBVRFDTURDAW-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581838262 1075819085 /nfs/dbraw/zinc/81/90/85/1075819085.db2.gz QAYBVRFDTURDAW-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581838262 1075819080 /nfs/dbraw/zinc/81/90/80/1075819080.db2.gz QAYBVRFDTURDAW-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CC(=O)N1C[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001581838326 1075819433 /nfs/dbraw/zinc/81/94/33/1075819433.db2.gz RWUZBZOMSOBQEG-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1nccc1CC(=O)N1C[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001581838326 1075819429 /nfs/dbraw/zinc/81/94/29/1075819429.db2.gz RWUZBZOMSOBQEG-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1nccc1CCC(=O)N1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001581838330 1075819511 /nfs/dbraw/zinc/81/95/11/1075819511.db2.gz RYXKONHCSCXXGW-KGLIPLIRSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1nccc1CCC(=O)N1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001581838330 1075819509 /nfs/dbraw/zinc/81/95/09/1075819509.db2.gz RYXKONHCSCXXGW-KGLIPLIRSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1nccc1CCC(=O)N[C@H](CO)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581838333 1075819525 /nfs/dbraw/zinc/81/95/25/1075819525.db2.gz RZZUUJRNNFGDRF-JTQLQIEISA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)N[C@H](CO)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581838333 1075819524 /nfs/dbraw/zinc/81/95/24/1075819524.db2.gz RZZUUJRNNFGDRF-JTQLQIEISA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)N[C@@H](CO)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581838334 1075819474 /nfs/dbraw/zinc/81/94/74/1075819474.db2.gz RZZUUJRNNFGDRF-SNVBAGLBSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)N[C@@H](CO)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581838334 1075819469 /nfs/dbraw/zinc/81/94/69/1075819469.db2.gz RZZUUJRNNFGDRF-SNVBAGLBSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CC(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581838388 1075819367 /nfs/dbraw/zinc/81/93/67/1075819367.db2.gz USJSXHPBPYACIY-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1nccc1CC(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581838388 1075819363 /nfs/dbraw/zinc/81/93/63/1075819363.db2.gz USJSXHPBPYACIY-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1nccc1CC(=O)N1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001581838389 1075819447 /nfs/dbraw/zinc/81/94/47/1075819447.db2.gz USJSXHPBPYACIY-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1nccc1CC(=O)N1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001581838389 1075819443 /nfs/dbraw/zinc/81/94/43/1075819443.db2.gz USJSXHPBPYACIY-OLZOCXBDSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581838468 1075819294 /nfs/dbraw/zinc/81/92/94/1075819294.db2.gz WXZGROCDIMYNPI-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581838468 1075819291 /nfs/dbraw/zinc/81/92/91/1075819291.db2.gz WXZGROCDIMYNPI-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581838469 1075819487 /nfs/dbraw/zinc/81/94/87/1075819487.db2.gz WXZGROCDIMYNPI-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581838469 1075819483 /nfs/dbraw/zinc/81/94/83/1075819483.db2.gz WXZGROCDIMYNPI-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581838470 1075819534 /nfs/dbraw/zinc/81/95/34/1075819534.db2.gz WYHCARHXPWGROR-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581838470 1075819532 /nfs/dbraw/zinc/81/95/32/1075819532.db2.gz WYHCARHXPWGROR-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)N[C@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581838471 1075819518 /nfs/dbraw/zinc/81/95/18/1075819518.db2.gz WYHCARHXPWGROR-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)N[C@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581838471 1075819516 /nfs/dbraw/zinc/81/95/16/1075819516.db2.gz WYHCARHXPWGROR-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CC(=O)N1CC(O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581838488 1075819503 /nfs/dbraw/zinc/81/95/03/1075819503.db2.gz XIVWEESWWZAEOM-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1nccc1CC(=O)N1CC(O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581838488 1075819501 /nfs/dbraw/zinc/81/95/01/1075819501.db2.gz XIVWEESWWZAEOM-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581838623 1075819307 /nfs/dbraw/zinc/81/93/07/1075819307.db2.gz YGVRZRHGQNQMQX-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581838623 1075819304 /nfs/dbraw/zinc/81/93/04/1075819304.db2.gz YGVRZRHGQNQMQX-GFCCVEGCSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581838624 1075819397 /nfs/dbraw/zinc/81/93/97/1075819397.db2.gz YGVRZRHGQNQMQX-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)NC[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581838624 1075819393 /nfs/dbraw/zinc/81/93/93/1075819393.db2.gz YGVRZRHGQNQMQX-LBPRGKRZSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581838633 1075819495 /nfs/dbraw/zinc/81/94/95/1075819495.db2.gz YWVMEMFTIDSKTL-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581838633 1075819492 /nfs/dbraw/zinc/81/94/92/1075819492.db2.gz YWVMEMFTIDSKTL-LLVKDONJSA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581838634 1075819417 /nfs/dbraw/zinc/81/94/17/1075819417.db2.gz YWVMEMFTIDSKTL-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CCC(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581838634 1075819411 /nfs/dbraw/zinc/81/94/11/1075819411.db2.gz YWVMEMFTIDSKTL-NSHDSACASA-N -1 3 387.404 -1.232 20 0 GAADHM Cn1nccc1CC(=O)N1CC(O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581838643 1075819544 /nfs/dbraw/zinc/81/95/44/1075819544.db2.gz ZNBXPSHHINZCFN-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1nccc1CC(=O)N1CC(O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581838643 1075819543 /nfs/dbraw/zinc/81/95/43/1075819543.db2.gz ZNBXPSHHINZCFN-UHFFFAOYSA-N -1 3 385.388 -1.526 20 0 GAADHM Cn1nccc1COCC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001581839506 1075819343 /nfs/dbraw/zinc/81/93/43/1075819343.db2.gz GNHHZPSBDTUGFF-KGLIPLIRSA-N -1 3 399.415 -1.122 20 0 GAADHM Cn1nccc1COCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001581839506 1075819337 /nfs/dbraw/zinc/81/93/37/1075819337.db2.gz GNHHZPSBDTUGFF-KGLIPLIRSA-N -1 3 399.415 -1.122 20 0 GAADHM Cn1nccc1COCC(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001581839712 1075819889 /nfs/dbraw/zinc/81/98/89/1075819889.db2.gz MOVYRLIFDHNPPI-KGLIPLIRSA-N -1 3 399.415 -1.122 20 0 GAADHM Cn1nccc1COCC(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001581839712 1075819887 /nfs/dbraw/zinc/81/98/87/1075819887.db2.gz MOVYRLIFDHNPPI-KGLIPLIRSA-N -1 3 399.415 -1.122 20 0 GAADHM Cn1nnc(C(=O)N2CC3(C2)CCN(C(=O)c2cc(-c4nn[n-]n4)c[nH]2)C3)n1 ZINC001581840706 1075820130 /nfs/dbraw/zinc/82/01/30/1075820130.db2.gz GEDOBBXKEOMEQB-UHFFFAOYSA-N -1 3 383.376 -1.293 20 0 GAADHM Cn1nnc(C(=O)N2CC3(C2)CCN(C(=O)c2cc(-c4nnn[n-]4)c[nH]2)C3)n1 ZINC001581840706 1075820127 /nfs/dbraw/zinc/82/01/27/1075820127.db2.gz GEDOBBXKEOMEQB-UHFFFAOYSA-N -1 3 383.376 -1.293 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C(C)(C)C2)n1 ZINC001581840730 1075820101 /nfs/dbraw/zinc/82/01/01/1075820101.db2.gz GZOXMPQVPHVVQT-JTQLQIEISA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C(C)(C)C2)n1 ZINC001581840730 1075820098 /nfs/dbraw/zinc/82/00/98/1075820098.db2.gz GZOXMPQVPHVVQT-JTQLQIEISA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C(C)(C)C2)n1 ZINC001581840731 1075820291 /nfs/dbraw/zinc/82/02/91/1075820291.db2.gz GZOXMPQVPHVVQT-SNVBAGLBSA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C(C)(C)C2)n1 ZINC001581840731 1075820286 /nfs/dbraw/zinc/82/02/86/1075820286.db2.gz GZOXMPQVPHVVQT-SNVBAGLBSA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1ncnc1COCC(=O)N1CC(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581840738 1075820323 /nfs/dbraw/zinc/82/03/23/1075820323.db2.gz HJKOQRIJXCFJEB-UHFFFAOYSA-N -1 3 386.376 -1.519 20 0 GAADHM Cn1ncnc1COCC(=O)N1CC(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581840738 1075820317 /nfs/dbraw/zinc/82/03/17/1075820317.db2.gz HJKOQRIJXCFJEB-UHFFFAOYSA-N -1 3 386.376 -1.519 20 0 GAADHM Cn1ncnc1CN1CCN(CCNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001581840771 1075820273 /nfs/dbraw/zinc/82/02/73/1075820273.db2.gz IIKRRMCMAOPNTH-UHFFFAOYSA-N -1 3 385.436 -1.129 20 0 GAADHM Cn1ncnc1CN1CCN(CCNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001581840771 1075820264 /nfs/dbraw/zinc/82/02/64/1075820264.db2.gz IIKRRMCMAOPNTH-UHFFFAOYSA-N -1 3 385.436 -1.129 20 0 GAADHM Cn1nnc(C(=O)N(CCO)CCNc2ncc(-c3nn[n-]n3)cc2F)n1 ZINC001581840772 1075820149 /nfs/dbraw/zinc/82/01/49/1075820149.db2.gz IJALPMVDVADSNK-UHFFFAOYSA-N -1 3 377.344 -1.529 20 0 GAADHM Cn1nnc(C(=O)N(CCO)CCNc2ncc(-c3nnn[n-]3)cc2F)n1 ZINC001581840772 1075820147 /nfs/dbraw/zinc/82/01/47/1075820147.db2.gz IJALPMVDVADSNK-UHFFFAOYSA-N -1 3 377.344 -1.529 20 0 GAADHM Cn1ncnc1CN1CCN(CCNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001581840860 1075820112 /nfs/dbraw/zinc/82/01/12/1075820112.db2.gz MQDOJCASEYVPJM-UHFFFAOYSA-N -1 3 385.436 -1.129 20 0 GAADHM Cn1ncnc1CN1CCN(CCNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001581840860 1075820108 /nfs/dbraw/zinc/82/01/08/1075820108.db2.gz MQDOJCASEYVPJM-UHFFFAOYSA-N -1 3 385.436 -1.129 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C(C)(C)C2)n1 ZINC001581840886 1075820092 /nfs/dbraw/zinc/82/00/92/1075820092.db2.gz NTJZLAAIRWFUDX-JTQLQIEISA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C(C)(C)C2)n1 ZINC001581840886 1075820088 /nfs/dbraw/zinc/82/00/88/1075820088.db2.gz NTJZLAAIRWFUDX-JTQLQIEISA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C(C)(C)C2)n1 ZINC001581840887 1075820197 /nfs/dbraw/zinc/82/01/97/1075820197.db2.gz NTJZLAAIRWFUDX-SNVBAGLBSA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C(C)(C)C2)n1 ZINC001581840887 1075820191 /nfs/dbraw/zinc/82/01/91/1075820191.db2.gz NTJZLAAIRWFUDX-SNVBAGLBSA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C(C)(C)C2)n1 ZINC001581840904 1075820172 /nfs/dbraw/zinc/82/01/72/1075820172.db2.gz OALWGOCJYQKGBJ-JTQLQIEISA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C(C)(C)C2)n1 ZINC001581840904 1075820168 /nfs/dbraw/zinc/82/01/68/1075820168.db2.gz OALWGOCJYQKGBJ-JTQLQIEISA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C(C)(C)C2)n1 ZINC001581840905 1075820121 /nfs/dbraw/zinc/82/01/21/1075820121.db2.gz OALWGOCJYQKGBJ-SNVBAGLBSA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C(C)(C)C2)n1 ZINC001581840905 1075820117 /nfs/dbraw/zinc/82/01/17/1075820117.db2.gz OALWGOCJYQKGBJ-SNVBAGLBSA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1ncnc1COCC(=O)N1CC(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581841003 1075820139 /nfs/dbraw/zinc/82/01/39/1075820139.db2.gz RQLASBUFJMDMBU-UHFFFAOYSA-N -1 3 386.376 -1.519 20 0 GAADHM Cn1ncnc1COCC(=O)N1CC(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581841003 1075820137 /nfs/dbraw/zinc/82/01/37/1075820137.db2.gz RQLASBUFJMDMBU-UHFFFAOYSA-N -1 3 386.376 -1.519 20 0 GAADHM Cn1ncnc1COCC(=O)N1CC(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581841066 1075820226 /nfs/dbraw/zinc/82/02/26/1075820226.db2.gz UMDCTCUAZAIKRW-UHFFFAOYSA-N -1 3 386.376 -1.519 20 0 GAADHM Cn1ncnc1COCC(=O)N1CC(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581841066 1075820221 /nfs/dbraw/zinc/82/02/21/1075820221.db2.gz UMDCTCUAZAIKRW-UHFFFAOYSA-N -1 3 386.376 -1.519 20 0 GAADHM Cn1nnc(C(=O)N2CC3(C2)CCN(C(=O)c2ccc(-c4nn[n-]n4)[nH]2)C3)n1 ZINC001581841344 1075820649 /nfs/dbraw/zinc/82/06/49/1075820649.db2.gz XNQIMUWXSBSTNH-UHFFFAOYSA-N -1 3 383.376 -1.293 20 0 GAADHM Cn1nnc(C(=O)N2CC3(C2)CCN(C(=O)c2ccc(-c4nnn[n-]4)[nH]2)C3)n1 ZINC001581841344 1075820645 /nfs/dbraw/zinc/82/06/45/1075820645.db2.gz XNQIMUWXSBSTNH-UHFFFAOYSA-N -1 3 383.376 -1.293 20 0 GAADHM Cn1nnc(C(=O)NC2(CO)CCN(c3ccc(-c4nn[n-]n4)cn3)CC2)n1 ZINC001581842037 1075820476 /nfs/dbraw/zinc/82/04/76/1075820476.db2.gz BJHHDWOUXNTDEZ-UHFFFAOYSA-N -1 3 385.392 -1.454 20 0 GAADHM Cn1nnc(C(=O)NC2(CO)CCN(c3ccc(-c4nnn[n-]4)cn3)CC2)n1 ZINC001581842037 1075820467 /nfs/dbraw/zinc/82/04/67/1075820467.db2.gz BJHHDWOUXNTDEZ-UHFFFAOYSA-N -1 3 385.392 -1.454 20 0 GAADHM Cn1nnc(C(=O)NC2(CCO)CN(Cc3cccc(-c4nn[n-]n4)c3)C2)n1 ZINC001581842041 1075820458 /nfs/dbraw/zinc/82/04/58/1075820458.db2.gz BKNOBQNQIOHPDB-UHFFFAOYSA-N -1 3 384.404 -1.243 20 0 GAADHM Cn1nnc(C(=O)NC2(CCO)CN(Cc3cccc(-c4nnn[n-]4)c3)C2)n1 ZINC001581842041 1075820454 /nfs/dbraw/zinc/82/04/54/1075820454.db2.gz BKNOBQNQIOHPDB-UHFFFAOYSA-N -1 3 384.404 -1.243 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CCN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]2O)n1 ZINC001581842042 1075820446 /nfs/dbraw/zinc/82/04/46/1075820446.db2.gz BNJISOKAGILDGP-NXEZZACHSA-N -1 3 389.355 -1.706 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CCN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]2O)n1 ZINC001581842042 1075820442 /nfs/dbraw/zinc/82/04/42/1075820442.db2.gz BNJISOKAGILDGP-NXEZZACHSA-N -1 3 389.355 -1.706 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2CCN(c3ncc(-c4nn[n-]n4)cc3F)C[C@@H]2O)n1 ZINC001581842043 1075820579 /nfs/dbraw/zinc/82/05/79/1075820579.db2.gz BNJISOKAGILDGP-UWVGGRQHSA-N -1 3 389.355 -1.706 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2CCN(c3ncc(-c4nnn[n-]4)cc3F)C[C@@H]2O)n1 ZINC001581842043 1075820576 /nfs/dbraw/zinc/82/05/76/1075820576.db2.gz BNJISOKAGILDGP-UWVGGRQHSA-N -1 3 389.355 -1.706 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2CCN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]2O)n1 ZINC001581842044 1075820561 /nfs/dbraw/zinc/82/05/61/1075820561.db2.gz BNJISOKAGILDGP-VHSXEESVSA-N -1 3 389.355 -1.706 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2CCN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]2O)n1 ZINC001581842044 1075820558 /nfs/dbraw/zinc/82/05/58/1075820558.db2.gz BNJISOKAGILDGP-VHSXEESVSA-N -1 3 389.355 -1.706 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CCN(c3ncc(-c4nn[n-]n4)cc3F)C[C@@H]2O)n1 ZINC001581842045 1075820598 /nfs/dbraw/zinc/82/05/98/1075820598.db2.gz BNJISOKAGILDGP-ZJUUUORDSA-N -1 3 389.355 -1.706 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CCN(c3ncc(-c4nnn[n-]4)cc3F)C[C@@H]2O)n1 ZINC001581842045 1075820594 /nfs/dbraw/zinc/82/05/94/1075820594.db2.gz BNJISOKAGILDGP-ZJUUUORDSA-N -1 3 389.355 -1.706 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H]3CCN(C(=O)c4c[nH]c(-c5nn[n-]n5)c4)C[C@H]32)n1 ZINC001581842092 1075820510 /nfs/dbraw/zinc/82/05/10/1075820510.db2.gz CPSPZSYICTVBMG-LDYMZIIASA-N -1 3 383.376 -1.295 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H]3CCN(C(=O)c4c[nH]c(-c5nnn[n-]5)c4)C[C@H]32)n1 ZINC001581842092 1075820504 /nfs/dbraw/zinc/82/05/04/1075820504.db2.gz CPSPZSYICTVBMG-LDYMZIIASA-N -1 3 383.376 -1.295 20 0 GAADHM Cn1nnc(C(=O)N2[C@@H]3CC[C@H]2[C@H](NC(=O)c2cc(-c4nn[n-]n4)c[nH]2)C3)n1 ZINC001581842127 1075820973 /nfs/dbraw/zinc/82/09/73/1075820973.db2.gz DIZNEQFILPDORL-KKZNHRDASA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(C(=O)N2[C@@H]3CC[C@H]2[C@H](NC(=O)c2cc(-c4nnn[n-]4)c[nH]2)C3)n1 ZINC001581842127 1075820970 /nfs/dbraw/zinc/82/09/70/1075820970.db2.gz DIZNEQFILPDORL-KKZNHRDASA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(C(=O)N2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2cc(-c4nn[n-]n4)c[nH]2)C3)n1 ZINC001581842128 1075820966 /nfs/dbraw/zinc/82/09/66/1075820966.db2.gz DIZNEQFILPDORL-YWVKMMECSA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(C(=O)N2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2cc(-c4nnn[n-]4)c[nH]2)C3)n1 ZINC001581842128 1075820963 /nfs/dbraw/zinc/82/09/63/1075820963.db2.gz DIZNEQFILPDORL-YWVKMMECSA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(C(=O)NC[C@@]2(C)CN(c3ncccc3-c3nn[n-]n3)CCO2)n1 ZINC001581842175 1075820843 /nfs/dbraw/zinc/82/08/43/1075820843.db2.gz FNHIAUNCFJITQY-HNNXBMFYSA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)NC[C@@]2(C)CN(c3ncccc3-c3nnn[n-]3)CCO2)n1 ZINC001581842175 1075820840 /nfs/dbraw/zinc/82/08/40/1075820840.db2.gz FNHIAUNCFJITQY-HNNXBMFYSA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)NC[C@]2(C)CN(c3ncccc3-c3nn[n-]n3)CCO2)n1 ZINC001581842176 1075820897 /nfs/dbraw/zinc/82/08/97/1075820897.db2.gz FNHIAUNCFJITQY-OAHLLOKOSA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)NC[C@]2(C)CN(c3ncccc3-c3nnn[n-]3)CCO2)n1 ZINC001581842176 1075820894 /nfs/dbraw/zinc/82/08/94/1075820894.db2.gz FNHIAUNCFJITQY-OAHLLOKOSA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)N2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2ccc(-c4nn[n-]n4)[nH]2)C3)n1 ZINC001581842190 1075820984 /nfs/dbraw/zinc/82/09/84/1075820984.db2.gz FWCVSCFGJAGTNW-GGVZMXCHSA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(C(=O)N2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2ccc(-c4nnn[n-]4)[nH]2)C3)n1 ZINC001581842190 1075820979 /nfs/dbraw/zinc/82/09/79/1075820979.db2.gz FWCVSCFGJAGTNW-GGVZMXCHSA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(C(=O)N2[C@@H]3CC[C@H]2[C@H](NC(=O)c2ccc(-c4nn[n-]n4)[nH]2)C3)n1 ZINC001581842191 1075820883 /nfs/dbraw/zinc/82/08/83/1075820883.db2.gz FWCVSCFGJAGTNW-ONOSFVFSSA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(C(=O)N2[C@@H]3CC[C@H]2[C@H](NC(=O)c2ccc(-c4nnn[n-]4)[nH]2)C3)n1 ZINC001581842191 1075820879 /nfs/dbraw/zinc/82/08/79/1075820879.db2.gz FWCVSCFGJAGTNW-ONOSFVFSSA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(C(=O)NC2(CCO)CN(Cc3ccc(-c4nn[n-]n4)cc3)C2)n1 ZINC001581842208 1075820912 /nfs/dbraw/zinc/82/09/12/1075820912.db2.gz GOLJBQMGHCYANO-UHFFFAOYSA-N -1 3 384.404 -1.243 20 0 GAADHM Cn1nnc(C(=O)NC2(CCO)CN(Cc3ccc(-c4nnn[n-]4)cc3)C2)n1 ZINC001581842208 1075820910 /nfs/dbraw/zinc/82/09/10/1075820910.db2.gz GOLJBQMGHCYANO-UHFFFAOYSA-N -1 3 384.404 -1.243 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H]3CN(C(=O)c4c[nH]c(-c5nn[n-]n5)c4)C[C@H]3C2)n1 ZINC001581842215 1075820959 /nfs/dbraw/zinc/82/09/59/1075820959.db2.gz GSVODUKXQMVQQK-AOOOYVTPSA-N -1 3 383.376 -1.438 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H]3CN(C(=O)c4c[nH]c(-c5nnn[n-]5)c4)C[C@H]3C2)n1 ZINC001581842215 1075820956 /nfs/dbraw/zinc/82/09/56/1075820956.db2.gz GSVODUKXQMVQQK-AOOOYVTPSA-N -1 3 383.376 -1.438 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2(C)C)n1 ZINC001581842220 1075820864 /nfs/dbraw/zinc/82/08/64/1075820864.db2.gz HAPZMZZMZNSKBE-JTQLQIEISA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2(C)C)n1 ZINC001581842220 1075820861 /nfs/dbraw/zinc/82/08/61/1075820861.db2.gz HAPZMZZMZNSKBE-JTQLQIEISA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2(C)C)n1 ZINC001581842221 1075820874 /nfs/dbraw/zinc/82/08/74/1075820874.db2.gz HAPZMZZMZNSKBE-SNVBAGLBSA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2(C)C)n1 ZINC001581842221 1075820871 /nfs/dbraw/zinc/82/08/71/1075820871.db2.gz HAPZMZZMZNSKBE-SNVBAGLBSA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N[C@@]2(CO)CCCN(c3ncccc3-c3nn[n-]n3)C2)n1 ZINC001581842225 1075820926 /nfs/dbraw/zinc/82/09/26/1075820926.db2.gz HCRCBKCAKPZFIW-HNNXBMFYSA-N -1 3 385.392 -1.454 20 0 GAADHM Cn1nnc(C(=O)N[C@@]2(CO)CCCN(c3ncccc3-c3nnn[n-]3)C2)n1 ZINC001581842225 1075820924 /nfs/dbraw/zinc/82/09/24/1075820924.db2.gz HCRCBKCAKPZFIW-HNNXBMFYSA-N -1 3 385.392 -1.454 20 0 GAADHM Cn1nnc(C(=O)N[C@]2(CO)CCCN(c3ncccc3-c3nn[n-]n3)C2)n1 ZINC001581842226 1075820934 /nfs/dbraw/zinc/82/09/34/1075820934.db2.gz HCRCBKCAKPZFIW-OAHLLOKOSA-N -1 3 385.392 -1.454 20 0 GAADHM Cn1nnc(C(=O)N[C@]2(CO)CCCN(c3ncccc3-c3nnn[n-]3)C2)n1 ZINC001581842226 1075820930 /nfs/dbraw/zinc/82/09/30/1075820930.db2.gz HCRCBKCAKPZFIW-OAHLLOKOSA-N -1 3 385.392 -1.454 20 0 GAADHM Cn1nnc(C(=O)NC[C@@]2(C)CN(c3ccc(-c4nn[n-]n4)cn3)CCO2)n1 ZINC001581842233 1075820905 /nfs/dbraw/zinc/82/09/05/1075820905.db2.gz HIIVCDDJXGZVON-HNNXBMFYSA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)NC[C@@]2(C)CN(c3ccc(-c4nnn[n-]4)cn3)CCO2)n1 ZINC001581842233 1075820902 /nfs/dbraw/zinc/82/09/02/1075820902.db2.gz HIIVCDDJXGZVON-HNNXBMFYSA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)NC[C@]2(C)CN(c3ccc(-c4nn[n-]n4)cn3)CCO2)n1 ZINC001581842234 1075820855 /nfs/dbraw/zinc/82/08/55/1075820855.db2.gz HIIVCDDJXGZVON-OAHLLOKOSA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)NC[C@]2(C)CN(c3ccc(-c4nnn[n-]4)cn3)CCO2)n1 ZINC001581842234 1075820851 /nfs/dbraw/zinc/82/08/51/1075820851.db2.gz HIIVCDDJXGZVON-OAHLLOKOSA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H]3CCN(C(=O)c4c[nH]c(-c5nn[n-]n5)c4)[C@@H]3C2)n1 ZINC001581842268 1075821162 /nfs/dbraw/zinc/82/11/62/1075821162.db2.gz IOFLJXDXIHXWMO-GZMMTYOYSA-N -1 3 383.376 -1.295 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H]3CCN(C(=O)c4c[nH]c(-c5nnn[n-]5)c4)[C@@H]3C2)n1 ZINC001581842268 1075821156 /nfs/dbraw/zinc/82/11/56/1075821156.db2.gz IOFLJXDXIHXWMO-GZMMTYOYSA-N -1 3 383.376 -1.295 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CCN(Cc3ccc(-c4nnn[n-]4)s3)C[C@H]2O)n1 ZINC001581842305 1075821219 /nfs/dbraw/zinc/82/12/19/1075821219.db2.gz JPKMELNEEKSYDN-NXEZZACHSA-N -1 3 390.433 -1.183 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2CCN(Cc3ccc(-c4nnn[n-]4)s3)C[C@@H]2O)n1 ZINC001581842306 1075821236 /nfs/dbraw/zinc/82/12/36/1075821236.db2.gz JPKMELNEEKSYDN-UWVGGRQHSA-N -1 3 390.433 -1.183 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2CCN(Cc3ccc(-c4nnn[n-]4)s3)C[C@H]2O)n1 ZINC001581842307 1075821315 /nfs/dbraw/zinc/82/13/15/1075821315.db2.gz JPKMELNEEKSYDN-VHSXEESVSA-N -1 3 390.433 -1.183 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CCN(Cc3ccc(-c4nnn[n-]4)s3)C[C@@H]2O)n1 ZINC001581842308 1075821275 /nfs/dbraw/zinc/82/12/75/1075821275.db2.gz JPKMELNEEKSYDN-ZJUUUORDSA-N -1 3 390.433 -1.183 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H]3CN(C(=O)c4ccc(-c5nn[n-]n5)[nH]4)C[C@H]3C2)n1 ZINC001581842321 1075821133 /nfs/dbraw/zinc/82/11/33/1075821133.db2.gz KBHXBECHFQUQCG-DTORHVGOSA-N -1 3 383.376 -1.438 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H]3CN(C(=O)c4ccc(-c5nnn[n-]5)[nH]4)C[C@H]3C2)n1 ZINC001581842321 1075821131 /nfs/dbraw/zinc/82/11/31/1075821131.db2.gz KBHXBECHFQUQCG-DTORHVGOSA-N -1 3 383.376 -1.438 20 0 GAADHM Cn1nnc(C(=O)NC2(CO)CCN(c3ncccc3-c3nn[n-]n3)CC2)n1 ZINC001581842327 1075821351 /nfs/dbraw/zinc/82/13/51/1075821351.db2.gz KGEWDDCXFYIXNI-UHFFFAOYSA-N -1 3 385.392 -1.454 20 0 GAADHM Cn1nnc(C(=O)NC2(CO)CCN(c3ncccc3-c3nnn[n-]3)CC2)n1 ZINC001581842327 1075821348 /nfs/dbraw/zinc/82/13/48/1075821348.db2.gz KGEWDDCXFYIXNI-UHFFFAOYSA-N -1 3 385.392 -1.454 20 0 GAADHM Cn1nnc(C(=O)NC2(CO)CCN(c3ccc(-c4nn[n-]n4)nc3)CC2)n1 ZINC001581842379 1075821523 /nfs/dbraw/zinc/82/15/23/1075821523.db2.gz LXSNHGKRPJALPK-UHFFFAOYSA-N -1 3 385.392 -1.454 20 0 GAADHM Cn1nnc(C(=O)NC2(CO)CCN(c3ccc(-c4nnn[n-]4)nc3)CC2)n1 ZINC001581842379 1075821516 /nfs/dbraw/zinc/82/15/16/1075821516.db2.gz LXSNHGKRPJALPK-UHFFFAOYSA-N -1 3 385.392 -1.454 20 0 GAADHM Cn1nnc(C(=O)NC2(CCO)CN(Cc3ccccc3-c3nn[n-]n3)C2)n1 ZINC001581842401 1075821498 /nfs/dbraw/zinc/82/14/98/1075821498.db2.gz MNIAQYPNQNYWGG-UHFFFAOYSA-N -1 3 384.404 -1.243 20 0 GAADHM Cn1nnc(C(=O)NC2(CCO)CN(Cc3ccccc3-c3nnn[n-]3)C2)n1 ZINC001581842401 1075821495 /nfs/dbraw/zinc/82/14/95/1075821495.db2.gz MNIAQYPNQNYWGG-UHFFFAOYSA-N -1 3 384.404 -1.243 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)CC2(C)C)n1 ZINC001581842420 1075821603 /nfs/dbraw/zinc/82/16/03/1075821603.db2.gz NBFMIQYMIJTBGI-JTQLQIEISA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)CC2(C)C)n1 ZINC001581842420 1075821598 /nfs/dbraw/zinc/82/15/98/1075821598.db2.gz NBFMIQYMIJTBGI-JTQLQIEISA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)CC2(C)C)n1 ZINC001581842421 1075821473 /nfs/dbraw/zinc/82/14/73/1075821473.db2.gz NBFMIQYMIJTBGI-SNVBAGLBSA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)CC2(C)C)n1 ZINC001581842421 1075821472 /nfs/dbraw/zinc/82/14/72/1075821472.db2.gz NBFMIQYMIJTBGI-SNVBAGLBSA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2c[nH]c(-c4nn[n-]n4)c2)C3)n1 ZINC001581842465 1075821483 /nfs/dbraw/zinc/82/14/83/1075821483.db2.gz OEJRQHPGSMLVNS-YWVKMMECSA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(C(=O)N2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2c[nH]c(-c4nnn[n-]4)c2)C3)n1 ZINC001581842465 1075821482 /nfs/dbraw/zinc/82/14/82/1075821482.db2.gz OEJRQHPGSMLVNS-YWVKMMECSA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(C(=O)NC[C@@H](CO)NCc2ccc(-c3nn[n-]n3)cc2F)n1 ZINC001581842468 1075821624 /nfs/dbraw/zinc/82/16/24/1075821624.db2.gz OIABNARZUUAZNH-JTQLQIEISA-N -1 3 376.356 -1.590 20 0 GAADHM Cn1nnc(C(=O)NC[C@H](CO)NCc2ccc(-c3nn[n-]n3)cc2F)n1 ZINC001581842469 1075821671 /nfs/dbraw/zinc/82/16/71/1075821671.db2.gz OIABNARZUUAZNH-SNVBAGLBSA-N -1 3 376.356 -1.590 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H]3CCN(C(=O)c4cc(-c5nn[n-]n5)c[nH]4)C[C@H]32)n1 ZINC001581842540 1075821974 /nfs/dbraw/zinc/82/19/74/1075821974.db2.gz PZGAFUPZYJPSRM-LDYMZIIASA-N -1 3 383.376 -1.295 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H]3CCN(C(=O)c4cc(-c5nnn[n-]5)c[nH]4)C[C@H]32)n1 ZINC001581842540 1075821972 /nfs/dbraw/zinc/82/19/72/1075821972.db2.gz PZGAFUPZYJPSRM-LDYMZIIASA-N -1 3 383.376 -1.295 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H]3CCN(C(=O)c4cc(-c5nn[n-]n5)c[nH]4)[C@@H]3C2)n1 ZINC001581842626 1075822034 /nfs/dbraw/zinc/82/20/34/1075822034.db2.gz SOKVUOZLPBJIMW-GZMMTYOYSA-N -1 3 383.376 -1.295 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H]3CCN(C(=O)c4cc(-c5nnn[n-]5)c[nH]4)[C@@H]3C2)n1 ZINC001581842626 1075822033 /nfs/dbraw/zinc/82/20/33/1075822033.db2.gz SOKVUOZLPBJIMW-GZMMTYOYSA-N -1 3 383.376 -1.295 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H]3CN(C(=O)c4cc(-c5nn[n-]n5)c[nH]4)C[C@H]3C2)n1 ZINC001581842627 1075822022 /nfs/dbraw/zinc/82/20/22/1075822022.db2.gz SQMOFFICOBWFEO-AOOOYVTPSA-N -1 3 383.376 -1.438 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H]3CN(C(=O)c4cc(-c5nnn[n-]5)c[nH]4)C[C@H]3C2)n1 ZINC001581842627 1075822020 /nfs/dbraw/zinc/82/20/20/1075822020.db2.gz SQMOFFICOBWFEO-AOOOYVTPSA-N -1 3 383.376 -1.438 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H]3CCN(C(=O)c4ccc(-c5nn[n-]n5)[nH]4)[C@@H]3C2)n1 ZINC001581842635 1075821991 /nfs/dbraw/zinc/82/19/91/1075821991.db2.gz SZPIOSZGARDWDS-GZMMTYOYSA-N -1 3 383.376 -1.295 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H]3CCN(C(=O)c4ccc(-c5nnn[n-]5)[nH]4)[C@@H]3C2)n1 ZINC001581842635 1075821989 /nfs/dbraw/zinc/82/19/89/1075821989.db2.gz SZPIOSZGARDWDS-GZMMTYOYSA-N -1 3 383.376 -1.295 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H]3CCN(C(=O)c4ccc(-c5nn[n-]n5)[nH]4)C[C@H]3C2)n1 ZINC001581842674 1075821889 /nfs/dbraw/zinc/82/18/89/1075821889.db2.gz VCMPQTUFJCEBNI-ZJUUUORDSA-N -1 3 397.403 -1.047 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H]3CCN(C(=O)c4ccc(-c5nnn[n-]5)[nH]4)C[C@H]3C2)n1 ZINC001581842674 1075821884 /nfs/dbraw/zinc/82/18/84/1075821884.db2.gz VCMPQTUFJCEBNI-ZJUUUORDSA-N -1 3 397.403 -1.047 20 0 GAADHM Cn1nnc(C(=O)NC[C@@]2(C)CN(c3ccc(-c4nn[n-]n4)nc3)CCO2)n1 ZINC001581842716 1075821925 /nfs/dbraw/zinc/82/19/25/1075821925.db2.gz WKVHLVMKRFEYGV-HNNXBMFYSA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)NC[C@@]2(C)CN(c3ccc(-c4nnn[n-]4)nc3)CCO2)n1 ZINC001581842716 1075821920 /nfs/dbraw/zinc/82/19/20/1075821920.db2.gz WKVHLVMKRFEYGV-HNNXBMFYSA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)NC[C@]2(C)CN(c3ccc(-c4nn[n-]n4)nc3)CCO2)n1 ZINC001581842717 1075822028 /nfs/dbraw/zinc/82/20/28/1075822028.db2.gz WKVHLVMKRFEYGV-OAHLLOKOSA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)NC[C@]2(C)CN(c3ccc(-c4nnn[n-]4)nc3)CCO2)n1 ZINC001581842717 1075822026 /nfs/dbraw/zinc/82/20/26/1075822026.db2.gz WKVHLVMKRFEYGV-OAHLLOKOSA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)N[C@@]2(CO)CCCN(c3ccc(-c4nn[n-]n4)nc3)C2)n1 ZINC001581842743 1075821999 /nfs/dbraw/zinc/82/19/99/1075821999.db2.gz XDDQJBLFGVEYIU-HNNXBMFYSA-N -1 3 385.392 -1.454 20 0 GAADHM Cn1nnc(C(=O)N[C@@]2(CO)CCCN(c3ccc(-c4nnn[n-]4)nc3)C2)n1 ZINC001581842743 1075821996 /nfs/dbraw/zinc/82/19/96/1075821996.db2.gz XDDQJBLFGVEYIU-HNNXBMFYSA-N -1 3 385.392 -1.454 20 0 GAADHM Cn1nnc(C(=O)N[C@]2(CO)CCCN(c3ccc(-c4nn[n-]n4)nc3)C2)n1 ZINC001581842744 1075822031 /nfs/dbraw/zinc/82/20/31/1075822031.db2.gz XDDQJBLFGVEYIU-OAHLLOKOSA-N -1 3 385.392 -1.454 20 0 GAADHM Cn1nnc(C(=O)N[C@]2(CO)CCCN(c3ccc(-c4nnn[n-]4)nc3)C2)n1 ZINC001581842744 1075822030 /nfs/dbraw/zinc/82/20/30/1075822030.db2.gz XDDQJBLFGVEYIU-OAHLLOKOSA-N -1 3 385.392 -1.454 20 0 GAADHM Cn1nnc(C(=O)N[C@@]2(CO)CCCN(c3ccc(-c4nn[n-]n4)cn3)C2)n1 ZINC001581842776 1075822149 /nfs/dbraw/zinc/82/21/49/1075822149.db2.gz YCZFTGRYVIKKBM-HNNXBMFYSA-N -1 3 385.392 -1.454 20 0 GAADHM Cn1nnc(C(=O)N[C@@]2(CO)CCCN(c3ccc(-c4nnn[n-]4)cn3)C2)n1 ZINC001581842776 1075822147 /nfs/dbraw/zinc/82/21/47/1075822147.db2.gz YCZFTGRYVIKKBM-HNNXBMFYSA-N -1 3 385.392 -1.454 20 0 GAADHM Cn1nnc(C(=O)N[C@]2(CO)CCCN(c3ccc(-c4nn[n-]n4)cn3)C2)n1 ZINC001581842777 1075822217 /nfs/dbraw/zinc/82/22/17/1075822217.db2.gz YCZFTGRYVIKKBM-OAHLLOKOSA-N -1 3 385.392 -1.454 20 0 GAADHM Cn1nnc(C(=O)N[C@]2(CO)CCCN(c3ccc(-c4nnn[n-]4)cn3)C2)n1 ZINC001581842777 1075822213 /nfs/dbraw/zinc/82/22/13/1075822213.db2.gz YCZFTGRYVIKKBM-OAHLLOKOSA-N -1 3 385.392 -1.454 20 0 GAADHM Cn1nnc(C(=O)NCC2(O)CN(Cc3cc(-c4nn[n-]n4)ccc3F)C2)n1 ZINC001581842869 1075822249 /nfs/dbraw/zinc/82/22/49/1075822249.db2.gz AHAQEKLWZYKZDQ-UHFFFAOYSA-N -1 3 388.367 -1.494 20 0 GAADHM Cn1nnc(C(=O)NCC2(O)CN(Cc3cc(-c4nnn[n-]4)ccc3F)C2)n1 ZINC001581842869 1075822244 /nfs/dbraw/zinc/82/22/44/1075822244.db2.gz AHAQEKLWZYKZDQ-UHFFFAOYSA-N -1 3 388.367 -1.494 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]2O)n1 ZINC001581842909 1075822304 /nfs/dbraw/zinc/82/23/04/1075822304.db2.gz BMPOYGNAFAQUKT-RKDXNWHRSA-N -1 3 375.328 -2.096 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]2O)n1 ZINC001581842909 1075822291 /nfs/dbraw/zinc/82/22/91/1075822291.db2.gz BMPOYGNAFAQUKT-RKDXNWHRSA-N -1 3 375.328 -2.096 20 0 GAADHM Cn1nnc(C(=O)NCC2(O)CN(Cc3ccc(-c4nn[n-]n4)cc3F)C2)n1 ZINC001581843004 1075822338 /nfs/dbraw/zinc/82/23/38/1075822338.db2.gz CPQPDYKWQFJTOF-UHFFFAOYSA-N -1 3 388.367 -1.494 20 0 GAADHM Cn1nnc(C(=O)NCC2(O)CN(Cc3ccc(-c4nnn[n-]4)cc3F)C2)n1 ZINC001581843004 1075822333 /nfs/dbraw/zinc/82/23/33/1075822333.db2.gz CPQPDYKWQFJTOF-UHFFFAOYSA-N -1 3 388.367 -1.494 20 0 GAADHM Cn1nnc(C(=O)NCC2(O)CN(Cc3ccc(-c4nn[n-]n4)c(F)c3)C2)n1 ZINC001581843019 1075822366 /nfs/dbraw/zinc/82/23/66/1075822366.db2.gz CWKVRRMNWSBIAJ-UHFFFAOYSA-N -1 3 388.367 -1.494 20 0 GAADHM Cn1nnc(C(=O)NCC2(O)CN(Cc3ccc(-c4nnn[n-]4)c(F)c3)C2)n1 ZINC001581843019 1075822362 /nfs/dbraw/zinc/82/23/62/1075822362.db2.gz CWKVRRMNWSBIAJ-UHFFFAOYSA-N -1 3 388.367 -1.494 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(Cc3cc(-c4nn[n-]n4)ccc3F)C[C@H]2O)n1 ZINC001581843043 1075822372 /nfs/dbraw/zinc/82/23/72/1075822372.db2.gz DSZOCOYYKQOPKR-VXGBXAGGSA-N -1 3 388.367 -1.496 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C(=O)c2cc(-c3nn[n-]n3)c[nH]2)n1 ZINC001581843334 1075822191 /nfs/dbraw/zinc/82/21/91/1075822191.db2.gz FJQIMVISIVIXAB-KKZNHRDASA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C(=O)c2cc(-c3nnn[n-]3)c[nH]2)n1 ZINC001581843334 1075822183 /nfs/dbraw/zinc/82/21/83/1075822183.db2.gz FJQIMVISIVIXAB-KKZNHRDASA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(C(=O)NC[C@@H]2[C@H]3CN(C(=O)c4c[nH]c(-c5nn[n-]n5)c4)C[C@H]32)n1 ZINC001581843340 1075822233 /nfs/dbraw/zinc/82/22/33/1075822233.db2.gz FLZALEBYZWOARQ-OWUUHHOZSA-N -1 3 383.376 -1.534 20 0 GAADHM Cn1nnc(C(=O)NC[C@@H]2[C@H]3CN(C(=O)c4c[nH]c(-c5nnn[n-]5)c4)C[C@H]32)n1 ZINC001581843340 1075822229 /nfs/dbraw/zinc/82/22/29/1075822229.db2.gz FLZALEBYZWOARQ-OWUUHHOZSA-N -1 3 383.376 -1.534 20 0 GAADHM Cn1nnc(C(=O)NC[C@@H]2CN(c3ncc(-c4nn[n-]n4)cc3F)CCO2)n1 ZINC001581843688 1075822547 /nfs/dbraw/zinc/82/25/47/1075822547.db2.gz LGTXMHBHKNWPIK-SECBINFHSA-N -1 3 389.355 -1.441 20 0 GAADHM Cn1nnc(C(=O)NC[C@@H]2CN(c3ncc(-c4nnn[n-]4)cc3F)CCO2)n1 ZINC001581843688 1075822542 /nfs/dbraw/zinc/82/25/42/1075822542.db2.gz LGTXMHBHKNWPIK-SECBINFHSA-N -1 3 389.355 -1.441 20 0 GAADHM Cn1nnc(C(=O)NC[C@H]2CN(c3ncc(-c4nn[n-]n4)cc3F)CCO2)n1 ZINC001581843689 1075822635 /nfs/dbraw/zinc/82/26/35/1075822635.db2.gz LGTXMHBHKNWPIK-VIFPVBQESA-N -1 3 389.355 -1.441 20 0 GAADHM Cn1nnc(C(=O)NC[C@H]2CN(c3ncc(-c4nnn[n-]4)cc3F)CCO2)n1 ZINC001581843689 1075822632 /nfs/dbraw/zinc/82/26/32/1075822632.db2.gz LGTXMHBHKNWPIK-VIFPVBQESA-N -1 3 389.355 -1.441 20 0 GAADHM Cn1nnc(C(=O)NC[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)CCCO2)n1 ZINC001581843699 1075822504 /nfs/dbraw/zinc/82/25/04/1075822504.db2.gz LRUUDMNETOFPSH-LLVKDONJSA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)NC[C@@H]2CN(c3ccc(-c4nnn[n-]4)cn3)CCCO2)n1 ZINC001581843699 1075822498 /nfs/dbraw/zinc/82/24/98/1075822498.db2.gz LRUUDMNETOFPSH-LLVKDONJSA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)NC[C@H]2CN(c3ccc(-c4nn[n-]n4)cn3)CCCO2)n1 ZINC001581843700 1075822603 /nfs/dbraw/zinc/82/26/03/1075822603.db2.gz LRUUDMNETOFPSH-NSHDSACASA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)NC[C@H]2CN(c3ccc(-c4nnn[n-]4)cn3)CCCO2)n1 ZINC001581843700 1075822600 /nfs/dbraw/zinc/82/26/00/1075822600.db2.gz LRUUDMNETOFPSH-NSHDSACASA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(c3ncc(-c4nn[n-]n4)cc3Cl)C[C@H]2O)n1 ZINC001581843726 1075822532 /nfs/dbraw/zinc/82/25/32/1075822532.db2.gz NBULMSNYZZJRAW-RKDXNWHRSA-N -1 3 391.783 -1.582 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(c3ncc(-c4nnn[n-]4)cc3Cl)C[C@H]2O)n1 ZINC001581843726 1075822528 /nfs/dbraw/zinc/82/25/28/1075822528.db2.gz NBULMSNYZZJRAW-RKDXNWHRSA-N -1 3 391.783 -1.582 20 0 GAADHM Cn1nnc(C(=O)NC[C@@H]2[C@H]3CN(C(=O)c4cc(-c5nn[n-]n5)c[nH]4)C[C@H]32)n1 ZINC001581843738 1075822480 /nfs/dbraw/zinc/82/24/80/1075822480.db2.gz NRQBBVYSTGZYPT-OWUUHHOZSA-N -1 3 383.376 -1.534 20 0 GAADHM Cn1nnc(C(=O)NC[C@@H]2[C@H]3CN(C(=O)c4cc(-c5nnn[n-]5)c[nH]4)C[C@H]32)n1 ZINC001581843738 1075822476 /nfs/dbraw/zinc/82/24/76/1075822476.db2.gz NRQBBVYSTGZYPT-OWUUHHOZSA-N -1 3 383.376 -1.534 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(Cc3cc(F)ccc3-c3nn[n-]n3)C[C@@H]2O)n1 ZINC001581843825 1075822582 /nfs/dbraw/zinc/82/25/82/1075822582.db2.gz RAQUYSJOWJDPQK-NEPJUHHUSA-N -1 3 388.367 -1.496 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(Cc3cc(F)ccc3-c3nnn[n-]3)C[C@@H]2O)n1 ZINC001581843825 1075822581 /nfs/dbraw/zinc/82/25/81/1075822581.db2.gz RAQUYSJOWJDPQK-NEPJUHHUSA-N -1 3 388.367 -1.496 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(Cc3cc(F)ccc3-c3nn[n-]n3)C[C@H]2O)n1 ZINC001581843826 1075822597 /nfs/dbraw/zinc/82/25/97/1075822597.db2.gz RAQUYSJOWJDPQK-VXGBXAGGSA-N -1 3 388.367 -1.496 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(Cc3cc(F)ccc3-c3nnn[n-]3)C[C@H]2O)n1 ZINC001581843826 1075822595 /nfs/dbraw/zinc/82/25/95/1075822595.db2.gz RAQUYSJOWJDPQK-VXGBXAGGSA-N -1 3 388.367 -1.496 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581843829 1075822590 /nfs/dbraw/zinc/82/25/90/1075822590.db2.gz RDKCVHCYMLRDQV-KKZNHRDASA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581843829 1075822589 /nfs/dbraw/zinc/82/25/89/1075822589.db2.gz RDKCVHCYMLRDQV-KKZNHRDASA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(Cc3ccc(-c4nn[n-]n4)cc3F)C[C@@H]2O)n1 ZINC001581843840 1075822643 /nfs/dbraw/zinc/82/26/43/1075822643.db2.gz SAFDQGZTMVHJLV-NEPJUHHUSA-N -1 3 388.367 -1.496 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(Cc3ccc(-c4nnn[n-]4)cc3F)C[C@@H]2O)n1 ZINC001581843840 1075822642 /nfs/dbraw/zinc/82/26/42/1075822642.db2.gz SAFDQGZTMVHJLV-NEPJUHHUSA-N -1 3 388.367 -1.496 20 0 GAADHM Cn1nnc(C(=O)NC[C@@H]2COCCN2c2ncc(-c3nn[n-]n3)cc2F)n1 ZINC001581843863 1075822567 /nfs/dbraw/zinc/82/25/67/1075822567.db2.gz TYDDJOZIZUHUKJ-SECBINFHSA-N -1 3 389.355 -1.441 20 0 GAADHM Cn1nnc(C(=O)NC[C@@H]2COCCN2c2ncc(-c3nnn[n-]3)cc2F)n1 ZINC001581843863 1075822562 /nfs/dbraw/zinc/82/25/62/1075822562.db2.gz TYDDJOZIZUHUKJ-SECBINFHSA-N -1 3 389.355 -1.441 20 0 GAADHM Cn1nnc(C(=O)NC[C@H]2COCCN2c2ncc(-c3nn[n-]n3)cc2F)n1 ZINC001581843864 1075822612 /nfs/dbraw/zinc/82/26/12/1075822612.db2.gz TYDDJOZIZUHUKJ-VIFPVBQESA-N -1 3 389.355 -1.441 20 0 GAADHM Cn1nnc(C(=O)NC[C@H]2COCCN2c2ncc(-c3nnn[n-]3)cc2F)n1 ZINC001581843864 1075822609 /nfs/dbraw/zinc/82/26/09/1075822609.db2.gz TYDDJOZIZUHUKJ-VIFPVBQESA-N -1 3 389.355 -1.441 20 0 GAADHM Cn1nnc(C(=O)NC[C@@]2(O)CCN(c3ncc(-c4nn[n-]n4)cc3F)C2)n1 ZINC001581843871 1075822627 /nfs/dbraw/zinc/82/26/27/1075822627.db2.gz UCVWYACNVVONGT-AWEZNQCLSA-N -1 3 389.355 -1.705 20 0 GAADHM Cn1nnc(C(=O)NC[C@@]2(O)CCN(c3ncc(-c4nnn[n-]4)cc3F)C2)n1 ZINC001581843871 1075822623 /nfs/dbraw/zinc/82/26/23/1075822623.db2.gz UCVWYACNVVONGT-AWEZNQCLSA-N -1 3 389.355 -1.705 20 0 GAADHM Cn1nnc(C(=O)NC[C@]2(O)CCN(c3ncc(-c4nn[n-]n4)cc3F)C2)n1 ZINC001581843872 1075822491 /nfs/dbraw/zinc/82/24/91/1075822491.db2.gz UCVWYACNVVONGT-CQSZACIVSA-N -1 3 389.355 -1.705 20 0 GAADHM Cn1nnc(C(=O)NC[C@]2(O)CCN(c3ncc(-c4nnn[n-]4)cc3F)C2)n1 ZINC001581843872 1075822485 /nfs/dbraw/zinc/82/24/85/1075822485.db2.gz UCVWYACNVVONGT-CQSZACIVSA-N -1 3 389.355 -1.705 20 0 GAADHM Cn1nnc(C(=O)NCC2(O)CN(Cc3cc(F)ccc3-c3nn[n-]n3)C2)n1 ZINC001581843885 1075822983 /nfs/dbraw/zinc/82/29/83/1075822983.db2.gz UYBQLXQFWILALJ-UHFFFAOYSA-N -1 3 388.367 -1.494 20 0 GAADHM Cn1nnc(C(=O)NCC2(O)CN(Cc3cc(F)ccc3-c3nnn[n-]3)C2)n1 ZINC001581843885 1075822980 /nfs/dbraw/zinc/82/29/80/1075822980.db2.gz UYBQLXQFWILALJ-UHFFFAOYSA-N -1 3 388.367 -1.494 20 0 GAADHM Cn1nnc(C(=O)NC[C@@]2(O)CCN(c3cccc(F)c3-c3nn[n-]n3)C2)n1 ZINC001581843889 1075822975 /nfs/dbraw/zinc/82/29/75/1075822975.db2.gz VFWWVDOUUKFBHE-HNNXBMFYSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1nnc(C(=O)NC[C@@]2(O)CCN(c3cccc(F)c3-c3nnn[n-]3)C2)n1 ZINC001581843889 1075822972 /nfs/dbraw/zinc/82/29/72/1075822972.db2.gz VFWWVDOUUKFBHE-HNNXBMFYSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1nnc(C(=O)NC[C@]2(O)CCN(c3cccc(F)c3-c3nn[n-]n3)C2)n1 ZINC001581843890 1075822961 /nfs/dbraw/zinc/82/29/61/1075822961.db2.gz VFWWVDOUUKFBHE-OAHLLOKOSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1nnc(C(=O)NC[C@]2(O)CCN(c3cccc(F)c3-c3nnn[n-]3)C2)n1 ZINC001581843890 1075822959 /nfs/dbraw/zinc/82/29/59/1075822959.db2.gz VFWWVDOUUKFBHE-OAHLLOKOSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1nnc(C(=O)NCCN2CCN(c3ncccc3-c3nn[n-]n3)CC2)n1 ZINC001581843931 1075823006 /nfs/dbraw/zinc/82/30/06/1075823006.db2.gz WMECULSERXZSMP-UHFFFAOYSA-N -1 3 384.408 -1.663 20 0 GAADHM Cn1nnc(C(=O)NCCN2CCN(c3ncccc3-c3nnn[n-]3)CC2)n1 ZINC001581843931 1075823004 /nfs/dbraw/zinc/82/30/04/1075823004.db2.gz WMECULSERXZSMP-UHFFFAOYSA-N -1 3 384.408 -1.663 20 0 GAADHM Cn1nnc(C(=O)N2CCC3(CN(C(=O)c4c[nH]c(-c5nn[n-]n5)c4)C3)C2)n1 ZINC001581843965 1075822910 /nfs/dbraw/zinc/82/29/10/1075822910.db2.gz BDABQASALCFZIM-UHFFFAOYSA-N -1 3 383.376 -1.293 20 0 GAADHM Cn1nnc(C(=O)N2CCC3(CN(C(=O)c4c[nH]c(-c5nnn[n-]5)c4)C3)C2)n1 ZINC001581843965 1075822907 /nfs/dbraw/zinc/82/29/07/1075822907.db2.gz BDABQASALCFZIM-UHFFFAOYSA-N -1 3 383.376 -1.293 20 0 GAADHM Cn1nnc(C(=O)N2CCC[C@](CO)(Nc3ccc(-c4nn[n-]n4)nc3)C2)n1 ZINC001581844022 1075822921 /nfs/dbraw/zinc/82/29/21/1075822921.db2.gz DOQUMIQWOHUJBX-HNNXBMFYSA-N -1 3 385.392 -1.136 20 0 GAADHM Cn1nnc(C(=O)N2CCC[C@](CO)(Nc3ccc(-c4nnn[n-]4)nc3)C2)n1 ZINC001581844022 1075822918 /nfs/dbraw/zinc/82/29/18/1075822918.db2.gz DOQUMIQWOHUJBX-HNNXBMFYSA-N -1 3 385.392 -1.136 20 0 GAADHM Cn1nnc(C(=O)N2CCC[C@@](CO)(Nc3ccc(-c4nn[n-]n4)nc3)C2)n1 ZINC001581844023 1075822869 /nfs/dbraw/zinc/82/28/69/1075822869.db2.gz DOQUMIQWOHUJBX-OAHLLOKOSA-N -1 3 385.392 -1.136 20 0 GAADHM Cn1nnc(C(=O)N2CCC[C@@](CO)(Nc3ccc(-c4nnn[n-]4)nc3)C2)n1 ZINC001581844023 1075822864 /nfs/dbraw/zinc/82/28/64/1075822864.db2.gz DOQUMIQWOHUJBX-OAHLLOKOSA-N -1 3 385.392 -1.136 20 0 GAADHM Cn1nnc(C(=O)NC[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)CCCO2)n1 ZINC001581844058 1075823053 /nfs/dbraw/zinc/82/30/53/1075823053.db2.gz XEBDPXJGSJGHON-LLVKDONJSA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)NC[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)CCCO2)n1 ZINC001581844058 1075823051 /nfs/dbraw/zinc/82/30/51/1075823051.db2.gz XEBDPXJGSJGHON-LLVKDONJSA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)NC[C@H]2CN(c3ccc(-c4nn[n-]n4)nc3)CCCO2)n1 ZINC001581844059 1075822993 /nfs/dbraw/zinc/82/29/93/1075822993.db2.gz XEBDPXJGSJGHON-NSHDSACASA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)NC[C@H]2CN(c3ccc(-c4nnn[n-]4)nc3)CCCO2)n1 ZINC001581844059 1075822990 /nfs/dbraw/zinc/82/29/90/1075822990.db2.gz XEBDPXJGSJGHON-NSHDSACASA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)NCC2(O)CN(Cc3ccc(F)c(-c4nn[n-]n4)c3)C2)n1 ZINC001581844083 1075822855 /nfs/dbraw/zinc/82/28/55/1075822855.db2.gz YVLMAVSHWKNLRU-UHFFFAOYSA-N -1 3 388.367 -1.494 20 0 GAADHM Cn1nnc(C(=O)NCC2(O)CN(Cc3ccc(F)c(-c4nnn[n-]4)c3)C2)n1 ZINC001581844083 1075822848 /nfs/dbraw/zinc/82/28/48/1075822848.db2.gz YVLMAVSHWKNLRU-UHFFFAOYSA-N -1 3 388.367 -1.494 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(Cc3ccc(F)c(-c4nn[n-]n4)c3)C[C@H]2O)n1 ZINC001581844087 1075822948 /nfs/dbraw/zinc/82/29/48/1075822948.db2.gz YWZNQPNEJLGKMT-VXGBXAGGSA-N -1 3 388.367 -1.496 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(Cc3ccc(F)c(-c4nnn[n-]4)c3)C[C@H]2O)n1 ZINC001581844087 1075822944 /nfs/dbraw/zinc/82/29/44/1075822944.db2.gz YWZNQPNEJLGKMT-VXGBXAGGSA-N -1 3 388.367 -1.496 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(Cc3ccc(-c4nn[n-]n4)s3)C[C@@H]2O)n1 ZINC001581844093 1075823048 /nfs/dbraw/zinc/82/30/48/1075823048.db2.gz ZGNVTKBAHDXUIC-BDAKNGLRSA-N -1 3 376.406 -1.573 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(Cc3ccc(-c4nnn[n-]4)s3)C[C@@H]2O)n1 ZINC001581844093 1075823042 /nfs/dbraw/zinc/82/30/42/1075823042.db2.gz ZGNVTKBAHDXUIC-BDAKNGLRSA-N -1 3 376.406 -1.573 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(Cc3ccc(-c4nn[n-]n4)s3)C[C@H]2O)n1 ZINC001581844094 1075822897 /nfs/dbraw/zinc/82/28/97/1075822897.db2.gz ZGNVTKBAHDXUIC-RKDXNWHRSA-N -1 3 376.406 -1.573 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(Cc3ccc(-c4nnn[n-]4)s3)C[C@H]2O)n1 ZINC001581844094 1075822893 /nfs/dbraw/zinc/82/28/93/1075822893.db2.gz ZGNVTKBAHDXUIC-RKDXNWHRSA-N -1 3 376.406 -1.573 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H]3[C@@H](CNC(=O)c4ccc(-c5nn[n-]n5)[nH]4)[C@@H]3C2)n1 ZINC001581844126 1075823223 /nfs/dbraw/zinc/82/32/23/1075823223.db2.gz FSQUBNPJOIWGKH-PSVAKVPMSA-N -1 3 383.376 -1.534 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H]3[C@@H](CNC(=O)c4ccc(-c5nnn[n-]5)[nH]4)[C@@H]3C2)n1 ZINC001581844126 1075823217 /nfs/dbraw/zinc/82/32/17/1075823217.db2.gz FSQUBNPJOIWGKH-PSVAKVPMSA-N -1 3 383.376 -1.534 20 0 GAADHM Cn1nnc(C(=O)N2CCC3(CN(C(=O)c4ccc(-c5nn[n-]n5)[nH]4)C3)C2)n1 ZINC001581844193 1075823250 /nfs/dbraw/zinc/82/32/50/1075823250.db2.gz ITQSECCGCGIRAD-UHFFFAOYSA-N -1 3 383.376 -1.293 20 0 GAADHM Cn1nnc(C(=O)N2CCC3(CN(C(=O)c4ccc(-c5nnn[n-]5)[nH]4)C3)C2)n1 ZINC001581844193 1075823244 /nfs/dbraw/zinc/82/32/44/1075823244.db2.gz ITQSECCGCGIRAD-UHFFFAOYSA-N -1 3 383.376 -1.293 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H]3[C@@H](CNC(=O)c4cc(-c5nn[n-]n5)c[nH]4)[C@@H]3C2)n1 ZINC001581844201 1075823280 /nfs/dbraw/zinc/82/32/80/1075823280.db2.gz JDLSZGZCJFLHKK-OWUUHHOZSA-N -1 3 383.376 -1.534 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H]3[C@@H](CNC(=O)c4cc(-c5nnn[n-]5)c[nH]4)[C@@H]3C2)n1 ZINC001581844201 1075823274 /nfs/dbraw/zinc/82/32/74/1075823274.db2.gz JDLSZGZCJFLHKK-OWUUHHOZSA-N -1 3 383.376 -1.534 20 0 GAADHM Cn1nnc(C(=O)N2CCC3(CN(C(=O)c4cc(-c5nn[n-]n5)c[nH]4)C3)C2)n1 ZINC001581844223 1075823339 /nfs/dbraw/zinc/82/33/39/1075823339.db2.gz JSWFPOXJTVPLOF-UHFFFAOYSA-N -1 3 383.376 -1.293 20 0 GAADHM Cn1nnc(C(=O)N2CCC3(CN(C(=O)c4cc(-c5nnn[n-]5)c[nH]4)C3)C2)n1 ZINC001581844223 1075823335 /nfs/dbraw/zinc/82/33/35/1075823335.db2.gz JSWFPOXJTVPLOF-UHFFFAOYSA-N -1 3 383.376 -1.293 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H]3[C@@H](CNC(=O)c4c[nH]c(-c5nn[n-]n5)c4)[C@@H]3C2)n1 ZINC001581844241 1075823323 /nfs/dbraw/zinc/82/33/23/1075823323.db2.gz KLSANFIEWJFWCH-OWUUHHOZSA-N -1 3 383.376 -1.534 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H]3[C@@H](CNC(=O)c4c[nH]c(-c5nnn[n-]5)c4)[C@@H]3C2)n1 ZINC001581844241 1075823319 /nfs/dbraw/zinc/82/33/19/1075823319.db2.gz KLSANFIEWJFWCH-OWUUHHOZSA-N -1 3 383.376 -1.534 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H]3CC[C@@H](C2)N3C(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581844289 1075823601 /nfs/dbraw/zinc/82/36/01/1075823601.db2.gz MSISLNLEWYBIDG-DTORHVGOSA-N -1 3 383.376 -1.153 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H]3CC[C@@H](C2)N3C(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581844289 1075823599 /nfs/dbraw/zinc/82/35/99/1075823599.db2.gz MSISLNLEWYBIDG-DTORHVGOSA-N -1 3 383.376 -1.153 20 0 GAADHM Cn1nnc(C(=O)N2CC[C@H]3CN(C(=O)c4c[nH]c(-c5nn[n-]n5)c4)C[C@H]32)n1 ZINC001581844357 1075823537 /nfs/dbraw/zinc/82/35/37/1075823537.db2.gz QEHAPBVYMRCSJL-GZMMTYOYSA-N -1 3 383.376 -1.295 20 0 GAADHM Cn1nnc(C(=O)N2CC[C@H]3CN(C(=O)c4c[nH]c(-c5nnn[n-]5)c4)C[C@H]32)n1 ZINC001581844357 1075823534 /nfs/dbraw/zinc/82/35/34/1075823534.db2.gz QEHAPBVYMRCSJL-GZMMTYOYSA-N -1 3 383.376 -1.295 20 0 GAADHM Cn1nnc(C(=O)N2CCC(O)(CNc3ncccc3-c3nn[n-]n3)CC2)n1 ZINC001581844373 1075823561 /nfs/dbraw/zinc/82/35/61/1075823561.db2.gz QVJZFJSDZYFAMH-UHFFFAOYSA-N -1 3 385.392 -1.136 20 0 GAADHM Cn1nnc(C(=O)N2CCC(O)(CNc3ncccc3-c3nnn[n-]3)CC2)n1 ZINC001581844373 1075823558 /nfs/dbraw/zinc/82/35/58/1075823558.db2.gz QVJZFJSDZYFAMH-UHFFFAOYSA-N -1 3 385.392 -1.136 20 0 GAADHM Cn1nnc(C(=O)N2CC=C(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)CC2)n1 ZINC001581844419 1075823639 /nfs/dbraw/zinc/82/36/39/1075823639.db2.gz SAGHQFFXJUDHTR-UHFFFAOYSA-N -1 3 383.376 -1.079 20 0 GAADHM Cn1nnc(C(=O)N2CC=C(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)CC2)n1 ZINC001581844419 1075823636 /nfs/dbraw/zinc/82/36/36/1075823636.db2.gz SAGHQFFXJUDHTR-UHFFFAOYSA-N -1 3 383.376 -1.079 20 0 GAADHM Cn1nnc(C(=O)N2CC[C@@H]3CN(C(=O)c4ccc(-c5nn[n-]n5)[nH]4)[C@@H]3C2)n1 ZINC001581844434 1075823931 /nfs/dbraw/zinc/82/39/31/1075823931.db2.gz TWZPPZHWPIWIGR-LDYMZIIASA-N -1 3 383.376 -1.295 20 0 GAADHM Cn1nnc(C(=O)N2CC[C@@H]3CN(C(=O)c4ccc(-c5nnn[n-]5)[nH]4)[C@@H]3C2)n1 ZINC001581844434 1075823927 /nfs/dbraw/zinc/82/39/27/1075823927.db2.gz TWZPPZHWPIWIGR-LDYMZIIASA-N -1 3 383.376 -1.295 20 0 GAADHM Cn1nnc(C(=O)N2CC[C@@H]3CN(C(=O)c4cc(-c5nn[n-]n5)c[nH]4)[C@@H]3C2)n1 ZINC001581844457 1075823919 /nfs/dbraw/zinc/82/39/19/1075823919.db2.gz UVSHWUJUWQYFBQ-LDYMZIIASA-N -1 3 383.376 -1.295 20 0 GAADHM Cn1nnc(C(=O)N2CC[C@@H]3CN(C(=O)c4cc(-c5nnn[n-]5)c[nH]4)[C@@H]3C2)n1 ZINC001581844457 1075823916 /nfs/dbraw/zinc/82/39/16/1075823916.db2.gz UVSHWUJUWQYFBQ-LDYMZIIASA-N -1 3 383.376 -1.295 20 0 GAADHM Cn1nnc(C(=O)N2CCC(O)(CNc3ccc(-c4nn[n-]n4)nc3)CC2)n1 ZINC001581844458 1075823885 /nfs/dbraw/zinc/82/38/85/1075823885.db2.gz UVVKWOLPQYSAGK-UHFFFAOYSA-N -1 3 385.392 -1.136 20 0 GAADHM Cn1nnc(C(=O)N2CCC(O)(CNc3ccc(-c4nnn[n-]4)nc3)CC2)n1 ZINC001581844458 1075823883 /nfs/dbraw/zinc/82/38/83/1075823883.db2.gz UVVKWOLPQYSAGK-UHFFFAOYSA-N -1 3 385.392 -1.136 20 0 GAADHM Cn1nnc(C(=O)N2CC[C@@H]3CN(C(=O)c4c[nH]c(-c5nn[n-]n5)c4)C[C@@H]3C2)n1 ZINC001581844478 1075823994 /nfs/dbraw/zinc/82/39/94/1075823994.db2.gz VTUMVVXVPMIVGB-KOLCDFICSA-N -1 3 397.403 -1.047 20 0 GAADHM Cn1nnc(C(=O)N2CC[C@@H]3CN(C(=O)c4c[nH]c(-c5nnn[n-]5)c4)C[C@@H]3C2)n1 ZINC001581844478 1075823989 /nfs/dbraw/zinc/82/39/89/1075823989.db2.gz VTUMVVXVPMIVGB-KOLCDFICSA-N -1 3 397.403 -1.047 20 0 GAADHM Cn1nnc(C(=O)N2CCO[C@H](CNc3ncc(-c4nn[n-]n4)cc3F)C2)n1 ZINC001581844524 1075823898 /nfs/dbraw/zinc/82/38/98/1075823898.db2.gz XTKFLXWGGOVRDT-SECBINFHSA-N -1 3 389.355 -1.123 20 0 GAADHM Cn1nnc(C(=O)N2CCO[C@H](CNc3ncc(-c4nnn[n-]4)cc3F)C2)n1 ZINC001581844524 1075823896 /nfs/dbraw/zinc/82/38/96/1075823896.db2.gz XTKFLXWGGOVRDT-SECBINFHSA-N -1 3 389.355 -1.123 20 0 GAADHM Cn1nnc(C(=O)N2CCO[C@@H](CNc3ncc(-c4nn[n-]n4)cc3F)C2)n1 ZINC001581844525 1075823891 /nfs/dbraw/zinc/82/38/91/1075823891.db2.gz XTKFLXWGGOVRDT-VIFPVBQESA-N -1 3 389.355 -1.123 20 0 GAADHM Cn1nnc(C(=O)N2CCO[C@@H](CNc3ncc(-c4nnn[n-]4)cc3F)C2)n1 ZINC001581844525 1075823889 /nfs/dbraw/zinc/82/38/89/1075823889.db2.gz XTKFLXWGGOVRDT-VIFPVBQESA-N -1 3 389.355 -1.123 20 0 GAADHM Cn1nnc(C(=O)N2CCC[C@](CO)(Nc3ccc(-c4nn[n-]n4)cn3)C2)n1 ZINC001581844543 1075823869 /nfs/dbraw/zinc/82/38/69/1075823869.db2.gz YOSAZDQBVXGHAY-HNNXBMFYSA-N -1 3 385.392 -1.136 20 0 GAADHM Cn1nnc(C(=O)N2CCC[C@](CO)(Nc3ccc(-c4nnn[n-]4)cn3)C2)n1 ZINC001581844543 1075823866 /nfs/dbraw/zinc/82/38/66/1075823866.db2.gz YOSAZDQBVXGHAY-HNNXBMFYSA-N -1 3 385.392 -1.136 20 0 GAADHM Cn1nnc(C(=O)N2CCC[C@@](CO)(Nc3ccc(-c4nn[n-]n4)cn3)C2)n1 ZINC001581844544 1075824027 /nfs/dbraw/zinc/82/40/27/1075824027.db2.gz YOSAZDQBVXGHAY-OAHLLOKOSA-N -1 3 385.392 -1.136 20 0 GAADHM Cn1nnc(C(=O)N2CCC[C@@](CO)(Nc3ccc(-c4nnn[n-]4)cn3)C2)n1 ZINC001581844544 1075824022 /nfs/dbraw/zinc/82/40/22/1075824022.db2.gz YOSAZDQBVXGHAY-OAHLLOKOSA-N -1 3 385.392 -1.136 20 0 GAADHM Cn1nnc(CN2CCC(CO)(NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)CC2)n1 ZINC001581844578 1075823978 /nfs/dbraw/zinc/82/39/78/1075823978.db2.gz ADPPEMMDESDDGK-UHFFFAOYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN2CCC(CO)(NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)CC2)n1 ZINC001581844578 1075823972 /nfs/dbraw/zinc/82/39/72/1075823972.db2.gz ADPPEMMDESDDGK-UHFFFAOYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN2CCN(CCNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)n1 ZINC001581844592 1075824003 /nfs/dbraw/zinc/82/40/03/1075824003.db2.gz APZZZTHBHLCBOZ-UHFFFAOYSA-N -1 3 386.424 -1.734 20 0 GAADHM Cn1nnc(CN2CCN(CCNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)n1 ZINC001581844592 1075823998 /nfs/dbraw/zinc/82/39/98/1075823998.db2.gz APZZZTHBHLCBOZ-UHFFFAOYSA-N -1 3 386.424 -1.734 20 0 GAADHM Cn1nnc(CN[C@@]2(CO)CCCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581844631 1075823962 /nfs/dbraw/zinc/82/39/62/1075823962.db2.gz CPVYFQIIVASRFY-HNNXBMFYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN[C@@]2(CO)CCCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581844631 1075823955 /nfs/dbraw/zinc/82/39/55/1075823955.db2.gz CPVYFQIIVASRFY-HNNXBMFYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN[C@]2(CO)CCCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581844632 1075823945 /nfs/dbraw/zinc/82/39/45/1075823945.db2.gz CPVYFQIIVASRFY-OAHLLOKOSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN[C@]2(CO)CCCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581844632 1075823942 /nfs/dbraw/zinc/82/39/42/1075823942.db2.gz CPVYFQIIVASRFY-OAHLLOKOSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CNCC2(NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)CCOCC2)n1 ZINC001581844639 1075824216 /nfs/dbraw/zinc/82/42/16/1075824216.db2.gz CTNYRAAKEIOVNC-UHFFFAOYSA-N -1 3 387.408 -1.213 20 0 GAADHM Cn1nnc(CNCC2(NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)CCOCC2)n1 ZINC001581844639 1075824207 /nfs/dbraw/zinc/82/42/07/1075824207.db2.gz CTNYRAAKEIOVNC-UHFFFAOYSA-N -1 3 387.408 -1.213 20 0 GAADHM Cn1nnc(CN2CCCO[C@H](CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581844649 1075824400 /nfs/dbraw/zinc/82/44/00/1075824400.db2.gz DPMZWHUBBHFUAJ-LLVKDONJSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCCO[C@H](CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581844649 1075824394 /nfs/dbraw/zinc/82/43/94/1075824394.db2.gz DPMZWHUBBHFUAJ-LLVKDONJSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCCO[C@@H](CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581844650 1075824360 /nfs/dbraw/zinc/82/43/60/1075824360.db2.gz DPMZWHUBBHFUAJ-NSHDSACASA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCCO[C@@H](CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581844650 1075824356 /nfs/dbraw/zinc/82/43/56/1075824356.db2.gz DPMZWHUBBHFUAJ-NSHDSACASA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCO[C@@](C)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581844669 1075824157 /nfs/dbraw/zinc/82/41/57/1075824157.db2.gz FHVFCIHLIMEAGH-HNNXBMFYSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCO[C@@](C)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581844669 1075824154 /nfs/dbraw/zinc/82/41/54/1075824154.db2.gz FHVFCIHLIMEAGH-HNNXBMFYSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCO[C@](C)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581844670 1075824420 /nfs/dbraw/zinc/82/44/20/1075824420.db2.gz FHVFCIHLIMEAGH-OAHLLOKOSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCO[C@](C)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581844670 1075824417 /nfs/dbraw/zinc/82/44/17/1075824417.db2.gz FHVFCIHLIMEAGH-OAHLLOKOSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCC[C@](CO)(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581844673 1075824166 /nfs/dbraw/zinc/82/41/66/1075824166.db2.gz FJXXNJKTQVFLII-HNNXBMFYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN2CCC[C@](CO)(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581844673 1075824163 /nfs/dbraw/zinc/82/41/63/1075824163.db2.gz FJXXNJKTQVFLII-HNNXBMFYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN2CCC[C@@](CO)(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581844674 1075824318 /nfs/dbraw/zinc/82/43/18/1075824318.db2.gz FJXXNJKTQVFLII-OAHLLOKOSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN2CCC[C@@](CO)(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581844674 1075824314 /nfs/dbraw/zinc/82/43/14/1075824314.db2.gz FJXXNJKTQVFLII-OAHLLOKOSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CNC[C@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CCCO2)n1 ZINC001581844692 1075824263 /nfs/dbraw/zinc/82/42/63/1075824263.db2.gz GCHJAPIWSNDIEY-JTQLQIEISA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CNC[C@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CCCO2)n1 ZINC001581844692 1075824257 /nfs/dbraw/zinc/82/42/57/1075824257.db2.gz GCHJAPIWSNDIEY-JTQLQIEISA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CNC[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CCCO2)n1 ZINC001581844693 1075824279 /nfs/dbraw/zinc/82/42/79/1075824279.db2.gz GCHJAPIWSNDIEY-SNVBAGLBSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CNC[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CCCO2)n1 ZINC001581844693 1075824273 /nfs/dbraw/zinc/82/42/73/1075824273.db2.gz GCHJAPIWSNDIEY-SNVBAGLBSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CC3(C2)CN(C(=O)c2c[nH]c(-c4nn[n-]n4)c2)CCO3)n1 ZINC001581844726 1075824386 /nfs/dbraw/zinc/82/43/86/1075824386.db2.gz HKEAWBZVQFLIJF-UHFFFAOYSA-N -1 3 385.392 -1.555 20 0 GAADHM Cn1nnc(CN2CC3(C2)CN(C(=O)c2c[nH]c(-c4nnn[n-]4)c2)CCO3)n1 ZINC001581844726 1075824380 /nfs/dbraw/zinc/82/43/80/1075824380.db2.gz HKEAWBZVQFLIJF-UHFFFAOYSA-N -1 3 385.392 -1.555 20 0 GAADHM Cn1nnc(CN2CCO[C@@](C)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581844761 1075824332 /nfs/dbraw/zinc/82/43/32/1075824332.db2.gz IWXFJZHIMMFFDD-HNNXBMFYSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCO[C@@](C)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581844761 1075824327 /nfs/dbraw/zinc/82/43/27/1075824327.db2.gz IWXFJZHIMMFFDD-HNNXBMFYSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCO[C@](C)(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581844762 1075824344 /nfs/dbraw/zinc/82/43/44/1075824344.db2.gz IWXFJZHIMMFFDD-OAHLLOKOSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCO[C@](C)(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581844762 1075824340 /nfs/dbraw/zinc/82/43/40/1075824340.db2.gz IWXFJZHIMMFFDD-OAHLLOKOSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CC3(C2)CN(C(=O)c2ccc(-c4nn[n-]n4)[nH]2)CCO3)n1 ZINC001581844803 1075824372 /nfs/dbraw/zinc/82/43/72/1075824372.db2.gz KZFXLERAUCXQGW-UHFFFAOYSA-N -1 3 385.392 -1.555 20 0 GAADHM Cn1nnc(CN2CC3(C2)CN(C(=O)c2ccc(-c4nnn[n-]4)[nH]2)CCO3)n1 ZINC001581844803 1075824369 /nfs/dbraw/zinc/82/43/69/1075824369.db2.gz KZFXLERAUCXQGW-UHFFFAOYSA-N -1 3 385.392 -1.555 20 0 GAADHM Cn1nnc(CN2CCO[C@@](C)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581844816 1075824179 /nfs/dbraw/zinc/82/41/79/1075824179.db2.gz LJSHIBBNJFGEOY-HNNXBMFYSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCO[C@@](C)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581844816 1075824174 /nfs/dbraw/zinc/82/41/74/1075824174.db2.gz LJSHIBBNJFGEOY-HNNXBMFYSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCO[C@](C)(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581844817 1075824231 /nfs/dbraw/zinc/82/42/31/1075824231.db2.gz LJSHIBBNJFGEOY-OAHLLOKOSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCO[C@](C)(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581844817 1075824227 /nfs/dbraw/zinc/82/42/27/1075824227.db2.gz LJSHIBBNJFGEOY-OAHLLOKOSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CNC[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)CCCO2)n1 ZINC001581844822 1075824192 /nfs/dbraw/zinc/82/41/92/1075824192.db2.gz LPUOYBODXOPVSX-LLVKDONJSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CNC[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)CCCO2)n1 ZINC001581844822 1075824187 /nfs/dbraw/zinc/82/41/87/1075824187.db2.gz LPUOYBODXOPVSX-LLVKDONJSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CNC[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)CCCO2)n1 ZINC001581844823 1075824409 /nfs/dbraw/zinc/82/44/09/1075824409.db2.gz LPUOYBODXOPVSX-NSHDSACASA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CNC[C@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)CCCO2)n1 ZINC001581844823 1075824406 /nfs/dbraw/zinc/82/44/06/1075824406.db2.gz LPUOYBODXOPVSX-NSHDSACASA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CNCC2(O)CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2)n1 ZINC001581844839 1075824300 /nfs/dbraw/zinc/82/43/00/1075824300.db2.gz MMWSZVTYFXZPJO-UHFFFAOYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CNCC2(O)CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2)n1 ZINC001581844839 1075824296 /nfs/dbraw/zinc/82/42/96/1075824296.db2.gz MMWSZVTYFXZPJO-UHFFFAOYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN2CCN(CCNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)CC2)n1 ZINC001581844840 1075824242 /nfs/dbraw/zinc/82/42/42/1075824242.db2.gz MPHSTKDDMNAUOR-UHFFFAOYSA-N -1 3 386.424 -1.734 20 0 GAADHM Cn1nnc(CN2CCN(CCNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)CC2)n1 ZINC001581844840 1075824237 /nfs/dbraw/zinc/82/42/37/1075824237.db2.gz MPHSTKDDMNAUOR-UHFFFAOYSA-N -1 3 386.424 -1.734 20 0 GAADHM Cn1nnc(CN2CC3(C2)C[C@H](NC(=O)c2cc(-c4nn[n-]n4)c[nH]2)CO3)n1 ZINC001581844854 1075824574 /nfs/dbraw/zinc/82/45/74/1075824574.db2.gz NMTCTYOKSBFMIS-JTQLQIEISA-N -1 3 385.392 -1.508 20 0 GAADHM Cn1nnc(CN2CC3(C2)C[C@H](NC(=O)c2cc(-c4nnn[n-]4)c[nH]2)CO3)n1 ZINC001581844854 1075824571 /nfs/dbraw/zinc/82/45/71/1075824571.db2.gz NMTCTYOKSBFMIS-JTQLQIEISA-N -1 3 385.392 -1.508 20 0 GAADHM Cn1nnc(CN2CC3(C2)C[C@@H](NC(=O)c2cc(-c4nn[n-]n4)c[nH]2)CO3)n1 ZINC001581844855 1075824711 /nfs/dbraw/zinc/82/47/11/1075824711.db2.gz NMTCTYOKSBFMIS-SNVBAGLBSA-N -1 3 385.392 -1.508 20 0 GAADHM Cn1nnc(CN2CC3(C2)C[C@@H](NC(=O)c2cc(-c4nnn[n-]4)c[nH]2)CO3)n1 ZINC001581844855 1075824708 /nfs/dbraw/zinc/82/47/08/1075824708.db2.gz NMTCTYOKSBFMIS-SNVBAGLBSA-N -1 3 385.392 -1.508 20 0 GAADHM Cn1nnc(CNCC2(O)CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)n1 ZINC001581844920 1075824599 /nfs/dbraw/zinc/82/45/99/1075824599.db2.gz PUJWIXKOXRLSGO-UHFFFAOYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CNCC2(O)CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)n1 ZINC001581844920 1075824593 /nfs/dbraw/zinc/82/45/93/1075824593.db2.gz PUJWIXKOXRLSGO-UHFFFAOYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN[C@@]2(CO)CCCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581844921 1075824694 /nfs/dbraw/zinc/82/46/94/1075824694.db2.gz PUKWJBJWQINLQY-HNNXBMFYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN[C@@]2(CO)CCCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581844921 1075824692 /nfs/dbraw/zinc/82/46/92/1075824692.db2.gz PUKWJBJWQINLQY-HNNXBMFYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN[C@]2(CO)CCCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581844922 1075824663 /nfs/dbraw/zinc/82/46/63/1075824663.db2.gz PUKWJBJWQINLQY-OAHLLOKOSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN[C@]2(CO)CCCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581844922 1075824660 /nfs/dbraw/zinc/82/46/60/1075824660.db2.gz PUKWJBJWQINLQY-OAHLLOKOSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C(=O)c2ccc(-c3nn[n-]n3)[nH]2)n1 ZINC001581844939 1075824688 /nfs/dbraw/zinc/82/46/88/1075824688.db2.gz QOHAUCBYOTXEMG-GGVZMXCHSA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C(=O)c2ccc(-c3nnn[n-]3)[nH]2)n1 ZINC001581844939 1075824686 /nfs/dbraw/zinc/82/46/86/1075824686.db2.gz QOHAUCBYOTXEMG-GGVZMXCHSA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(CN2CC3(C2)CN(C(=O)c2cc(-c4nn[n-]n4)c[nH]2)CCO3)n1 ZINC001581844941 1075824653 /nfs/dbraw/zinc/82/46/53/1075824653.db2.gz QPBPBVFVTNWDDJ-UHFFFAOYSA-N -1 3 385.392 -1.555 20 0 GAADHM Cn1nnc(CN2CC3(C2)CN(C(=O)c2cc(-c4nnn[n-]4)c[nH]2)CCO3)n1 ZINC001581844941 1075824650 /nfs/dbraw/zinc/82/46/50/1075824650.db2.gz QPBPBVFVTNWDDJ-UHFFFAOYSA-N -1 3 385.392 -1.555 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001581844959 1075824641 /nfs/dbraw/zinc/82/46/41/1075824641.db2.gz RDKCVHCYMLRDQV-YWVKMMECSA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001581844959 1075824637 /nfs/dbraw/zinc/82/46/37/1075824637.db2.gz RDKCVHCYMLRDQV-YWVKMMECSA-N -1 3 383.376 -1.106 20 0 GAADHM Cn1nnc(CN2CCCO[C@H](CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581844981 1075824742 /nfs/dbraw/zinc/82/47/42/1075824742.db2.gz SCHSWFHYFGAHHM-LLVKDONJSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCCO[C@H](CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581844981 1075824739 /nfs/dbraw/zinc/82/47/39/1075824739.db2.gz SCHSWFHYFGAHHM-LLVKDONJSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCCO[C@@H](CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001581844982 1075824768 /nfs/dbraw/zinc/82/47/68/1075824768.db2.gz SCHSWFHYFGAHHM-NSHDSACASA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCCO[C@@H](CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001581844982 1075824762 /nfs/dbraw/zinc/82/47/62/1075824762.db2.gz SCHSWFHYFGAHHM-NSHDSACASA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CNC2(CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)CCOCC2)n1 ZINC001581845014 1075824734 /nfs/dbraw/zinc/82/47/34/1075824734.db2.gz UDVVSMODEXPTPC-UHFFFAOYSA-N -1 3 387.408 -1.213 20 0 GAADHM Cn1nnc(CNC2(CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)CCOCC2)n1 ZINC001581845014 1075824732 /nfs/dbraw/zinc/82/47/32/1075824732.db2.gz UDVVSMODEXPTPC-UHFFFAOYSA-N -1 3 387.408 -1.213 20 0 GAADHM Cn1nnc(CN2CCC(CO)(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2)n1 ZINC001581845043 1075824672 /nfs/dbraw/zinc/82/46/72/1075824672.db2.gz UZAPIUOEWJRECZ-UHFFFAOYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN2CCC(CO)(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2)n1 ZINC001581845043 1075824669 /nfs/dbraw/zinc/82/46/69/1075824669.db2.gz UZAPIUOEWJRECZ-UHFFFAOYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CNC2(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)CCOCC2)n1 ZINC001581845061 1075824558 /nfs/dbraw/zinc/82/45/58/1075824558.db2.gz VJRIGHUHRMHRER-UHFFFAOYSA-N -1 3 387.408 -1.213 20 0 GAADHM Cn1nnc(CNC2(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)CCOCC2)n1 ZINC001581845061 1075824555 /nfs/dbraw/zinc/82/45/55/1075824555.db2.gz VJRIGHUHRMHRER-UHFFFAOYSA-N -1 3 387.408 -1.213 20 0 GAADHM Cn1nnc(CN2CC3(C2)C[C@@H](NC(=O)c2ccc(-c4nn[n-]n4)[nH]2)CO3)n1 ZINC001581845084 1075824701 /nfs/dbraw/zinc/82/47/01/1075824701.db2.gz VUDYAQVLJMDHIV-SECBINFHSA-N -1 3 385.392 -1.508 20 0 GAADHM Cn1nnc(CN2CC3(C2)C[C@@H](NC(=O)c2ccc(-c4nnn[n-]4)[nH]2)CO3)n1 ZINC001581845084 1075824698 /nfs/dbraw/zinc/82/46/98/1075824698.db2.gz VUDYAQVLJMDHIV-SECBINFHSA-N -1 3 385.392 -1.508 20 0 GAADHM Cn1nnc(CN2CC3(C2)C[C@H](NC(=O)c2ccc(-c4nn[n-]n4)[nH]2)CO3)n1 ZINC001581845086 1075824717 /nfs/dbraw/zinc/82/47/17/1075824717.db2.gz VUDYAQVLJMDHIV-VIFPVBQESA-N -1 3 385.392 -1.508 20 0 GAADHM Cn1nnc(CN2CC3(C2)C[C@H](NC(=O)c2ccc(-c4nnn[n-]4)[nH]2)CO3)n1 ZINC001581845086 1075824716 /nfs/dbraw/zinc/82/47/16/1075824716.db2.gz VUDYAQVLJMDHIV-VIFPVBQESA-N -1 3 385.392 -1.508 20 0 GAADHM Cn1nnc(CN2CCC[C@](CO)(NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581845115 1075824614 /nfs/dbraw/zinc/82/46/14/1075824614.db2.gz WOUNMTTUAFNKLN-HNNXBMFYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN2CCC[C@](CO)(NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581845115 1075824610 /nfs/dbraw/zinc/82/46/10/1075824610.db2.gz WOUNMTTUAFNKLN-HNNXBMFYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN2CCC[C@@](CO)(NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001581845118 1075824681 /nfs/dbraw/zinc/82/46/81/1075824681.db2.gz WOUNMTTUAFNKLN-OAHLLOKOSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN2CCC[C@@](CO)(NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001581845118 1075824678 /nfs/dbraw/zinc/82/46/78/1075824678.db2.gz WOUNMTTUAFNKLN-OAHLLOKOSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CNCC2(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)CCOCC2)n1 ZINC001581845183 1075824980 /nfs/dbraw/zinc/82/49/80/1075824980.db2.gz XAQNGCITXPWNFZ-UHFFFAOYSA-N -1 3 387.408 -1.213 20 0 GAADHM Cn1nnc(CNCC2(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)CCOCC2)n1 ZINC001581845183 1075824977 /nfs/dbraw/zinc/82/49/77/1075824977.db2.gz XAQNGCITXPWNFZ-UHFFFAOYSA-N -1 3 387.408 -1.213 20 0 GAADHM Cn1nnc(CNCC2(O)CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)CC2)n1 ZINC001581845194 1075825022 /nfs/dbraw/zinc/82/50/22/1075825022.db2.gz XPPNSJZQANDMBS-UHFFFAOYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CNCC2(O)CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)CC2)n1 ZINC001581845194 1075825016 /nfs/dbraw/zinc/82/50/16/1075825016.db2.gz XPPNSJZQANDMBS-UHFFFAOYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CNC2(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)CCOCC2)n1 ZINC001581845198 1075824945 /nfs/dbraw/zinc/82/49/45/1075824945.db2.gz XSVTWKYVCSYAAU-UHFFFAOYSA-N -1 3 387.408 -1.213 20 0 GAADHM Cn1nnc(CNC2(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)CCOCC2)n1 ZINC001581845198 1075824943 /nfs/dbraw/zinc/82/49/43/1075824943.db2.gz XSVTWKYVCSYAAU-UHFFFAOYSA-N -1 3 387.408 -1.213 20 0 GAADHM Cn1nnc(CN[C@@]2(CO)CCCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581845238 1075825036 /nfs/dbraw/zinc/82/50/36/1075825036.db2.gz YNHWPCLKRNSFCO-HNNXBMFYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN[C@@]2(CO)CCCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581845238 1075825030 /nfs/dbraw/zinc/82/50/30/1075825030.db2.gz YNHWPCLKRNSFCO-HNNXBMFYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN[C@]2(CO)CCCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581845241 1075825124 /nfs/dbraw/zinc/82/51/24/1075825124.db2.gz YNHWPCLKRNSFCO-OAHLLOKOSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN[C@]2(CO)CCCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581845241 1075825118 /nfs/dbraw/zinc/82/51/18/1075825118.db2.gz YNHWPCLKRNSFCO-OAHLLOKOSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnc(CN2CCCO[C@@H](CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581845325 1075825093 /nfs/dbraw/zinc/82/50/93/1075825093.db2.gz ZSWWEPMRJGEEOD-JTQLQIEISA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCCO[C@@H](CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581845325 1075825090 /nfs/dbraw/zinc/82/50/90/1075825090.db2.gz ZSWWEPMRJGEEOD-JTQLQIEISA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCCO[C@H](CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001581845327 1075825146 /nfs/dbraw/zinc/82/51/46/1075825146.db2.gz ZSWWEPMRJGEEOD-SNVBAGLBSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCCO[C@H](CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001581845327 1075825143 /nfs/dbraw/zinc/82/51/43/1075825143.db2.gz ZSWWEPMRJGEEOD-SNVBAGLBSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CN2CCN(CCNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2)n1 ZINC001581845329 1075824994 /nfs/dbraw/zinc/82/49/94/1075824994.db2.gz ZSYJMPXMOFLBAU-UHFFFAOYSA-N -1 3 386.424 -1.734 20 0 GAADHM Cn1nnc(CN2CCN(CCNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2)n1 ZINC001581845329 1075824990 /nfs/dbraw/zinc/82/49/90/1075824990.db2.gz ZSYJMPXMOFLBAU-UHFFFAOYSA-N -1 3 386.424 -1.734 20 0 GAADHM Cn1nnc2c1C[C@H](C(=O)NCCNC(=O)c1c[nH]c(-c3nn[n-]n3)c1)CC2 ZINC001581845767 1075825055 /nfs/dbraw/zinc/82/50/55/1075825055.db2.gz IIYJLBXVYCPYGC-SECBINFHSA-N -1 3 384.404 -1.026 20 0 GAADHM Cn1nnc2c1C[C@H](C(=O)NCCNC(=O)c1c[nH]c(-c3nnn[n-]3)c1)CC2 ZINC001581845767 1075825049 /nfs/dbraw/zinc/82/50/49/1075825049.db2.gz IIYJLBXVYCPYGC-SECBINFHSA-N -1 3 384.404 -1.026 20 0 GAADHM Cn1nnc2c1C[C@@H](C(=O)NCCNC(=O)c1c[nH]c(-c3nn[n-]n3)c1)CC2 ZINC001581845768 1075824937 /nfs/dbraw/zinc/82/49/37/1075824937.db2.gz IIYJLBXVYCPYGC-VIFPVBQESA-N -1 3 384.404 -1.026 20 0 GAADHM Cn1nnc2c1C[C@@H](C(=O)NCCNC(=O)c1c[nH]c(-c3nnn[n-]3)c1)CC2 ZINC001581845768 1075824933 /nfs/dbraw/zinc/82/49/33/1075824933.db2.gz IIYJLBXVYCPYGC-VIFPVBQESA-N -1 3 384.404 -1.026 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@](O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581845843 1075825321 /nfs/dbraw/zinc/82/53/21/1075825321.db2.gz LLBNQKMONLKCGF-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@](O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581845843 1075825318 /nfs/dbraw/zinc/82/53/18/1075825318.db2.gz LLBNQKMONLKCGF-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@@](O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581845844 1075825308 /nfs/dbraw/zinc/82/53/08/1075825308.db2.gz LLBNQKMONLKCGF-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@@](O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581845844 1075825303 /nfs/dbraw/zinc/82/53/03/1075825303.db2.gz LLBNQKMONLKCGF-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@](O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581845865 1075825494 /nfs/dbraw/zinc/82/54/94/1075825494.db2.gz MCIORGWUASPPER-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@](O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581845865 1075825489 /nfs/dbraw/zinc/82/54/89/1075825489.db2.gz MCIORGWUASPPER-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@@](O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581845866 1075825505 /nfs/dbraw/zinc/82/55/05/1075825505.db2.gz MCIORGWUASPPER-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@@](O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581845866 1075825502 /nfs/dbraw/zinc/82/55/02/1075825502.db2.gz MCIORGWUASPPER-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@H](O)C1 ZINC001581845948 1075825394 /nfs/dbraw/zinc/82/53/94/1075825394.db2.gz PCYYOEVDZADXRK-BXKDBHETSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@H](O)C1 ZINC001581845948 1075825389 /nfs/dbraw/zinc/82/53/89/1075825389.db2.gz PCYYOEVDZADXRK-BXKDBHETSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001581845949 1075825446 /nfs/dbraw/zinc/82/54/46/1075825446.db2.gz PCYYOEVDZADXRK-CABZTGNLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001581845949 1075825442 /nfs/dbraw/zinc/82/54/42/1075825442.db2.gz PCYYOEVDZADXRK-CABZTGNLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@H](O)C1 ZINC001581845950 1075825409 /nfs/dbraw/zinc/82/54/09/1075825409.db2.gz PCYYOEVDZADXRK-JOYOIKCWSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@H](O)C1 ZINC001581845950 1075825403 /nfs/dbraw/zinc/82/54/03/1075825403.db2.gz PCYYOEVDZADXRK-JOYOIKCWSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001581845951 1075825472 /nfs/dbraw/zinc/82/54/72/1075825472.db2.gz PCYYOEVDZADXRK-SKDRFNHKSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001581845951 1075825469 /nfs/dbraw/zinc/82/54/69/1075825469.db2.gz PCYYOEVDZADXRK-SKDRFNHKSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@H](O)C1 ZINC001581846105 1075825346 /nfs/dbraw/zinc/82/53/46/1075825346.db2.gz WHBFNVDOLFRECU-BXKDBHETSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@H](O)C1 ZINC001581846105 1075825341 /nfs/dbraw/zinc/82/53/41/1075825341.db2.gz WHBFNVDOLFRECU-BXKDBHETSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001581846106 1075825482 /nfs/dbraw/zinc/82/54/82/1075825482.db2.gz WHBFNVDOLFRECU-CABZTGNLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001581846106 1075825478 /nfs/dbraw/zinc/82/54/78/1075825478.db2.gz WHBFNVDOLFRECU-CABZTGNLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@H](O)C1 ZINC001581846107 1075825706 /nfs/dbraw/zinc/82/57/06/1075825706.db2.gz WHBFNVDOLFRECU-JOYOIKCWSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@H](O)C1 ZINC001581846107 1075825704 /nfs/dbraw/zinc/82/57/04/1075825704.db2.gz WHBFNVDOLFRECU-JOYOIKCWSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001581846108 1075825823 /nfs/dbraw/zinc/82/58/23/1075825823.db2.gz WHBFNVDOLFRECU-SKDRFNHKSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001581846108 1075825820 /nfs/dbraw/zinc/82/58/20/1075825820.db2.gz WHBFNVDOLFRECU-SKDRFNHKSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@](O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581846148 1075825794 /nfs/dbraw/zinc/82/57/94/1075825794.db2.gz XVWUDQCEVCDDTF-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@](O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581846148 1075825788 /nfs/dbraw/zinc/82/57/88/1075825788.db2.gz XVWUDQCEVCDDTF-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@@](O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581846149 1075825844 /nfs/dbraw/zinc/82/58/44/1075825844.db2.gz XVWUDQCEVCDDTF-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)N1CC[C@@](O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581846149 1075825841 /nfs/dbraw/zinc/82/58/41/1075825841.db2.gz XVWUDQCEVCDDTF-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)NC1(CCO)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581846265 1075825731 /nfs/dbraw/zinc/82/57/31/1075825731.db2.gz BTUZLUPFKPJUDA-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)NC1(CCO)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581846265 1075825727 /nfs/dbraw/zinc/82/57/27/1075825727.db2.gz BTUZLUPFKPJUDA-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)N1CCOC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581846294 1075825890 /nfs/dbraw/zinc/82/58/90/1075825890.db2.gz CSGBSDLBZMBNBV-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)N1CCOC[C@@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581846294 1075825885 /nfs/dbraw/zinc/82/58/85/1075825885.db2.gz CSGBSDLBZMBNBV-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)N1CCOC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581846295 1075825854 /nfs/dbraw/zinc/82/58/54/1075825854.db2.gz CSGBSDLBZMBNBV-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)N1CCOC[C@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581846295 1075825851 /nfs/dbraw/zinc/82/58/51/1075825851.db2.gz CSGBSDLBZMBNBV-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NC1(CCO)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581846324 1075825834 /nfs/dbraw/zinc/82/58/34/1075825834.db2.gz DXRLLTFGXVGXFK-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)NC1(CCO)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581846324 1075825831 /nfs/dbraw/zinc/82/58/31/1075825831.db2.gz DXRLLTFGXVGXFK-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)NC1(CCO)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581846418 1075825769 /nfs/dbraw/zinc/82/57/69/1075825769.db2.gz IMVBNMYUMGZLMO-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)NC1(CCO)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581846418 1075825765 /nfs/dbraw/zinc/82/57/65/1075825765.db2.gz IMVBNMYUMGZLMO-UHFFFAOYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)N1CCO[C@@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581846420 1075825718 /nfs/dbraw/zinc/82/57/18/1075825718.db2.gz IOGIHXKMEYPKFA-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)N1CCO[C@@H](CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581846420 1075825716 /nfs/dbraw/zinc/82/57/16/1075825716.db2.gz IOGIHXKMEYPKFA-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)N1CCO[C@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581846421 1075825754 /nfs/dbraw/zinc/82/57/54/1075825754.db2.gz IOGIHXKMEYPKFA-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)N1CCO[C@H](CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581846421 1075825752 /nfs/dbraw/zinc/82/57/52/1075825752.db2.gz IOGIHXKMEYPKFA-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)N1CCO[C@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581846507 1075825876 /nfs/dbraw/zinc/82/58/76/1075825876.db2.gz LWGQQBMBZALGTD-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)N1CCO[C@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581846507 1075825872 /nfs/dbraw/zinc/82/58/72/1075825872.db2.gz LWGQQBMBZALGTD-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)N1CCO[C@@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581846508 1075826184 /nfs/dbraw/zinc/82/61/84/1075826184.db2.gz LWGQQBMBZALGTD-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)N1CCO[C@@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581846508 1075826181 /nfs/dbraw/zinc/82/61/81/1075826181.db2.gz LWGQQBMBZALGTD-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)N1CCO[C@@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581846509 1075826299 /nfs/dbraw/zinc/82/62/99/1075826299.db2.gz LWSVGYPUPXGSII-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)N1CCO[C@@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581846509 1075826297 /nfs/dbraw/zinc/82/62/97/1075826297.db2.gz LWSVGYPUPXGSII-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)N1CCO[C@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581846510 1075826246 /nfs/dbraw/zinc/82/62/46/1075826246.db2.gz LWSVGYPUPXGSII-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)N1CCO[C@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581846510 1075826243 /nfs/dbraw/zinc/82/62/43/1075826243.db2.gz LWSVGYPUPXGSII-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)N1CCOC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581846753 1075826268 /nfs/dbraw/zinc/82/62/68/1075826268.db2.gz YBZZFDJZEOVWHV-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)N1CCOC[C@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581846753 1075826267 /nfs/dbraw/zinc/82/62/67/1075826267.db2.gz YBZZFDJZEOVWHV-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)N1CCOC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581846754 1075826200 /nfs/dbraw/zinc/82/62/00/1075826200.db2.gz YBZZFDJZEOVWHV-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)N1CCOC[C@@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581846754 1075826196 /nfs/dbraw/zinc/82/61/96/1075826196.db2.gz YBZZFDJZEOVWHV-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NC[C@@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581846839 1075826263 /nfs/dbraw/zinc/82/62/63/1075826263.db2.gz BJPXGTCASHCDMY-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)NC[C@@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581846839 1075826261 /nfs/dbraw/zinc/82/62/61/1075826261.db2.gz BJPXGTCASHCDMY-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)NC[C@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581846840 1075826218 /nfs/dbraw/zinc/82/62/18/1075826218.db2.gz BJPXGTCASHCDMY-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)NC[C@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581846840 1075826213 /nfs/dbraw/zinc/82/62/13/1075826213.db2.gz BJPXGTCASHCDMY-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O ZINC001581847470 1075826234 /nfs/dbraw/zinc/82/62/34/1075826234.db2.gz KVZYRERLPCZWQD-PELKAZGASA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O ZINC001581847470 1075826228 /nfs/dbraw/zinc/82/62/28/1075826228.db2.gz KVZYRERLPCZWQD-PELKAZGASA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O ZINC001581847471 1075826556 /nfs/dbraw/zinc/82/65/56/1075826556.db2.gz KVZYRERLPCZWQD-PRHODGIISA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O ZINC001581847471 1075826551 /nfs/dbraw/zinc/82/65/51/1075826551.db2.gz KVZYRERLPCZWQD-PRHODGIISA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O ZINC001581847472 1075826451 /nfs/dbraw/zinc/82/64/51/1075826451.db2.gz KVZYRERLPCZWQD-QPUJVOFHSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O ZINC001581847472 1075826444 /nfs/dbraw/zinc/82/64/44/1075826444.db2.gz KVZYRERLPCZWQD-QPUJVOFHSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O ZINC001581847473 1075826544 /nfs/dbraw/zinc/82/65/44/1075826544.db2.gz KVZYRERLPCZWQD-UFBFGSQYSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O ZINC001581847473 1075826541 /nfs/dbraw/zinc/82/65/41/1075826541.db2.gz KVZYRERLPCZWQD-UFBFGSQYSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581847595 1075826652 /nfs/dbraw/zinc/82/66/52/1075826652.db2.gz LTZOTYZSXYAXMM-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581847595 1075826648 /nfs/dbraw/zinc/82/66/48/1075826648.db2.gz LTZOTYZSXYAXMM-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)NC[C@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581847596 1075826722 /nfs/dbraw/zinc/82/67/22/1075826722.db2.gz LTZOTYZSXYAXMM-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)NC[C@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581847596 1075826717 /nfs/dbraw/zinc/82/67/17/1075826717.db2.gz LTZOTYZSXYAXMM-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O ZINC001581847778 1075826610 /nfs/dbraw/zinc/82/66/10/1075826610.db2.gz QRDCDTKSNQCHFN-BXKDBHETSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O ZINC001581847778 1075826604 /nfs/dbraw/zinc/82/66/04/1075826604.db2.gz QRDCDTKSNQCHFN-BXKDBHETSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O ZINC001581847779 1075826466 /nfs/dbraw/zinc/82/64/66/1075826466.db2.gz QRDCDTKSNQCHFN-CABZTGNLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O ZINC001581847779 1075826461 /nfs/dbraw/zinc/82/64/61/1075826461.db2.gz QRDCDTKSNQCHFN-CABZTGNLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O ZINC001581847780 1075826477 /nfs/dbraw/zinc/82/64/77/1075826477.db2.gz QRDCDTKSNQCHFN-JOYOIKCWSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O ZINC001581847780 1075826475 /nfs/dbraw/zinc/82/64/75/1075826475.db2.gz QRDCDTKSNQCHFN-JOYOIKCWSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O ZINC001581847781 1075826518 /nfs/dbraw/zinc/82/65/18/1075826518.db2.gz QRDCDTKSNQCHFN-SKDRFNHKSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O ZINC001581847781 1075826514 /nfs/dbraw/zinc/82/65/14/1075826514.db2.gz QRDCDTKSNQCHFN-SKDRFNHKSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581847918 1075826631 /nfs/dbraw/zinc/82/66/31/1075826631.db2.gz VISDIJROBWPNGJ-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581847918 1075826627 /nfs/dbraw/zinc/82/66/27/1075826627.db2.gz VISDIJROBWPNGJ-HNNXBMFYSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001581847919 1075826492 /nfs/dbraw/zinc/82/64/92/1075826492.db2.gz VISDIJROBWPNGJ-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581847919 1075826488 /nfs/dbraw/zinc/82/64/88/1075826488.db2.gz VISDIJROBWPNGJ-OAHLLOKOSA-N -1 3 386.376 -1.670 20 0 GAADHM Cn1nncc1C(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1O ZINC001581847961 1075826688 /nfs/dbraw/zinc/82/66/88/1075826688.db2.gz WBGPNLLCHZKRIR-BXKDBHETSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1O ZINC001581847961 1075826682 /nfs/dbraw/zinc/82/66/82/1075826682.db2.gz WBGPNLLCHZKRIR-BXKDBHETSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O ZINC001581847962 1075826506 /nfs/dbraw/zinc/82/65/06/1075826506.db2.gz WBGPNLLCHZKRIR-CABZTGNLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O ZINC001581847962 1075826500 /nfs/dbraw/zinc/82/65/00/1075826500.db2.gz WBGPNLLCHZKRIR-CABZTGNLSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1O ZINC001581847963 1075826710 /nfs/dbraw/zinc/82/67/10/1075826710.db2.gz WBGPNLLCHZKRIR-JOYOIKCWSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1O ZINC001581847963 1075826706 /nfs/dbraw/zinc/82/67/06/1075826706.db2.gz WBGPNLLCHZKRIR-JOYOIKCWSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O ZINC001581847964 1075826533 /nfs/dbraw/zinc/82/65/33/1075826533.db2.gz WBGPNLLCHZKRIR-SKDRFNHKSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)N[C@@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O ZINC001581847964 1075826530 /nfs/dbraw/zinc/82/65/30/1075826530.db2.gz WBGPNLLCHZKRIR-SKDRFNHKSA-N -1 3 386.376 -1.671 20 0 GAADHM Cn1nncc1C(=O)NC[C@@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001581847993 1075826588 /nfs/dbraw/zinc/82/65/88/1075826588.db2.gz WTFAMXWFTDQCBE-HNNXBMFYSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1nncc1C(=O)NC[C@@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001581847993 1075826581 /nfs/dbraw/zinc/82/65/81/1075826581.db2.gz WTFAMXWFTDQCBE-HNNXBMFYSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1nncc1C(=O)NC[C@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001581847994 1075827037 /nfs/dbraw/zinc/82/70/37/1075827037.db2.gz WTFAMXWFTDQCBE-OAHLLOKOSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1nncc1C(=O)NC[C@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001581847994 1075827034 /nfs/dbraw/zinc/82/70/34/1075827034.db2.gz WTFAMXWFTDQCBE-OAHLLOKOSA-N -1 3 388.367 -1.100 20 0 GAADHM Cn1nncc1C(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCO1 ZINC001581848205 1075826929 /nfs/dbraw/zinc/82/69/29/1075826929.db2.gz GESZMIPIRZYNNK-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCO1 ZINC001581848205 1075826922 /nfs/dbraw/zinc/82/69/22/1075826922.db2.gz GESZMIPIRZYNNK-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NC[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCO1 ZINC001581848206 1075827013 /nfs/dbraw/zinc/82/70/13/1075827013.db2.gz GESZMIPIRZYNNK-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NC[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCO1 ZINC001581848206 1075827008 /nfs/dbraw/zinc/82/70/08/1075827008.db2.gz GESZMIPIRZYNNK-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C1(O)CN(C(=O)CNC(=O)c2ccc(-c3nn[n-]n3)cc2)C1 ZINC001581848211 1075826969 /nfs/dbraw/zinc/82/69/69/1075826969.db2.gz GLYMEHBIFHQWKM-UHFFFAOYSA-N -1 3 383.372 -1.545 20 0 GAADHM Cn1nncc1C1(O)CN(C(=O)CNC(=O)c2ccc(-c3nnn[n-]3)cc2)C1 ZINC001581848211 1075826967 /nfs/dbraw/zinc/82/69/67/1075826967.db2.gz GLYMEHBIFHQWKM-UHFFFAOYSA-N -1 3 383.372 -1.545 20 0 GAADHM Cn1nncc1C(=O)NCCN1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001581848224 1075827002 /nfs/dbraw/zinc/82/70/02/1075827002.db2.gz HSCJEAFNRJXDBP-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1nncc1C(=O)NCCN1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001581848224 1075826999 /nfs/dbraw/zinc/82/69/99/1075826999.db2.gz HSCJEAFNRJXDBP-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1nncc1C(=O)NC[C@H]1COCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581848235 1075826961 /nfs/dbraw/zinc/82/69/61/1075826961.db2.gz IOKAKYLSMRXQIM-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NC[C@H]1COCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581848235 1075826958 /nfs/dbraw/zinc/82/69/58/1075826958.db2.gz IOKAKYLSMRXQIM-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NC[C@@H]1COCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581848236 1075826871 /nfs/dbraw/zinc/82/68/71/1075826871.db2.gz IOKAKYLSMRXQIM-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NC[C@@H]1COCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581848236 1075826867 /nfs/dbraw/zinc/82/68/67/1075826867.db2.gz IOKAKYLSMRXQIM-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NCCN1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001581848264 1075826887 /nfs/dbraw/zinc/82/68/87/1075826887.db2.gz JQNOTHQNTAVPLM-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1nncc1C(=O)NCCN1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001581848264 1075826884 /nfs/dbraw/zinc/82/68/84/1075826884.db2.gz JQNOTHQNTAVPLM-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1nncc1C(=O)NCCN1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001581848412 1075826950 /nfs/dbraw/zinc/82/69/50/1075826950.db2.gz QPKHAIHRUKZAAL-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1nncc1C(=O)NCCN1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001581848412 1075826949 /nfs/dbraw/zinc/82/69/49/1075826949.db2.gz QPKHAIHRUKZAAL-UHFFFAOYSA-N -1 3 383.420 -1.058 20 0 GAADHM Cn1nncc1C(=O)NC[C@@H]1COCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581848468 1075827235 /nfs/dbraw/zinc/82/72/35/1075827235.db2.gz UCYIFONPCDYXDA-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NC[C@@H]1COCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581848468 1075827230 /nfs/dbraw/zinc/82/72/30/1075827230.db2.gz UCYIFONPCDYXDA-SECBINFHSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NC[C@H]1COCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581848469 1075827371 /nfs/dbraw/zinc/82/73/71/1075827371.db2.gz UCYIFONPCDYXDA-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NC[C@H]1COCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581848469 1075827364 /nfs/dbraw/zinc/82/73/64/1075827364.db2.gz UCYIFONPCDYXDA-VIFPVBQESA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NC[C@H]1COCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581848479 1075827251 /nfs/dbraw/zinc/82/72/51/1075827251.db2.gz UMGNPVXZFXFSAR-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NC[C@H]1COCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581848479 1075827246 /nfs/dbraw/zinc/82/72/46/1075827246.db2.gz UMGNPVXZFXFSAR-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NC[C@@H]1COCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581848480 1075827433 /nfs/dbraw/zinc/82/74/33/1075827433.db2.gz UMGNPVXZFXFSAR-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NC[C@@H]1COCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581848480 1075827428 /nfs/dbraw/zinc/82/74/28/1075827428.db2.gz UMGNPVXZFXFSAR-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NC[C@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1 ZINC001581848537 1075827452 /nfs/dbraw/zinc/82/74/52/1075827452.db2.gz WQKGKWZHSGLGJI-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NC[C@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1 ZINC001581848537 1075827451 /nfs/dbraw/zinc/82/74/51/1075827451.db2.gz WQKGKWZHSGLGJI-JTQLQIEISA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NC[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1 ZINC001581848538 1075827302 /nfs/dbraw/zinc/82/73/02/1075827302.db2.gz WQKGKWZHSGLGJI-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nncc1C(=O)NC[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1 ZINC001581848538 1075827299 /nfs/dbraw/zinc/82/72/99/1075827299.db2.gz WQKGKWZHSGLGJI-SNVBAGLBSA-N -1 3 386.376 -1.406 20 0 GAADHM Cn1nnnc1CNC[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCCO1 ZINC001581848610 1075827406 /nfs/dbraw/zinc/82/74/06/1075827406.db2.gz ASEPCIKHUJLZPZ-LLVKDONJSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnnc1CNC[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCCO1 ZINC001581848610 1075827402 /nfs/dbraw/zinc/82/74/02/1075827402.db2.gz ASEPCIKHUJLZPZ-LLVKDONJSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnnc1CNC[C@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCCO1 ZINC001581848611 1075827320 /nfs/dbraw/zinc/82/73/20/1075827320.db2.gz ASEPCIKHUJLZPZ-NSHDSACASA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnnc1CNC[C@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCCO1 ZINC001581848611 1075827316 /nfs/dbraw/zinc/82/73/16/1075827316.db2.gz ASEPCIKHUJLZPZ-NSHDSACASA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnnc1CN1CCN(CCNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001581848738 1075827464 /nfs/dbraw/zinc/82/74/64/1075827464.db2.gz BWQLWYOGBZPDKL-UHFFFAOYSA-N -1 3 386.424 -1.734 20 0 GAADHM Cn1nnnc1CN1CCN(CCNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001581848738 1075827462 /nfs/dbraw/zinc/82/74/62/1075827462.db2.gz BWQLWYOGBZPDKL-UHFFFAOYSA-N -1 3 386.424 -1.734 20 0 GAADHM Cn1oc(C(=O)N2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)cc1=O ZINC001581848739 1075827336 /nfs/dbraw/zinc/82/73/36/1075827336.db2.gz BXNYCTRFSNBCJT-BWPRHRIFSA-N -1 3 384.356 -1.013 20 0 GAADHM Cn1oc(C(=O)N2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cc1=O ZINC001581848739 1075827331 /nfs/dbraw/zinc/82/73/31/1075827331.db2.gz BXNYCTRFSNBCJT-BWPRHRIFSA-N -1 3 384.356 -1.013 20 0 GAADHM Cn1nnnc1CN1CCO[C@@](C)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581848949 1075827445 /nfs/dbraw/zinc/82/74/45/1075827445.db2.gz GRLNBHHCCKNRQC-HNNXBMFYSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnnc1CN1CCO[C@@](C)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581848949 1075827442 /nfs/dbraw/zinc/82/74/42/1075827442.db2.gz GRLNBHHCCKNRQC-HNNXBMFYSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnnc1CN1CCO[C@](C)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001581848950 1075827386 /nfs/dbraw/zinc/82/73/86/1075827386.db2.gz GRLNBHHCCKNRQC-OAHLLOKOSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnnc1CN1CCO[C@](C)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001581848950 1075827382 /nfs/dbraw/zinc/82/73/82/1075827382.db2.gz GRLNBHHCCKNRQC-OAHLLOKOSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnnc1CNC[C@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCCO1 ZINC001581848978 1075827289 /nfs/dbraw/zinc/82/72/89/1075827289.db2.gz HPCQHIMYQOQXFF-JTQLQIEISA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnnc1CNC[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCCO1 ZINC001581848979 1075827473 /nfs/dbraw/zinc/82/74/73/1075827473.db2.gz 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Cn1nnnc1CNC1(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCOCC1 ZINC001581849097 1075827351 /nfs/dbraw/zinc/82/73/51/1075827351.db2.gz IJVFGKOZWMWKBQ-UHFFFAOYSA-N -1 3 387.408 -1.213 20 0 GAADHM Cn1nnnc1CNCC1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001581849122 1075827885 /nfs/dbraw/zinc/82/78/85/1075827885.db2.gz IUEOWXSDWMYYPY-UHFFFAOYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnnc1CNCC1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001581849122 1075827881 /nfs/dbraw/zinc/82/78/81/1075827881.db2.gz IUEOWXSDWMYYPY-UHFFFAOYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnnc1CNCC1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001581849135 1075827812 /nfs/dbraw/zinc/82/78/12/1075827812.db2.gz JNTYRHDWWVOMRW-UHFFFAOYSA-N -1 3 387.408 -1.525 20 0 GAADHM Cn1nnnc1CN1CCN(CCNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001581849183 1075827845 /nfs/dbraw/zinc/82/78/45/1075827845.db2.gz LGGSWUXTYUJYQW-UHFFFAOYSA-N -1 3 386.424 -1.734 20 0 GAADHM Cn1nnnc1CN1CCN(CCNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001581849183 1075827842 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Cn1nncc1CN1CCN(CCNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001581849852 1075828173 /nfs/dbraw/zinc/82/81/73/1075828173.db2.gz GCOOFOLEVGSDHN-UHFFFAOYSA-N -1 3 385.436 -1.129 20 0 GAADHM Cn1nncc1CN1CCN(CCNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001581850120 1075828285 /nfs/dbraw/zinc/82/82/85/1075828285.db2.gz PSMGEPBQWZKTHA-UHFFFAOYSA-N -1 3 385.436 -1.129 20 0 GAADHM Cn1nncc1CN1CCN(CCNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001581850120 1075828280 /nfs/dbraw/zinc/82/82/80/1075828280.db2.gz PSMGEPBQWZKTHA-UHFFFAOYSA-N -1 3 385.436 -1.129 20 0 GAADHM NC(=O)C(=O)N1CCC(OC2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)CC1 ZINC001581885731 1075828539 /nfs/dbraw/zinc/82/85/39/1075828539.db2.gz KIBWZNMVPJTZTI-UHFFFAOYSA-N -1 3 388.388 -1.488 20 0 GAADHM NC(=O)C(=O)N1CCC(OC2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)CC1 ZINC001581885731 1075828535 /nfs/dbraw/zinc/82/85/35/1075828535.db2.gz KIBWZNMVPJTZTI-UHFFFAOYSA-N -1 3 388.388 -1.488 20 0 GAADHM NC(=O)C(=O)N1CC(OC2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)C1 ZINC001581885893 1075828603 /nfs/dbraw/zinc/82/86/03/1075828603.db2.gz QQYXKJKULBGOSH-UHFFFAOYSA-N -1 3 388.388 -1.488 20 0 GAADHM NC(=O)C(=O)N1CC(OC2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)C1 ZINC001581885893 1075828601 /nfs/dbraw/zinc/82/86/01/1075828601.db2.gz QQYXKJKULBGOSH-UHFFFAOYSA-N -1 3 388.388 -1.488 20 0 GAADHM NC(=O)C(=O)N1CCC(OC2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)CC1 ZINC001581885991 1075828613 /nfs/dbraw/zinc/82/86/13/1075828613.db2.gz ULVNLPWQNUBJSW-UHFFFAOYSA-N -1 3 388.388 -1.488 20 0 GAADHM NC(=O)C(=O)N1CCC(OC2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)CC1 ZINC001581885991 1075828610 /nfs/dbraw/zinc/82/86/10/1075828610.db2.gz ULVNLPWQNUBJSW-UHFFFAOYSA-N -1 3 388.388 -1.488 20 0 GAADHM NC(=O)C(=O)N1CCOC2(CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)CC2)C1 ZINC001581886510 1075828644 /nfs/dbraw/zinc/82/86/44/1075828644.db2.gz BQKUPSBJGXHUCQ-UHFFFAOYSA-N -1 3 388.388 -1.486 20 0 GAADHM NC(=O)C(=O)N1CCOC2(CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)CC2)C1 ZINC001581886510 1075828641 /nfs/dbraw/zinc/82/86/41/1075828641.db2.gz BQKUPSBJGXHUCQ-UHFFFAOYSA-N -1 3 388.388 -1.486 20 0 GAADHM NC(=O)C(=O)N[C@@]1(CO)CCCN(Cc2cc(F)ccc2-c2nn[n-]n2)C1 ZINC001581886540 1075828633 /nfs/dbraw/zinc/82/86/33/1075828633.db2.gz CQBLTDQKQBZVHM-INIZCTEOSA-N -1 3 377.380 -1.066 20 0 GAADHM NC(=O)C(=O)N[C@]1(CO)CCCN(Cc2cc(F)ccc2-c2nn[n-]n2)C1 ZINC001581886541 1075828667 /nfs/dbraw/zinc/82/86/67/1075828667.db2.gz CQBLTDQKQBZVHM-MRXNPFEDSA-N -1 3 377.380 -1.066 20 0 GAADHM NC(=O)C(=O)N1CCOC2(CN(Cc3ccc(-c4nn[n-]n4)cc3F)C2)C1 ZINC001581886622 1075828684 /nfs/dbraw/zinc/82/86/84/1075828684.db2.gz GJRMZTZSKVMMIM-UHFFFAOYSA-N -1 3 375.364 -1.096 20 0 GAADHM NC(=O)C(=O)N1CCOC2(CN(Cc3ccc(-c4nnn[n-]4)cc3F)C2)C1 ZINC001581886622 1075828677 /nfs/dbraw/zinc/82/86/77/1075828677.db2.gz GJRMZTZSKVMMIM-UHFFFAOYSA-N -1 3 375.364 -1.096 20 0 GAADHM NC(=O)C1(C(=O)NC[C@@H]2[C@H]3CN(C(=O)c4ccc(-c5nn[n-]n5)[nH]4)C[C@H]32)CC1 ZINC001581886746 1075828623 /nfs/dbraw/zinc/82/86/23/1075828623.db2.gz ADRGDCLLTZREIJ-OWUUHHOZSA-N -1 3 384.400 -1.106 20 0 GAADHM NC(=O)C1(C(=O)NC[C@@H]2[C@H]3CN(C(=O)c4ccc(-c5nnn[n-]5)[nH]4)C[C@H]32)CC1 ZINC001581886746 1075828620 /nfs/dbraw/zinc/82/86/20/1075828620.db2.gz ADRGDCLLTZREIJ-OWUUHHOZSA-N -1 3 384.400 -1.106 20 0 GAADHM NC(=O)C1(C(=O)NCC2(O)CN(Cc3ccc(-c4nn[n-]n4)cc3F)C2)CC1 ZINC001581886958 1075828863 /nfs/dbraw/zinc/82/88/63/1075828863.db2.gz DJGHSOVAMOLGGA-UHFFFAOYSA-N -1 3 389.391 -1.066 20 0 GAADHM NC(=O)C1(C(=O)NCC2(O)CN(Cc3ccc(-c4nnn[n-]4)cc3F)C2)CC1 ZINC001581886958 1075828858 /nfs/dbraw/zinc/82/88/58/1075828858.db2.gz DJGHSOVAMOLGGA-UHFFFAOYSA-N -1 3 389.391 -1.066 20 0 GAADHM NC(=O)C(NC(=O)Cc1ccc(Br)cc1-c1nn[n-]n1)C(N)=O ZINC001581887047 1075828592 /nfs/dbraw/zinc/82/85/92/1075828592.db2.gz MLJRQBBYDLJZES-UHFFFAOYSA-N -1 3 382.178 -1.373 20 0 GAADHM NC(=O)C(NC(=O)Cc1ccc(Br)cc1-c1nnn[n-]1)C(N)=O ZINC001581887047 1075828588 /nfs/dbraw/zinc/82/85/88/1075828588.db2.gz MLJRQBBYDLJZES-UHFFFAOYSA-N -1 3 382.178 -1.373 20 0 GAADHM NC(=O)C(=O)N1CCC2(CC1)CN(C(=O)c1ccc(-c3nn[n-]n3)[nH]1)CCO2 ZINC001581887133 1075828965 /nfs/dbraw/zinc/82/89/65/1075828965.db2.gz PBQHQJXBWYVXJG-UHFFFAOYSA-N -1 3 388.388 -1.486 20 0 GAADHM NC(=O)C(=O)N1CCC2(CC1)CN(C(=O)c1ccc(-c3nnn[n-]3)[nH]1)CCO2 ZINC001581887133 1075828962 /nfs/dbraw/zinc/82/89/62/1075828962.db2.gz PBQHQJXBWYVXJG-UHFFFAOYSA-N -1 3 388.388 -1.486 20 0 GAADHM NC(=O)[C@H](c1ccc(-c2nn[n-]n2)cc1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001581887147 1075828990 /nfs/dbraw/zinc/82/89/90/1075828990.db2.gz GKKMIPIBEMUPIU-NEPJUHHUSA-N -1 3 378.418 -1.773 20 0 GAADHM NC(=O)[C@H](c1ccc(-c2nnn[n-]2)cc1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001581887147 1075828986 /nfs/dbraw/zinc/82/89/86/1075828986.db2.gz GKKMIPIBEMUPIU-NEPJUHHUSA-N -1 3 378.418 -1.773 20 0 GAADHM NC(=O)[C@@H](c1ccc(-c2nn[n-]n2)cc1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001581887148 1075829038 /nfs/dbraw/zinc/82/90/38/1075829038.db2.gz GKKMIPIBEMUPIU-NWDGAFQWSA-N -1 3 378.418 -1.773 20 0 GAADHM NC(=O)[C@@H](c1ccc(-c2nnn[n-]2)cc1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001581887148 1075829035 /nfs/dbraw/zinc/82/90/35/1075829035.db2.gz GKKMIPIBEMUPIU-NWDGAFQWSA-N -1 3 378.418 -1.773 20 0 GAADHM NC(=O)[C@H](c1ccc(-c2nn[n-]n2)cc1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001581887149 1075828900 /nfs/dbraw/zinc/82/89/00/1075828900.db2.gz GKKMIPIBEMUPIU-RYUDHWBXSA-N -1 3 378.418 -1.773 20 0 GAADHM NC(=O)[C@H](c1ccc(-c2nnn[n-]2)cc1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001581887149 1075828896 /nfs/dbraw/zinc/82/88/96/1075828896.db2.gz GKKMIPIBEMUPIU-RYUDHWBXSA-N -1 3 378.418 -1.773 20 0 GAADHM NC(=O)[C@@H](c1ccc(-c2nn[n-]n2)cc1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001581887150 1075828935 /nfs/dbraw/zinc/82/89/35/1075828935.db2.gz GKKMIPIBEMUPIU-VXGBXAGGSA-N -1 3 378.418 -1.773 20 0 GAADHM NC(=O)[C@@H](c1ccc(-c2nnn[n-]2)cc1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001581887150 1075828931 /nfs/dbraw/zinc/82/89/31/1075828931.db2.gz GKKMIPIBEMUPIU-VXGBXAGGSA-N -1 3 378.418 -1.773 20 0 GAADHM NC(=O)C(=O)NCc1cn(C2CN(Cc3cccc(-c4nn[n-]n4)c3)C2)nn1 ZINC001581887332 1075828883 /nfs/dbraw/zinc/82/88/83/1075828883.db2.gz RRNLTRANEYERKK-UHFFFAOYSA-N -1 3 382.388 -1.383 20 0 GAADHM NC(=O)C(=O)NCc1cn(C2CN(Cc3cccc(-c4nnn[n-]4)c3)C2)nn1 ZINC001581887332 1075828877 /nfs/dbraw/zinc/82/88/77/1075828877.db2.gz RRNLTRANEYERKK-UHFFFAOYSA-N -1 3 382.388 -1.383 20 0 GAADHM NC(=O)C1(C(=O)NCC2(O)CN(Cc3ccc(F)c(-c4nn[n-]n4)c3)C2)CC1 ZINC001581887427 1075829048 /nfs/dbraw/zinc/82/90/48/1075829048.db2.gz KPKXIVDUOIAGBJ-UHFFFAOYSA-N -1 3 389.391 -1.066 20 0 GAADHM NC(=O)C1(C(=O)NCC2(O)CN(Cc3ccc(F)c(-c4nnn[n-]4)c3)C2)CC1 ZINC001581887427 1075829046 /nfs/dbraw/zinc/82/90/46/1075829046.db2.gz KPKXIVDUOIAGBJ-UHFFFAOYSA-N -1 3 389.391 -1.066 20 0 GAADHM NC(=O)C(=O)N1CCC2(CC1)CN(C(=O)c1cc(-c3nn[n-]n3)c[nH]1)CCO2 ZINC001581887456 1075828851 /nfs/dbraw/zinc/82/88/51/1075828851.db2.gz SROIPKMSGJAVGV-UHFFFAOYSA-N -1 3 388.388 -1.486 20 0 GAADHM NC(=O)C(=O)N1CCC2(CC1)CN(C(=O)c1cc(-c3nnn[n-]3)c[nH]1)CCO2 ZINC001581887456 1075828847 /nfs/dbraw/zinc/82/88/47/1075828847.db2.gz SROIPKMSGJAVGV-UHFFFAOYSA-N -1 3 388.388 -1.486 20 0 GAADHM NC(=O)C(=O)N1CCN(C2CN(Cc3ccc(F)c(-c4nn[n-]n4)c3)C2)CC1 ZINC001581887684 1075829067 /nfs/dbraw/zinc/82/90/67/1075829067.db2.gz XFMBPXCYMSGVAR-UHFFFAOYSA-N -1 3 388.407 -1.181 20 0 GAADHM NC(=O)C(=O)N1CCN(C2CN(Cc3ccc(F)c(-c4nnn[n-]4)c3)C2)CC1 ZINC001581887684 1075829062 /nfs/dbraw/zinc/82/90/62/1075829062.db2.gz XFMBPXCYMSGVAR-UHFFFAOYSA-N -1 3 388.407 -1.181 20 0 GAADHM NC(=O)C1(C(=O)N[C@@H]2CCN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]2O)CC1 ZINC001581887699 1075829084 /nfs/dbraw/zinc/82/90/84/1075829084.db2.gz ORFPEBOWEVCVTG-GHMZBOCLSA-N -1 3 390.379 -1.278 20 0 GAADHM NC(=O)C1(C(=O)N[C@@H]2CCN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]2O)CC1 ZINC001581887699 1075829083 /nfs/dbraw/zinc/82/90/83/1075829083.db2.gz ORFPEBOWEVCVTG-GHMZBOCLSA-N -1 3 390.379 -1.278 20 0 GAADHM NC(=O)C1(C(=O)N[C@@H]2CCN(c3ncc(-c4nn[n-]n4)cc3F)C[C@@H]2O)CC1 ZINC001581887701 1075829019 /nfs/dbraw/zinc/82/90/19/1075829019.db2.gz ORFPEBOWEVCVTG-MNOVXSKESA-N -1 3 390.379 -1.278 20 0 GAADHM NC(=O)C1(C(=O)N[C@@H]2CCN(c3ncc(-c4nnn[n-]4)cc3F)C[C@@H]2O)CC1 ZINC001581887701 1075829017 /nfs/dbraw/zinc/82/90/17/1075829017.db2.gz ORFPEBOWEVCVTG-MNOVXSKESA-N -1 3 390.379 -1.278 20 0 GAADHM NC(=O)C1(C(=O)N[C@H]2CCN(c3ncc(-c4nn[n-]n4)cc3F)C[C@@H]2O)CC1 ZINC001581887702 1075829028 /nfs/dbraw/zinc/82/90/28/1075829028.db2.gz ORFPEBOWEVCVTG-QWRGUYRKSA-N -1 3 390.379 -1.278 20 0 GAADHM NC(=O)C1(C(=O)N[C@H]2CCN(c3ncc(-c4nnn[n-]4)cc3F)C[C@@H]2O)CC1 ZINC001581887702 1075829025 /nfs/dbraw/zinc/82/90/25/1075829025.db2.gz ORFPEBOWEVCVTG-QWRGUYRKSA-N -1 3 390.379 -1.278 20 0 GAADHM NC(=O)C1(C(=O)N[C@H]2CCN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]2O)CC1 ZINC001581887704 1075828920 /nfs/dbraw/zinc/82/89/20/1075828920.db2.gz ORFPEBOWEVCVTG-WDEREUQCSA-N -1 3 390.379 -1.278 20 0 GAADHM NC(=O)C1(C(=O)N[C@H]2CCN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]2O)CC1 ZINC001581887704 1075828914 /nfs/dbraw/zinc/82/89/14/1075828914.db2.gz ORFPEBOWEVCVTG-WDEREUQCSA-N -1 3 390.379 -1.278 20 0 GAADHM NC(=O)C1(NC(=O)Cc2cccc(-c3nn[n-]n3)c2)CCS(=O)(=O)CC1 ZINC001581887837 1075828978 /nfs/dbraw/zinc/82/89/78/1075828978.db2.gz QIJRJUIMIOLKDZ-UHFFFAOYSA-N -1 3 378.414 -1.042 20 0 GAADHM NC(=O)C1(NC(=O)Cc2cccc(-c3nnn[n-]3)c2)CCS(=O)(=O)CC1 ZINC001581887837 1075828974 /nfs/dbraw/zinc/82/89/74/1075828974.db2.gz QIJRJUIMIOLKDZ-UHFFFAOYSA-N -1 3 378.414 -1.042 20 0 GAADHM NC(=O)C1(C(=O)N[C@@H]2CN(c3cccc(F)c3-c3nn[n-]n3)C[C@@H]2O)CC1 ZINC001581887842 1075828838 /nfs/dbraw/zinc/82/88/38/1075828838.db2.gz QMWNUWOIRGNUPR-KOLCDFICSA-N -1 3 375.364 -1.063 20 0 GAADHM NC(=O)C1(C(=O)N[C@@H]2CN(c3cccc(F)c3-c3nnn[n-]3)C[C@@H]2O)CC1 ZINC001581887842 1075828832 /nfs/dbraw/zinc/82/88/32/1075828832.db2.gz QMWNUWOIRGNUPR-KOLCDFICSA-N -1 3 375.364 -1.063 20 0 GAADHM NC(=O)C1(N2CCCCC2)CCN(C(=O)Cn2cnc(-c3nnn[n-]3)n2)CC1 ZINC001581887867 1075829081 /nfs/dbraw/zinc/82/90/81/1075829081.db2.gz RWLJSTRCJSXRDU-UHFFFAOYSA-N -1 3 388.436 -1.209 20 0 GAADHM NC(=O)C1(C(=O)N[C@@H]2CN(Cc3cc(-c4nn[n-]n4)ccc3F)C[C@@H]2O)CC1 ZINC001581887935 1075828952 /nfs/dbraw/zinc/82/89/52/1075828952.db2.gz UTFUQOXBHJIDMA-OLZOCXBDSA-N -1 3 389.391 -1.067 20 0 GAADHM NC(=O)C1(O)CN(C(=O)[C@H]2CCN(c3ccc(-c4nn[n-]n4)cc3F)C2)C1 ZINC001581888010 1075829375 /nfs/dbraw/zinc/82/93/75/1075829375.db2.gz APGMLROKRGPWQQ-JTQLQIEISA-N -1 3 375.364 -1.109 20 0 GAADHM NC(=O)C1(O)CN(C(=O)[C@@H]2CCN(c3ccc(-c4nn[n-]n4)cc3F)C2)C1 ZINC001581888011 1075829325 /nfs/dbraw/zinc/82/93/25/1075829325.db2.gz APGMLROKRGPWQQ-SNVBAGLBSA-N -1 3 375.364 -1.109 20 0 GAADHM NC(=O)[C@H]1CC[C@@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581888032 1075829383 /nfs/dbraw/zinc/82/93/83/1075829383.db2.gz BAFAOTSXOXDHMR-HKLXJQGRSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@H]1CC[C@@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581888032 1075829380 /nfs/dbraw/zinc/82/93/80/1075829380.db2.gz BAFAOTSXOXDHMR-HKLXJQGRSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581888033 1075829337 /nfs/dbraw/zinc/82/93/37/1075829337.db2.gz BAFAOTSXOXDHMR-OQEOFVATSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581888033 1075829332 /nfs/dbraw/zinc/82/93/32/1075829332.db2.gz BAFAOTSXOXDHMR-OQEOFVATSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@H]1CC[C@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581888034 1075829353 /nfs/dbraw/zinc/82/93/53/1075829353.db2.gz BAFAOTSXOXDHMR-VLLVSFFDSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@H]1CC[C@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581888034 1075829350 /nfs/dbraw/zinc/82/93/50/1075829350.db2.gz BAFAOTSXOXDHMR-VLLVSFFDSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581888035 1075829224 /nfs/dbraw/zinc/82/92/24/1075829224.db2.gz BAFAOTSXOXDHMR-YFVNTRNASA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581888035 1075829222 /nfs/dbraw/zinc/82/92/22/1075829222.db2.gz BAFAOTSXOXDHMR-YFVNTRNASA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)C1(NC(=O)Cc2ccc(-c3nn[n-]n3)cc2)CCS(=O)(=O)CC1 ZINC001581888265 1075829194 /nfs/dbraw/zinc/82/91/94/1075829194.db2.gz ZPXWSTZHAPGGIS-UHFFFAOYSA-N -1 3 378.414 -1.042 20 0 GAADHM NC(=O)C1(NC(=O)Cc2ccc(-c3nnn[n-]3)cc2)CCS(=O)(=O)CC1 ZINC001581888265 1075829187 /nfs/dbraw/zinc/82/91/87/1075829187.db2.gz ZPXWSTZHAPGGIS-UHFFFAOYSA-N -1 3 378.414 -1.042 20 0 GAADHM NC(=O)C1(O)CCN(CCS(=O)(=O)c2cccc(-c3nn[n-]n3)c2)CC1 ZINC001581888695 1075829213 /nfs/dbraw/zinc/82/92/13/1075829213.db2.gz OOSBSVOEKAPOCO-UHFFFAOYSA-N -1 3 380.430 -1.047 20 0 GAADHM NC(=O)C1(O)CCN(CCS(=O)(=O)c2cccc(-c3nnn[n-]3)c2)CC1 ZINC001581888695 1075829208 /nfs/dbraw/zinc/82/92/08/1075829208.db2.gz OOSBSVOEKAPOCO-UHFFFAOYSA-N -1 3 380.430 -1.047 20 0 GAADHM NC(=O)[C@H]1CC[C@@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581888782 1075829273 /nfs/dbraw/zinc/82/92/73/1075829273.db2.gz RCTRPLGAFOVRDV-HKLXJQGRSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@H]1CC[C@@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581888782 1075829269 /nfs/dbraw/zinc/82/92/69/1075829269.db2.gz RCTRPLGAFOVRDV-HKLXJQGRSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581888783 1075829370 /nfs/dbraw/zinc/82/93/70/1075829370.db2.gz RCTRPLGAFOVRDV-OQEOFVATSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581888783 1075829368 /nfs/dbraw/zinc/82/93/68/1075829368.db2.gz RCTRPLGAFOVRDV-OQEOFVATSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@H]1CC[C@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581888784 1075829389 /nfs/dbraw/zinc/82/93/89/1075829389.db2.gz RCTRPLGAFOVRDV-VLLVSFFDSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@H]1CC[C@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581888784 1075829387 /nfs/dbraw/zinc/82/93/87/1075829387.db2.gz RCTRPLGAFOVRDV-VLLVSFFDSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581888785 1075829315 /nfs/dbraw/zinc/82/93/15/1075829315.db2.gz RCTRPLGAFOVRDV-YFVNTRNASA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581888785 1075829309 /nfs/dbraw/zinc/82/93/09/1075829309.db2.gz RCTRPLGAFOVRDV-YFVNTRNASA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581888816 1075829299 /nfs/dbraw/zinc/82/92/99/1075829299.db2.gz SOIPKSRSVMRNQF-DUYQIWHPSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581888816 1075829295 /nfs/dbraw/zinc/82/92/95/1075829295.db2.gz SOIPKSRSVMRNQF-DUYQIWHPSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581888817 1075829346 /nfs/dbraw/zinc/82/93/46/1075829346.db2.gz SOIPKSRSVMRNQF-LGMRYKSHSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581888817 1075829343 /nfs/dbraw/zinc/82/93/43/1075829343.db2.gz SOIPKSRSVMRNQF-LGMRYKSHSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@H]1CC[C@@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581888818 1075829285 /nfs/dbraw/zinc/82/92/85/1075829285.db2.gz SOIPKSRSVMRNQF-PXSXMVNOSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@H]1CC[C@@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581888818 1075829281 /nfs/dbraw/zinc/82/92/81/1075829281.db2.gz SOIPKSRSVMRNQF-PXSXMVNOSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@H]1CC[C@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581888819 1075829361 /nfs/dbraw/zinc/82/93/61/1075829361.db2.gz SOIPKSRSVMRNQF-TURJHENQSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@H]1CC[C@H]1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581888819 1075829359 /nfs/dbraw/zinc/82/93/59/1075829359.db2.gz SOIPKSRSVMRNQF-TURJHENQSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)CC(=O)N1CCN(C2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)CC1 ZINC001581889288 1075829712 /nfs/dbraw/zinc/82/97/12/1075829712.db2.gz FYESNXGEGMTFSS-UHFFFAOYSA-N -1 3 387.404 -1.961 20 0 GAADHM NC(=O)CC(=O)N1CCN(C2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)CC1 ZINC001581889288 1075829708 /nfs/dbraw/zinc/82/97/08/1075829708.db2.gz FYESNXGEGMTFSS-UHFFFAOYSA-N -1 3 387.404 -1.961 20 0 GAADHM NC(=O)CC(=O)N1CCN([C@@H]2CCN(c3ccc(-c4nn[n-]n4)cn3)C2)CC1 ZINC001581889356 1075829556 /nfs/dbraw/zinc/82/95/56/1075829556.db2.gz HTWPPHBDVFQNTH-CYBMUJFWSA-N -1 3 385.432 -1.140 20 0 GAADHM NC(=O)CC(=O)N1CCN([C@@H]2CCN(c3ccc(-c4nnn[n-]4)cn3)C2)CC1 ZINC001581889356 1075829552 /nfs/dbraw/zinc/82/95/52/1075829552.db2.gz HTWPPHBDVFQNTH-CYBMUJFWSA-N -1 3 385.432 -1.140 20 0 GAADHM NC(=O)CC(=O)N1CCN([C@H]2CCN(c3ccc(-c4nn[n-]n4)cn3)C2)CC1 ZINC001581889357 1075829580 /nfs/dbraw/zinc/82/95/80/1075829580.db2.gz HTWPPHBDVFQNTH-ZDUSSCGKSA-N -1 3 385.432 -1.140 20 0 GAADHM NC(=O)CC(=O)N1CCN([C@H]2CCN(c3ccc(-c4nnn[n-]4)cn3)C2)CC1 ZINC001581889357 1075829577 /nfs/dbraw/zinc/82/95/77/1075829577.db2.gz HTWPPHBDVFQNTH-ZDUSSCGKSA-N -1 3 385.432 -1.140 20 0 GAADHM NC(=O)CC(=O)N1CC[C@@H](N2CCN(c3cnc(-c4nn[n-]n4)cn3)CC2)C1 ZINC001581889484 1075829738 /nfs/dbraw/zinc/82/97/38/1075829738.db2.gz LWLJFRHQNADULU-LLVKDONJSA-N -1 3 386.420 -1.745 20 0 GAADHM NC(=O)CC(=O)N1CC[C@@H](N2CCN(c3cnc(-c4nnn[n-]4)cn3)CC2)C1 ZINC001581889484 1075829733 /nfs/dbraw/zinc/82/97/33/1075829733.db2.gz LWLJFRHQNADULU-LLVKDONJSA-N -1 3 386.420 -1.745 20 0 GAADHM NC(=O)CC(=O)N1CC[C@H](N2CCN(c3cnc(-c4nn[n-]n4)cn3)CC2)C1 ZINC001581889485 1075829598 /nfs/dbraw/zinc/82/95/98/1075829598.db2.gz LWLJFRHQNADULU-NSHDSACASA-N -1 3 386.420 -1.745 20 0 GAADHM NC(=O)CC(=O)N1CC[C@H](N2CCN(c3cnc(-c4nnn[n-]4)cn3)CC2)C1 ZINC001581889485 1075829596 /nfs/dbraw/zinc/82/95/96/1075829596.db2.gz LWLJFRHQNADULU-NSHDSACASA-N -1 3 386.420 -1.745 20 0 GAADHM NC(=O)CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(-c3nn[n-]n3)c[nH]1)CCO2 ZINC001581889507 1075829631 /nfs/dbraw/zinc/82/96/31/1075829631.db2.gz MURIINUBZJEDRH-INIZCTEOSA-N -1 3 388.388 -1.486 20 0 GAADHM NC(=O)CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(-c3nnn[n-]3)c[nH]1)CCO2 ZINC001581889507 1075829627 /nfs/dbraw/zinc/82/96/27/1075829627.db2.gz MURIINUBZJEDRH-INIZCTEOSA-N -1 3 388.388 -1.486 20 0 GAADHM NC(=O)CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(-c3nn[n-]n3)c[nH]1)CCO2 ZINC001581889508 1075829638 /nfs/dbraw/zinc/82/96/38/1075829638.db2.gz MURIINUBZJEDRH-MRXNPFEDSA-N -1 3 388.388 -1.486 20 0 GAADHM NC(=O)CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(-c3nnn[n-]3)c[nH]1)CCO2 ZINC001581889508 1075829634 /nfs/dbraw/zinc/82/96/34/1075829634.db2.gz MURIINUBZJEDRH-MRXNPFEDSA-N -1 3 388.388 -1.486 20 0 GAADHM NC(=O)CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(-c3nn[n-]n3)[nH]1)CCO2 ZINC001581889853 1075829618 /nfs/dbraw/zinc/82/96/18/1075829618.db2.gz ZHFNDSFZAKCUGF-INIZCTEOSA-N -1 3 388.388 -1.486 20 0 GAADHM NC(=O)CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(-c3nnn[n-]3)[nH]1)CCO2 ZINC001581889853 1075829615 /nfs/dbraw/zinc/82/96/15/1075829615.db2.gz ZHFNDSFZAKCUGF-INIZCTEOSA-N -1 3 388.388 -1.486 20 0 GAADHM NC(=O)CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(-c3nn[n-]n3)[nH]1)CCO2 ZINC001581889854 1075829722 /nfs/dbraw/zinc/82/97/22/1075829722.db2.gz ZHFNDSFZAKCUGF-MRXNPFEDSA-N -1 3 388.388 -1.486 20 0 GAADHM NC(=O)CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(-c3nnn[n-]3)[nH]1)CCO2 ZINC001581889854 1075829720 /nfs/dbraw/zinc/82/97/20/1075829720.db2.gz ZHFNDSFZAKCUGF-MRXNPFEDSA-N -1 3 388.388 -1.486 20 0 GAADHM NC(=O)[C@H]1CN([C@H]2CCN(c3sccc3-c3nnn[n-]3)C2=O)C[C@H]1C(N)=O ZINC001581890211 1075830063 /nfs/dbraw/zinc/83/00/63/1075830063.db2.gz HKZXQLQFKVZORR-AEJSXWLSSA-N -1 3 390.429 -1.448 20 0 GAADHM NC(=O)[C@@H]1CN([C@H]2CCN(c3sccc3-c3nnn[n-]3)C2=O)C[C@H]1C(N)=O ZINC001581890212 1075830041 /nfs/dbraw/zinc/83/00/41/1075830041.db2.gz HKZXQLQFKVZORR-BBBLOLIVSA-N -1 3 390.429 -1.448 20 0 GAADHM NC(=O)[C@H]1CN([C@@H]2CCN(c3sccc3-c3nnn[n-]3)C2=O)C[C@H]1C(N)=O ZINC001581890213 1075830001 /nfs/dbraw/zinc/83/00/01/1075830001.db2.gz HKZXQLQFKVZORR-KXUCPTDWSA-N -1 3 390.429 -1.448 20 0 GAADHM NC(=O)[C@@H]1CN([C@@H]2CCN(c3sccc3-c3nnn[n-]3)C2=O)C[C@H]1C(N)=O ZINC001581890214 1075830015 /nfs/dbraw/zinc/83/00/15/1075830015.db2.gz HKZXQLQFKVZORR-OPRDCNLKSA-N -1 3 390.429 -1.448 20 0 GAADHM NC(=O)[C@H]1CC[C@@H]1C(=O)N[C@@H]1[C@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]21 ZINC001581890725 1075830143 /nfs/dbraw/zinc/83/01/43/1075830143.db2.gz RSTJHTNSUXZHBS-HKLXJQGRSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@H]1CC[C@@H]1C(=O)N[C@@H]1[C@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]21 ZINC001581890725 1075830136 /nfs/dbraw/zinc/83/01/36/1075830136.db2.gz RSTJHTNSUXZHBS-HKLXJQGRSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@@H]1C(=O)N[C@@H]1[C@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]21 ZINC001581890726 1075830009 /nfs/dbraw/zinc/83/00/09/1075830009.db2.gz RSTJHTNSUXZHBS-OQEOFVATSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@@H]1C(=O)N[C@@H]1[C@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]21 ZINC001581890726 1075830006 /nfs/dbraw/zinc/83/00/06/1075830006.db2.gz RSTJHTNSUXZHBS-OQEOFVATSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@H]1CC[C@H]1C(=O)N[C@@H]1[C@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]21 ZINC001581890727 1075830075 /nfs/dbraw/zinc/83/00/75/1075830075.db2.gz RSTJHTNSUXZHBS-VLLVSFFDSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@H]1CC[C@H]1C(=O)N[C@@H]1[C@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]21 ZINC001581890727 1075830071 /nfs/dbraw/zinc/83/00/71/1075830071.db2.gz RSTJHTNSUXZHBS-VLLVSFFDSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@H]1C(=O)N[C@@H]1[C@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]21 ZINC001581890728 1075830026 /nfs/dbraw/zinc/83/00/26/1075830026.db2.gz RSTJHTNSUXZHBS-YFVNTRNASA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@H]1C(=O)N[C@@H]1[C@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]21 ZINC001581890728 1075830024 /nfs/dbraw/zinc/83/00/24/1075830024.db2.gz RSTJHTNSUXZHBS-YFVNTRNASA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)C[C@@H]1COCCN1CCS(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001581891500 1075830089 /nfs/dbraw/zinc/83/00/89/1075830089.db2.gz MPNOFKJZVQLPEJ-LLVKDONJSA-N -1 3 381.418 -1.388 20 0 GAADHM NC(=O)C[C@@H]1COCCN1CCS(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001581891500 1075830086 /nfs/dbraw/zinc/83/00/86/1075830086.db2.gz MPNOFKJZVQLPEJ-LLVKDONJSA-N -1 3 381.418 -1.388 20 0 GAADHM NC(=O)C[C@H]1COCCN1CCS(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001581891502 1075830104 /nfs/dbraw/zinc/83/01/04/1075830104.db2.gz MPNOFKJZVQLPEJ-NSHDSACASA-N -1 3 381.418 -1.388 20 0 GAADHM NC(=O)C[C@H]1COCCN1CCS(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001581891502 1075830101 /nfs/dbraw/zinc/83/01/01/1075830101.db2.gz MPNOFKJZVQLPEJ-NSHDSACASA-N -1 3 381.418 -1.388 20 0 GAADHM NC(=O)[C@H]1CC[C@@H]1C(=O)N[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]21 ZINC001581891516 1075829990 /nfs/dbraw/zinc/82/99/90/1075829990.db2.gz ZESOUPPKISFWCU-HKLXJQGRSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@H]1CC[C@@H]1C(=O)N[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]21 ZINC001581891516 1075829985 /nfs/dbraw/zinc/82/99/85/1075829985.db2.gz ZESOUPPKISFWCU-HKLXJQGRSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@@H]1C(=O)N[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]21 ZINC001581891517 1075830117 /nfs/dbraw/zinc/83/01/17/1075830117.db2.gz ZESOUPPKISFWCU-OQEOFVATSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@@H]1C(=O)N[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]21 ZINC001581891517 1075830114 /nfs/dbraw/zinc/83/01/14/1075830114.db2.gz ZESOUPPKISFWCU-OQEOFVATSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@H]1CC[C@H]1C(=O)N[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]21 ZINC001581891518 1075830048 /nfs/dbraw/zinc/83/00/48/1075830048.db2.gz ZESOUPPKISFWCU-VLLVSFFDSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@H]1CC[C@H]1C(=O)N[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]21 ZINC001581891518 1075830045 /nfs/dbraw/zinc/83/00/45/1075830045.db2.gz ZESOUPPKISFWCU-VLLVSFFDSA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@H]1C(=O)N[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]21 ZINC001581891519 1075830033 /nfs/dbraw/zinc/83/00/33/1075830033.db2.gz ZESOUPPKISFWCU-YFVNTRNASA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)[C@@H]1CC[C@H]1C(=O)N[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]21 ZINC001581891519 1075830032 /nfs/dbraw/zinc/83/00/32/1075830032.db2.gz ZESOUPPKISFWCU-YFVNTRNASA-N -1 3 384.400 -1.107 20 0 GAADHM NC(=O)CCCC(=O)NCCN1CCN(c2cnc(-c3nnn[n-]3)cn2)CC1 ZINC001581893277 1075830322 /nfs/dbraw/zinc/83/03/22/1075830322.db2.gz QBGXXDAPDOUHNS-UHFFFAOYSA-N -1 3 388.436 -1.450 20 0 GAADHM NC(=O)CCCC(=O)NCCN1CCN(c2ccc(-c3nnn[n-]3)nn2)CC1 ZINC001581893512 1075830751 /nfs/dbraw/zinc/83/07/51/1075830751.db2.gz WZQHOQSYKQGOAZ-UHFFFAOYSA-N -1 3 388.436 -1.450 20 0 GAADHM NC(=O)CCCC(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001581893945 1075830957 /nfs/dbraw/zinc/83/09/57/1075830957.db2.gz SCDMDBWMDAPPCB-GHMZBOCLSA-N -1 3 378.368 -1.278 20 0 GAADHM NC(=O)CCCC(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001581893945 1075830948 /nfs/dbraw/zinc/83/09/48/1075830948.db2.gz SCDMDBWMDAPPCB-GHMZBOCLSA-N -1 3 378.368 -1.278 20 0 GAADHM NC(=O)CCCC(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001581893946 1075830892 /nfs/dbraw/zinc/83/08/92/1075830892.db2.gz SCDMDBWMDAPPCB-MNOVXSKESA-N -1 3 378.368 -1.278 20 0 GAADHM NC(=O)CCCC(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001581893946 1075830884 /nfs/dbraw/zinc/83/08/84/1075830884.db2.gz SCDMDBWMDAPPCB-MNOVXSKESA-N -1 3 378.368 -1.278 20 0 GAADHM NC(=O)CN1CCN(S(=O)(=O)Cc2ccc(-c3nn[n-]n3)cc2)CC1=O ZINC001581894145 1075830781 /nfs/dbraw/zinc/83/07/81/1075830781.db2.gz AYYSRVWAYQPLFQ-UHFFFAOYSA-N -1 3 379.402 -1.674 20 0 GAADHM NC(=O)CN1CCN(S(=O)(=O)Cc2ccc(-c3nnn[n-]3)cc2)CC1=O ZINC001581894145 1075830778 /nfs/dbraw/zinc/83/07/78/1075830778.db2.gz AYYSRVWAYQPLFQ-UHFFFAOYSA-N -1 3 379.402 -1.674 20 0 GAADHM NC(=O)CN1CCN(S(=O)(=O)c2cc(F)cc(-c3nn[n-]n3)c2)CC1=O ZINC001581894193 1075830935 /nfs/dbraw/zinc/83/09/35/1075830935.db2.gz DCNRVTIPESBCFX-UHFFFAOYSA-N -1 3 383.365 -1.676 20 0 GAADHM NC(=O)CN1CCN(S(=O)(=O)c2cc(F)cc(-c3nnn[n-]3)c2)CC1=O ZINC001581894193 1075830928 /nfs/dbraw/zinc/83/09/28/1075830928.db2.gz DCNRVTIPESBCFX-UHFFFAOYSA-N -1 3 383.365 -1.676 20 0 GAADHM NC(=O)CN1CCN(S(=O)(=O)c2ccc(F)c(-c3nnn[n-]3)c2)CC1=O ZINC001581894222 1075830821 /nfs/dbraw/zinc/83/08/21/1075830821.db2.gz FFASFMHFVHVRTQ-UHFFFAOYSA-N -1 3 383.365 -1.676 20 0 GAADHM NC(=O)CN1CC2(C1)C[C@@H](NC(=O)c1cc(-c3nn[n-]n3)c[nH]1)c1nccn12 ZINC001581894351 1075830837 /nfs/dbraw/zinc/83/08/37/1075830837.db2.gz JLHZWTUJYAUNSH-LLVKDONJSA-N -1 3 382.388 -1.238 20 0 GAADHM NC(=O)CN1CC2(C1)C[C@@H](NC(=O)c1cc(-c3nnn[n-]3)c[nH]1)c1nccn12 ZINC001581894351 1075830830 /nfs/dbraw/zinc/83/08/30/1075830830.db2.gz JLHZWTUJYAUNSH-LLVKDONJSA-N -1 3 382.388 -1.238 20 0 GAADHM NC(=O)CN1CC2(C1)C[C@H](NC(=O)c1cc(-c3nn[n-]n3)c[nH]1)c1nccn12 ZINC001581894352 1075831029 /nfs/dbraw/zinc/83/10/29/1075831029.db2.gz JLHZWTUJYAUNSH-NSHDSACASA-N -1 3 382.388 -1.238 20 0 GAADHM NC(=O)CN1CC2(C1)C[C@H](NC(=O)c1cc(-c3nnn[n-]3)c[nH]1)c1nccn12 ZINC001581894352 1075831024 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CUJSODGGXNSVQI-SECBINFHSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)N1CCC[C@H](C(=O)N2CC(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)C1 ZINC001581895329 1075831272 /nfs/dbraw/zinc/83/12/72/1075831272.db2.gz CUJSODGGXNSVQI-VIFPVBQESA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)N1CCC[C@H](C(=O)N2CC(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)C1 ZINC001581895329 1075831267 /nfs/dbraw/zinc/83/12/67/1075831267.db2.gz CUJSODGGXNSVQI-VIFPVBQESA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)Cn1cc(C(=O)NC2CN(Cc3ccc(-c4nnn[n-]4)s3)C2)nn1 ZINC001581895428 1075831147 /nfs/dbraw/zinc/83/11/47/1075831147.db2.gz IGTSJIGBAVRFFF-UHFFFAOYSA-N -1 3 388.417 -1.381 20 0 GAADHM NC(=O)N1CCC[C@@H](C(=O)NC2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)C1 ZINC001581895499 1075831339 /nfs/dbraw/zinc/83/13/39/1075831339.db2.gz KTEMNNBRDCZQCZ-SECBINFHSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)N1CCC[C@@H](C(=O)NC2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)C1 ZINC001581895499 1075831337 /nfs/dbraw/zinc/83/13/37/1075831337.db2.gz KTEMNNBRDCZQCZ-SECBINFHSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)N1CCC[C@H](C(=O)NC2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)C1 ZINC001581895500 1075831296 /nfs/dbraw/zinc/83/12/96/1075831296.db2.gz KTEMNNBRDCZQCZ-VIFPVBQESA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)N1CCC[C@H](C(=O)NC2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)C1 ZINC001581895500 1075831294 /nfs/dbraw/zinc/83/12/94/1075831294.db2.gz KTEMNNBRDCZQCZ-VIFPVBQESA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)Cn1cc(C(=O)N2CCN(c3ccc(-c4nn[n-]n4)cc3)CC2)nn1 ZINC001581895505 1075831224 /nfs/dbraw/zinc/83/12/24/1075831224.db2.gz KYPNEVHHGVVKON-UHFFFAOYSA-N -1 3 382.388 -1.094 20 0 GAADHM NC(=O)Cn1cc(C(=O)N2CCN(c3ccc(-c4nn[n-]n4)cn3)CC2)nn1 ZINC001581895575 1075831325 /nfs/dbraw/zinc/83/13/25/1075831325.db2.gz OMFIRGDYJJOBKY-UHFFFAOYSA-N -1 3 383.376 -1.699 20 0 GAADHM NC(=O)Cn1cc(C(=O)N2CCN(c3ccc(-c4nnn[n-]4)cn3)CC2)nn1 ZINC001581895575 1075831324 /nfs/dbraw/zinc/83/13/24/1075831324.db2.gz OMFIRGDYJJOBKY-UHFFFAOYSA-N -1 3 383.376 -1.699 20 0 GAADHM NC(=O)N1CCC[C@@H](C(=O)NC2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)C1 ZINC001581895642 1075831259 /nfs/dbraw/zinc/83/12/59/1075831259.db2.gz RBNNXMLPFXHOIB-SECBINFHSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)N1CCC[C@@H](C(=O)NC2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)C1 ZINC001581895642 1075831257 /nfs/dbraw/zinc/83/12/57/1075831257.db2.gz RBNNXMLPFXHOIB-SECBINFHSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)N1CCC[C@H](C(=O)NC2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)C1 ZINC001581895643 1075831314 /nfs/dbraw/zinc/83/13/14/1075831314.db2.gz RBNNXMLPFXHOIB-VIFPVBQESA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)N1CCC[C@H](C(=O)NC2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)C1 ZINC001581895643 1075831312 /nfs/dbraw/zinc/83/13/12/1075831312.db2.gz RBNNXMLPFXHOIB-VIFPVBQESA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)N1CCC[C@@H](C(=O)N2CC(NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)C1 ZINC001581895654 1075831194 /nfs/dbraw/zinc/83/11/94/1075831194.db2.gz RNUZZEULGVFXIZ-SECBINFHSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)N1CCC[C@@H](C(=O)N2CC(NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)C1 ZINC001581895654 1075831188 /nfs/dbraw/zinc/83/11/88/1075831188.db2.gz RNUZZEULGVFXIZ-SECBINFHSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)N1CCC[C@H](C(=O)N2CC(NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)C1 ZINC001581895655 1075831290 /nfs/dbraw/zinc/83/12/90/1075831290.db2.gz RNUZZEULGVFXIZ-VIFPVBQESA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)N1CCC[C@H](C(=O)N2CC(NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)C1 ZINC001581895655 1075831288 /nfs/dbraw/zinc/83/12/88/1075831288.db2.gz RNUZZEULGVFXIZ-VIFPVBQESA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)Cn1cc(C(=O)NC2CN(Cc3ccc(-c4nn[n-]n4)cc3)C2)nn1 ZINC001581895749 1075831249 /nfs/dbraw/zinc/83/12/49/1075831249.db2.gz VVYMVPVZYFLVHJ-UHFFFAOYSA-N -1 3 382.388 -1.442 20 0 GAADHM NC(=O)Cn1cc(C(=O)NC2CN(Cc3ccc(-c4nnn[n-]4)cc3)C2)nn1 ZINC001581895749 1075831244 /nfs/dbraw/zinc/83/12/44/1075831244.db2.gz VVYMVPVZYFLVHJ-UHFFFAOYSA-N -1 3 382.388 -1.442 20 0 GAADHM 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ZINC001581897382 1075833620 /nfs/dbraw/zinc/83/36/20/1075833620.db2.gz KRFITUBDRWBTFT-JOYOIKCWSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)NCCC(=O)N1C[C@@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H]2C1 ZINC001581897382 1075833612 /nfs/dbraw/zinc/83/36/12/1075833612.db2.gz KRFITUBDRWBTFT-JOYOIKCWSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)NCCC(=O)N1C[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H]2C1 ZINC001581897396 1075833460 /nfs/dbraw/zinc/83/34/60/1075833460.db2.gz LCRXMUARMREEKV-JOYOIKCWSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)NCCC(=O)N1C[C@@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H]2C1 ZINC001581897396 1075833458 /nfs/dbraw/zinc/83/34/58/1075833458.db2.gz LCRXMUARMREEKV-JOYOIKCWSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)NCCC(=O)N1CCO[C@H](CNc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001581897399 1075833498 /nfs/dbraw/zinc/83/34/98/1075833498.db2.gz LISOEKUXWCSZGE-LLVKDONJSA-N -1 3 375.393 -1.041 20 0 GAADHM NC(=O)NCCC(=O)N1CCO[C@H](CNc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001581897399 1075833494 /nfs/dbraw/zinc/83/34/94/1075833494.db2.gz LISOEKUXWCSZGE-LLVKDONJSA-N -1 3 375.393 -1.041 20 0 GAADHM NC(=O)NCCC(=O)N1CCO[C@@H](CNc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001581897400 1075833394 /nfs/dbraw/zinc/83/33/94/1075833394.db2.gz LISOEKUXWCSZGE-NSHDSACASA-N -1 3 375.393 -1.041 20 0 GAADHM NC(=O)NCCC(=O)N1CCO[C@@H](CNc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001581897400 1075833389 /nfs/dbraw/zinc/83/33/89/1075833389.db2.gz LISOEKUXWCSZGE-NSHDSACASA-N -1 3 375.393 -1.041 20 0 GAADHM NC(=O)NCCC(=O)NC1(CCO)CN(Cc2cccc(-c3nn[n-]n3)c2)C1 ZINC001581897452 1075833831 /nfs/dbraw/zinc/83/38/31/1075833831.db2.gz NCSHBLFSNZWRNW-UHFFFAOYSA-N -1 3 388.432 -1.022 20 0 GAADHM NC(=O)NCCC(=O)NC1(CCO)CN(Cc2cccc(-c3nnn[n-]3)c2)C1 ZINC001581897452 1075833824 /nfs/dbraw/zinc/83/38/24/1075833824.db2.gz NCSHBLFSNZWRNW-UHFFFAOYSA-N -1 3 388.432 -1.022 20 0 GAADHM NC(=O)NCCC(=O)N1CC[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H]2C1 ZINC001581897492 1075833868 /nfs/dbraw/zinc/83/38/68/1075833868.db2.gz OORIJHOECAMMCX-BXKDBHETSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)NCCC(=O)N1CC[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H]2C1 ZINC001581897492 1075833862 /nfs/dbraw/zinc/83/38/62/1075833862.db2.gz OORIJHOECAMMCX-BXKDBHETSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)NCCC(=O)N1CCO[C@H](CNc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001581897494 1075833926 /nfs/dbraw/zinc/83/39/26/1075833926.db2.gz OZERMHYWIWMUJR-LLVKDONJSA-N -1 3 375.393 -1.041 20 0 GAADHM NC(=O)NCCC(=O)N1CCO[C@H](CNc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001581897494 1075833919 /nfs/dbraw/zinc/83/39/19/1075833919.db2.gz OZERMHYWIWMUJR-LLVKDONJSA-N -1 3 375.393 -1.041 20 0 GAADHM NC(=O)NCCC(=O)N1CCO[C@@H](CNc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001581897495 1075833848 /nfs/dbraw/zinc/83/38/48/1075833848.db2.gz OZERMHYWIWMUJR-NSHDSACASA-N -1 3 375.393 -1.041 20 0 GAADHM NC(=O)NCCC(=O)N1CCO[C@@H](CNc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001581897495 1075833845 /nfs/dbraw/zinc/83/38/45/1075833845.db2.gz OZERMHYWIWMUJR-NSHDSACASA-N -1 3 375.393 -1.041 20 0 GAADHM NC(=O)NCCC(=O)N1C[C@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]21 ZINC001581897496 1075833992 /nfs/dbraw/zinc/83/39/92/1075833992.db2.gz PCFLSBMNGHFPMS-BXKDBHETSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)NCCC(=O)N1C[C@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]21 ZINC001581897496 1075833989 /nfs/dbraw/zinc/83/39/89/1075833989.db2.gz PCFLSBMNGHFPMS-BXKDBHETSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)NCCC(=O)N1C[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2C1 ZINC001581897517 1075833768 /nfs/dbraw/zinc/83/37/68/1075833768.db2.gz PPJPVBWFSAQOGS-AOOOYVTPSA-N -1 3 387.404 -1.216 20 0 GAADHM NC(=O)NCCC(=O)N1C[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2C1 ZINC001581897517 1075833765 /nfs/dbraw/zinc/83/37/65/1075833765.db2.gz PPJPVBWFSAQOGS-AOOOYVTPSA-N -1 3 387.404 -1.216 20 0 GAADHM NC(=O)NCCC(=O)N1CC[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H]2C1 ZINC001581897572 1075833801 /nfs/dbraw/zinc/83/38/01/1075833801.db2.gz RTIIMRBPTCQZDT-BXKDBHETSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)NCCC(=O)N1CC[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H]2C1 ZINC001581897572 1075833793 /nfs/dbraw/zinc/83/37/93/1075833793.db2.gz RTIIMRBPTCQZDT-BXKDBHETSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)NCCC(=O)N1CC[C@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]21 ZINC001581897615 1075833967 /nfs/dbraw/zinc/83/39/67/1075833967.db2.gz SXQBDIGKIWTVJX-JOYOIKCWSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)NCCC(=O)N1CC[C@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]21 ZINC001581897615 1075833963 /nfs/dbraw/zinc/83/39/63/1075833963.db2.gz SXQBDIGKIWTVJX-JOYOIKCWSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)NCCC(=O)N1C[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2C1 ZINC001581897616 1075833945 /nfs/dbraw/zinc/83/39/45/1075833945.db2.gz SXZZVWFUMLJGLR-PHIMTYICSA-N -1 3 387.404 -1.216 20 0 GAADHM NC(=O)NCCC(=O)N1C[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2C1 ZINC001581897616 1075833937 /nfs/dbraw/zinc/83/39/37/1075833937.db2.gz SXZZVWFUMLJGLR-PHIMTYICSA-N -1 3 387.404 -1.216 20 0 GAADHM NC(=O)NCCC(=O)N1CCCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001581897672 1075833907 /nfs/dbraw/zinc/83/39/07/1075833907.db2.gz VNZDNVGQXYNECV-UHFFFAOYSA-N -1 3 375.393 -1.072 20 0 GAADHM NC(=O)NCCC(=O)N1CCCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001581897672 1075833899 /nfs/dbraw/zinc/83/38/99/1075833899.db2.gz VNZDNVGQXYNECV-UHFFFAOYSA-N -1 3 375.393 -1.072 20 0 GAADHM NC(=O)NCCC(=O)N1CCO[C@@H](CNc2ncccc2-c2nn[n-]n2)C1 ZINC001581897682 1075833759 /nfs/dbraw/zinc/83/37/59/1075833759.db2.gz VVAXMQSOLDCAGO-JTQLQIEISA-N -1 3 375.393 -1.041 20 0 GAADHM NC(=O)NCCC(=O)N1CCO[C@@H](CNc2ncccc2-c2nnn[n-]2)C1 ZINC001581897682 1075833756 /nfs/dbraw/zinc/83/37/56/1075833756.db2.gz VVAXMQSOLDCAGO-JTQLQIEISA-N -1 3 375.393 -1.041 20 0 GAADHM NC(=O)NCCC(=O)N1CCO[C@H](CNc2ncccc2-c2nn[n-]n2)C1 ZINC001581897683 1075833752 /nfs/dbraw/zinc/83/37/52/1075833752.db2.gz VVAXMQSOLDCAGO-SNVBAGLBSA-N -1 3 375.393 -1.041 20 0 GAADHM NC(=O)NCCC(=O)N1CCO[C@H](CNc2ncccc2-c2nnn[n-]2)C1 ZINC001581897683 1075833751 /nfs/dbraw/zinc/83/37/51/1075833751.db2.gz VVAXMQSOLDCAGO-SNVBAGLBSA-N -1 3 375.393 -1.041 20 0 GAADHM NC(=O)NCCC(=O)NC1(CCO)CN(Cc2ccc(-c3nn[n-]n3)cc2)C1 ZINC001581897765 1075834326 /nfs/dbraw/zinc/83/43/26/1075834326.db2.gz YLHSERIHAQUVLX-UHFFFAOYSA-N -1 3 388.432 -1.022 20 0 GAADHM NC(=O)NCCC(=O)NC1(CCO)CN(Cc2ccc(-c3nnn[n-]3)cc2)C1 ZINC001581897765 1075834325 /nfs/dbraw/zinc/83/43/25/1075834325.db2.gz YLHSERIHAQUVLX-UHFFFAOYSA-N -1 3 388.432 -1.022 20 0 GAADHM NC(=O)NCCC(=O)N1C[C@@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H]2C1 ZINC001581897771 1075834292 /nfs/dbraw/zinc/83/42/92/1075834292.db2.gz YTDWRHDMJISDOK-JOYOIKCWSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)NCCC(=O)N1C[C@@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H]2C1 ZINC001581897771 1075834287 /nfs/dbraw/zinc/83/42/87/1075834287.db2.gz YTDWRHDMJISDOK-JOYOIKCWSA-N -1 3 387.404 -1.074 20 0 GAADHM NC(=O)NCCC(=O)NC[C@@H]1COCCN1c1ccc(-c2nn[n-]n2)cn1 ZINC001581897808 1075834277 /nfs/dbraw/zinc/83/42/77/1075834277.db2.gz APGNRZCXDALJPA-LLVKDONJSA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)NC[C@@H]1COCCN1c1ccc(-c2nnn[n-]2)cn1 ZINC001581897808 1075834272 /nfs/dbraw/zinc/83/42/72/1075834272.db2.gz APGNRZCXDALJPA-LLVKDONJSA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)NC[C@H]1COCCN1c1ccc(-c2nn[n-]n2)cn1 ZINC001581897809 1075834235 /nfs/dbraw/zinc/83/42/35/1075834235.db2.gz APGNRZCXDALJPA-NSHDSACASA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)NC[C@H]1COCCN1c1ccc(-c2nnn[n-]2)cn1 ZINC001581897809 1075834228 /nfs/dbraw/zinc/83/42/28/1075834228.db2.gz APGNRZCXDALJPA-NSHDSACASA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(Cc2cc(F)ccc2-c2nn[n-]n2)C[C@H]1O ZINC001581897818 1075834198 /nfs/dbraw/zinc/83/41/98/1075834198.db2.gz BKCVJMFUVSMSCM-CHWSQXEVSA-N -1 3 392.395 -1.275 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(Cc2cc(F)ccc2-c2nn[n-]n2)C[C@@H]1O ZINC001581897819 1075834263 /nfs/dbraw/zinc/83/42/63/1075834263.db2.gz BKCVJMFUVSMSCM-OLZOCXBDSA-N -1 3 392.395 -1.275 20 0 GAADHM NC(=O)NCCC(=O)NCCN1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001581897822 1075834169 /nfs/dbraw/zinc/83/41/69/1075834169.db2.gz BMUNESOTDNCGCE-UHFFFAOYSA-N -1 3 388.436 -1.442 20 0 GAADHM NC(=O)NCCC(=O)NCCN1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001581897822 1075834162 /nfs/dbraw/zinc/83/41/62/1075834162.db2.gz BMUNESOTDNCGCE-UHFFFAOYSA-N -1 3 388.436 -1.442 20 0 GAADHM NC(=O)NCCC(=O)NCC1(O)CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C1 ZINC001581897861 1075834312 /nfs/dbraw/zinc/83/43/12/1075834312.db2.gz DJFONXRWYCXUEN-UHFFFAOYSA-N -1 3 392.395 -1.273 20 0 GAADHM NC(=O)NCCC(=O)NCC1(O)CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C1 ZINC001581897861 1075834309 /nfs/dbraw/zinc/83/43/09/1075834309.db2.gz DJFONXRWYCXUEN-UHFFFAOYSA-N -1 3 392.395 -1.273 20 0 GAADHM NC(=O)NCCC(=O)NC[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)CCO1 ZINC001581897863 1075834305 /nfs/dbraw/zinc/83/43/05/1075834305.db2.gz DNOAQAJJADIOPJ-LLVKDONJSA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)NC[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)CCO1 ZINC001581897863 1075834301 /nfs/dbraw/zinc/83/43/01/1075834301.db2.gz DNOAQAJJADIOPJ-LLVKDONJSA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)NC[C@H]1CN(c2ccc(-c3nn[n-]n3)nc2)CCO1 ZINC001581897864 1075834338 /nfs/dbraw/zinc/83/43/38/1075834338.db2.gz DNOAQAJJADIOPJ-NSHDSACASA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)NC[C@H]1CN(c2ccc(-c3nnn[n-]3)nc2)CCO1 ZINC001581897864 1075834334 /nfs/dbraw/zinc/83/43/34/1075834334.db2.gz DNOAQAJJADIOPJ-NSHDSACASA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)NCCN1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001581897977 1075834368 /nfs/dbraw/zinc/83/43/68/1075834368.db2.gz IQAARTWTLHJSPI-UHFFFAOYSA-N -1 3 388.436 -1.442 20 0 GAADHM NC(=O)NCCC(=O)NCCN1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001581897977 1075834366 /nfs/dbraw/zinc/83/43/66/1075834366.db2.gz IQAARTWTLHJSPI-UHFFFAOYSA-N -1 3 388.436 -1.442 20 0 GAADHM NC(=O)NCCC(=O)NC[C@H]1COCCN1c1ncccc1-c1nn[n-]n1 ZINC001581898022 1075834361 /nfs/dbraw/zinc/83/43/61/1075834361.db2.gz JLZMXIMQPFDPSC-JTQLQIEISA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)NC[C@H]1COCCN1c1ncccc1-c1nnn[n-]1 ZINC001581898022 1075834359 /nfs/dbraw/zinc/83/43/59/1075834359.db2.gz JLZMXIMQPFDPSC-JTQLQIEISA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)NC[C@@H]1COCCN1c1ncccc1-c1nn[n-]n1 ZINC001581898023 1075834413 /nfs/dbraw/zinc/83/44/13/1075834413.db2.gz JLZMXIMQPFDPSC-SNVBAGLBSA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)NC[C@@H]1COCCN1c1ncccc1-c1nnn[n-]1 ZINC001581898023 1075834409 /nfs/dbraw/zinc/83/44/09/1075834409.db2.gz JLZMXIMQPFDPSC-SNVBAGLBSA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)NC[C@H]1CN(c2ncccc2-c2nn[n-]n2)CCO1 ZINC001581898067 1075834380 /nfs/dbraw/zinc/83/43/80/1075834380.db2.gz LLIRZYFZCTVYAQ-JTQLQIEISA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)NC[C@H]1CN(c2ncccc2-c2nnn[n-]2)CCO1 ZINC001581898067 1075834375 /nfs/dbraw/zinc/83/43/75/1075834375.db2.gz LLIRZYFZCTVYAQ-JTQLQIEISA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)NC[C@@H]1CN(c2ncccc2-c2nn[n-]n2)CCO1 ZINC001581898068 1075834354 /nfs/dbraw/zinc/83/43/54/1075834354.db2.gz LLIRZYFZCTVYAQ-SNVBAGLBSA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)NC[C@@H]1CN(c2ncccc2-c2nnn[n-]2)CCO1 ZINC001581898068 1075834352 /nfs/dbraw/zinc/83/43/52/1075834352.db2.gz LLIRZYFZCTVYAQ-SNVBAGLBSA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(Cc2cc(-c3nn[n-]n3)ccc2F)C[C@H]1O ZINC001581898079 1075834425 /nfs/dbraw/zinc/83/44/25/1075834425.db2.gz LRRPCJMOWYRKKP-CHWSQXEVSA-N -1 3 392.395 -1.275 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(Cc2cc(-c3nn[n-]n3)ccc2F)C[C@@H]1O ZINC001581898080 1075834894 /nfs/dbraw/zinc/83/48/94/1075834894.db2.gz LRRPCJMOWYRKKP-OLZOCXBDSA-N -1 3 392.395 -1.275 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(c2cccc(F)c2-c2nn[n-]n2)C[C@@H]1O ZINC001581898085 1075834759 /nfs/dbraw/zinc/83/47/59/1075834759.db2.gz LZBLYSGLFOUUTC-KOLCDFICSA-N -1 3 378.368 -1.270 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(c2cccc(F)c2-c2nnn[n-]2)C[C@@H]1O ZINC001581898085 1075834751 /nfs/dbraw/zinc/83/47/51/1075834751.db2.gz LZBLYSGLFOUUTC-KOLCDFICSA-N -1 3 378.368 -1.270 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(c2cccc(F)c2-c2nn[n-]n2)C[C@H]1O ZINC001581898086 1075834736 /nfs/dbraw/zinc/83/47/36/1075834736.db2.gz LZBLYSGLFOUUTC-MWLCHTKSSA-N -1 3 378.368 -1.270 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(c2cccc(F)c2-c2nnn[n-]2)C[C@H]1O ZINC001581898086 1075834730 /nfs/dbraw/zinc/83/47/30/1075834730.db2.gz LZBLYSGLFOUUTC-MWLCHTKSSA-N -1 3 378.368 -1.270 20 0 GAADHM NC(=O)NCCC(=O)NC[C@@H]1COCCN1c1ccc(-c2nn[n-]n2)nc1 ZINC001581898117 1075834854 /nfs/dbraw/zinc/83/48/54/1075834854.db2.gz NIGUTBRZFINYIF-LLVKDONJSA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)NC[C@@H]1COCCN1c1ccc(-c2nnn[n-]2)nc1 ZINC001581898117 1075834850 /nfs/dbraw/zinc/83/48/50/1075834850.db2.gz NIGUTBRZFINYIF-LLVKDONJSA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)NC[C@H]1COCCN1c1ccc(-c2nn[n-]n2)nc1 ZINC001581898118 1075834675 /nfs/dbraw/zinc/83/46/75/1075834675.db2.gz NIGUTBRZFINYIF-NSHDSACASA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)NC[C@H]1COCCN1c1ccc(-c2nnn[n-]2)nc1 ZINC001581898118 1075834669 /nfs/dbraw/zinc/83/46/69/1075834669.db2.gz NIGUTBRZFINYIF-NSHDSACASA-N -1 3 375.393 -1.359 20 0 GAADHM NC(=O)NCCC(=O)NCC1(O)CN(Cc2cc(F)ccc2-c2nn[n-]n2)C1 ZINC001581898142 1075834838 /nfs/dbraw/zinc/83/48/38/1075834838.db2.gz OGMKDCKKEWPXMV-UHFFFAOYSA-N -1 3 392.395 -1.273 20 0 GAADHM NC(=O)NCCC(=O)NCC1(O)CN(Cc2cc(F)ccc2-c2nnn[n-]2)C1 ZINC001581898142 1075834833 /nfs/dbraw/zinc/83/48/33/1075834833.db2.gz OGMKDCKKEWPXMV-UHFFFAOYSA-N -1 3 392.395 -1.273 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)s2)C[C@H]1O ZINC001581898152 1075834564 /nfs/dbraw/zinc/83/45/64/1075834564.db2.gz OXMZQMJDEBTURV-NXEZZACHSA-N -1 3 380.434 -1.352 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)s2)C[C@H]1O ZINC001581898152 1075834558 /nfs/dbraw/zinc/83/45/58/1075834558.db2.gz OXMZQMJDEBTURV-NXEZZACHSA-N -1 3 380.434 -1.352 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)s2)C[C@@H]1O ZINC001581898153 1075834703 /nfs/dbraw/zinc/83/47/03/1075834703.db2.gz OXMZQMJDEBTURV-ZJUUUORDSA-N -1 3 380.434 -1.352 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)s2)C[C@@H]1O ZINC001581898153 1075834696 /nfs/dbraw/zinc/83/46/96/1075834696.db2.gz OXMZQMJDEBTURV-ZJUUUORDSA-N -1 3 380.434 -1.352 20 0 GAADHM NC(=O)[C@@H]1CCCN1CCCNS(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001581898249 1075834791 /nfs/dbraw/zinc/83/47/91/1075834791.db2.gz DMPXXMLIKKQIRI-NSHDSACASA-N -1 3 380.434 -1.120 20 0 GAADHM NC(=O)[C@@H]1CC[C@H](C(=O)N2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)O1 ZINC001581898370 1075834816 /nfs/dbraw/zinc/83/48/16/1075834816.db2.gz GRLMPTLMRBDYLH-NWDGAFQWSA-N -1 3 388.388 -1.488 20 0 GAADHM NC(=O)[C@@H]1CC[C@H](C(=O)N2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)O1 ZINC001581898370 1075834808 /nfs/dbraw/zinc/83/48/08/1075834808.db2.gz GRLMPTLMRBDYLH-NWDGAFQWSA-N -1 3 388.388 -1.488 20 0 GAADHM NC(=O)[C@@H]1CC[C@H](C(=O)N2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)CC2)O1 ZINC001581898486 1075835322 /nfs/dbraw/zinc/83/53/22/1075835322.db2.gz KLWRYGCTFNCGNB-NWDGAFQWSA-N -1 3 388.388 -1.488 20 0 GAADHM NC(=O)[C@@H]1CC[C@H](C(=O)N2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)CC2)O1 ZINC001581898486 1075835313 /nfs/dbraw/zinc/83/53/13/1075835313.db2.gz KLWRYGCTFNCGNB-NWDGAFQWSA-N -1 3 388.388 -1.488 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001581898499 1075835025 /nfs/dbraw/zinc/83/50/25/1075835025.db2.gz RUNBTZUIUFSXBR-CHWSQXEVSA-N -1 3 392.395 -1.275 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001581898499 1075835020 /nfs/dbraw/zinc/83/50/20/1075835020.db2.gz RUNBTZUIUFSXBR-CHWSQXEVSA-N -1 3 392.395 -1.275 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001581898500 1075835219 /nfs/dbraw/zinc/83/52/19/1075835219.db2.gz RUNBTZUIUFSXBR-OLZOCXBDSA-N -1 3 392.395 -1.275 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001581898500 1075835214 /nfs/dbraw/zinc/83/52/14/1075835214.db2.gz RUNBTZUIUFSXBR-OLZOCXBDSA-N -1 3 392.395 -1.275 20 0 GAADHM NC(=O)NCCC(=O)NCC1(O)CN(Cc2ccc(-c3nnn[n-]3)s2)C1 ZINC001581898664 1075835245 /nfs/dbraw/zinc/83/52/45/1075835245.db2.gz UMWPZDZQKIFGPH-UHFFFAOYSA-N -1 3 380.434 -1.351 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C[C@H]1O ZINC001581898674 1075835049 /nfs/dbraw/zinc/83/50/49/1075835049.db2.gz UXPNKPMWZMHIDR-CHWSQXEVSA-N -1 3 392.395 -1.275 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C[C@H]1O ZINC001581898674 1075835042 /nfs/dbraw/zinc/83/50/42/1075835042.db2.gz UXPNKPMWZMHIDR-CHWSQXEVSA-N -1 3 392.395 -1.275 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C[C@@H]1O ZINC001581898675 1075835197 /nfs/dbraw/zinc/83/51/97/1075835197.db2.gz UXPNKPMWZMHIDR-OLZOCXBDSA-N -1 3 392.395 -1.275 20 0 GAADHM NC(=O)NCCC(=O)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C[C@@H]1O ZINC001581898675 1075835195 /nfs/dbraw/zinc/83/51/95/1075835195.db2.gz UXPNKPMWZMHIDR-OLZOCXBDSA-N -1 3 392.395 -1.275 20 0 GAADHM NC(=O)NCCC(=O)NCC1(O)CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C1 ZINC001581898905 1075835100 /nfs/dbraw/zinc/83/51/00/1075835100.db2.gz ZNJHLGCSUFWSFC-UHFFFAOYSA-N -1 3 392.395 -1.273 20 0 GAADHM NC(=O)NCCC(=O)NCC1(O)CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C1 ZINC001581898905 1075835096 /nfs/dbraw/zinc/83/50/96/1075835096.db2.gz ZNJHLGCSUFWSFC-UHFFFAOYSA-N -1 3 392.395 -1.273 20 0 GAADHM NC(=O)[C@@H]1CC[C@H](C(=O)N2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2)O1 ZINC001581898972 1075835157 /nfs/dbraw/zinc/83/51/57/1075835157.db2.gz WCPNIICQEZZFAJ-NWDGAFQWSA-N -1 3 388.388 -1.488 20 0 GAADHM NC(=O)[C@@H]1CC[C@H](C(=O)N2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2)O1 ZINC001581898972 1075835154 /nfs/dbraw/zinc/83/51/54/1075835154.db2.gz WCPNIICQEZZFAJ-NWDGAFQWSA-N -1 3 388.388 -1.488 20 0 GAADHM NC(=O)[C@@H]1C[C@@H]1C(=O)N1CCC2(CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)C1 ZINC001581899101 1075835629 /nfs/dbraw/zinc/83/56/29/1075835629.db2.gz CDOHEBJVFNCWNY-ZJUUUORDSA-N -1 3 384.400 -1.009 20 0 GAADHM NC(=O)[C@@H]1C[C@@H]1C(=O)N1CCC2(CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)C1 ZINC001581899101 1075835625 /nfs/dbraw/zinc/83/56/25/1075835625.db2.gz CDOHEBJVFNCWNY-ZJUUUORDSA-N -1 3 384.400 -1.009 20 0 GAADHM NC(=O)[C@@H]1C[C@@H]1C(=O)N(CCO)CCNc1ncc(-c2nn[n-]n2)cc1F ZINC001581899113 1075835512 /nfs/dbraw/zinc/83/55/12/1075835512.db2.gz CXALHSCLQIZMOD-ZJUUUORDSA-N -1 3 378.368 -1.245 20 0 GAADHM NC(=O)[C@@H]1C[C@@H]1C(=O)N(CCO)CCNc1ncc(-c2nnn[n-]2)cc1F ZINC001581899113 1075835506 /nfs/dbraw/zinc/83/55/06/1075835506.db2.gz CXALHSCLQIZMOD-ZJUUUORDSA-N -1 3 378.368 -1.245 20 0 GAADHM NC(=O)[C@@H]1C[C@@H]1C(=O)N1CC2(C1)CCN(C(=O)c1c[nH]c(-c3nn[n-]n3)c1)C2 ZINC001581899173 1075835684 /nfs/dbraw/zinc/83/56/84/1075835684.db2.gz GJEZDJNKHDXBBL-MNOVXSKESA-N -1 3 384.400 -1.009 20 0 GAADHM NC(=O)[C@@H]1C[C@@H]1C(=O)N1CC2(C1)CCN(C(=O)c1c[nH]c(-c3nnn[n-]3)c1)C2 ZINC001581899173 1075835681 /nfs/dbraw/zinc/83/56/81/1075835681.db2.gz GJEZDJNKHDXBBL-MNOVXSKESA-N -1 3 384.400 -1.009 20 0 GAADHM NC(=O)[C@@H]1C[C@@H]1C(=O)N1C[C@@H]2[C@@H](CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H]2C1 ZINC001581899178 1075835587 /nfs/dbraw/zinc/83/55/87/1075835587.db2.gz GLXSFRWTZSIBJT-ROHXPCBUSA-N -1 3 384.400 -1.250 20 0 GAADHM NC(=O)[C@@H]1C[C@@H]1C(=O)N1C[C@@H]2[C@@H](CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H]2C1 ZINC001581899178 1075835586 /nfs/dbraw/zinc/83/55/86/1075835586.db2.gz GLXSFRWTZSIBJT-ROHXPCBUSA-N -1 3 384.400 -1.250 20 0 GAADHM NC(=O)[C@@H]1C[C@@H]1C(=O)N1CCC2(CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)C1 ZINC001581899247 1075835662 /nfs/dbraw/zinc/83/56/62/1075835662.db2.gz JGHGJDCOOQDQBX-MNOVXSKESA-N -1 3 384.400 -1.009 20 0 GAADHM NC(=O)[C@@H]1C[C@@H]1C(=O)N1CCC2(CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)C1 ZINC001581899247 1075835659 /nfs/dbraw/zinc/83/56/59/1075835659.db2.gz JGHGJDCOOQDQBX-MNOVXSKESA-N -1 3 384.400 -1.009 20 0 GAADHM NC(=O)[C@@H]1C[C@@H]1C(=O)N1C[C@@H]2[C@@H](CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H]2C1 ZINC001581899337 1075835496 /nfs/dbraw/zinc/83/54/96/1075835496.db2.gz 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-1.442 20 0 GAADHM NC(=O)c1ncn(CC(=O)NC2CN(Cc3ccc(-c4nnn[n-]4)s3)C2)n1 ZINC001581906498 1075838606 /nfs/dbraw/zinc/83/86/06/1075838606.db2.gz VQUXJYUPOKBIRK-UHFFFAOYSA-N -1 3 388.417 -1.381 20 0 GAADHM NC(=O)c1ncn(CC(=O)NC2CN(Cc3ccc(-c4nn[n-]n4)cc3)C2)n1 ZINC001581906512 1075838662 /nfs/dbraw/zinc/83/86/62/1075838662.db2.gz VTUOAQAEMSFQEP-UHFFFAOYSA-N -1 3 382.388 -1.442 20 0 GAADHM NC(=O)c1ncn(CC(=O)NC2CN(Cc3ccc(-c4nnn[n-]4)cc3)C2)n1 ZINC001581906512 1075838658 /nfs/dbraw/zinc/83/86/58/1075838658.db2.gz VTUOAQAEMSFQEP-UHFFFAOYSA-N -1 3 382.388 -1.442 20 0 GAADHM NC(=O)c1ncn(CC(=O)N2CCN(c3ccc(-c4nn[n-]n4)cn3)CC2)n1 ZINC001581906636 1075838514 /nfs/dbraw/zinc/83/85/14/1075838514.db2.gz YAAUJQPNDPCDDN-UHFFFAOYSA-N -1 3 383.376 -1.699 20 0 GAADHM NC(=O)c1ncn(CC(=O)N2CCN(c3ccc(-c4nnn[n-]4)cn3)CC2)n1 ZINC001581906636 1075838509 /nfs/dbraw/zinc/83/85/09/1075838509.db2.gz YAAUJQPNDPCDDN-UHFFFAOYSA-N -1 3 383.376 -1.699 20 0 GAADHM NS(=O)(=O)C1CN(C(=O)[C@H]2CC(=O)N(c3ccc(-c4nn[n-]n4)cc3)C2)C1 ZINC001581906934 1075838630 /nfs/dbraw/zinc/83/86/30/1075838630.db2.gz IQHQSLFNMZTSED-JTQLQIEISA-N -1 3 391.413 -1.281 20 0 GAADHM NS(=O)(=O)C1CN(C(=O)[C@H]2CC(=O)N(c3ccc(-c4nnn[n-]4)cc3)C2)C1 ZINC001581906934 1075838625 /nfs/dbraw/zinc/83/86/25/1075838625.db2.gz IQHQSLFNMZTSED-JTQLQIEISA-N -1 3 391.413 -1.281 20 0 GAADHM NS(=O)(=O)C1CN(C(=O)[C@@H]2CC(=O)N(c3ccc(-c4nn[n-]n4)cc3)C2)C1 ZINC001581906935 1075838419 /nfs/dbraw/zinc/83/84/19/1075838419.db2.gz IQHQSLFNMZTSED-SNVBAGLBSA-N -1 3 391.413 -1.281 20 0 GAADHM NS(=O)(=O)C1CN(C(=O)[C@@H]2CC(=O)N(c3ccc(-c4nnn[n-]4)cc3)C2)C1 ZINC001581906935 1075838415 /nfs/dbraw/zinc/83/84/15/1075838415.db2.gz IQHQSLFNMZTSED-SNVBAGLBSA-N -1 3 391.413 -1.281 20 0 GAADHM NS(=O)(=O)CCCC(=O)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1 ZINC001581907063 1075838826 /nfs/dbraw/zinc/83/88/26/1075838826.db2.gz OKQHILMSOUHOKP-UHFFFAOYSA-N -1 3 380.434 -1.021 20 0 GAADHM NS(=O)(=O)CCCC(=O)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1 ZINC001581907063 1075838822 /nfs/dbraw/zinc/83/88/22/1075838822.db2.gz OKQHILMSOUHOKP-UHFFFAOYSA-N -1 3 380.434 -1.021 20 0 GAADHM NS(=O)(=O)CCCC(=O)N1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001581907067 1075838918 /nfs/dbraw/zinc/83/89/18/1075838918.db2.gz OQMTUBFUGSOFSU-UHFFFAOYSA-N -1 3 380.434 -1.021 20 0 GAADHM NS(=O)(=O)CCCC(=O)N1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001581907067 1075838912 /nfs/dbraw/zinc/83/89/12/1075838912.db2.gz OQMTUBFUGSOFSU-UHFFFAOYSA-N -1 3 380.434 -1.021 20 0 GAADHM NS(=O)(=O)CCCC(=O)N1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001581907074 1075839031 /nfs/dbraw/zinc/83/90/31/1075839031.db2.gz OYADEYTZGZSHPZ-UHFFFAOYSA-N -1 3 380.434 -1.021 20 0 GAADHM NS(=O)(=O)CCCC(=O)N1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001581907074 1075839026 /nfs/dbraw/zinc/83/90/26/1075839026.db2.gz OYADEYTZGZSHPZ-UHFFFAOYSA-N -1 3 380.434 -1.021 20 0 GAADHM NS(=O)(=O)C[C@@H]1CCCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001581907079 1075839041 /nfs/dbraw/zinc/83/90/41/1075839041.db2.gz PDNWUKAPIJGLRP-SECBINFHSA-N -1 3 387.447 -1.049 20 0 GAADHM NS(=O)(=O)C[C@@H]1CCCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001581907079 1075839039 /nfs/dbraw/zinc/83/90/39/1075839039.db2.gz PDNWUKAPIJGLRP-SECBINFHSA-N -1 3 387.447 -1.049 20 0 GAADHM NS(=O)(=O)C[C@H]1CCCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001581907080 1075838847 /nfs/dbraw/zinc/83/88/47/1075838847.db2.gz PDNWUKAPIJGLRP-VIFPVBQESA-N -1 3 387.447 -1.049 20 0 GAADHM NS(=O)(=O)C[C@H]1CCCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001581907080 1075838842 /nfs/dbraw/zinc/83/88/42/1075838842.db2.gz PDNWUKAPIJGLRP-VIFPVBQESA-N -1 3 387.447 -1.049 20 0 GAADHM NS(=O)(=O)CCCC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]21 ZINC001581907170 1075838966 /nfs/dbraw/zinc/83/89/66/1075838966.db2.gz SISCEPSENBIRBZ-YABSGUDNSA-N -1 3 392.445 -1.119 20 0 GAADHM NS(=O)(=O)CCCC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]21 ZINC001581907170 1075838960 /nfs/dbraw/zinc/83/89/60/1075838960.db2.gz SISCEPSENBIRBZ-YABSGUDNSA-N -1 3 392.445 -1.119 20 0 GAADHM NS(=O)(=O)CCCC(=O)N[C@@H]1[C@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]21 ZINC001581907214 1075839019 /nfs/dbraw/zinc/83/90/19/1075839019.db2.gz VFPNKTVIOQXPEE-PJXYFTJBSA-N -1 3 392.445 -1.119 20 0 GAADHM NS(=O)(=O)CCCC(=O)N[C@@H]1[C@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]21 ZINC001581907214 1075839014 /nfs/dbraw/zinc/83/90/14/1075839014.db2.gz VFPNKTVIOQXPEE-PJXYFTJBSA-N -1 3 392.445 -1.119 20 0 GAADHM NS(=O)(=O)C1CN(S(=O)(=O)c2c(F)cc(-c3nn[n-]n3)cc2F)C1 ZINC001581907251 1075838812 /nfs/dbraw/zinc/83/88/12/1075838812.db2.gz WMTPVSSXMJQURA-UHFFFAOYSA-N -1 3 380.358 -1.194 20 0 GAADHM NS(=O)(=O)C1CN(S(=O)(=O)c2c(F)cc(-c3nnn[n-]3)cc2F)C1 ZINC001581907251 1075838809 /nfs/dbraw/zinc/83/88/09/1075838809.db2.gz WMTPVSSXMJQURA-UHFFFAOYSA-N -1 3 380.358 -1.194 20 0 GAADHM NS(=O)(=O)CCCNC(=O)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001581907258 1075838873 /nfs/dbraw/zinc/83/88/73/1075838873.db2.gz WRIXEVMFLKPXNX-UHFFFAOYSA-N -1 3 395.449 -1.228 20 0 GAADHM NS(=O)(=O)CCCNC(=O)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001581907258 1075838870 /nfs/dbraw/zinc/83/88/70/1075838870.db2.gz WRIXEVMFLKPXNX-UHFFFAOYSA-N -1 3 395.449 -1.228 20 0 GAADHM NS(=O)(=O)CCCC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]21 ZINC001581907338 1075838860 /nfs/dbraw/zinc/83/88/60/1075838860.db2.gz YWEYWJHCKAYWAO-YABSGUDNSA-N -1 3 392.445 -1.119 20 0 GAADHM NS(=O)(=O)CCCC(=O)N[C@@H]1[C@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@H]21 ZINC001581907338 1075838854 /nfs/dbraw/zinc/83/88/54/1075838854.db2.gz YWEYWJHCKAYWAO-YABSGUDNSA-N -1 3 392.445 -1.119 20 0 GAADHM NS(=O)(=O)CCN1CCN(C[C@H](O)c2cccc(-c3nn[n-]n3)c2)CC1 ZINC001581907344 1075839000 /nfs/dbraw/zinc/83/90/00/1075839000.db2.gz ZABKSPFMRDDVPY-AWEZNQCLSA-N -1 3 381.462 -1.194 20 0 GAADHM NS(=O)(=O)CCN1CCN(C[C@@H](O)c2cccc(-c3nn[n-]n3)c2)CC1 ZINC001581907345 1075838902 /nfs/dbraw/zinc/83/89/02/1075838902.db2.gz ZABKSPFMRDDVPY-CQSZACIVSA-N -1 3 381.462 -1.194 20 0 GAADHM NS(=O)(=O)NC1CN(C(=O)[C@H]2CCCN2c2ccc(-c3nn[n-]n3)cc2)C1 ZINC001581907536 1075838928 /nfs/dbraw/zinc/83/89/28/1075838928.db2.gz COTVJIUKPLFRTQ-CYBMUJFWSA-N -1 3 392.445 -1.161 20 0 GAADHM NS(=O)(=O)NC1CN(C(=O)[C@@H]2CCCN2c2ccc(-c3nn[n-]n3)cc2)C1 ZINC001581907537 1075838834 /nfs/dbraw/zinc/83/88/34/1075838834.db2.gz COTVJIUKPLFRTQ-ZDUSSCGKSA-N -1 3 392.445 -1.161 20 0 GAADHM NS(=O)(=O)N1CCC(NS(=O)(=O)c2ccccc2-c2nn[n-]n2)CC1 ZINC001581907609 1075839316 /nfs/dbraw/zinc/83/93/16/1075839316.db2.gz HIECGABODGSRKD-UHFFFAOYSA-N -1 3 387.447 -1.187 20 0 GAADHM NS(=O)(=O)N1CCC(NS(=O)(=O)c2ccccc2-c2nnn[n-]2)CC1 ZINC001581907609 1075839311 /nfs/dbraw/zinc/83/93/11/1075839311.db2.gz HIECGABODGSRKD-UHFFFAOYSA-N -1 3 387.447 -1.187 20 0 GAADHM NS(=O)(=O)NC1CN(C(=O)c2ccn(-c3cccc(-c4nn[n-]n4)c3)n2)C1 ZINC001581907781 1075839241 /nfs/dbraw/zinc/83/92/41/1075839241.db2.gz QBWRGUUYXSAKJE-UHFFFAOYSA-N -1 3 389.401 -1.330 20 0 GAADHM NS(=O)(=O)NC1CN(C(=O)c2ccn(-c3cccc(-c4nnn[n-]4)c3)n2)C1 ZINC001581907781 1075839237 /nfs/dbraw/zinc/83/92/37/1075839237.db2.gz QBWRGUUYXSAKJE-UHFFFAOYSA-N -1 3 389.401 -1.330 20 0 GAADHM NS(=O)(=O)N1CCC(NC(=O)[C@H](O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001581907813 1075839381 /nfs/dbraw/zinc/83/93/81/1075839381.db2.gz RTEJAHZYEBLPCC-GFCCVEGCSA-N -1 3 381.418 -1.316 20 0 GAADHM NS(=O)(=O)N1CCC(NC(=O)[C@H](O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001581907813 1075839377 /nfs/dbraw/zinc/83/93/77/1075839377.db2.gz RTEJAHZYEBLPCC-GFCCVEGCSA-N -1 3 381.418 -1.316 20 0 GAADHM NS(=O)(=O)N1CCC(NC(=O)[C@@H](O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001581907814 1075839256 /nfs/dbraw/zinc/83/92/56/1075839256.db2.gz RTEJAHZYEBLPCC-LBPRGKRZSA-N -1 3 381.418 -1.316 20 0 GAADHM NS(=O)(=O)N1CCC(NC(=O)[C@@H](O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001581907814 1075839250 /nfs/dbraw/zinc/83/92/50/1075839250.db2.gz RTEJAHZYEBLPCC-LBPRGKRZSA-N -1 3 381.418 -1.316 20 0 GAADHM NS(=O)(=O)N1CCC(NS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001581907906 1075839468 /nfs/dbraw/zinc/83/94/68/1075839468.db2.gz XFRWVMDOZCFODL-UHFFFAOYSA-N -1 3 387.447 -1.187 20 0 GAADHM NS(=O)(=O)N1CCC(NS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001581907906 1075839460 /nfs/dbraw/zinc/83/94/60/1075839460.db2.gz XFRWVMDOZCFODL-UHFFFAOYSA-N -1 3 387.447 -1.187 20 0 GAADHM O=C([C@@H](O)c1ccc(-c2nn[n-]n2)cc1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001581914239 1075839421 /nfs/dbraw/zinc/83/94/21/1075839421.db2.gz CCRPVLREOHWERM-NEPJUHHUSA-N -1 3 379.402 -1.739 20 0 GAADHM O=C([C@@H](O)c1ccc(-c2nnn[n-]2)cc1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001581914239 1075839419 /nfs/dbraw/zinc/83/94/19/1075839419.db2.gz CCRPVLREOHWERM-NEPJUHHUSA-N -1 3 379.402 -1.739 20 0 GAADHM O=C([C@H](O)c1ccc(-c2nn[n-]n2)cc1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001581914240 1075839270 /nfs/dbraw/zinc/83/92/70/1075839270.db2.gz CCRPVLREOHWERM-NWDGAFQWSA-N -1 3 379.402 -1.739 20 0 GAADHM O=C([C@H](O)c1ccc(-c2nnn[n-]2)cc1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001581914240 1075839263 /nfs/dbraw/zinc/83/92/63/1075839263.db2.gz CCRPVLREOHWERM-NWDGAFQWSA-N -1 3 379.402 -1.739 20 0 GAADHM O=C([C@@H](O)c1ccc(-c2nn[n-]n2)cc1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001581914241 1075839397 /nfs/dbraw/zinc/83/93/97/1075839397.db2.gz CCRPVLREOHWERM-RYUDHWBXSA-N -1 3 379.402 -1.739 20 0 GAADHM O=C([C@@H](O)c1ccc(-c2nnn[n-]2)cc1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001581914241 1075839393 /nfs/dbraw/zinc/83/93/93/1075839393.db2.gz CCRPVLREOHWERM-RYUDHWBXSA-N -1 3 379.402 -1.739 20 0 GAADHM O=C([C@H](O)c1ccc(-c2nn[n-]n2)cc1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001581914242 1075839228 /nfs/dbraw/zinc/83/92/28/1075839228.db2.gz CCRPVLREOHWERM-VXGBXAGGSA-N -1 3 379.402 -1.739 20 0 GAADHM O=C([C@H](O)c1ccc(-c2nnn[n-]2)cc1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001581914242 1075839221 /nfs/dbraw/zinc/83/92/21/1075839221.db2.gz CCRPVLREOHWERM-VXGBXAGGSA-N -1 3 379.402 -1.739 20 0 GAADHM O=C(C1=C[C@@H](O)[C@@H](O)[C@H](O)C1)N1CCN(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001581917540 1075839208 /nfs/dbraw/zinc/83/92/08/1075839208.db2.gz FUMSYLHKEIVPIC-BZUAXINKSA-N -1 3 386.412 -1.072 20 0 GAADHM O=C(C1=NN(CCO)C(=O)CC1)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001581917827 1075839451 /nfs/dbraw/zinc/83/94/51/1075839451.db2.gz QUNQLQJEJWPURS-UHFFFAOYSA-N -1 3 399.415 -1.119 20 0 GAADHM O=C(C1=NN(CCO)C(=O)CC1)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001581917827 1075839444 /nfs/dbraw/zinc/83/94/44/1075839444.db2.gz QUNQLQJEJWPURS-UHFFFAOYSA-N -1 3 399.415 -1.119 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CC[C@@H](Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001581947099 1075840301 /nfs/dbraw/zinc/84/03/01/1075840301.db2.gz DNQHYFXVGIMZDJ-GHMZBOCLSA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CC[C@@H](Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001581947099 1075840299 /nfs/dbraw/zinc/84/02/99/1075840299.db2.gz DNQHYFXVGIMZDJ-GHMZBOCLSA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CC[C@@H](Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001581947101 1075840292 /nfs/dbraw/zinc/84/02/92/1075840292.db2.gz DNQHYFXVGIMZDJ-MNOVXSKESA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CC[C@@H](Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001581947101 1075840289 /nfs/dbraw/zinc/84/02/89/1075840289.db2.gz DNQHYFXVGIMZDJ-MNOVXSKESA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CC[C@H](Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001581947103 1075840172 /nfs/dbraw/zinc/84/01/72/1075840172.db2.gz DNQHYFXVGIMZDJ-QWRGUYRKSA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CC[C@H](Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001581947103 1075840168 /nfs/dbraw/zinc/84/01/68/1075840168.db2.gz DNQHYFXVGIMZDJ-QWRGUYRKSA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CC[C@H](Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001581947105 1075840203 /nfs/dbraw/zinc/84/02/03/1075840203.db2.gz DNQHYFXVGIMZDJ-WDEREUQCSA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CC[C@H](Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001581947105 1075840201 /nfs/dbraw/zinc/84/02/01/1075840201.db2.gz DNQHYFXVGIMZDJ-WDEREUQCSA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CC[C@H](Nc2ncccc2-c2nn[n-]n2)C1 ZINC001581947118 1075840091 /nfs/dbraw/zinc/84/00/91/1075840091.db2.gz DPXLRYKRJFSSMS-GXSJLCMTSA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CC[C@H](Nc2ncccc2-c2nnn[n-]2)C1 ZINC001581947118 1075840086 /nfs/dbraw/zinc/84/00/86/1075840086.db2.gz DPXLRYKRJFSSMS-GXSJLCMTSA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CC[C@@H](Nc2ncccc2-c2nn[n-]n2)C1 ZINC001581947119 1075840579 /nfs/dbraw/zinc/84/05/79/1075840579.db2.gz DPXLRYKRJFSSMS-KOLCDFICSA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CC[C@@H](Nc2ncccc2-c2nnn[n-]2)C1 ZINC001581947119 1075840578 /nfs/dbraw/zinc/84/05/78/1075840578.db2.gz DPXLRYKRJFSSMS-KOLCDFICSA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CC[C@@H](Nc2ncccc2-c2nn[n-]n2)C1 ZINC001581947120 1075840452 /nfs/dbraw/zinc/84/04/52/1075840452.db2.gz DPXLRYKRJFSSMS-MWLCHTKSSA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CC[C@@H](Nc2ncccc2-c2nnn[n-]2)C1 ZINC001581947120 1075840445 /nfs/dbraw/zinc/84/04/45/1075840445.db2.gz DPXLRYKRJFSSMS-MWLCHTKSSA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CC[C@H](Nc2ncccc2-c2nn[n-]n2)C1 ZINC001581947121 1075840586 /nfs/dbraw/zinc/84/05/86/1075840586.db2.gz DPXLRYKRJFSSMS-ONGXEEELSA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CC[C@H](Nc2ncccc2-c2nnn[n-]2)C1 ZINC001581947121 1075840585 /nfs/dbraw/zinc/84/05/85/1075840585.db2.gz DPXLRYKRJFSSMS-ONGXEEELSA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001581947460 1075840602 /nfs/dbraw/zinc/84/06/02/1075840602.db2.gz LTCBDDIHIRKLLX-LLVKDONJSA-N -1 3 378.418 -1.398 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001581947460 1075840599 /nfs/dbraw/zinc/84/05/99/1075840599.db2.gz LTCBDDIHIRKLLX-LLVKDONJSA-N -1 3 378.418 -1.398 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001581947461 1075840516 /nfs/dbraw/zinc/84/05/16/1075840516.db2.gz LTCBDDIHIRKLLX-NSHDSACASA-N -1 3 378.418 -1.398 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001581947461 1075840509 /nfs/dbraw/zinc/84/05/09/1075840509.db2.gz LTCBDDIHIRKLLX-NSHDSACASA-N -1 3 378.418 -1.398 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nn[n-]n2)cn1 ZINC001581947667 1075840566 /nfs/dbraw/zinc/84/05/66/1075840566.db2.gz CEPXFYFDRAUDPW-SDDRHHMPSA-N -1 3 390.429 -1.257 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nnn[n-]2)cn1 ZINC001581947667 1075840560 /nfs/dbraw/zinc/84/05/60/1075840560.db2.gz CEPXFYFDRAUDPW-SDDRHHMPSA-N -1 3 390.429 -1.257 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nn[n-]n2)cn1 ZINC001581947670 1075840555 /nfs/dbraw/zinc/84/05/55/1075840555.db2.gz CEPXFYFDRAUDPW-SRVKXCTJSA-N -1 3 390.429 -1.257 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nnn[n-]2)cn1 ZINC001581947670 1075840551 /nfs/dbraw/zinc/84/05/51/1075840551.db2.gz CEPXFYFDRAUDPW-SRVKXCTJSA-N -1 3 390.429 -1.257 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001581948199 1075840897 /nfs/dbraw/zinc/84/08/97/1075840897.db2.gz UPCVTSDBQDHXDJ-LLVKDONJSA-N -1 3 378.418 -1.398 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001581948199 1075840891 /nfs/dbraw/zinc/84/08/91/1075840891.db2.gz UPCVTSDBQDHXDJ-LLVKDONJSA-N -1 3 378.418 -1.398 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001581948201 1075840943 /nfs/dbraw/zinc/84/09/43/1075840943.db2.gz UPCVTSDBQDHXDJ-NSHDSACASA-N -1 3 378.418 -1.398 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001581948201 1075840937 /nfs/dbraw/zinc/84/09/37/1075840937.db2.gz UPCVTSDBQDHXDJ-NSHDSACASA-N -1 3 378.418 -1.398 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CCCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001581948292 1075841249 /nfs/dbraw/zinc/84/12/49/1075841249.db2.gz YPEKPWYWSPNAOP-GFCCVEGCSA-N -1 3 392.445 -1.008 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CCCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001581948292 1075841246 /nfs/dbraw/zinc/84/12/46/1075841246.db2.gz YPEKPWYWSPNAOP-GFCCVEGCSA-N -1 3 392.445 -1.008 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CCCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001581948293 1075841322 /nfs/dbraw/zinc/84/13/22/1075841322.db2.gz YPEKPWYWSPNAOP-LBPRGKRZSA-N -1 3 392.445 -1.008 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CCCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001581948293 1075841320 /nfs/dbraw/zinc/84/13/20/1075841320.db2.gz YPEKPWYWSPNAOP-LBPRGKRZSA-N -1 3 392.445 -1.008 20 0 GAADHM O=C(C1CN([C@H]2CCOC2)C1)N1CC(n2cc(-c3nn[n-]n3)c(=O)[nH]c2=O)C1 ZINC001581950154 1075842406 /nfs/dbraw/zinc/84/24/06/1075842406.db2.gz VCCBONGSZZJWAJ-JTQLQIEISA-N -1 3 388.388 -1.767 20 0 GAADHM O=C(C1CN([C@@H]2CCOC2)C1)N1CC(n2cc(-c3nn[n-]n3)c(=O)[nH]c2=O)C1 ZINC001581950155 1075842558 /nfs/dbraw/zinc/84/25/58/1075842558.db2.gz VCCBONGSZZJWAJ-SNVBAGLBSA-N -1 3 388.388 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DZWNWERLIKIPGQ-UHFFFAOYSA-N -1 3 375.389 -1.197 20 0 GAADHM O=C(CC1(O)CCC1)NCC1(O)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001581963561 1075843638 /nfs/dbraw/zinc/84/36/38/1075843638.db2.gz DZWNWERLIKIPGQ-UHFFFAOYSA-N -1 3 375.389 -1.197 20 0 GAADHM O=C(CC1(O)CCC1)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O ZINC001581963624 1075843472 /nfs/dbraw/zinc/84/34/72/1075843472.db2.gz HDHBXVKFKCEVBB-NEPJUHHUSA-N -1 3 375.389 -1.199 20 0 GAADHM O=C(CC1(O)CCC1)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O ZINC001581963624 1075843470 /nfs/dbraw/zinc/84/34/70/1075843470.db2.gz HDHBXVKFKCEVBB-NEPJUHHUSA-N -1 3 375.389 -1.199 20 0 GAADHM O=C(CC1(O)CCC1)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O ZINC001581963632 1075843863 /nfs/dbraw/zinc/84/38/63/1075843863.db2.gz HJKUZSOJCMYGJY-VXGBXAGGSA-N -1 3 375.389 -1.199 20 0 GAADHM O=C(CC1(O)CCC1)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O ZINC001581963632 1075843859 /nfs/dbraw/zinc/84/38/59/1075843859.db2.gz HJKUZSOJCMYGJY-VXGBXAGGSA-N -1 3 375.389 -1.199 20 0 GAADHM O=C(CC1(O)CCC1)NCC1(O)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581963870 1075843846 /nfs/dbraw/zinc/84/38/46/1075843846.db2.gz LBDFSMPDNSELCZ-UHFFFAOYSA-N -1 3 375.389 -1.197 20 0 GAADHM O=C(CC1(O)CCC1)NCC1(O)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581963870 1075843842 /nfs/dbraw/zinc/84/38/42/1075843842.db2.gz LBDFSMPDNSELCZ-UHFFFAOYSA-N -1 3 375.389 -1.197 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)NC[C@H]1CCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581965769 1075843816 /nfs/dbraw/zinc/84/38/16/1075843816.db2.gz QGRSWQKIDCMALB-PSASIEDQSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)NC[C@H]1CCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581965769 1075843811 /nfs/dbraw/zinc/84/38/11/1075843811.db2.gz QGRSWQKIDCMALB-PSASIEDQSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)NC[C@@H]1CCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581965771 1075843946 /nfs/dbraw/zinc/84/39/46/1075843946.db2.gz QGRSWQKIDCMALB-SCZZXKLOSA-N -1 3 386.372 -1.422 20 0 GAADHM 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O=C(C[C@@H]1CCC(=O)N1)NC[C@H](O)CNc1ncc(-c2nn[n-]n2)cc1F ZINC001581973844 1075844138 /nfs/dbraw/zinc/84/41/38/1075844138.db2.gz LYXINPISXNJENK-UWVGGRQHSA-N -1 3 378.368 -1.042 20 0 GAADHM O=C(C[C@@H]1CCC(=O)N1)NC[C@H](O)CNc1ncc(-c2nnn[n-]2)cc1F ZINC001581973844 1075844136 /nfs/dbraw/zinc/84/41/36/1075844136.db2.gz LYXINPISXNJENK-UWVGGRQHSA-N -1 3 378.368 -1.042 20 0 GAADHM O=C(C[C@@H]1CCC(=O)N1)NC[C@@H](O)CNc1ncc(-c2nn[n-]n2)cc1F ZINC001581973845 1075844167 /nfs/dbraw/zinc/84/41/67/1075844167.db2.gz LYXINPISXNJENK-VHSXEESVSA-N -1 3 378.368 -1.042 20 0 GAADHM O=C(C[C@@H]1CCC(=O)N1)NC[C@@H](O)CNc1ncc(-c2nnn[n-]2)cc1F ZINC001581973845 1075844162 /nfs/dbraw/zinc/84/41/62/1075844162.db2.gz LYXINPISXNJENK-VHSXEESVSA-N -1 3 378.368 -1.042 20 0 GAADHM O=C(C[C@H]1CCC(=O)N1)NC[C@H](O)CNc1ncc(-c2nn[n-]n2)cc1F ZINC001581973846 1075844307 /nfs/dbraw/zinc/84/43/07/1075844307.db2.gz LYXINPISXNJENK-ZJUUUORDSA-N -1 3 378.368 -1.042 20 0 GAADHM O=C(C[C@H]1CCC(=O)N1)NC[C@H](O)CNc1ncc(-c2nnn[n-]2)cc1F ZINC001581973846 1075844301 /nfs/dbraw/zinc/84/43/01/1075844301.db2.gz LYXINPISXNJENK-ZJUUUORDSA-N -1 3 378.368 -1.042 20 0 GAADHM O=C(C[C@@H]1CCC(=O)N1)NCC1(O)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581973953 1075844516 /nfs/dbraw/zinc/84/45/16/1075844516.db2.gz NYKNJQVSYDYFDJ-JTQLQIEISA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(C[C@@H]1CCC(=O)N1)NCC1(O)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581973953 1075844508 /nfs/dbraw/zinc/84/45/08/1075844508.db2.gz NYKNJQVSYDYFDJ-JTQLQIEISA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(C[C@H]1CCC(=O)N1)NCC1(O)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001581973954 1075844688 /nfs/dbraw/zinc/84/46/88/1075844688.db2.gz NYKNJQVSYDYFDJ-SNVBAGLBSA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(C[C@H]1CCC(=O)N1)NCC1(O)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001581973954 1075844684 /nfs/dbraw/zinc/84/46/84/1075844684.db2.gz NYKNJQVSYDYFDJ-SNVBAGLBSA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(C[C@@H]1CCC(=O)N1)NC[C@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001581974323 1075844618 /nfs/dbraw/zinc/84/46/18/1075844618.db2.gz WJROAHHRPHVPKT-APPDUMDISA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(C[C@@H]1CCC(=O)N1)NC[C@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001581974323 1075844616 /nfs/dbraw/zinc/84/46/16/1075844616.db2.gz WJROAHHRPHVPKT-APPDUMDISA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(C[C@H]1CCC(=O)N1)NC[C@@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001581974324 1075844713 /nfs/dbraw/zinc/84/47/13/1075844713.db2.gz WJROAHHRPHVPKT-DIFFPNOSSA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(C[C@H]1CCC(=O)N1)NC[C@@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001581974324 1075844710 /nfs/dbraw/zinc/84/47/10/1075844710.db2.gz WJROAHHRPHVPKT-DIFFPNOSSA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(C[C@@H]1CCC(=O)N1)NC[C@@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001581974325 1075844705 /nfs/dbraw/zinc/84/47/05/1075844705.db2.gz WJROAHHRPHVPKT-GTNSWQLSSA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(C[C@@H]1CCC(=O)N1)NC[C@@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001581974325 1075844701 /nfs/dbraw/zinc/84/47/01/1075844701.db2.gz WJROAHHRPHVPKT-GTNSWQLSSA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(C[C@H]1CCC(=O)N1)NC[C@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001581974326 1075844695 /nfs/dbraw/zinc/84/46/95/1075844695.db2.gz WJROAHHRPHVPKT-PIGZYNQJSA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(C[C@H]1CCC(=O)N1)NC[C@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001581974326 1075844693 /nfs/dbraw/zinc/84/46/93/1075844693.db2.gz WJROAHHRPHVPKT-PIGZYNQJSA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(C[C@@H]1CCC(=O)N1)NC[C@]1(O)CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001581974405 1075844491 /nfs/dbraw/zinc/84/44/91/1075844491.db2.gz YHTXOXHNYNGUCW-APPDUMDISA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(C[C@@H]1CCC(=O)N1)NC[C@]1(O)CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001581974405 1075844484 /nfs/dbraw/zinc/84/44/84/1075844484.db2.gz YHTXOXHNYNGUCW-APPDUMDISA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(C[C@H]1CCC(=O)N1)NC[C@@]1(O)CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001581974406 1075844666 /nfs/dbraw/zinc/84/46/66/1075844666.db2.gz YHTXOXHNYNGUCW-DIFFPNOSSA-N -1 3 386.416 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O=C(C[C@H]1CCC(=O)N1)NCCN(CCO)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581975656 1075845341 /nfs/dbraw/zinc/84/53/41/1075845341.db2.gz LIIXSHMQWOBWKL-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(C[C@H]1CCC(=O)N1)NCCN(CCO)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581975656 1075845338 /nfs/dbraw/zinc/84/53/38/1075845338.db2.gz LIIXSHMQWOBWKL-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(C[C@@H]1CCC(=O)N1)NCCN(CCO)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001581975657 1075845357 /nfs/dbraw/zinc/84/53/57/1075845357.db2.gz LIIXSHMQWOBWKL-NSHDSACASA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(C[C@@H]1CCC(=O)N1)NCCN(CCO)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001581975657 1075845351 /nfs/dbraw/zinc/84/53/51/1075845351.db2.gz LIIXSHMQWOBWKL-NSHDSACASA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(C[C@@H]1CCC(=O)N1)NCCN(CCO)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581975690 1075845301 /nfs/dbraw/zinc/84/53/01/1075845301.db2.gz MEBCFTXRIPAJRJ-JTQLQIEISA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(C[C@@H]1CCC(=O)N1)NCCN(CCO)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581975690 1075845296 /nfs/dbraw/zinc/84/52/96/1075845296.db2.gz MEBCFTXRIPAJRJ-JTQLQIEISA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(C[C@H]1CCC(=O)N1)NCCN(CCO)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001581975691 1075845510 /nfs/dbraw/zinc/84/55/10/1075845510.db2.gz MEBCFTXRIPAJRJ-SNVBAGLBSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(C[C@H]1CCC(=O)N1)NCCN(CCO)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001581975691 1075845507 /nfs/dbraw/zinc/84/55/07/1075845507.db2.gz MEBCFTXRIPAJRJ-SNVBAGLBSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(C[C@H]1CCC(=O)N1)NCCN(CCO)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581976626 1075845454 /nfs/dbraw/zinc/84/54/54/1075845454.db2.gz ZEVAGNDMSOYLOK-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(C[C@H]1CCC(=O)N1)NCCN(CCO)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581976626 1075845450 /nfs/dbraw/zinc/84/54/50/1075845450.db2.gz ZEVAGNDMSOYLOK-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(C[C@@H]1CCC(=O)N1)NCCN(CCO)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001581976627 1075845373 /nfs/dbraw/zinc/84/53/73/1075845373.db2.gz ZEVAGNDMSOYLOK-NSHDSACASA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(C[C@@H]1CCC(=O)N1)NCCN(CCO)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001581976627 1075845370 /nfs/dbraw/zinc/84/53/70/1075845370.db2.gz ZEVAGNDMSOYLOK-NSHDSACASA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(C[C@@H]1CCNC1=O)NC[C@]1(O)CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001581996316 1075845419 /nfs/dbraw/zinc/84/54/19/1075845419.db2.gz BBDFGOZXCNTBMU-APPDUMDISA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(C[C@@H]1CCNC1=O)NC[C@]1(O)CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001581996316 1075845413 /nfs/dbraw/zinc/84/54/13/1075845413.db2.gz BBDFGOZXCNTBMU-APPDUMDISA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(C[C@H]1CCNC1=O)NC[C@@]1(O)CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001581996317 1075845698 /nfs/dbraw/zinc/84/56/98/1075845698.db2.gz BBDFGOZXCNTBMU-DIFFPNOSSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(C[C@H]1CCNC1=O)NC[C@@]1(O)CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001581996317 1075845691 /nfs/dbraw/zinc/84/56/91/1075845691.db2.gz BBDFGOZXCNTBMU-DIFFPNOSSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(C[C@@H]1CCNC1=O)NC[C@@]1(O)CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001581996318 1075845877 /nfs/dbraw/zinc/84/58/77/1075845877.db2.gz BBDFGOZXCNTBMU-GTNSWQLSSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(C[C@@H]1CCNC1=O)NC[C@@]1(O)CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001581996318 1075845873 /nfs/dbraw/zinc/84/58/73/1075845873.db2.gz BBDFGOZXCNTBMU-GTNSWQLSSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(C[C@H]1CCNC1=O)NC[C@]1(O)CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001581996319 1075845793 /nfs/dbraw/zinc/84/57/93/1075845793.db2.gz BBDFGOZXCNTBMU-PIGZYNQJSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(C[C@H]1CCNC1=O)NC[C@]1(O)CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001581996319 1075845789 /nfs/dbraw/zinc/84/57/89/1075845789.db2.gz BBDFGOZXCNTBMU-PIGZYNQJSA-N -1 3 386.416 -1.155 20 0 GAADHM 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/nfs/dbraw/zinc/85/07/29/1075850729.db2.gz FNJYVTUXTGADGE-NEPJUHHUSA-N -1 3 391.388 -1.351 20 0 GAADHM O=C(CC1OCCCO1)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O ZINC001582010432 1075850634 /nfs/dbraw/zinc/85/06/34/1075850634.db2.gz GHJQZTCTUPPWBI-NEPJUHHUSA-N -1 3 391.388 -1.351 20 0 GAADHM O=C(CC1OCCCO1)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O ZINC001582010432 1075850630 /nfs/dbraw/zinc/85/06/30/1075850630.db2.gz GHJQZTCTUPPWBI-NEPJUHHUSA-N -1 3 391.388 -1.351 20 0 GAADHM O=C(CC1OCCCO1)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O ZINC001582010433 1075850903 /nfs/dbraw/zinc/85/09/03/1075850903.db2.gz GHJQZTCTUPPWBI-VXGBXAGGSA-N -1 3 391.388 -1.351 20 0 GAADHM O=C(CC1OCCCO1)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O ZINC001582010433 1075850898 /nfs/dbraw/zinc/85/08/98/1075850898.db2.gz GHJQZTCTUPPWBI-VXGBXAGGSA-N -1 3 391.388 -1.351 20 0 GAADHM O=C(CC1OCCCO1)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O ZINC001582010716 1075850707 /nfs/dbraw/zinc/85/07/07/1075850707.db2.gz SJBNUWGTHSFRRO-NEPJUHHUSA-N -1 3 391.388 -1.351 20 0 GAADHM O=C(CC1OCCCO1)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O ZINC001582010716 1075850704 /nfs/dbraw/zinc/85/07/04/1075850704.db2.gz SJBNUWGTHSFRRO-NEPJUHHUSA-N -1 3 391.388 -1.351 20 0 GAADHM O=C(CC1OCCCO1)NCC1(O)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582010966 1075850777 /nfs/dbraw/zinc/85/07/77/1075850777.db2.gz AVTGKLKZZVIULX-UHFFFAOYSA-N -1 3 391.388 -1.349 20 0 GAADHM O=C(CC1OCCCO1)NCC1(O)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582010966 1075850774 /nfs/dbraw/zinc/85/07/74/1075850774.db2.gz AVTGKLKZZVIULX-UHFFFAOYSA-N -1 3 391.388 -1.349 20 0 GAADHM O=C(CC1OCCCO1)NC[C@H](CO)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582011010 1075851120 /nfs/dbraw/zinc/85/11/20/1075851120.db2.gz CCRALSRIYASMEE-SECBINFHSA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@H](CO)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582011010 1075851116 /nfs/dbraw/zinc/85/11/16/1075851116.db2.gz CCRALSRIYASMEE-SECBINFHSA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@@H](CO)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582011011 1075851085 /nfs/dbraw/zinc/85/10/85/1075851085.db2.gz CCRALSRIYASMEE-VIFPVBQESA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@@H](CO)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582011011 1075851081 /nfs/dbraw/zinc/85/10/81/1075851081.db2.gz CCRALSRIYASMEE-VIFPVBQESA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NCC1(O)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582011210 1075851274 /nfs/dbraw/zinc/85/12/74/1075851274.db2.gz GHSSSDMIFQOCCG-UHFFFAOYSA-N -1 3 391.388 -1.349 20 0 GAADHM O=C(CC1OCCCO1)NCC1(O)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582011210 1075851265 /nfs/dbraw/zinc/85/12/65/1075851265.db2.gz GHSSSDMIFQOCCG-UHFFFAOYSA-N -1 3 391.388 -1.349 20 0 GAADHM O=C(CC1OCCCO1)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582011218 1075851132 /nfs/dbraw/zinc/85/11/32/1075851132.db2.gz GUDNBIGDZMYLMX-JTQLQIEISA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582011218 1075851128 /nfs/dbraw/zinc/85/11/28/1075851128.db2.gz GUDNBIGDZMYLMX-JTQLQIEISA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582011219 1075851038 /nfs/dbraw/zinc/85/10/38/1075851038.db2.gz GUDNBIGDZMYLMX-SNVBAGLBSA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582011219 1075851032 /nfs/dbraw/zinc/85/10/32/1075851032.db2.gz GUDNBIGDZMYLMX-SNVBAGLBSA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)N[C@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582011530 1075851096 /nfs/dbraw/zinc/85/10/96/1075851096.db2.gz JPGPXMRABCQWFM-JTQLQIEISA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)N[C@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582011530 1075851092 /nfs/dbraw/zinc/85/10/92/1075851092.db2.gz JPGPXMRABCQWFM-JTQLQIEISA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)N[C@@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582011531 1075851235 /nfs/dbraw/zinc/85/12/35/1075851235.db2.gz JPGPXMRABCQWFM-SNVBAGLBSA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)N[C@@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582011531 1075851228 /nfs/dbraw/zinc/85/12/28/1075851228.db2.gz JPGPXMRABCQWFM-SNVBAGLBSA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582011711 1075851109 /nfs/dbraw/zinc/85/11/09/1075851109.db2.gz MFIHAOBDGIHHNL-JTQLQIEISA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582011711 1075851105 /nfs/dbraw/zinc/85/11/05/1075851105.db2.gz MFIHAOBDGIHHNL-JTQLQIEISA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582011712 1075851070 /nfs/dbraw/zinc/85/10/70/1075851070.db2.gz MFIHAOBDGIHHNL-SNVBAGLBSA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582011712 1075851067 /nfs/dbraw/zinc/85/10/67/1075851067.db2.gz MFIHAOBDGIHHNL-SNVBAGLBSA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)N[C@@H](CO)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582011728 1075851145 /nfs/dbraw/zinc/85/11/45/1075851145.db2.gz NDYXSHQZZFTYMX-SECBINFHSA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)N[C@@H](CO)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582011728 1075851141 /nfs/dbraw/zinc/85/11/41/1075851141.db2.gz NDYXSHQZZFTYMX-SECBINFHSA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)N[C@H](CO)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582011729 1075851292 /nfs/dbraw/zinc/85/12/92/1075851292.db2.gz NDYXSHQZZFTYMX-VIFPVBQESA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)N[C@H](CO)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582011729 1075851286 /nfs/dbraw/zinc/85/12/86/1075851286.db2.gz NDYXSHQZZFTYMX-VIFPVBQESA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@@H](CO)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582011788 1075851216 /nfs/dbraw/zinc/85/12/16/1075851216.db2.gz OKGXSGOYLWKBKC-JTQLQIEISA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@@H](CO)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582011788 1075851212 /nfs/dbraw/zinc/85/12/12/1075851212.db2.gz OKGXSGOYLWKBKC-JTQLQIEISA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@H](CO)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582011793 1075851200 /nfs/dbraw/zinc/85/12/00/1075851200.db2.gz OKGXSGOYLWKBKC-SNVBAGLBSA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@H](CO)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582011793 1075851193 /nfs/dbraw/zinc/85/11/93/1075851193.db2.gz OKGXSGOYLWKBKC-SNVBAGLBSA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582012186 1075851539 /nfs/dbraw/zinc/85/15/39/1075851539.db2.gz SMEGEOCFNHPBAO-JTQLQIEISA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582012186 1075851532 /nfs/dbraw/zinc/85/15/32/1075851532.db2.gz SMEGEOCFNHPBAO-JTQLQIEISA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582012187 1075851520 /nfs/dbraw/zinc/85/15/20/1075851520.db2.gz SMEGEOCFNHPBAO-SNVBAGLBSA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582012187 1075851514 /nfs/dbraw/zinc/85/15/14/1075851514.db2.gz SMEGEOCFNHPBAO-SNVBAGLBSA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582012195 1075851603 /nfs/dbraw/zinc/85/16/03/1075851603.db2.gz SSCQVZWAKVYUGS-SECBINFHSA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582012195 1075851597 /nfs/dbraw/zinc/85/15/97/1075851597.db2.gz SSCQVZWAKVYUGS-SECBINFHSA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582012196 1075851689 /nfs/dbraw/zinc/85/16/89/1075851689.db2.gz SSCQVZWAKVYUGS-VIFPVBQESA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582012196 1075851685 /nfs/dbraw/zinc/85/16/85/1075851685.db2.gz SSCQVZWAKVYUGS-VIFPVBQESA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582012284 1075851460 /nfs/dbraw/zinc/85/14/60/1075851460.db2.gz UXUGULHSPWGLRI-JTQLQIEISA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582012284 1075851458 /nfs/dbraw/zinc/85/14/58/1075851458.db2.gz UXUGULHSPWGLRI-JTQLQIEISA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582012285 1075851432 /nfs/dbraw/zinc/85/14/32/1075851432.db2.gz UXUGULHSPWGLRI-SNVBAGLBSA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CC1OCCCO1)NC[C@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582012285 1075851429 /nfs/dbraw/zinc/85/14/29/1075851429.db2.gz UXUGULHSPWGLRI-SNVBAGLBSA-N -1 3 379.377 -1.445 20 0 GAADHM O=C(CCCn1ccnc1)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nn2)C[C@H]1O ZINC001582050687 1075851895 /nfs/dbraw/zinc/85/18/95/1075851895.db2.gz AFONOCLBMIMCGH-CHWSQXEVSA-N -1 3 384.404 -1.001 20 0 GAADHM O=C(CCCn1ccnc1)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nn2)C[C@H]1O ZINC001582050687 1075851889 /nfs/dbraw/zinc/85/18/89/1075851889.db2.gz AFONOCLBMIMCGH-CHWSQXEVSA-N -1 3 384.404 -1.001 20 0 GAADHM O=C(CCCn1ccnc1)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nn2)C[C@@H]1O ZINC001582050688 1075851990 /nfs/dbraw/zinc/85/19/90/1075851990.db2.gz AFONOCLBMIMCGH-OLZOCXBDSA-N -1 3 384.404 -1.001 20 0 GAADHM O=C(CCCn1ccnc1)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nn2)C[C@@H]1O ZINC001582050688 1075851986 /nfs/dbraw/zinc/85/19/86/1075851986.db2.gz AFONOCLBMIMCGH-OLZOCXBDSA-N -1 3 384.404 -1.001 20 0 GAADHM O=C(CCCn1ccnc1)N[C@@H]1CN(c2cnc(-c3nn[n-]n3)cn2)C[C@H]1O ZINC001582051276 1075851980 /nfs/dbraw/zinc/85/19/80/1075851980.db2.gz VPAHXLCSCLFYEC-CHWSQXEVSA-N -1 3 384.404 -1.001 20 0 GAADHM O=C(CCCn1ccnc1)N[C@@H]1CN(c2cnc(-c3nnn[n-]3)cn2)C[C@H]1O ZINC001582051276 1075851977 /nfs/dbraw/zinc/85/19/77/1075851977.db2.gz VPAHXLCSCLFYEC-CHWSQXEVSA-N -1 3 384.404 -1.001 20 0 GAADHM O=C(CCCn1ccnc1)N[C@@H]1CN(c2cnc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001582051305 1075852115 /nfs/dbraw/zinc/85/21/15/1075852115.db2.gz VPAHXLCSCLFYEC-OLZOCXBDSA-N -1 3 384.404 -1.001 20 0 GAADHM O=C(CCCn1ccnc1)N[C@@H]1CN(c2cnc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001582051305 1075852109 /nfs/dbraw/zinc/85/21/09/1075852109.db2.gz VPAHXLCSCLFYEC-OLZOCXBDSA-N -1 3 384.404 -1.001 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@H](CO)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582052129 1075851942 /nfs/dbraw/zinc/85/19/42/1075851942.db2.gz AXTMDDZOAPCDQZ-JTQLQIEISA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@H](CO)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582052129 1075851936 /nfs/dbraw/zinc/85/19/36/1075851936.db2.gz AXTMDDZOAPCDQZ-JTQLQIEISA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@@H](CO)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582052130 1075852088 /nfs/dbraw/zinc/85/20/88/1075852088.db2.gz AXTMDDZOAPCDQZ-SNVBAGLBSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@@H](CO)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582052130 1075852083 /nfs/dbraw/zinc/85/20/83/1075852083.db2.gz AXTMDDZOAPCDQZ-SNVBAGLBSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCCn1cncn1)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1O ZINC001582052217 1075852404 /nfs/dbraw/zinc/85/24/04/1075852404.db2.gz FFUDDNIOPOVQLQ-CHWSQXEVSA-N -1 3 384.404 -1.001 20 0 GAADHM O=C(CCCn1cncn1)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@H]1O ZINC001582052217 1075852399 /nfs/dbraw/zinc/85/23/99/1075852399.db2.gz FFUDDNIOPOVQLQ-CHWSQXEVSA-N -1 3 384.404 -1.001 20 0 GAADHM O=C(CCCn1cncn1)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001582052218 1075852253 /nfs/dbraw/zinc/85/22/53/1075852253.db2.gz FFUDDNIOPOVQLQ-OLZOCXBDSA-N -1 3 384.404 -1.001 20 0 GAADHM O=C(CCCn1cncn1)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001582052218 1075852247 /nfs/dbraw/zinc/85/22/47/1075852247.db2.gz FFUDDNIOPOVQLQ-OLZOCXBDSA-N -1 3 384.404 -1.001 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582052233 1075852471 /nfs/dbraw/zinc/85/24/71/1075852471.db2.gz FWWWXSQRBLGKNA-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582052233 1075852467 /nfs/dbraw/zinc/85/24/67/1075852467.db2.gz FWWWXSQRBLGKNA-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582052234 1075852363 /nfs/dbraw/zinc/85/23/63/1075852363.db2.gz FWWWXSQRBLGKNA-NSHDSACASA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582052234 1075852358 /nfs/dbraw/zinc/85/23/58/1075852358.db2.gz FWWWXSQRBLGKNA-NSHDSACASA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001582052302 1075852449 /nfs/dbraw/zinc/85/24/49/1075852449.db2.gz ISHVXOAHUBTWCD-KGLIPLIRSA-N -1 3 386.416 -1.060 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001582052302 1075852446 /nfs/dbraw/zinc/85/24/46/1075852446.db2.gz ISHVXOAHUBTWCD-KGLIPLIRSA-N -1 3 386.416 -1.060 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1O ZINC001582052321 1075852378 /nfs/dbraw/zinc/85/23/78/1075852378.db2.gz JFHRCSOJQPEQJG-CHWSQXEVSA-N -1 3 386.416 -1.060 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@H]1O ZINC001582052321 1075852374 /nfs/dbraw/zinc/85/23/74/1075852374.db2.gz JFHRCSOJQPEQJG-CHWSQXEVSA-N -1 3 386.416 -1.060 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582052508 1075852728 /nfs/dbraw/zinc/85/27/28/1075852728.db2.gz OGARXCDDSBXYSY-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582052508 1075852725 /nfs/dbraw/zinc/85/27/25/1075852725.db2.gz OGARXCDDSBXYSY-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582052509 1075852716 /nfs/dbraw/zinc/85/27/16/1075852716.db2.gz OGARXCDDSBXYSY-NSHDSACASA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582052509 1075852712 /nfs/dbraw/zinc/85/27/12/1075852712.db2.gz OGARXCDDSBXYSY-NSHDSACASA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582052526 1075852699 /nfs/dbraw/zinc/85/26/99/1075852699.db2.gz OVGCXPLBBBPONW-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582052526 1075852693 /nfs/dbraw/zinc/85/26/93/1075852693.db2.gz OVGCXPLBBBPONW-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582052527 1075852850 /nfs/dbraw/zinc/85/28/50/1075852850.db2.gz OVGCXPLBBBPONW-NSHDSACASA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582052527 1075852844 /nfs/dbraw/zinc/85/28/44/1075852844.db2.gz OVGCXPLBBBPONW-NSHDSACASA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](CO)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582052584 1075852753 /nfs/dbraw/zinc/85/27/53/1075852753.db2.gz AVNOAQXMZVIWRL-GFCCVEGCSA-N -1 3 392.420 -1.876 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](CO)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582052584 1075852748 /nfs/dbraw/zinc/85/27/48/1075852748.db2.gz AVNOAQXMZVIWRL-GFCCVEGCSA-N -1 3 392.420 -1.876 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](CO)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582052585 1075852773 /nfs/dbraw/zinc/85/27/73/1075852773.db2.gz AVNOAQXMZVIWRL-LBPRGKRZSA-N -1 3 392.420 -1.876 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](CO)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582052585 1075852765 /nfs/dbraw/zinc/85/27/65/1075852765.db2.gz AVNOAQXMZVIWRL-LBPRGKRZSA-N -1 3 392.420 -1.876 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H](CO)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582052603 1075853153 /nfs/dbraw/zinc/85/31/53/1075853153.db2.gz BKDXXAHHUSNKPY-LLVKDONJSA-N -1 3 392.420 -1.876 20 0 GAADHM O=C(CCN1CCOCC1)N[C@H](CO)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582052604 1075853146 /nfs/dbraw/zinc/85/31/46/1075853146.db2.gz BKDXXAHHUSNKPY-NSHDSACASA-N -1 3 392.420 -1.876 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1[C@H]2CN(c3cncc(-c4nn[n-]n4)n3)C[C@H]21 ZINC001582052607 1075853166 /nfs/dbraw/zinc/85/31/66/1075853166.db2.gz BLHLCEWZHFVTJU-ATCWAGBWSA-N -1 3 385.432 -1.070 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1[C@H]2CN(c3cncc(-c4nnn[n-]4)n3)C[C@H]21 ZINC001582052607 1075853164 /nfs/dbraw/zinc/85/31/64/1075853164.db2.gz BLHLCEWZHFVTJU-ATCWAGBWSA-N -1 3 385.432 -1.070 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1[C@H]2CN(c3ccnc(-c4nn[n-]n4)n3)C[C@H]21 ZINC001582052608 1075853203 /nfs/dbraw/zinc/85/32/03/1075853203.db2.gz BMYGFGJORCLSNZ-JYAVWHMHSA-N -1 3 385.432 -1.070 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1[C@H]2CN(c3nccnc3-c3nn[n-]n3)C[C@H]21 ZINC001582052619 1075853003 /nfs/dbraw/zinc/85/30/03/1075853003.db2.gz BWZVOGGRAZNXDN-IMRBUKKESA-N -1 3 385.432 -1.070 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1[C@H]2CN(c3nccnc3-c3nnn[n-]3)C[C@H]21 ZINC001582052619 1075852997 /nfs/dbraw/zinc/85/29/97/1075852997.db2.gz BWZVOGGRAZNXDN-IMRBUKKESA-N -1 3 385.432 -1.070 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2cncc(-c3nn[n-]n3)n2)C[C@H]1O ZINC001582052620 1075853110 /nfs/dbraw/zinc/85/31/10/1075853110.db2.gz CDVDOROKMYZKQT-CHWSQXEVSA-N -1 3 389.420 -1.955 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2cncc(-c3nnn[n-]3)n2)C[C@H]1O ZINC001582052620 1075853099 /nfs/dbraw/zinc/85/30/99/1075853099.db2.gz CDVDOROKMYZKQT-CHWSQXEVSA-N -1 3 389.420 -1.955 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2cncc(-c3nn[n-]n3)n2)C[C@@H]1O ZINC001582052621 1075853054 /nfs/dbraw/zinc/85/30/54/1075853054.db2.gz CDVDOROKMYZKQT-OLZOCXBDSA-N -1 3 389.420 -1.955 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2cncc(-c3nnn[n-]3)n2)C[C@@H]1O ZINC001582052621 1075853046 /nfs/dbraw/zinc/85/30/46/1075853046.db2.gz CDVDOROKMYZKQT-OLZOCXBDSA-N -1 3 389.420 -1.955 20 0 GAADHM O=C(CCN1CCOCC1)N(CCO)CCNc1cncc(-c2nn[n-]n2)n1 ZINC001582052643 1075853226 /nfs/dbraw/zinc/85/32/26/1075853226.db2.gz DLOXSEIVULGBFU-UHFFFAOYSA-N -1 3 391.436 -1.388 20 0 GAADHM O=C(CCN1CCOCC1)N(CCO)CCNc1cncc(-c2nnn[n-]2)n1 ZINC001582052643 1075853222 /nfs/dbraw/zinc/85/32/22/1075853222.db2.gz DLOXSEIVULGBFU-UHFFFAOYSA-N -1 3 391.436 -1.388 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](CO)Nc1ccnc(-c2nn[n-]n2)n1 ZINC001582052662 1075853210 /nfs/dbraw/zinc/85/32/10/1075853210.db2.gz FSOBBLCWIRMJHO-LLVKDONJSA-N -1 3 377.409 -2.310 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](CO)Nc1ccnc(-c2nn[n-]n2)n1 ZINC001582052663 1075853192 /nfs/dbraw/zinc/85/31/92/1075853192.db2.gz FSOBBLCWIRMJHO-NSHDSACASA-N -1 3 377.409 -2.310 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](CO)Nc1ncccc1-c1nn[n-]n1 ZINC001582052664 1075853027 /nfs/dbraw/zinc/85/30/27/1075853027.db2.gz FUEVWULQBBUFGV-GFCCVEGCSA-N -1 3 376.421 -1.127 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](CO)Nc1ncccc1-c1nnn[n-]1 ZINC001582052664 1075853022 /nfs/dbraw/zinc/85/30/22/1075853022.db2.gz FUEVWULQBBUFGV-GFCCVEGCSA-N -1 3 376.421 -1.127 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](CO)Nc1ncccc1-c1nn[n-]n1 ZINC001582052665 1075853077 /nfs/dbraw/zinc/85/30/77/1075853077.db2.gz FUEVWULQBBUFGV-LBPRGKRZSA-N -1 3 376.421 -1.127 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](CO)Nc1ncccc1-c1nnn[n-]1 ZINC001582052665 1075853070 /nfs/dbraw/zinc/85/30/70/1075853070.db2.gz FUEVWULQBBUFGV-LBPRGKRZSA-N -1 3 376.421 -1.127 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582052688 1075853126 /nfs/dbraw/zinc/85/31/26/1075853126.db2.gz RIVKFPOGMCADSE-JTQLQIEISA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582052688 1075853123 /nfs/dbraw/zinc/85/31/23/1075853123.db2.gz RIVKFPOGMCADSE-JTQLQIEISA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582052689 1075853159 /nfs/dbraw/zinc/85/31/59/1075853159.db2.gz RIVKFPOGMCADSE-SNVBAGLBSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582052689 1075853157 /nfs/dbraw/zinc/85/31/57/1075853157.db2.gz RIVKFPOGMCADSE-SNVBAGLBSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582052725 1075853644 /nfs/dbraw/zinc/85/36/44/1075853644.db2.gz SKKVDSHZULUTSI-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582052725 1075853639 /nfs/dbraw/zinc/85/36/39/1075853639.db2.gz SKKVDSHZULUTSI-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582052726 1075853453 /nfs/dbraw/zinc/85/34/53/1075853453.db2.gz SKKVDSHZULUTSI-NSHDSACASA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582052726 1075853448 /nfs/dbraw/zinc/85/34/48/1075853448.db2.gz SKKVDSHZULUTSI-NSHDSACASA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](CO)Nc1ccc(-c2nn[n-]n2)nn1 ZINC001582052781 1075853439 /nfs/dbraw/zinc/85/34/39/1075853439.db2.gz GKYSVTVHRVQVOI-LLVKDONJSA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](CO)Nc1ccc(-c2nnn[n-]2)nn1 ZINC001582052781 1075853435 /nfs/dbraw/zinc/85/34/35/1075853435.db2.gz GKYSVTVHRVQVOI-LLVKDONJSA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](CO)Nc1ccc(-c2nn[n-]n2)nn1 ZINC001582052782 1075853493 /nfs/dbraw/zinc/85/34/93/1075853493.db2.gz GKYSVTVHRVQVOI-NSHDSACASA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)nn1 ZINC001582052782 1075853487 /nfs/dbraw/zinc/85/34/87/1075853487.db2.gz GKYSVTVHRVQVOI-NSHDSACASA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](O)CNc1ncccc1-c1nn[n-]n1 ZINC001582052815 1075853665 /nfs/dbraw/zinc/85/36/65/1075853665.db2.gz HKYFGTZRBMBXKL-GFCCVEGCSA-N -1 3 376.421 -1.127 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](O)CNc1ncccc1-c1nnn[n-]1 ZINC001582052815 1075853662 /nfs/dbraw/zinc/85/36/62/1075853662.db2.gz HKYFGTZRBMBXKL-GFCCVEGCSA-N -1 3 376.421 -1.127 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](O)CNc1ncccc1-c1nn[n-]n1 ZINC001582052816 1075853538 /nfs/dbraw/zinc/85/35/38/1075853538.db2.gz HKYFGTZRBMBXKL-LBPRGKRZSA-N -1 3 376.421 -1.127 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](O)CNc1ncccc1-c1nnn[n-]1 ZINC001582052816 1075853535 /nfs/dbraw/zinc/85/35/35/1075853535.db2.gz HKYFGTZRBMBXKL-LBPRGKRZSA-N -1 3 376.421 -1.127 20 0 GAADHM O=C(CCN1CCOCC1)N(CCO)CCNc1ccc(-c2nn[n-]n2)nn1 ZINC001582052825 1075853473 /nfs/dbraw/zinc/85/34/73/1075853473.db2.gz HRCDFEOSUFPQRL-UHFFFAOYSA-N -1 3 391.436 -1.388 20 0 GAADHM O=C(CCN1CCOCC1)N(CCO)CCNc1ccc(-c2nnn[n-]2)nn1 ZINC001582052825 1075853469 /nfs/dbraw/zinc/85/34/69/1075853469.db2.gz HRCDFEOSUFPQRL-UHFFFAOYSA-N -1 3 391.436 -1.388 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1[C@H]2CN(c3cnc(-c4nn[n-]n4)cn3)C[C@H]21 ZINC001582052913 1075853400 /nfs/dbraw/zinc/85/34/00/1075853400.db2.gz JUVCQNITRLJBSP-ATCWAGBWSA-N -1 3 385.432 -1.070 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1[C@H]2CN(c3cnc(-c4nnn[n-]4)cn3)C[C@H]21 ZINC001582052913 1075853397 /nfs/dbraw/zinc/85/33/97/1075853397.db2.gz JUVCQNITRLJBSP-ATCWAGBWSA-N -1 3 385.432 -1.070 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1[C@H]2CN(c3ccc(-c4nn[n-]n4)nn3)C[C@H]21 ZINC001582052952 1075853580 /nfs/dbraw/zinc/85/35/80/1075853580.db2.gz KVUCZFPQMGHDMJ-ATCWAGBWSA-N -1 3 385.432 -1.070 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1[C@H]2CN(c3ccc(-c4nnn[n-]4)nn3)C[C@H]21 ZINC001582052952 1075853574 /nfs/dbraw/zinc/85/35/74/1075853574.db2.gz KVUCZFPQMGHDMJ-ATCWAGBWSA-N -1 3 385.432 -1.070 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582052959 1075853629 /nfs/dbraw/zinc/85/36/29/1075853629.db2.gz WRZCZSNHBPYXLR-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582052959 1075853624 /nfs/dbraw/zinc/85/36/24/1075853624.db2.gz WRZCZSNHBPYXLR-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582052960 1075853599 /nfs/dbraw/zinc/85/35/99/1075853599.db2.gz WRZCZSNHBPYXLR-NSHDSACASA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582052960 1075853593 /nfs/dbraw/zinc/85/35/93/1075853593.db2.gz WRZCZSNHBPYXLR-NSHDSACASA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCCn1cncn1)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O ZINC001582052983 1075853410 /nfs/dbraw/zinc/85/34/10/1075853410.db2.gz XLHBOWLKDBOALP-ZIAGYGMSSA-N -1 3 384.404 -1.001 20 0 GAADHM O=C(CCCn1cncn1)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O ZINC001582052983 1075853407 /nfs/dbraw/zinc/85/34/07/1075853407.db2.gz XLHBOWLKDBOALP-ZIAGYGMSSA-N -1 3 384.404 -1.001 20 0 GAADHM O=C(CCCn1cncn1)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@H]1O ZINC001582053001 1075853417 /nfs/dbraw/zinc/85/34/17/1075853417.db2.gz XUFAQFWTPKLNEZ-CHWSQXEVSA-N -1 3 384.404 -1.001 20 0 GAADHM O=C(CCCn1cncn1)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@H]1O ZINC001582053001 1075853415 /nfs/dbraw/zinc/85/34/15/1075853415.db2.gz XUFAQFWTPKLNEZ-CHWSQXEVSA-N -1 3 384.404 -1.001 20 0 GAADHM O=C(CCCn1cncn1)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001582053003 1075853955 /nfs/dbraw/zinc/85/39/55/1075853955.db2.gz XUFAQFWTPKLNEZ-OLZOCXBDSA-N -1 3 384.404 -1.001 20 0 GAADHM O=C(CCCn1cncn1)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001582053003 1075853951 /nfs/dbraw/zinc/85/39/51/1075853951.db2.gz XUFAQFWTPKLNEZ-OLZOCXBDSA-N -1 3 384.404 -1.001 20 0 GAADHM O=C(CCN1CCCS1(=O)=O)Nc1nc2n(c1-c1nn[n-]n1)CCOC2 ZINC001582053013 1075853850 /nfs/dbraw/zinc/85/38/50/1075853850.db2.gz MDEINFQRNAGBNK-UHFFFAOYSA-N -1 3 382.406 -1.043 20 0 GAADHM O=C(CCN1CCCS1(=O)=O)Nc1nc2n(c1-c1nnn[n-]1)CCOC2 ZINC001582053013 1075853842 /nfs/dbraw/zinc/85/38/42/1075853842.db2.gz MDEINFQRNAGBNK-UHFFFAOYSA-N -1 3 382.406 -1.043 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2ccnc(-c3nn[n-]n3)n2)C[C@@H]1O ZINC001582053056 1075853963 /nfs/dbraw/zinc/85/39/63/1075853963.db2.gz MUPGVRGBKNWVMQ-NEPJUHHUSA-N -1 3 389.420 -1.955 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2ccnc(-c3nn[n-]n3)n2)C[C@H]1O ZINC001582053057 1075853893 /nfs/dbraw/zinc/85/38/93/1075853893.db2.gz MUPGVRGBKNWVMQ-VXGBXAGGSA-N -1 3 389.420 -1.955 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@@H](CO)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582053091 1075853980 /nfs/dbraw/zinc/85/39/80/1075853980.db2.gz ZFWARPCYQFXZDJ-JTQLQIEISA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@@H](CO)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582053091 1075853976 /nfs/dbraw/zinc/85/39/76/1075853976.db2.gz ZFWARPCYQFXZDJ-JTQLQIEISA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@H](CO)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582053092 1075853810 /nfs/dbraw/zinc/85/38/10/1075853810.db2.gz ZFWARPCYQFXZDJ-SNVBAGLBSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1CCCC1=O)NC[C@H](CO)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582053092 1075853803 /nfs/dbraw/zinc/85/38/03/1075853803.db2.gz ZFWARPCYQFXZDJ-SNVBAGLBSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(CCN1C(=O)CCC1=O)NCCCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582053112 1075853926 /nfs/dbraw/zinc/85/39/26/1075853926.db2.gz ZYBMHZIWFPGLAA-UHFFFAOYSA-N -1 3 388.388 -1.030 20 0 GAADHM O=C(CCN1C(=O)CCC1=O)NCCCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582053112 1075853921 /nfs/dbraw/zinc/85/39/21/1075853921.db2.gz ZYBMHZIWFPGLAA-UHFFFAOYSA-N -1 3 388.388 -1.030 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001582053187 1075853912 /nfs/dbraw/zinc/85/39/12/1075853912.db2.gz OZKXCBRIRWNFJD-KGLIPLIRSA-N -1 3 388.432 -1.350 20 0 GAADHM O=C(CCN1CCOCC1)N(CCO)CCNc1nccnc1-c1nn[n-]n1 ZINC001582053218 1075853867 /nfs/dbraw/zinc/85/38/67/1075853867.db2.gz QBAUPUATRIOEHY-UHFFFAOYSA-N -1 3 391.436 -1.388 20 0 GAADHM O=C(CCN1CCOCC1)N(CCO)CCNc1nccnc1-c1nnn[n-]1 ZINC001582053218 1075853862 /nfs/dbraw/zinc/85/38/62/1075853862.db2.gz QBAUPUATRIOEHY-UHFFFAOYSA-N -1 3 391.436 -1.388 20 0 GAADHM O=C(CCN1CCOCC1)N(CCO)CCNc1ccnc(-c2nn[n-]n2)n1 ZINC001582053235 1075853752 /nfs/dbraw/zinc/85/37/52/1075853752.db2.gz QHFBNTYBYPBGQF-UHFFFAOYSA-N -1 3 391.436 -1.966 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2nccnc2-c2nn[n-]n2)C[C@@H]1O ZINC001582053236 1075854348 /nfs/dbraw/zinc/85/43/48/1075854348.db2.gz QHPVBIXVSBLSFH-NEPJUHHUSA-N -1 3 389.420 -1.955 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2nccnc2-c2nnn[n-]2)C[C@@H]1O ZINC001582053236 1075854346 /nfs/dbraw/zinc/85/43/46/1075854346.db2.gz QHPVBIXVSBLSFH-NEPJUHHUSA-N -1 3 389.420 -1.955 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nn2)C[C@H]1O ZINC001582053241 1075854177 /nfs/dbraw/zinc/85/41/77/1075854177.db2.gz QOYLKOHQFLDECP-CHWSQXEVSA-N -1 3 389.420 -1.955 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nn2)C[C@H]1O ZINC001582053241 1075854175 /nfs/dbraw/zinc/85/41/75/1075854175.db2.gz QOYLKOHQFLDECP-CHWSQXEVSA-N -1 3 389.420 -1.955 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nn2)C[C@@H]1O ZINC001582053242 1075854298 /nfs/dbraw/zinc/85/42/98/1075854298.db2.gz QOYLKOHQFLDECP-OLZOCXBDSA-N -1 3 389.420 -1.955 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nn2)C[C@@H]1O ZINC001582053242 1075854296 /nfs/dbraw/zinc/85/42/96/1075854296.db2.gz QOYLKOHQFLDECP-OLZOCXBDSA-N -1 3 389.420 -1.955 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@H]1O ZINC001582053259 1075854196 /nfs/dbraw/zinc/85/41/96/1075854196.db2.gz RERNNCCMLJDZRO-ZIAGYGMSSA-N -1 3 388.432 -1.350 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@H]1O ZINC001582053259 1075854194 /nfs/dbraw/zinc/85/41/94/1075854194.db2.gz RERNNCCMLJDZRO-ZIAGYGMSSA-N -1 3 388.432 -1.350 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](CO)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001582053300 1075854232 /nfs/dbraw/zinc/85/42/32/1075854232.db2.gz SMNNMFXVCICDPE-CYBMUJFWSA-N -1 3 376.421 -1.127 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](CO)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001582053300 1075854227 /nfs/dbraw/zinc/85/42/27/1075854227.db2.gz SMNNMFXVCICDPE-CYBMUJFWSA-N -1 3 376.421 -1.127 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](CO)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001582053302 1075854164 /nfs/dbraw/zinc/85/41/64/1075854164.db2.gz SMNNMFXVCICDPE-ZDUSSCGKSA-N -1 3 376.421 -1.127 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001582053302 1075854161 /nfs/dbraw/zinc/85/41/61/1075854161.db2.gz SMNNMFXVCICDPE-ZDUSSCGKSA-N -1 3 376.421 -1.127 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](O)CNc1cnc(-c2nn[n-]n2)cn1 ZINC001582053321 1075854360 /nfs/dbraw/zinc/85/43/60/1075854360.db2.gz SXIMVZLBLODMLR-LLVKDONJSA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](O)CNc1cnc(-c2nnn[n-]2)cn1 ZINC001582053321 1075854355 /nfs/dbraw/zinc/85/43/55/1075854355.db2.gz SXIMVZLBLODMLR-LLVKDONJSA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](O)CNc1cnc(-c2nn[n-]n2)cn1 ZINC001582053322 1075854249 /nfs/dbraw/zinc/85/42/49/1075854249.db2.gz SXIMVZLBLODMLR-NSHDSACASA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](O)CNc1cnc(-c2nnn[n-]2)cn1 ZINC001582053322 1075854245 /nfs/dbraw/zinc/85/42/45/1075854245.db2.gz SXIMVZLBLODMLR-NSHDSACASA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](O)CNc1ccc(-c2nn[n-]n2)nn1 ZINC001582053324 1075854331 /nfs/dbraw/zinc/85/43/31/1075854331.db2.gz TWSUEGSSNVVUEX-LLVKDONJSA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](O)CNc1ccc(-c2nnn[n-]2)nn1 ZINC001582053324 1075854329 /nfs/dbraw/zinc/85/43/29/1075854329.db2.gz TWSUEGSSNVVUEX-LLVKDONJSA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](O)CNc1ccc(-c2nn[n-]n2)nn1 ZINC001582053325 1075854216 /nfs/dbraw/zinc/85/42/16/1075854216.db2.gz TWSUEGSSNVVUEX-NSHDSACASA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](O)CNc1ccc(-c2nnn[n-]2)nn1 ZINC001582053325 1075854214 /nfs/dbraw/zinc/85/42/14/1075854214.db2.gz TWSUEGSSNVVUEX-NSHDSACASA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](CO)Nc1cncc(-c2nn[n-]n2)n1 ZINC001582053333 1075854340 /nfs/dbraw/zinc/85/43/40/1075854340.db2.gz UJAWLNPLDDGNCQ-LLVKDONJSA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](CO)Nc1cncc(-c2nnn[n-]2)n1 ZINC001582053333 1075854338 /nfs/dbraw/zinc/85/43/38/1075854338.db2.gz UJAWLNPLDDGNCQ-LLVKDONJSA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](CO)Nc1cncc(-c2nn[n-]n2)n1 ZINC001582053334 1075854284 /nfs/dbraw/zinc/85/42/84/1075854284.db2.gz UJAWLNPLDDGNCQ-NSHDSACASA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](CO)Nc1cncc(-c2nnn[n-]2)n1 ZINC001582053334 1075854279 /nfs/dbraw/zinc/85/42/79/1075854279.db2.gz UJAWLNPLDDGNCQ-NSHDSACASA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2cnc(-c3nn[n-]n3)cn2)C[C@H]1O ZINC001582053346 1075854271 /nfs/dbraw/zinc/85/42/71/1075854271.db2.gz VMYLFBXULRMMEI-CHWSQXEVSA-N -1 3 389.420 -1.955 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2cnc(-c3nnn[n-]3)cn2)C[C@H]1O ZINC001582053346 1075854269 /nfs/dbraw/zinc/85/42/69/1075854269.db2.gz VMYLFBXULRMMEI-CHWSQXEVSA-N -1 3 389.420 -1.955 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2cnc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001582053347 1075854317 /nfs/dbraw/zinc/85/43/17/1075854317.db2.gz VMYLFBXULRMMEI-OLZOCXBDSA-N -1 3 389.420 -1.955 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2cnc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001582053347 1075854312 /nfs/dbraw/zinc/85/43/12/1075854312.db2.gz VMYLFBXULRMMEI-OLZOCXBDSA-N -1 3 389.420 -1.955 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001582053379 1075854807 /nfs/dbraw/zinc/85/48/07/1075854807.db2.gz WYNPGQJWGKFGHS-CABCVRRESA-N -1 3 388.432 -1.350 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001582053379 1075854805 /nfs/dbraw/zinc/85/48/05/1075854805.db2.gz WYNPGQJWGKFGHS-CABCVRRESA-N -1 3 388.432 -1.350 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O ZINC001582053380 1075854689 /nfs/dbraw/zinc/85/46/89/1075854689.db2.gz WYNPGQJWGKFGHS-HUUCEWRRSA-N -1 3 388.432 -1.350 20 0 GAADHM O=C(CCN1CCOCC1)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O ZINC001582053380 1075854683 /nfs/dbraw/zinc/85/46/83/1075854683.db2.gz WYNPGQJWGKFGHS-HUUCEWRRSA-N -1 3 388.432 -1.350 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](O)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001582053399 1075854568 /nfs/dbraw/zinc/85/45/68/1075854568.db2.gz XWCPYPXJINNECP-CYBMUJFWSA-N -1 3 376.421 -1.127 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](O)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001582053399 1075854561 /nfs/dbraw/zinc/85/45/61/1075854561.db2.gz XWCPYPXJINNECP-CYBMUJFWSA-N -1 3 376.421 -1.127 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](O)CNc1ccc(-c2nn[n-]n2)nc1 ZINC001582053400 1075854779 /nfs/dbraw/zinc/85/47/79/1075854779.db2.gz XWCPYPXJINNECP-ZDUSSCGKSA-N -1 3 376.421 -1.127 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](O)CNc1ccc(-c2nnn[n-]2)nc1 ZINC001582053400 1075854777 /nfs/dbraw/zinc/85/47/77/1075854777.db2.gz XWCPYPXJINNECP-ZDUSSCGKSA-N -1 3 376.421 -1.127 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](O)CNc1ccnc(-c2nn[n-]n2)n1 ZINC001582053402 1075854541 /nfs/dbraw/zinc/85/45/41/1075854541.db2.gz XYQQWQYRBCHCAL-LLVKDONJSA-N -1 3 377.409 -2.310 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](O)CNc1ccnc(-c2nn[n-]n2)n1 ZINC001582053403 1075854724 /nfs/dbraw/zinc/85/47/24/1075854724.db2.gz XYQQWQYRBCHCAL-NSHDSACASA-N -1 3 377.409 -2.310 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](O)CNc1nccnc1-c1nn[n-]n1 ZINC001582053545 1075854824 /nfs/dbraw/zinc/85/48/24/1075854824.db2.gz ZFILYEPRTCVCFF-LLVKDONJSA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](O)CNc1nccnc1-c1nnn[n-]1 ZINC001582053545 1075854823 /nfs/dbraw/zinc/85/48/23/1075854823.db2.gz ZFILYEPRTCVCFF-LLVKDONJSA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](O)CNc1nccnc1-c1nn[n-]n1 ZINC001582053547 1075854662 /nfs/dbraw/zinc/85/46/62/1075854662.db2.gz ZFILYEPRTCVCFF-NSHDSACASA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](O)CNc1nccnc1-c1nnn[n-]1 ZINC001582053547 1075854656 /nfs/dbraw/zinc/85/46/56/1075854656.db2.gz ZFILYEPRTCVCFF-NSHDSACASA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](O)CNc1cncc(-c2nn[n-]n2)n1 ZINC001582053573 1075854530 /nfs/dbraw/zinc/85/45/30/1075854530.db2.gz ZVTHFERHKLSVLN-LLVKDONJSA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@H](O)CNc1cncc(-c2nnn[n-]2)n1 ZINC001582053573 1075854525 /nfs/dbraw/zinc/85/45/25/1075854525.db2.gz ZVTHFERHKLSVLN-LLVKDONJSA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](O)CNc1cncc(-c2nn[n-]n2)n1 ZINC001582053574 1075854594 /nfs/dbraw/zinc/85/45/94/1075854594.db2.gz ZVTHFERHKLSVLN-NSHDSACASA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCOCC1)NC[C@@H](O)CNc1cncc(-c2nnn[n-]2)n1 ZINC001582053574 1075854587 /nfs/dbraw/zinc/85/45/87/1075854587.db2.gz ZVTHFERHKLSVLN-NSHDSACASA-N -1 3 377.409 -1.732 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O ZINC001582053624 1075854799 /nfs/dbraw/zinc/85/47/99/1075854799.db2.gz ISHVXOAHUBTWCD-ZIAGYGMSSA-N -1 3 386.416 -1.060 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O ZINC001582053624 1075854797 /nfs/dbraw/zinc/85/47/97/1075854797.db2.gz ISHVXOAHUBTWCD-ZIAGYGMSSA-N -1 3 386.416 -1.060 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@H]1O ZINC001582053882 1075855043 /nfs/dbraw/zinc/85/50/43/1075855043.db2.gz UMSPZSGRVNFWBH-CHWSQXEVSA-N -1 3 386.416 -1.060 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@H]1O ZINC001582053882 1075855040 /nfs/dbraw/zinc/85/50/40/1075855040.db2.gz UMSPZSGRVNFWBH-CHWSQXEVSA-N -1 3 386.416 -1.060 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001582053883 1075855012 /nfs/dbraw/zinc/85/50/12/1075855012.db2.gz UMSPZSGRVNFWBH-OLZOCXBDSA-N -1 3 386.416 -1.060 20 0 GAADHM O=C(CCN1CCCC1=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001582053883 1075855008 /nfs/dbraw/zinc/85/50/08/1075855008.db2.gz UMSPZSGRVNFWBH-OLZOCXBDSA-N -1 3 386.416 -1.060 20 0 GAADHM O=C(CCNC(=O)[C@H]1CCCO1)NCCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582055030 1075854961 /nfs/dbraw/zinc/85/49/61/1075854961.db2.gz DWEWVHBKIWNYRF-GFCCVEGCSA-N -1 3 390.404 -1.274 20 0 GAADHM O=C(CCNC(=O)[C@H]1CCCO1)NCCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582055030 1075854956 /nfs/dbraw/zinc/85/49/56/1075854956.db2.gz DWEWVHBKIWNYRF-GFCCVEGCSA-N -1 3 390.404 -1.274 20 0 GAADHM O=C(CCNC(=O)[C@@H]1CCCO1)NCCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582055031 1075855077 /nfs/dbraw/zinc/85/50/77/1075855077.db2.gz DWEWVHBKIWNYRF-LBPRGKRZSA-N -1 3 390.404 -1.274 20 0 GAADHM O=C(CCNC(=O)[C@@H]1CCCO1)NCCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582055031 1075855073 /nfs/dbraw/zinc/85/50/73/1075855073.db2.gz DWEWVHBKIWNYRF-LBPRGKRZSA-N -1 3 390.404 -1.274 20 0 GAADHM O=C(CCc1cn[nH]c1)NCC1(O)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582074036 1075855779 /nfs/dbraw/zinc/85/57/79/1075855779.db2.gz GZQQXFYBPGXBOS-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM O=C(CCc1cn[nH]c1)NCC1(O)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582074036 1075855772 /nfs/dbraw/zinc/85/57/72/1075855772.db2.gz GZQQXFYBPGXBOS-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM O=C(CCc1cn[nH]c1)NCC1(O)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582074561 1075855852 /nfs/dbraw/zinc/85/58/52/1075855852.db2.gz PZACIYGNDHCTSE-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM O=C(CCc1cn[nH]c1)NCC1(O)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582074561 1075855848 /nfs/dbraw/zinc/85/58/48/1075855848.db2.gz PZACIYGNDHCTSE-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM O=C(CCc1cn[nH]c1)NCC1(O)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582074579 1075855700 /nfs/dbraw/zinc/85/57/00/1075855700.db2.gz QZDUCEKPPJNQCX-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM O=C(CCc1cn[nH]c1)NCC1(O)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582074579 1075855697 /nfs/dbraw/zinc/85/56/97/1075855697.db2.gz QZDUCEKPPJNQCX-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM O=C(CCc1cn[nH]c1)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O ZINC001582075657 1075855870 /nfs/dbraw/zinc/85/58/70/1075855870.db2.gz HKZLBHDFXHBBAM-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(CCc1cn[nH]c1)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O ZINC001582075657 1075855869 /nfs/dbraw/zinc/85/58/69/1075855869.db2.gz HKZLBHDFXHBBAM-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(CCc1cn[nH]c1)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O ZINC001582075658 1075855759 /nfs/dbraw/zinc/85/57/59/1075855759.db2.gz HKZLBHDFXHBBAM-OLZOCXBDSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(CCc1cn[nH]c1)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O ZINC001582075658 1075855751 /nfs/dbraw/zinc/85/57/51/1075855751.db2.gz HKZLBHDFXHBBAM-OLZOCXBDSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(CCc1cn[nH]c1)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O ZINC001582075869 1075855739 /nfs/dbraw/zinc/85/57/39/1075855739.db2.gz RTARAIFQPKGCTL-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(CCc1cn[nH]c1)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O ZINC001582075869 1075855734 /nfs/dbraw/zinc/85/57/34/1075855734.db2.gz RTARAIFQPKGCTL-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(CCc1cn[nH]c1)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O ZINC001582075870 1075855873 /nfs/dbraw/zinc/85/58/73/1075855873.db2.gz RTARAIFQPKGCTL-OLZOCXBDSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(CCc1cn[nH]c1)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O ZINC001582075870 1075855872 /nfs/dbraw/zinc/85/58/72/1075855872.db2.gz RTARAIFQPKGCTL-OLZOCXBDSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(CCc1cncnc1)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O ZINC001582076484 1075856223 /nfs/dbraw/zinc/85/62/23/1075856223.db2.gz BOOBNLAVQASPFU-KGLIPLIRSA-N -1 3 397.399 -1.081 20 0 GAADHM O=C(CCc1cncnc1)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O ZINC001582076484 1075856219 /nfs/dbraw/zinc/85/62/19/1075856219.db2.gz BOOBNLAVQASPFU-KGLIPLIRSA-N -1 3 397.399 -1.081 20 0 GAADHM O=C(CCn1cc(-c2nnn[n-]2)c(=O)[nH]c1=O)N1CC(N[C@@H]2CCOC2)C1 ZINC001582081097 1075857013 /nfs/dbraw/zinc/85/70/13/1075857013.db2.gz IQYWTPNSUZOBRZ-SECBINFHSA-N -1 3 376.377 -1.892 20 0 GAADHM O=C(CCn1cc(-c2nnn[n-]2)c(=O)[nH]c1=O)N1CC(N[C@H]2CCOC2)C1 ZINC001582081098 1075856993 /nfs/dbraw/zinc/85/69/93/1075856993.db2.gz IQYWTPNSUZOBRZ-VIFPVBQESA-N -1 3 376.377 -1.892 20 0 GAADHM O=C(CCc1nnc[nH]1)NC[C@H]1CN(c2ccnc(-c3nn[n-]n3)n2)CCO1 ZINC001582082081 1075857754 /nfs/dbraw/zinc/85/77/54/1075857754.db2.gz JGVIDEGQNSEMSH-JTQLQIEISA-N -1 3 385.392 -1.271 20 0 GAADHM O=C(CCc1nnc[nH]1)NC[C@H]1CN(c2ccnc(-c3nnn[n-]3)n2)CCO1 ZINC001582082081 1075857750 /nfs/dbraw/zinc/85/77/50/1075857750.db2.gz JGVIDEGQNSEMSH-JTQLQIEISA-N -1 3 385.392 -1.271 20 0 GAADHM O=C(CCc1nnc[nH]1)NC[C@@H]1CN(c2ccnc(-c3nn[n-]n3)n2)CCO1 ZINC001582082087 1075857723 /nfs/dbraw/zinc/85/77/23/1075857723.db2.gz JGVIDEGQNSEMSH-SNVBAGLBSA-N -1 3 385.392 -1.271 20 0 GAADHM O=C(CCc1nnc[nH]1)NC[C@@H]1CN(c2ccnc(-c3nnn[n-]3)n2)CCO1 ZINC001582082087 1075857718 /nfs/dbraw/zinc/85/77/18/1075857718.db2.gz JGVIDEGQNSEMSH-SNVBAGLBSA-N -1 3 385.392 -1.271 20 0 GAADHM O=C(CCc1nnc[nH]1)NC[C@H]1COCCN1c1ccnc(-c2nn[n-]n2)n1 ZINC001582082738 1075857712 /nfs/dbraw/zinc/85/77/12/1075857712.db2.gz OUYLTAGKMWVHPH-JTQLQIEISA-N -1 3 385.392 -1.271 20 0 GAADHM O=C(CCc1nnc[nH]1)NC[C@H]1COCCN1c1ccnc(-c2nnn[n-]2)n1 ZINC001582082738 1075857709 /nfs/dbraw/zinc/85/77/09/1075857709.db2.gz OUYLTAGKMWVHPH-JTQLQIEISA-N -1 3 385.392 -1.271 20 0 GAADHM O=C(CCc1nnc[nH]1)NC[C@@H]1COCCN1c1ccnc(-c2nn[n-]n2)n1 ZINC001582082742 1075857799 /nfs/dbraw/zinc/85/77/99/1075857799.db2.gz OUYLTAGKMWVHPH-SNVBAGLBSA-N -1 3 385.392 -1.271 20 0 GAADHM O=C(CCc1nnc[nH]1)NC[C@@H]1COCCN1c1ccnc(-c2nnn[n-]2)n1 ZINC001582082742 1075857796 /nfs/dbraw/zinc/85/77/96/1075857796.db2.gz OUYLTAGKMWVHPH-SNVBAGLBSA-N -1 3 385.392 -1.271 20 0 GAADHM O=C(CCn1cc(-c2nn[n-]n2)c(=O)[nH]c1=O)NCCN1CCSCC1 ZINC001582083193 1075857695 /nfs/dbraw/zinc/85/76/95/1075857695.db2.gz BITOLUDVOUKKAL-UHFFFAOYSA-N -1 3 380.434 -1.316 20 0 GAADHM O=C(CCc1nnc[nH]1)N1CCO[C@@H](CNc2ccnc(-c3nn[n-]n3)n2)C1 ZINC001582083348 1075858060 /nfs/dbraw/zinc/85/80/60/1075858060.db2.gz 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388.392 -1.573 20 0 GAADHM O=C(CCn1ccnn1)NCCN(CCO)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582092099 1075861781 /nfs/dbraw/zinc/86/17/81/1075861781.db2.gz FOPRILACHQIZIO-UHFFFAOYSA-N -1 3 388.392 -1.573 20 0 GAADHM O=C(CCn1cnccc1=O)NC1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582092136 1075861740 /nfs/dbraw/zinc/86/17/40/1075861740.db2.gz HTZIBNPZFBHIFE-UHFFFAOYSA-N -1 3 383.372 -1.218 20 0 GAADHM O=C(CCn1cnccc1=O)NC1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582092136 1075861738 /nfs/dbraw/zinc/86/17/38/1075861738.db2.gz HTZIBNPZFBHIFE-UHFFFAOYSA-N -1 3 383.372 -1.218 20 0 GAADHM O=C(CCn1cnccc1=O)NC[C@H](CO)Nc1ncccc1-c1nn[n-]n1 ZINC001582092156 1075861769 /nfs/dbraw/zinc/86/17/69/1075861769.db2.gz ISHXUGIVKBJWKD-LLVKDONJSA-N -1 3 385.388 -1.202 20 0 GAADHM O=C(CCn1cnccc1=O)NC[C@H](CO)Nc1ncccc1-c1nnn[n-]1 ZINC001582092156 1075861765 /nfs/dbraw/zinc/86/17/65/1075861765.db2.gz ISHXUGIVKBJWKD-LLVKDONJSA-N -1 3 385.388 -1.202 20 0 GAADHM O=C(CCn1cnccc1=O)NC[C@@H](CO)Nc1ncccc1-c1nn[n-]n1 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3 385.392 -1.604 20 0 GAADHM O=C(CCn1cnnn1)NC[C@@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001582096008 1075866147 /nfs/dbraw/zinc/86/61/47/1075866147.db2.gz VHVITWDVWJPKHB-HNNXBMFYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(CCn1cnnn1)NC[C@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001582096009 1075866472 /nfs/dbraw/zinc/86/64/72/1075866472.db2.gz VHVITWDVWJPKHB-OAHLLOKOSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(CCn1cnnn1)NC[C@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001582096009 1075866468 /nfs/dbraw/zinc/86/64/68/1075866468.db2.gz VHVITWDVWJPKHB-OAHLLOKOSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(CCn1cnnn1)N1CCO[C@H](CNc2ncccc2-c2nn[n-]n2)C1 ZINC001582096010 1075866649 /nfs/dbraw/zinc/86/66/49/1075866649.db2.gz VICYBECDSPBRRF-LLVKDONJSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(CCn1cnnn1)N1CCO[C@H](CNc2ncccc2-c2nnn[n-]2)C1 ZINC001582096010 1075866644 /nfs/dbraw/zinc/86/66/44/1075866644.db2.gz VICYBECDSPBRRF-LLVKDONJSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(CCn1cnnn1)N1CCO[C@@H](CNc2ncccc2-c2nn[n-]n2)C1 ZINC001582096011 1075866534 /nfs/dbraw/zinc/86/65/34/1075866534.db2.gz VICYBECDSPBRRF-NSHDSACASA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(CCn1cnnn1)N1CCO[C@@H](CNc2ncccc2-c2nnn[n-]2)C1 ZINC001582096011 1075866527 /nfs/dbraw/zinc/86/65/27/1075866527.db2.gz VICYBECDSPBRRF-NSHDSACASA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(CCn1cnnn1)NC[C@H]1CCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582096012 1075866676 /nfs/dbraw/zinc/86/66/76/1075866676.db2.gz VJMQETGBVRXNEZ-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)NC[C@H]1CCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582096012 1075866673 /nfs/dbraw/zinc/86/66/73/1075866673.db2.gz VJMQETGBVRXNEZ-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)NC[C@@H]1CCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582096013 1075866513 /nfs/dbraw/zinc/86/65/13/1075866513.db2.gz VJMQETGBVRXNEZ-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)NC[C@@H]1CCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582096013 1075866509 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SNSGKCPYFPHOBQ-QGZVFWFLSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(CNC(=O)C1CC1)NC[C@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001582107518 1075881497 /nfs/dbraw/zinc/88/14/97/1075881497.db2.gz SNSGKCPYFPHOBQ-QGZVFWFLSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(CNC(=O)C1CC1)NC[C@H](O)CNc1ncc(-c2nn[n-]n2)cc1F ZINC001582107645 1075881875 /nfs/dbraw/zinc/88/18/75/1075881875.db2.gz XEIQIAXKEVLXPF-JTQLQIEISA-N -1 3 378.368 -1.184 20 0 GAADHM O=C(CNC(=O)C1CC1)NC[C@H](O)CNc1ncc(-c2nnn[n-]2)cc1F ZINC001582107645 1075881873 /nfs/dbraw/zinc/88/18/73/1075881873.db2.gz XEIQIAXKEVLXPF-JTQLQIEISA-N -1 3 378.368 -1.184 20 0 GAADHM O=C(CNC(=O)C1CC1)NC[C@@H](O)CNc1ncc(-c2nn[n-]n2)cc1F ZINC001582107647 1075881864 /nfs/dbraw/zinc/88/18/64/1075881864.db2.gz XEIQIAXKEVLXPF-SNVBAGLBSA-N -1 3 378.368 -1.184 20 0 GAADHM O=C(CNC(=O)C1CC1)NC[C@@H](O)CNc1ncc(-c2nnn[n-]2)cc1F ZINC001582107647 1075881862 /nfs/dbraw/zinc/88/18/62/1075881862.db2.gz XEIQIAXKEVLXPF-SNVBAGLBSA-N -1 3 378.368 -1.184 20 0 GAADHM O=C(CNC(=O)C1CC1)NC[C@@]1(O)CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582107690 1075881847 /nfs/dbraw/zinc/88/18/47/1075881847.db2.gz YNTVPXPXVNZBSU-KRWDZBQOSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(CNC(=O)C1CC1)NC[C@@]1(O)CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582107690 1075881846 /nfs/dbraw/zinc/88/18/46/1075881846.db2.gz YNTVPXPXVNZBSU-KRWDZBQOSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(CNC(=O)C1CC1)NC[C@]1(O)CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582107692 1075881850 /nfs/dbraw/zinc/88/18/50/1075881850.db2.gz YNTVPXPXVNZBSU-QGZVFWFLSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(CNC(=O)C1CC1)NC[C@]1(O)CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582107692 1075881849 /nfs/dbraw/zinc/88/18/49/1075881849.db2.gz YNTVPXPXVNZBSU-QGZVFWFLSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582108425 1075881884 /nfs/dbraw/zinc/88/18/84/1075881884.db2.gz CAYAXAOPTJTAKS-UHFFFAOYSA-N -1 3 387.404 -1.059 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582108425 1075881882 /nfs/dbraw/zinc/88/18/82/1075881882.db2.gz CAYAXAOPTJTAKS-UHFFFAOYSA-N -1 3 387.404 -1.059 20 0 GAADHM O=C(CNC(=O)C1CC1)NCCN(CCO)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582108434 1075881843 /nfs/dbraw/zinc/88/18/43/1075881843.db2.gz COXMTQJOGKGROP-UHFFFAOYSA-N -1 3 390.404 -1.728 20 0 GAADHM O=C(CNC(=O)C1CC1)NCCN(CCO)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582108434 1075881842 /nfs/dbraw/zinc/88/18/42/1075881842.db2.gz COXMTQJOGKGROP-UHFFFAOYSA-N -1 3 390.404 -1.728 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC[C@@H](O)CNc1ncccc1-c1nn[n-]n1 ZINC001582108442 1075881838 /nfs/dbraw/zinc/88/18/38/1075881838.db2.gz DDCHRGGMZADHRO-LLVKDONJSA-N -1 3 389.420 -1.044 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC[C@@H](O)CNc1ncccc1-c1nnn[n-]1 ZINC001582108442 1075881833 /nfs/dbraw/zinc/88/18/33/1075881833.db2.gz DDCHRGGMZADHRO-LLVKDONJSA-N -1 3 389.420 -1.044 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC[C@H](O)CNc1ncccc1-c1nn[n-]n1 ZINC001582108443 1075881927 /nfs/dbraw/zinc/88/19/27/1075881927.db2.gz DDCHRGGMZADHRO-NSHDSACASA-N -1 3 389.420 -1.044 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC[C@H](O)CNc1ncccc1-c1nnn[n-]1 ZINC001582108443 1075881921 /nfs/dbraw/zinc/88/19/21/1075881921.db2.gz DDCHRGGMZADHRO-NSHDSACASA-N -1 3 389.420 -1.044 20 0 GAADHM O=C(CNC(=O)C1CC1)NCCN(CCO)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582108531 1075881950 /nfs/dbraw/zinc/88/19/50/1075881950.db2.gz IKOFUZQZDOZNQT-UHFFFAOYSA-N -1 3 390.404 -1.728 20 0 GAADHM O=C(CNC(=O)C1CC1)NCCN(CCO)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582108531 1075881944 /nfs/dbraw/zinc/88/19/44/1075881944.db2.gz IKOFUZQZDOZNQT-UHFFFAOYSA-N -1 3 390.404 -1.728 20 0 GAADHM O=C(CNC(=O)C1CCOCC1)NCCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582108573 1075881853 /nfs/dbraw/zinc/88/18/53/1075881853.db2.gz KMIVDUOOWRDHEN-UHFFFAOYSA-N -1 3 390.404 -1.416 20 0 GAADHM O=C(CNC(=O)C1CCOCC1)NCCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582108573 1075881852 /nfs/dbraw/zinc/88/18/52/1075881852.db2.gz KMIVDUOOWRDHEN-UHFFFAOYSA-N -1 3 390.404 -1.416 20 0 GAADHM O=C(CNC(=O)C1CC1)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O ZINC001582108577 1075882204 /nfs/dbraw/zinc/88/22/04/1075882204.db2.gz KWCJTMAMFDQPGS-NEPJUHHUSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(CNC(=O)C1CC1)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O ZINC001582108577 1075882201 /nfs/dbraw/zinc/88/22/01/1075882201.db2.gz KWCJTMAMFDQPGS-NEPJUHHUSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(CNC(=O)C1CC1)N[C@@H]1[C@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]21 ZINC001582108605 1075882135 /nfs/dbraw/zinc/88/21/35/1075882135.db2.gz MSFQQFBXDWTCAD-YABSGUDNSA-N -1 3 384.400 -1.092 20 0 GAADHM O=C(CNC(=O)C1CC1)N[C@@H]1[C@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]21 ZINC001582108605 1075882130 /nfs/dbraw/zinc/88/21/30/1075882130.db2.gz MSFQQFBXDWTCAD-YABSGUDNSA-N -1 3 384.400 -1.092 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582108612 1075882319 /nfs/dbraw/zinc/88/23/19/1075882319.db2.gz MWQGMRACFXYREW-UHFFFAOYSA-N -1 3 387.404 -1.059 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582108612 1075882315 /nfs/dbraw/zinc/88/23/15/1075882315.db2.gz MWQGMRACFXYREW-UHFFFAOYSA-N -1 3 387.404 -1.059 20 0 GAADHM O=C(CNC(=O)C1CC1)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O ZINC001582108619 1075882339 /nfs/dbraw/zinc/88/23/39/1075882339.db2.gz NHUJLNODFAJVID-NEPJUHHUSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(CNC(=O)C1CC1)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O ZINC001582108619 1075882336 /nfs/dbraw/zinc/88/23/36/1075882336.db2.gz NHUJLNODFAJVID-NEPJUHHUSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(CNC(=O)C1CC1)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1O ZINC001582108620 1075882225 /nfs/dbraw/zinc/88/22/25/1075882225.db2.gz NHUJLNODFAJVID-VXGBXAGGSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(CNC(=O)C1CC1)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1O ZINC001582108620 1075882218 /nfs/dbraw/zinc/88/22/18/1075882218.db2.gz NHUJLNODFAJVID-VXGBXAGGSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(CNC(=O)C1CCOCC1)NCCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582108657 1075882251 /nfs/dbraw/zinc/88/22/51/1075882251.db2.gz PEPWSJDOWZZVMJ-UHFFFAOYSA-N -1 3 390.404 -1.416 20 0 GAADHM O=C(CNC(=O)C1CCOCC1)NCCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582108657 1075882247 /nfs/dbraw/zinc/88/22/47/1075882247.db2.gz PEPWSJDOWZZVMJ-UHFFFAOYSA-N -1 3 390.404 -1.416 20 0 GAADHM O=C(CNC(=O)C1CC1)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O ZINC001582108672 1075882271 /nfs/dbraw/zinc/88/22/71/1075882271.db2.gz QRMVDLIPINQYDR-NEPJUHHUSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(CNC(=O)C1CC1)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O ZINC001582108672 1075882269 /nfs/dbraw/zinc/88/22/69/1075882269.db2.gz QRMVDLIPINQYDR-NEPJUHHUSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC[C@H](CO)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001582108756 1075882307 /nfs/dbraw/zinc/88/23/07/1075882307.db2.gz WSKFYCMVBVFVPI-GFCCVEGCSA-N -1 3 389.420 -1.044 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC[C@H](CO)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001582108756 1075882303 /nfs/dbraw/zinc/88/23/03/1075882303.db2.gz WSKFYCMVBVFVPI-GFCCVEGCSA-N -1 3 389.420 -1.044 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC[C@@H](CO)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001582108757 1075882326 /nfs/dbraw/zinc/88/23/26/1075882326.db2.gz WSKFYCMVBVFVPI-LBPRGKRZSA-N -1 3 389.420 -1.044 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001582108757 1075882324 /nfs/dbraw/zinc/88/23/24/1075882324.db2.gz WSKFYCMVBVFVPI-LBPRGKRZSA-N -1 3 389.420 -1.044 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC[C@H](CO)Nc1ncccc1-c1nn[n-]n1 ZINC001582108770 1075882240 /nfs/dbraw/zinc/88/22/40/1075882240.db2.gz XPISQMGPBQLGBR-LLVKDONJSA-N -1 3 389.420 -1.044 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC[C@H](CO)Nc1ncccc1-c1nnn[n-]1 ZINC001582108770 1075882235 /nfs/dbraw/zinc/88/22/35/1075882235.db2.gz XPISQMGPBQLGBR-LLVKDONJSA-N -1 3 389.420 -1.044 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC[C@@H](CO)Nc1ncccc1-c1nn[n-]n1 ZINC001582108771 1075882188 /nfs/dbraw/zinc/88/21/88/1075882188.db2.gz XPISQMGPBQLGBR-NSHDSACASA-N -1 3 389.420 -1.044 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC[C@@H](CO)Nc1ncccc1-c1nnn[n-]1 ZINC001582108771 1075882181 /nfs/dbraw/zinc/88/21/81/1075882181.db2.gz XPISQMGPBQLGBR-NSHDSACASA-N -1 3 389.420 -1.044 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC[C@H](CO)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001582108812 1075882352 /nfs/dbraw/zinc/88/23/52/1075882352.db2.gz ZSTDQNKDNUJUCL-GFCCVEGCSA-N -1 3 389.420 -1.044 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC[C@H](CO)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001582108812 1075882351 /nfs/dbraw/zinc/88/23/51/1075882351.db2.gz ZSTDQNKDNUJUCL-GFCCVEGCSA-N -1 3 389.420 -1.044 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC[C@@H](CO)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001582108813 1075882347 /nfs/dbraw/zinc/88/23/47/1075882347.db2.gz ZSTDQNKDNUJUCL-LBPRGKRZSA-N -1 3 389.420 -1.044 20 0 GAADHM O=C(CNC(=O)N1CCCC1)NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001582108813 1075882345 /nfs/dbraw/zinc/88/23/45/1075882345.db2.gz ZSTDQNKDNUJUCL-LBPRGKRZSA-N -1 3 389.420 -1.044 20 0 GAADHM 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ZINC001582200679 1075900805 /nfs/dbraw/zinc/90/08/05/1075900805.db2.gz CWPCPVJRJWOEOK-JTQLQIEISA-N -1 3 386.376 -1.556 20 0 GAADHM O=C(Cn1cncn1)NC[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCO1 ZINC001582200680 1075901060 /nfs/dbraw/zinc/90/10/60/1075901060.db2.gz CWPCPVJRJWOEOK-SNVBAGLBSA-N -1 3 386.376 -1.556 20 0 GAADHM O=C(Cn1cncn1)NC[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCO1 ZINC001582200680 1075901055 /nfs/dbraw/zinc/90/10/55/1075901055.db2.gz CWPCPVJRJWOEOK-SNVBAGLBSA-N -1 3 386.376 -1.556 20 0 GAADHM O=C(Cn1cncn1)NC[C@@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001582200735 1075901028 /nfs/dbraw/zinc/90/10/28/1075901028.db2.gz FUWFYMWSDVQRET-HNNXBMFYSA-N -1 3 388.367 -1.250 20 0 GAADHM O=C(Cn1cncn1)NC[C@@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001582200735 1075901022 /nfs/dbraw/zinc/90/10/22/1075901022.db2.gz FUWFYMWSDVQRET-HNNXBMFYSA-N -1 3 388.367 -1.250 20 0 GAADHM O=C(Cn1cncn1)NC[C@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001582200736 1075900911 /nfs/dbraw/zinc/90/09/11/1075900911.db2.gz FUWFYMWSDVQRET-OAHLLOKOSA-N -1 3 388.367 -1.250 20 0 GAADHM O=C(Cn1cncn1)NC[C@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001582200736 1075900907 /nfs/dbraw/zinc/90/09/07/1075900907.db2.gz FUWFYMWSDVQRET-OAHLLOKOSA-N -1 3 388.367 -1.250 20 0 GAADHM O=C(Cn1cncn1)NC[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCO1 ZINC001582200795 1075900995 /nfs/dbraw/zinc/90/09/95/1075900995.db2.gz HANLZWSCXXCLDU-LLVKDONJSA-N -1 3 386.376 -1.556 20 0 GAADHM O=C(Cn1cncn1)NC[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCO1 ZINC001582200795 1075900990 /nfs/dbraw/zinc/90/09/90/1075900990.db2.gz HANLZWSCXXCLDU-LLVKDONJSA-N -1 3 386.376 -1.556 20 0 GAADHM O=C(Cn1cncn1)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCO1 ZINC001582200796 1075900947 /nfs/dbraw/zinc/90/09/47/1075900947.db2.gz HANLZWSCXXCLDU-NSHDSACASA-N -1 3 386.376 -1.556 20 0 GAADHM O=C(Cn1cncn1)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCO1 ZINC001582200796 1075900943 /nfs/dbraw/zinc/90/09/43/1075900943.db2.gz HANLZWSCXXCLDU-NSHDSACASA-N -1 3 386.376 -1.556 20 0 GAADHM O=C(Cn1cncn1)NC[C@@H]1COCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582200819 1075901014 /nfs/dbraw/zinc/90/10/14/1075901014.db2.gz HXVKKSQOBRVASH-LLVKDONJSA-N -1 3 386.376 -1.556 20 0 GAADHM O=C(Cn1cncn1)NC[C@@H]1COCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582200819 1075901008 /nfs/dbraw/zinc/90/10/08/1075901008.db2.gz HXVKKSQOBRVASH-LLVKDONJSA-N -1 3 386.376 -1.556 20 0 GAADHM O=C(Cn1cncn1)NC[C@H]1COCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582200820 1075900828 /nfs/dbraw/zinc/90/08/28/1075900828.db2.gz HXVKKSQOBRVASH-NSHDSACASA-N -1 3 386.376 -1.556 20 0 GAADHM O=C(Cn1cncn1)NC[C@H]1COCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582200820 1075900823 /nfs/dbraw/zinc/90/08/23/1075900823.db2.gz HXVKKSQOBRVASH-NSHDSACASA-N -1 3 386.376 -1.556 20 0 GAADHM O=C(Cn1cncn1)NCC1(O)CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C1 ZINC001582200851 1075900848 /nfs/dbraw/zinc/90/08/48/1075900848.db2.gz ILORUXUTRNJREE-UHFFFAOYSA-N -1 3 387.379 -1.040 20 0 GAADHM O=C(Cn1cncn1)NCC1(O)CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C1 ZINC001582200851 1075900843 /nfs/dbraw/zinc/90/08/43/1075900843.db2.gz ILORUXUTRNJREE-UHFFFAOYSA-N -1 3 387.379 -1.040 20 0 GAADHM O=C(Cn1cncn1)NCC1(O)CN(Cc2cc(F)ccc2-c2nn[n-]n2)C1 ZINC001582200884 1075900981 /nfs/dbraw/zinc/90/09/81/1075900981.db2.gz KANBLCBBRQXMSQ-UHFFFAOYSA-N -1 3 387.379 -1.040 20 0 GAADHM O=C(Cn1cncn1)NCC1(O)CN(Cc2cc(F)ccc2-c2nnn[n-]2)C1 ZINC001582200884 1075900976 /nfs/dbraw/zinc/90/09/76/1075900976.db2.gz KANBLCBBRQXMSQ-UHFFFAOYSA-N -1 3 387.379 -1.040 20 0 GAADHM O=C(Cn1cncn1)NCC1(O)CN(Cc2cc(-c3nn[n-]n3)ccc2F)C1 ZINC001582200903 1075901531 /nfs/dbraw/zinc/90/15/31/1075901531.db2.gz KYQZXTHUHKFGDO-UHFFFAOYSA-N -1 3 387.379 -1.040 20 0 GAADHM O=C(Cn1cncn1)NCC1(O)CN(Cc2cc(-c3nnn[n-]3)ccc2F)C1 ZINC001582200903 1075901524 /nfs/dbraw/zinc/90/15/24/1075901524.db2.gz KYQZXTHUHKFGDO-UHFFFAOYSA-N -1 3 387.379 -1.040 20 0 GAADHM O=C(Cn1cncn1)NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582200914 1075901431 /nfs/dbraw/zinc/90/14/31/1075901431.db2.gz LHRDGVCQTQSUNG-HNNXBMFYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582200914 1075901425 /nfs/dbraw/zinc/90/14/25/1075901425.db2.gz LHRDGVCQTQSUNG-HNNXBMFYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)NC[C@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582200915 1075901289 /nfs/dbraw/zinc/90/12/89/1075901289.db2.gz LHRDGVCQTQSUNG-OAHLLOKOSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)NC[C@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582200915 1075901282 /nfs/dbraw/zinc/90/12/82/1075901282.db2.gz LHRDGVCQTQSUNG-OAHLLOKOSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)NC[C@@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582200917 1075901551 /nfs/dbraw/zinc/90/15/51/1075901551.db2.gz LLRUBLXQQYAOQF-HNNXBMFYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)NC[C@@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582200917 1075901544 /nfs/dbraw/zinc/90/15/44/1075901544.db2.gz LLRUBLXQQYAOQF-HNNXBMFYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)NC[C@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582200918 1075901310 /nfs/dbraw/zinc/90/13/10/1075901310.db2.gz LLRUBLXQQYAOQF-OAHLLOKOSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)NC[C@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582200918 1075901303 /nfs/dbraw/zinc/90/13/03/1075901303.db2.gz LLRUBLXQQYAOQF-OAHLLOKOSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O ZINC001582200974 1075901412 /nfs/dbraw/zinc/90/14/12/1075901412.db2.gz NIXVGATZKHNQHN-BXKDBHETSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1cncn1)N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O ZINC001582200974 1075901406 /nfs/dbraw/zinc/90/14/06/1075901406.db2.gz NIXVGATZKHNQHN-BXKDBHETSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1cncn1)N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O ZINC001582200975 1075901578 /nfs/dbraw/zinc/90/15/78/1075901578.db2.gz NIXVGATZKHNQHN-CABZTGNLSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1cncn1)N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O ZINC001582200975 1075901571 /nfs/dbraw/zinc/90/15/71/1075901571.db2.gz NIXVGATZKHNQHN-CABZTGNLSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1cncn1)N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O ZINC001582200976 1075901345 /nfs/dbraw/zinc/90/13/45/1075901345.db2.gz NIXVGATZKHNQHN-JOYOIKCWSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1cncn1)N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O ZINC001582200976 1075901339 /nfs/dbraw/zinc/90/13/39/1075901339.db2.gz NIXVGATZKHNQHN-JOYOIKCWSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1cncn1)N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O ZINC001582200977 1075901606 /nfs/dbraw/zinc/90/16/06/1075901606.db2.gz NIXVGATZKHNQHN-SKDRFNHKSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1cncn1)N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O ZINC001582200977 1075901595 /nfs/dbraw/zinc/90/15/95/1075901595.db2.gz NIXVGATZKHNQHN-SKDRFNHKSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1cncn1)N[C@@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001582200979 1075901479 /nfs/dbraw/zinc/90/14/79/1075901479.db2.gz NKCQEOWFLZHFRU-NEPJUHHUSA-N -1 3 388.367 -1.252 20 0 GAADHM O=C(Cn1cncn1)N[C@@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001582200979 1075901472 /nfs/dbraw/zinc/90/14/72/1075901472.db2.gz NKCQEOWFLZHFRU-NEPJUHHUSA-N -1 3 388.367 -1.252 20 0 GAADHM O=C(Cn1cncn1)N[C@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001582200980 1075901513 /nfs/dbraw/zinc/90/15/13/1075901513.db2.gz NKCQEOWFLZHFRU-NWDGAFQWSA-N -1 3 388.367 -1.252 20 0 GAADHM O=C(Cn1cncn1)N[C@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001582200980 1075901508 /nfs/dbraw/zinc/90/15/08/1075901508.db2.gz NKCQEOWFLZHFRU-NWDGAFQWSA-N -1 3 388.367 -1.252 20 0 GAADHM O=C(Cn1cncn1)N[C@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001582200981 1075901501 /nfs/dbraw/zinc/90/15/01/1075901501.db2.gz NKCQEOWFLZHFRU-RYUDHWBXSA-N -1 3 388.367 -1.252 20 0 GAADHM O=C(Cn1cncn1)N[C@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001582200981 1075901494 /nfs/dbraw/zinc/90/14/94/1075901494.db2.gz NKCQEOWFLZHFRU-RYUDHWBXSA-N -1 3 388.367 -1.252 20 0 GAADHM O=C(Cn1cncn1)N[C@@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001582200982 1075901365 /nfs/dbraw/zinc/90/13/65/1075901365.db2.gz NKCQEOWFLZHFRU-VXGBXAGGSA-N -1 3 388.367 -1.252 20 0 GAADHM O=C(Cn1cncn1)N[C@@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001582200982 1075901358 /nfs/dbraw/zinc/90/13/58/1075901358.db2.gz NKCQEOWFLZHFRU-VXGBXAGGSA-N -1 3 388.367 -1.252 20 0 GAADHM O=C(Cn1cncn1)NC[C@@H]1[C@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]21 ZINC001582201003 1075901456 /nfs/dbraw/zinc/90/14/56/1075901456.db2.gz OBGADUUBSRJXLS-RTCCRHLQSA-N -1 3 382.388 -1.079 20 0 GAADHM O=C(Cn1cncn1)NC[C@@H]1[C@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]21 ZINC001582201003 1075901446 /nfs/dbraw/zinc/90/14/46/1075901446.db2.gz OBGADUUBSRJXLS-RTCCRHLQSA-N -1 3 382.388 -1.079 20 0 GAADHM O=C(Cn1cncn1)NC[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]21 ZINC001582201037 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1075903201 /nfs/dbraw/zinc/90/32/01/1075903201.db2.gz ALCGIWPPGQUJLI-UHFFFAOYSA-N -1 3 386.351 -1.023 20 0 GAADHM O=C(Cn1cnnn1)N1CCN(C(=O)c2ccc(-c3nnn[n-]3)cc2F)CC1 ZINC001582201944 1075903195 /nfs/dbraw/zinc/90/31/95/1075903195.db2.gz ALCGIWPPGQUJLI-UHFFFAOYSA-N -1 3 386.351 -1.023 20 0 GAADHM O=C(Cn1cnnn1)N1CC[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H]2C1 ZINC001582202023 1075903335 /nfs/dbraw/zinc/90/33/35/1075903335.db2.gz DRBGEMAXXFKKFG-BXKDBHETSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1cnnn1)N1CC[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H]2C1 ZINC001582202023 1075903334 /nfs/dbraw/zinc/90/33/34/1075903334.db2.gz DRBGEMAXXFKKFG-BXKDBHETSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@](CO)(Nc2ncccc2-c2nn[n-]n2)C1 ZINC001582202026 1075903178 /nfs/dbraw/zinc/90/31/78/1075903178.db2.gz DTYFARWQTUUIKR-HNNXBMFYSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@](CO)(Nc2ncccc2-c2nnn[n-]2)C1 ZINC001582202026 1075903172 /nfs/dbraw/zinc/90/31/72/1075903172.db2.gz DTYFARWQTUUIKR-HNNXBMFYSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@@](CO)(Nc2ncccc2-c2nn[n-]n2)C1 ZINC001582202027 1075903263 /nfs/dbraw/zinc/90/32/63/1075903263.db2.gz DTYFARWQTUUIKR-OAHLLOKOSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@@](CO)(Nc2ncccc2-c2nnn[n-]2)C1 ZINC001582202027 1075903260 /nfs/dbraw/zinc/90/32/60/1075903260.db2.gz DTYFARWQTUUIKR-OAHLLOKOSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1cnnn1)N[C@@]1(CO)CCCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001582202030 1075903349 /nfs/dbraw/zinc/90/33/49/1075903349.db2.gz FBGIMRGVXXZLRJ-HNNXBMFYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1cnnn1)N[C@@]1(CO)CCCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001582202030 1075903345 /nfs/dbraw/zinc/90/33/45/1075903345.db2.gz FBGIMRGVXXZLRJ-HNNXBMFYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1cnnn1)N[C@]1(CO)CCCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001582202031 1075903150 /nfs/dbraw/zinc/90/31/50/1075903150.db2.gz FBGIMRGVXXZLRJ-OAHLLOKOSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1cnnn1)N[C@]1(CO)CCCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001582202031 1075903144 /nfs/dbraw/zinc/90/31/44/1075903144.db2.gz FBGIMRGVXXZLRJ-OAHLLOKOSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@](CO)(Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582202066 1075903233 /nfs/dbraw/zinc/90/32/33/1075903233.db2.gz GCGXQRGMERLEDI-HNNXBMFYSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@](CO)(Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582202066 1075903230 /nfs/dbraw/zinc/90/32/30/1075903230.db2.gz GCGXQRGMERLEDI-HNNXBMFYSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@@](CO)(Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582202067 1075903163 /nfs/dbraw/zinc/90/31/63/1075903163.db2.gz GCGXQRGMERLEDI-OAHLLOKOSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@@](CO)(Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582202067 1075903161 /nfs/dbraw/zinc/90/31/61/1075903161.db2.gz GCGXQRGMERLEDI-OAHLLOKOSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1cnnn1)N1CCO[C@@H](CNc2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001582202072 1075903284 /nfs/dbraw/zinc/90/32/84/1075903284.db2.gz GGJIXPNNWOSOJU-JTQLQIEISA-N -1 3 389.355 -1.273 20 0 GAADHM O=C(Cn1cnnn1)N1CCO[C@@H](CNc2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001582202072 1075903280 /nfs/dbraw/zinc/90/32/80/1075903280.db2.gz GGJIXPNNWOSOJU-JTQLQIEISA-N -1 3 389.355 -1.273 20 0 GAADHM O=C(Cn1cnnn1)N1CCO[C@H](CNc2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001582202073 1075903309 /nfs/dbraw/zinc/90/33/09/1075903309.db2.gz GGJIXPNNWOSOJU-SNVBAGLBSA-N -1 3 389.355 -1.273 20 0 GAADHM O=C(Cn1cnnn1)N1CCO[C@H](CNc2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001582202073 1075903307 /nfs/dbraw/zinc/90/33/07/1075903307.db2.gz GGJIXPNNWOSOJU-SNVBAGLBSA-N -1 3 389.355 -1.273 20 0 GAADHM O=C(Cn1cnnn1)NC1(CO)CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001582202078 1075903373 /nfs/dbraw/zinc/90/33/73/1075903373.db2.gz GHLTXEBPOFPESJ-UHFFFAOYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1cnnn1)NC1(CO)CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001582202078 1075903370 /nfs/dbraw/zinc/90/33/70/1075903370.db2.gz GHLTXEBPOFPESJ-UHFFFAOYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1cnnn1)NC1(CO)CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001582202089 1075903135 /nfs/dbraw/zinc/90/31/35/1075903135.db2.gz HBTDSFSWBSVDIY-UHFFFAOYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1cnnn1)NC1(CO)CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001582202089 1075903129 /nfs/dbraw/zinc/90/31/29/1075903129.db2.gz HBTDSFSWBSVDIY-UHFFFAOYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1cnnn1)N1C[C@H]2CN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]2C1 ZINC001582202100 1075903924 /nfs/dbraw/zinc/90/39/24/1075903924.db2.gz HPDUXFDASFBKDR-PHIMTYICSA-N -1 3 385.367 -1.018 20 0 GAADHM O=C(Cn1cnnn1)N1C[C@H]2CN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]2C1 ZINC001582202100 1075903921 /nfs/dbraw/zinc/90/39/21/1075903921.db2.gz HPDUXFDASFBKDR-PHIMTYICSA-N -1 3 385.367 -1.018 20 0 GAADHM O=C(Cn1cnnn1)N1CCC2(CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)C1 ZINC001582202103 1075903635 /nfs/dbraw/zinc/90/36/35/1075903635.db2.gz HQHMOGYOOCSLHY-UHFFFAOYSA-N -1 3 383.376 -1.444 20 0 GAADHM O=C(Cn1cnnn1)N1CCC2(CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)C1 ZINC001582202103 1075903631 /nfs/dbraw/zinc/90/36/31/1075903631.db2.gz HQHMOGYOOCSLHY-UHFFFAOYSA-N -1 3 383.376 -1.444 20 0 GAADHM O=C(Cn1cnnn1)NC1(CCO)CN(Cc2ccc(-c3nn[n-]n3)cc2)C1 ZINC001582202142 1075903914 /nfs/dbraw/zinc/90/39/14/1075903914.db2.gz IUQCEUNSNDWSPW-UHFFFAOYSA-N -1 3 384.404 -1.394 20 0 GAADHM O=C(Cn1cnnn1)NC1(CCO)CN(Cc2ccc(-c3nnn[n-]3)cc2)C1 ZINC001582202142 1075903907 /nfs/dbraw/zinc/90/39/07/1075903907.db2.gz IUQCEUNSNDWSPW-UHFFFAOYSA-N -1 3 384.404 -1.394 20 0 GAADHM O=C(Cn1cnnn1)N1C[C@@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H]2C1 ZINC001582202161 1075903726 /nfs/dbraw/zinc/90/37/26/1075903726.db2.gz JSCVAEHMUBYETF-JOYOIKCWSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1cnnn1)N1C[C@@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H]2C1 ZINC001582202161 1075903719 /nfs/dbraw/zinc/90/37/19/1075903719.db2.gz JSCVAEHMUBYETF-JOYOIKCWSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1cnnn1)N1CCC(O)(CNc2ncccc2-c2nn[n-]n2)CC1 ZINC001582202162 1075903750 /nfs/dbraw/zinc/90/37/50/1075903750.db2.gz JULAJVCNEBGBDZ-UHFFFAOYSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1cnnn1)N1CCC(O)(CNc2ncccc2-c2nnn[n-]2)CC1 ZINC001582202162 1075903740 /nfs/dbraw/zinc/90/37/40/1075903740.db2.gz JULAJVCNEBGBDZ-UHFFFAOYSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1cnnn1)N1C[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2C1 ZINC001582202174 1075903584 /nfs/dbraw/zinc/90/35/84/1075903584.db2.gz KOOKMBNZWFGLGV-PHIMTYICSA-N -1 3 383.376 -1.588 20 0 GAADHM O=C(Cn1cnnn1)N1C[C@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2C1 ZINC001582202174 1075903582 /nfs/dbraw/zinc/90/35/82/1075903582.db2.gz KOOKMBNZWFGLGV-PHIMTYICSA-N -1 3 383.376 -1.588 20 0 GAADHM O=C(Cn1cnnn1)N1C[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2C1 ZINC001582202195 1075904234 /nfs/dbraw/zinc/90/42/34/1075904234.db2.gz LCICXXPIVCLESR-AOOOYVTPSA-N -1 3 383.376 -1.588 20 0 GAADHM O=C(Cn1cnnn1)N1C[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2C1 ZINC001582202195 1075904227 /nfs/dbraw/zinc/90/42/27/1075904227.db2.gz LCICXXPIVCLESR-AOOOYVTPSA-N -1 3 383.376 -1.588 20 0 GAADHM O=C(Cn1cnnn1)N[C@@]1(CO)CCCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001582202202 1075904119 /nfs/dbraw/zinc/90/41/19/1075904119.db2.gz LHEZVLAZKOFNNL-HNNXBMFYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1cnnn1)N[C@@]1(CO)CCCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001582202202 1075904116 /nfs/dbraw/zinc/90/41/16/1075904116.db2.gz LHEZVLAZKOFNNL-HNNXBMFYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1cnnn1)N[C@]1(CO)CCCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001582202203 1075904128 /nfs/dbraw/zinc/90/41/28/1075904128.db2.gz LHEZVLAZKOFNNL-OAHLLOKOSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1cnnn1)N[C@]1(CO)CCCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001582202203 1075904126 /nfs/dbraw/zinc/90/41/26/1075904126.db2.gz LHEZVLAZKOFNNL-OAHLLOKOSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1cnnn1)N1CCN(C(=O)Nc2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001582202219 1075904091 /nfs/dbraw/zinc/90/40/91/1075904091.db2.gz LXRIIHGUZOOMMV-UHFFFAOYSA-N -1 3 384.364 -1.376 20 0 GAADHM O=C(Cn1cnnn1)N1CCN(C(=O)Nc2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001582202219 1075904088 /nfs/dbraw/zinc/90/40/88/1075904088.db2.gz LXRIIHGUZOOMMV-UHFFFAOYSA-N -1 3 384.364 -1.376 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@](CO)(Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001582202265 1075904678 /nfs/dbraw/zinc/90/46/78/1075904678.db2.gz ODIFAKLSGFEOMX-HNNXBMFYSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@](CO)(Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001582202265 1075904674 /nfs/dbraw/zinc/90/46/74/1075904674.db2.gz ODIFAKLSGFEOMX-HNNXBMFYSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@@](CO)(Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001582202266 1075904878 /nfs/dbraw/zinc/90/48/78/1075904878.db2.gz ODIFAKLSGFEOMX-OAHLLOKOSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@@](CO)(Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001582202266 1075904866 /nfs/dbraw/zinc/90/48/66/1075904866.db2.gz ODIFAKLSGFEOMX-OAHLLOKOSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1cnnn1)NC1(CO)CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001582202275 1075904640 /nfs/dbraw/zinc/90/46/40/1075904640.db2.gz OQZSCGKQAMIFLY-UHFFFAOYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1cnnn1)NC1(CO)CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001582202275 1075904634 /nfs/dbraw/zinc/90/46/34/1075904634.db2.gz OQZSCGKQAMIFLY-UHFFFAOYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1cnnn1)N1CCC2(CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)C1 ZINC001582202299 1075904707 /nfs/dbraw/zinc/90/47/07/1075904707.db2.gz POGRAIBOAIQFNM-UHFFFAOYSA-N -1 3 383.376 -1.444 20 0 GAADHM O=C(Cn1cnnn1)N1CCC2(CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)C1 ZINC001582202299 1075904703 /nfs/dbraw/zinc/90/47/03/1075904703.db2.gz POGRAIBOAIQFNM-UHFFFAOYSA-N -1 3 383.376 -1.444 20 0 GAADHM O=C(Cn1cnnn1)N1C[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H]2C1 ZINC001582202326 1075904618 /nfs/dbraw/zinc/90/46/18/1075904618.db2.gz QPCRTQPIIRYVON-JOYOIKCWSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1cnnn1)N1C[C@@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H]2C1 ZINC001582202326 1075904615 /nfs/dbraw/zinc/90/46/15/1075904615.db2.gz QPCRTQPIIRYVON-JOYOIKCWSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1cnnn1)N1CCCO[C@H](CNc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582202410 1075905411 /nfs/dbraw/zinc/90/54/11/1075905411.db2.gz VCWFIMGSWJXZRZ-GFCCVEGCSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1cnnn1)N1CCCO[C@H](CNc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582202410 1075905404 /nfs/dbraw/zinc/90/54/04/1075905404.db2.gz VCWFIMGSWJXZRZ-GFCCVEGCSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1cnnn1)N1CCCO[C@@H](CNc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582202411 1075905180 /nfs/dbraw/zinc/90/51/80/1075905180.db2.gz VCWFIMGSWJXZRZ-LBPRGKRZSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1cnnn1)N1CCCO[C@@H](CNc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582202411 1075905176 /nfs/dbraw/zinc/90/51/76/1075905176.db2.gz VCWFIMGSWJXZRZ-LBPRGKRZSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1cnnn1)N1CC[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H]2C1 ZINC001582202420 1075905254 /nfs/dbraw/zinc/90/52/54/1075905254.db2.gz VIBRTGXRLRCOMD-BXKDBHETSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1cnnn1)N1CC[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H]2C1 ZINC001582202420 1075905248 /nfs/dbraw/zinc/90/52/48/1075905248.db2.gz VIBRTGXRLRCOMD-BXKDBHETSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1cnnn1)NC1(CCO)CN(Cc2ccccc2-c2nn[n-]n2)C1 ZINC001582202474 1075905139 /nfs/dbraw/zinc/90/51/39/1075905139.db2.gz YATXPHGEJTYFPP-UHFFFAOYSA-N -1 3 384.404 -1.394 20 0 GAADHM O=C(Cn1cnnn1)NC1(CCO)CN(Cc2ccccc2-c2nnn[n-]2)C1 ZINC001582202474 1075905134 /nfs/dbraw/zinc/90/51/34/1075905134.db2.gz YATXPHGEJTYFPP-UHFFFAOYSA-N -1 3 384.404 -1.394 20 0 GAADHM O=C(Cn1cnnn1)N[C@@]1(CO)CCCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582202484 1075905064 /nfs/dbraw/zinc/90/50/64/1075905064.db2.gz YHXNERWELCQFCC-HNNXBMFYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1cnnn1)N[C@@]1(CO)CCCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582202484 1075905055 /nfs/dbraw/zinc/90/50/55/1075905055.db2.gz YHXNERWELCQFCC-HNNXBMFYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1cnnn1)N[C@]1(CO)CCCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582202485 1075905198 /nfs/dbraw/zinc/90/51/98/1075905198.db2.gz YHXNERWELCQFCC-OAHLLOKOSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1cnnn1)N[C@]1(CO)CCCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582202485 1075905192 /nfs/dbraw/zinc/90/51/92/1075905192.db2.gz YHXNERWELCQFCC-OAHLLOKOSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1cnnn1)N1CC[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H]2C1 ZINC001582202486 1075905435 /nfs/dbraw/zinc/90/54/35/1075905435.db2.gz YJRGHWXGLORLCT-BXKDBHETSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1cnnn1)N1CC[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H]2C1 ZINC001582202486 1075905428 /nfs/dbraw/zinc/90/54/28/1075905428.db2.gz YJRGHWXGLORLCT-BXKDBHETSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1cnnn1)N1CCCO[C@H](CNc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001582202512 1075905813 /nfs/dbraw/zinc/90/58/13/1075905813.db2.gz ZPCXJVPCJRNYMJ-GFCCVEGCSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1cnnn1)N1CCCO[C@H](CNc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001582202512 1075905808 /nfs/dbraw/zinc/90/58/08/1075905808.db2.gz ZPCXJVPCJRNYMJ-GFCCVEGCSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1cnnn1)N1CCCO[C@@H](CNc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001582202513 1075905861 /nfs/dbraw/zinc/90/58/61/1075905861.db2.gz ZPCXJVPCJRNYMJ-LBPRGKRZSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1cnnn1)N1CCCO[C@@H](CNc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001582202513 1075905856 /nfs/dbraw/zinc/90/58/56/1075905856.db2.gz ZPCXJVPCJRNYMJ-LBPRGKRZSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1cnnn1)NC1(CCO)CN(Cc2cccc(-c3nn[n-]n3)c2)C1 ZINC001582202527 1075905713 /nfs/dbraw/zinc/90/57/13/1075905713.db2.gz ZXAYYTHZACBOEG-UHFFFAOYSA-N -1 3 384.404 -1.394 20 0 GAADHM O=C(Cn1cnnn1)NC1(CCO)CN(Cc2cccc(-c3nnn[n-]3)c2)C1 ZINC001582202527 1075905709 /nfs/dbraw/zinc/90/57/09/1075905709.db2.gz ZXAYYTHZACBOEG-UHFFFAOYSA-N -1 3 384.404 -1.394 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2Cl)C[C@H]1O ZINC001582202863 1075905901 /nfs/dbraw/zinc/90/59/01/1075905901.db2.gz BYEFGHNIALBLHF-NXEZZACHSA-N -1 3 391.783 -1.733 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2Cl)C[C@H]1O ZINC001582202863 1075905892 /nfs/dbraw/zinc/90/58/92/1075905892.db2.gz BYEFGHNIALBLHF-NXEZZACHSA-N -1 3 391.783 -1.733 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2Cl)C[C@@H]1O ZINC001582202864 1075905611 /nfs/dbraw/zinc/90/56/11/1075905611.db2.gz BYEFGHNIALBLHF-ZJUUUORDSA-N -1 3 391.783 -1.733 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2Cl)C[C@@H]1O ZINC001582202864 1075905604 /nfs/dbraw/zinc/90/56/04/1075905604.db2.gz BYEFGHNIALBLHF-ZJUUUORDSA-N -1 3 391.783 -1.733 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001582202947 1075905921 /nfs/dbraw/zinc/90/59/21/1075905921.db2.gz FIKLHIVDGMZVRW-NXEZZACHSA-N -1 3 375.328 -2.247 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001582202947 1075905915 /nfs/dbraw/zinc/90/59/15/1075905915.db2.gz FIKLHIVDGMZVRW-NXEZZACHSA-N -1 3 375.328 -2.247 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001582202948 1075905943 /nfs/dbraw/zinc/90/59/43/1075905943.db2.gz FIKLHIVDGMZVRW-ZJUUUORDSA-N -1 3 375.328 -2.247 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001582202948 1075905935 /nfs/dbraw/zinc/90/59/35/1075905935.db2.gz FIKLHIVDGMZVRW-ZJUUUORDSA-N -1 3 375.328 -2.247 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(Cc2cc(F)ccc2-c2nn[n-]n2)C[C@@H]1O ZINC001582202998 1075905693 /nfs/dbraw/zinc/90/56/93/1075905693.db2.gz GPYJDMFTHFAUEE-OLZOCXBDSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CCCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582203232 1075905879 /nfs/dbraw/zinc/90/58/79/1075905879.db2.gz MIZHYGPADDUBHU-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CCCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582203232 1075905874 /nfs/dbraw/zinc/90/58/74/1075905874.db2.gz MIZHYGPADDUBHU-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CCCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582203233 1075905753 /nfs/dbraw/zinc/90/57/53/1075905753.db2.gz MIZHYGPADDUBHU-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CCCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582203233 1075905750 /nfs/dbraw/zinc/90/57/50/1075905750.db2.gz MIZHYGPADDUBHU-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CCCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582203371 1075906333 /nfs/dbraw/zinc/90/63/33/1075906333.db2.gz NTSPRUPBMUJJBT-JTQLQIEISA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CCCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582203371 1075906328 /nfs/dbraw/zinc/90/63/28/1075906328.db2.gz NTSPRUPBMUJJBT-JTQLQIEISA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CCCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582203372 1075906432 /nfs/dbraw/zinc/90/64/32/1075906432.db2.gz NTSPRUPBMUJJBT-SNVBAGLBSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CCCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582203372 1075906428 /nfs/dbraw/zinc/90/64/28/1075906428.db2.gz NTSPRUPBMUJJBT-SNVBAGLBSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)NCCN1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001582203389 1075906376 /nfs/dbraw/zinc/90/63/76/1075906376.db2.gz OYLGHHFZLAJNHW-UHFFFAOYSA-N -1 3 384.408 -1.813 20 0 GAADHM O=C(Cn1cnnn1)NCCN1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001582203389 1075906371 /nfs/dbraw/zinc/90/63/71/1075906371.db2.gz OYLGHHFZLAJNHW-UHFFFAOYSA-N -1 3 384.408 -1.813 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C[C@H]1O ZINC001582203404 1075906476 /nfs/dbraw/zinc/90/64/76/1075906476.db2.gz PNLHFAQHQYASRY-CHWSQXEVSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C[C@H]1O ZINC001582203404 1075906474 /nfs/dbraw/zinc/90/64/74/1075906474.db2.gz PNLHFAQHQYASRY-CHWSQXEVSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C[C@@H]1O ZINC001582203405 1075906419 /nfs/dbraw/zinc/90/64/19/1075906419.db2.gz PNLHFAQHQYASRY-OLZOCXBDSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C[C@@H]1O ZINC001582203405 1075906416 /nfs/dbraw/zinc/90/64/16/1075906416.db2.gz PNLHFAQHQYASRY-OLZOCXBDSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(Cc2cc(-c3nn[n-]n3)ccc2F)C[C@H]1O ZINC001582203599 1075906275 /nfs/dbraw/zinc/90/62/75/1075906275.db2.gz UNJUUYZARROGNI-CHWSQXEVSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(Cc2cc(-c3nn[n-]n3)ccc2F)C[C@@H]1O ZINC001582203600 1075906460 /nfs/dbraw/zinc/90/64/60/1075906460.db2.gz UNJUUYZARROGNI-OLZOCXBDSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582203632 1075906162 /nfs/dbraw/zinc/90/61/62/1075906162.db2.gz VTMVEOVMYSSIAK-FOGDFJRCSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582203632 1075906156 /nfs/dbraw/zinc/90/61/56/1075906156.db2.gz VTMVEOVMYSSIAK-FOGDFJRCSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582203633 1075906506 /nfs/dbraw/zinc/90/65/06/1075906506.db2.gz VTMVEOVMYSSIAK-SCVCMEIPSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582203633 1075906504 /nfs/dbraw/zinc/90/65/04/1075906504.db2.gz VTMVEOVMYSSIAK-SCVCMEIPSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C[C@H]1O ZINC001582203787 1075906497 /nfs/dbraw/zinc/90/64/97/1075906497.db2.gz WTNHCZKVEBXTPU-CHWSQXEVSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C[C@H]1O ZINC001582203787 1075906493 /nfs/dbraw/zinc/90/64/93/1075906493.db2.gz WTNHCZKVEBXTPU-CHWSQXEVSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C[C@@H]1O ZINC001582203788 1075906317 /nfs/dbraw/zinc/90/63/17/1075906317.db2.gz WTNHCZKVEBXTPU-OLZOCXBDSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C[C@@H]1O ZINC001582203788 1075906311 /nfs/dbraw/zinc/90/63/11/1075906311.db2.gz WTNHCZKVEBXTPU-OLZOCXBDSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582203822 1075906443 /nfs/dbraw/zinc/90/64/43/1075906443.db2.gz YONHFVRCPZZEJL-FOGDFJRCSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582203822 1075906440 /nfs/dbraw/zinc/90/64/40/1075906440.db2.gz YONHFVRCPZZEJL-FOGDFJRCSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582203823 1075906405 /nfs/dbraw/zinc/90/64/05/1075906405.db2.gz YONHFVRCPZZEJL-SCVCMEIPSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582203823 1075906404 /nfs/dbraw/zinc/90/64/04/1075906404.db2.gz YONHFVRCPZZEJL-SCVCMEIPSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001582203830 1075906396 /nfs/dbraw/zinc/90/63/96/1075906396.db2.gz YXFKWMVXNSBEKB-CHWSQXEVSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001582203830 1075906393 /nfs/dbraw/zinc/90/63/93/1075906393.db2.gz YXFKWMVXNSBEKB-CHWSQXEVSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001582203831 1075906207 /nfs/dbraw/zinc/90/62/07/1075906207.db2.gz YXFKWMVXNSBEKB-OLZOCXBDSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001582203831 1075906199 /nfs/dbraw/zinc/90/61/99/1075906199.db2.gz YXFKWMVXNSBEKB-OLZOCXBDSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)CCCO1 ZINC001582203854 1075906249 /nfs/dbraw/zinc/90/62/49/1075906249.db2.gz AATMFLJPWXBEBL-GFCCVEGCSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)CCCO1 ZINC001582203854 1075906240 /nfs/dbraw/zinc/90/62/40/1075906240.db2.gz AATMFLJPWXBEBL-GFCCVEGCSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CN(c2ccc(-c3nn[n-]n3)nc2)CCCO1 ZINC001582203855 1075906821 /nfs/dbraw/zinc/90/68/21/1075906821.db2.gz AATMFLJPWXBEBL-LBPRGKRZSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CN(c2ccc(-c3nnn[n-]3)nc2)CCCO1 ZINC001582203855 1075906818 /nfs/dbraw/zinc/90/68/18/1075906818.db2.gz AATMFLJPWXBEBL-LBPRGKRZSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1COCCN1Cc1cccc(-c2nn[n-]n2)c1 ZINC001582203856 1075906859 /nfs/dbraw/zinc/90/68/59/1075906859.db2.gz ACEAMWULENLCHT-AWEZNQCLSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1COCCN1Cc1cccc(-c2nnn[n-]2)c1 ZINC001582203856 1075906857 /nfs/dbraw/zinc/90/68/57/1075906857.db2.gz ACEAMWULENLCHT-AWEZNQCLSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1COCCN1Cc1cccc(-c2nn[n-]n2)c1 ZINC001582203857 1075906878 /nfs/dbraw/zinc/90/68/78/1075906878.db2.gz ACEAMWULENLCHT-CQSZACIVSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1COCCN1Cc1cccc(-c2nnn[n-]2)c1 ZINC001582203857 1075906875 /nfs/dbraw/zinc/90/68/75/1075906875.db2.gz ACEAMWULENLCHT-CQSZACIVSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)CCO1 ZINC001582203871 1075906851 /nfs/dbraw/zinc/90/68/51/1075906851.db2.gz AJLSDUBTRIRAGB-JTQLQIEISA-N -1 3 389.355 -1.591 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)CCO1 ZINC001582203871 1075906847 /nfs/dbraw/zinc/90/68/47/1075906847.db2.gz AJLSDUBTRIRAGB-JTQLQIEISA-N -1 3 389.355 -1.591 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)CCO1 ZINC001582203872 1075906869 /nfs/dbraw/zinc/90/68/69/1075906869.db2.gz AJLSDUBTRIRAGB-SNVBAGLBSA-N -1 3 389.355 -1.591 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)CCO1 ZINC001582203872 1075906866 /nfs/dbraw/zinc/90/68/66/1075906866.db2.gz AJLSDUBTRIRAGB-SNVBAGLBSA-N -1 3 389.355 -1.591 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CCCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001582203876 1075906792 /nfs/dbraw/zinc/90/67/92/1075906792.db2.gz ANHBOCDXIXNFDM-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CCCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001582203876 1075906788 /nfs/dbraw/zinc/90/67/88/1075906788.db2.gz ANHBOCDXIXNFDM-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1CCCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001582203877 1075906903 /nfs/dbraw/zinc/90/69/03/1075906903.db2.gz ANHBOCDXIXNFDM-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1CCCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001582203877 1075906897 /nfs/dbraw/zinc/90/68/97/1075906897.db2.gz ANHBOCDXIXNFDM-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)NCC[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582204194 1075906760 /nfs/dbraw/zinc/90/67/60/1075906760.db2.gz FPWNVDCLEXNHJC-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NCC[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582204194 1075906755 /nfs/dbraw/zinc/90/67/55/1075906755.db2.gz FPWNVDCLEXNHJC-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NCC[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582204195 1075906842 /nfs/dbraw/zinc/90/68/42/1075906842.db2.gz FPWNVDCLEXNHJC-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NCC[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582204195 1075906838 /nfs/dbraw/zinc/90/68/38/1075906838.db2.gz FPWNVDCLEXNHJC-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NCC1(O)CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C1 ZINC001582204198 1075906889 /nfs/dbraw/zinc/90/68/89/1075906889.db2.gz FSIWGMJLYKFOQS-UHFFFAOYSA-N -1 3 388.367 -1.645 20 0 GAADHM O=C(Cn1cnnn1)NCC1(O)CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C1 ZINC001582204198 1075906884 /nfs/dbraw/zinc/90/68/84/1075906884.db2.gz FSIWGMJLYKFOQS-UHFFFAOYSA-N -1 3 388.367 -1.645 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]21 ZINC001582204209 1075907352 /nfs/dbraw/zinc/90/73/52/1075907352.db2.gz GFJILVJQVRRKRO-RTCCRHLQSA-N -1 3 383.376 -1.684 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]21 ZINC001582204209 1075907348 /nfs/dbraw/zinc/90/73/48/1075907348.db2.gz GFJILVJQVRRKRO-RTCCRHLQSA-N -1 3 383.376 -1.684 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001582204236 1075907295 /nfs/dbraw/zinc/90/72/95/1075907295.db2.gz GWETZEXUXXALAC-GHMZBOCLSA-N -1 3 389.355 -1.857 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001582204236 1075907288 /nfs/dbraw/zinc/90/72/88/1075907288.db2.gz GWETZEXUXXALAC-GHMZBOCLSA-N -1 3 389.355 -1.857 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001582204237 1075907180 /nfs/dbraw/zinc/90/71/80/1075907180.db2.gz GWETZEXUXXALAC-MNOVXSKESA-N -1 3 389.355 -1.857 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001582204237 1075907173 /nfs/dbraw/zinc/90/71/73/1075907173.db2.gz GWETZEXUXXALAC-MNOVXSKESA-N -1 3 389.355 -1.857 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001582204238 1075907125 /nfs/dbraw/zinc/90/71/25/1075907125.db2.gz GWETZEXUXXALAC-QWRGUYRKSA-N -1 3 389.355 -1.857 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001582204238 1075907120 /nfs/dbraw/zinc/90/71/20/1075907120.db2.gz GWETZEXUXXALAC-QWRGUYRKSA-N -1 3 389.355 -1.857 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001582204239 1075907278 /nfs/dbraw/zinc/90/72/78/1075907278.db2.gz GWETZEXUXXALAC-WDEREUQCSA-N -1 3 389.355 -1.857 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001582204239 1075907272 /nfs/dbraw/zinc/90/72/72/1075907272.db2.gz GWETZEXUXXALAC-WDEREUQCSA-N -1 3 389.355 -1.857 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CCCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001582204243 1075907158 /nfs/dbraw/zinc/90/71/58/1075907158.db2.gz HAVIZYPMNZQFCI-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CCCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001582204243 1075907153 /nfs/dbraw/zinc/90/71/53/1075907153.db2.gz HAVIZYPMNZQFCI-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1CCCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001582204244 1075907367 /nfs/dbraw/zinc/90/73/67/1075907367.db2.gz HAVIZYPMNZQFCI-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1CCCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001582204244 1075907363 /nfs/dbraw/zinc/90/73/63/1075907363.db2.gz HAVIZYPMNZQFCI-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1CCN(c2cccc(F)c2-c2nn[n-]n2)C[C@H]1O ZINC001582204245 1075907322 /nfs/dbraw/zinc/90/73/22/1075907322.db2.gz HBEVUBWDFXHRTN-CMPLNLGQSA-N -1 3 388.367 -1.252 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1CCN(c2cccc(F)c2-c2nnn[n-]2)C[C@H]1O ZINC001582204245 1075907319 /nfs/dbraw/zinc/90/73/19/1075907319.db2.gz HBEVUBWDFXHRTN-CMPLNLGQSA-N -1 3 388.367 -1.252 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1CCN(c2cccc(F)c2-c2nn[n-]n2)C[C@@H]1O ZINC001582204246 1075907144 /nfs/dbraw/zinc/90/71/44/1075907144.db2.gz HBEVUBWDFXHRTN-JQWIXIFHSA-N -1 3 388.367 -1.252 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1CCN(c2cccc(F)c2-c2nnn[n-]2)C[C@@H]1O ZINC001582204246 1075907137 /nfs/dbraw/zinc/90/71/37/1075907137.db2.gz HBEVUBWDFXHRTN-JQWIXIFHSA-N -1 3 388.367 -1.252 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CCN(c2cccc(F)c2-c2nn[n-]n2)C[C@@H]1O ZINC001582204247 1075907339 /nfs/dbraw/zinc/90/73/39/1075907339.db2.gz HBEVUBWDFXHRTN-PWSUYJOCSA-N -1 3 388.367 -1.252 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CCN(c2cccc(F)c2-c2nnn[n-]2)C[C@@H]1O ZINC001582204247 1075907334 /nfs/dbraw/zinc/90/73/34/1075907334.db2.gz HBEVUBWDFXHRTN-PWSUYJOCSA-N -1 3 388.367 -1.252 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CCN(c2cccc(F)c2-c2nn[n-]n2)C[C@H]1O ZINC001582204248 1075907113 /nfs/dbraw/zinc/90/71/13/1075907113.db2.gz HBEVUBWDFXHRTN-ZYHUDNBSSA-N -1 3 388.367 -1.252 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CCN(c2cccc(F)c2-c2nnn[n-]2)C[C@H]1O ZINC001582204248 1075907108 /nfs/dbraw/zinc/90/71/08/1075907108.db2.gz HBEVUBWDFXHRTN-ZYHUDNBSSA-N -1 3 388.367 -1.252 20 0 GAADHM O=C(Cn1cnnn1)NCC[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582204265 1075907309 /nfs/dbraw/zinc/90/73/09/1075907309.db2.gz HJSFJHVEOCFVEK-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NCC[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582204265 1075907305 /nfs/dbraw/zinc/90/73/05/1075907305.db2.gz HJSFJHVEOCFVEK-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NCC[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582204266 1075907097 /nfs/dbraw/zinc/90/70/97/1075907097.db2.gz HJSFJHVEOCFVEK-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NCC[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582204266 1075907094 /nfs/dbraw/zinc/90/70/94/1075907094.db2.gz HJSFJHVEOCFVEK-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NCC1(O)CN(Cc2cc(F)ccc2-c2nn[n-]n2)C1 ZINC001582204276 1075907230 /nfs/dbraw/zinc/90/72/30/1075907230.db2.gz HWOZYDQBVJCBMA-UHFFFAOYSA-N -1 3 388.367 -1.645 20 0 GAADHM O=C(Cn1cnnn1)NCC1(O)CN(Cc2cc(F)ccc2-c2nnn[n-]2)C1 ZINC001582204276 1075907218 /nfs/dbraw/zinc/90/72/18/1075907218.db2.gz HWOZYDQBVJCBMA-UHFFFAOYSA-N -1 3 388.367 -1.645 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001582204282 1075907850 /nfs/dbraw/zinc/90/78/50/1075907850.db2.gz IBBNASSDKIRULG-AWEZNQCLSA-N -1 3 389.355 -1.855 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001582204282 1075907844 /nfs/dbraw/zinc/90/78/44/1075907844.db2.gz IBBNASSDKIRULG-AWEZNQCLSA-N -1 3 389.355 -1.855 20 0 GAADHM O=C(Cn1cnnn1)NC[C@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001582204283 1075907684 /nfs/dbraw/zinc/90/76/84/1075907684.db2.gz IBBNASSDKIRULG-CQSZACIVSA-N -1 3 389.355 -1.855 20 0 GAADHM O=C(Cn1cnnn1)NC[C@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001582204283 1075907680 /nfs/dbraw/zinc/90/76/80/1075907680.db2.gz IBBNASSDKIRULG-CQSZACIVSA-N -1 3 389.355 -1.855 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CCN(Cc2ccc(-c3nnn[n-]3)s2)C[C@H]1O ZINC001582204289 1075907740 /nfs/dbraw/zinc/90/77/40/1075907740.db2.gz IEJMFIAKNHFLBK-GHMZBOCLSA-N -1 3 390.433 -1.334 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CCN(Cc2ccc(-c3nnn[n-]3)s2)C[C@@H]1O ZINC001582204290 1075907618 /nfs/dbraw/zinc/90/76/18/1075907618.db2.gz IEJMFIAKNHFLBK-MNOVXSKESA-N -1 3 390.433 -1.334 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1CCN(Cc2ccc(-c3nnn[n-]3)s2)C[C@@H]1O ZINC001582204291 1075907705 /nfs/dbraw/zinc/90/77/05/1075907705.db2.gz IEJMFIAKNHFLBK-QWRGUYRKSA-N -1 3 390.433 -1.334 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1CCN(Cc2ccc(-c3nnn[n-]3)s2)C[C@H]1O ZINC001582204292 1075907642 /nfs/dbraw/zinc/90/76/42/1075907642.db2.gz IEJMFIAKNHFLBK-WDEREUQCSA-N -1 3 390.433 -1.334 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)CCCO1 ZINC001582204303 1075907835 /nfs/dbraw/zinc/90/78/35/1075907835.db2.gz IKUAZHSAFNUEHN-GFCCVEGCSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)CCCO1 ZINC001582204303 1075907828 /nfs/dbraw/zinc/90/78/28/1075907828.db2.gz IKUAZHSAFNUEHN-GFCCVEGCSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CN(c2ccc(-c3nn[n-]n3)cn2)CCCO1 ZINC001582204304 1075907880 /nfs/dbraw/zinc/90/78/80/1075907880.db2.gz IKUAZHSAFNUEHN-LBPRGKRZSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CN(c2ccc(-c3nnn[n-]3)cn2)CCCO1 ZINC001582204304 1075907876 /nfs/dbraw/zinc/90/78/76/1075907876.db2.gz IKUAZHSAFNUEHN-LBPRGKRZSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CN(Cc2ccccc2-c2nn[n-]n2)CCO1 ZINC001582204319 1075907778 /nfs/dbraw/zinc/90/77/78/1075907778.db2.gz ISQNZGLWAOBJRS-CYBMUJFWSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CN(Cc2ccccc2-c2nnn[n-]2)CCO1 ZINC001582204319 1075907775 /nfs/dbraw/zinc/90/77/75/1075907775.db2.gz ISQNZGLWAOBJRS-CYBMUJFWSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CN(Cc2ccccc2-c2nn[n-]n2)CCO1 ZINC001582204320 1075907668 /nfs/dbraw/zinc/90/76/68/1075907668.db2.gz ISQNZGLWAOBJRS-ZDUSSCGKSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CN(Cc2ccccc2-c2nnn[n-]2)CCO1 ZINC001582204320 1075907663 /nfs/dbraw/zinc/90/76/63/1075907663.db2.gz ISQNZGLWAOBJRS-ZDUSSCGKSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1COCCN1Cc1ccccc1-c1nn[n-]n1 ZINC001582204375 1075907868 /nfs/dbraw/zinc/90/78/68/1075907868.db2.gz JPKHGMIWRUZBMI-CYBMUJFWSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1COCCN1Cc1ccccc1-c1nnn[n-]1 ZINC001582204375 1075907862 /nfs/dbraw/zinc/90/78/62/1075907862.db2.gz JPKHGMIWRUZBMI-CYBMUJFWSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1COCCN1Cc1ccccc1-c1nn[n-]n1 ZINC001582204376 1075907729 /nfs/dbraw/zinc/90/77/29/1075907729.db2.gz JPKHGMIWRUZBMI-ZDUSSCGKSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1COCCN1Cc1ccccc1-c1nnn[n-]1 ZINC001582204376 1075907724 /nfs/dbraw/zinc/90/77/24/1075907724.db2.gz JPKHGMIWRUZBMI-ZDUSSCGKSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CCCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582204390 1075908209 /nfs/dbraw/zinc/90/82/09/1075908209.db2.gz KCRDGVSBXOXKEU-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CCCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582204390 1075908203 /nfs/dbraw/zinc/90/82/03/1075908203.db2.gz KCRDGVSBXOXKEU-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CCCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582204391 1075908315 /nfs/dbraw/zinc/90/83/15/1075908315.db2.gz KCRDGVSBXOXKEU-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CCCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582204391 1075908311 /nfs/dbraw/zinc/90/83/11/1075908311.db2.gz KCRDGVSBXOXKEU-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CCCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582204398 1075908138 /nfs/dbraw/zinc/90/81/38/1075908138.db2.gz KKCHWFWCBWEVBD-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CCCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582204398 1075908131 /nfs/dbraw/zinc/90/81/31/1075908131.db2.gz KKCHWFWCBWEVBD-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CCCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582204399 1075908303 /nfs/dbraw/zinc/90/83/03/1075908303.db2.gz KKCHWFWCBWEVBD-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CCCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582204399 1075908298 /nfs/dbraw/zinc/90/82/98/1075908298.db2.gz KKCHWFWCBWEVBD-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)NCC[C@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582204402 1075908118 /nfs/dbraw/zinc/90/81/18/1075908118.db2.gz KPQYVYIWIDVSNQ-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NCC[C@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582204402 1075908113 /nfs/dbraw/zinc/90/81/13/1075908113.db2.gz KPQYVYIWIDVSNQ-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NCC[C@@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582204403 1075908344 /nfs/dbraw/zinc/90/83/44/1075908344.db2.gz KPQYVYIWIDVSNQ-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NCC[C@@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582204403 1075908339 /nfs/dbraw/zinc/90/83/39/1075908339.db2.gz KPQYVYIWIDVSNQ-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1[C@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]21 ZINC001582204405 1075908275 /nfs/dbraw/zinc/90/82/75/1075908275.db2.gz KRLZIUNNZBDNAE-OWUUHHOZSA-N -1 3 383.376 -1.684 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1[C@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]21 ZINC001582204405 1075908268 /nfs/dbraw/zinc/90/82/68/1075908268.db2.gz KRLZIUNNZBDNAE-OWUUHHOZSA-N -1 3 383.376 -1.684 20 0 GAADHM O=C(Cn1cnnn1)NCC1(O)CN(Cc2ccc(-c3nnn[n-]3)s2)C1 ZINC001582204432 1075908184 /nfs/dbraw/zinc/90/81/84/1075908184.db2.gz LNYSANSMNKALDL-UHFFFAOYSA-N -1 3 376.406 -1.722 20 0 GAADHM O=C(Cn1cnnn1)NCC1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001582204515 1075908641 /nfs/dbraw/zinc/90/86/41/1075908641.db2.gz MNWFOUUQHCXRNB-UHFFFAOYSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NCC1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001582204515 1075908636 /nfs/dbraw/zinc/90/86/36/1075908636.db2.gz MNWFOUUQHCXRNB-UHFFFAOYSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1CCCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001582204523 1075908726 /nfs/dbraw/zinc/90/87/26/1075908726.db2.gz MSODHHXWCDUYEO-JTQLQIEISA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N[C@H]1CCCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001582204523 1075908724 /nfs/dbraw/zinc/90/87/24/1075908724.db2.gz MSODHHXWCDUYEO-JTQLQIEISA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CCCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001582204524 1075908626 /nfs/dbraw/zinc/90/86/26/1075908626.db2.gz MSODHHXWCDUYEO-SNVBAGLBSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N[C@@H]1CCCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001582204524 1075908621 /nfs/dbraw/zinc/90/86/21/1075908621.db2.gz MSODHHXWCDUYEO-SNVBAGLBSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CN(c2ncccc2-c2nn[n-]n2)CCCO1 ZINC001582204541 1075908697 /nfs/dbraw/zinc/90/86/97/1075908697.db2.gz NKHJSOIYXIIHQX-LLVKDONJSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CN(c2ncccc2-c2nnn[n-]2)CCCO1 ZINC001582204541 1075908694 /nfs/dbraw/zinc/90/86/94/1075908694.db2.gz NKHJSOIYXIIHQX-LLVKDONJSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CN(c2ncccc2-c2nn[n-]n2)CCCO1 ZINC001582204542 1075908765 /nfs/dbraw/zinc/90/87/65/1075908765.db2.gz NKHJSOIYXIIHQX-NSHDSACASA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CN(c2ncccc2-c2nnn[n-]2)CCCO1 ZINC001582204542 1075908763 /nfs/dbraw/zinc/90/87/63/1075908763.db2.gz NKHJSOIYXIIHQX-NSHDSACASA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H](CO)NCc1ccc(-c2nn[n-]n2)cc1F ZINC001582204613 1075908738 /nfs/dbraw/zinc/90/87/38/1075908738.db2.gz PESCUMCCZYXPAW-LLVKDONJSA-N -1 3 376.356 -1.741 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H](CO)NCc1ccc(-c2nn[n-]n2)cc1F ZINC001582204614 1075908670 /nfs/dbraw/zinc/90/86/70/1075908670.db2.gz PESCUMCCZYXPAW-NSHDSACASA-N -1 3 376.356 -1.741 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1COCCN1c1ncc(-c2nn[n-]n2)cc1F ZINC001582204626 1075908710 /nfs/dbraw/zinc/90/87/10/1075908710.db2.gz PMDJEIAGWYWOOI-JTQLQIEISA-N -1 3 389.355 -1.591 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1COCCN1c1ncc(-c2nnn[n-]2)cc1F ZINC001582204626 1075908707 /nfs/dbraw/zinc/90/87/07/1075908707.db2.gz PMDJEIAGWYWOOI-JTQLQIEISA-N -1 3 389.355 -1.591 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1COCCN1c1ncc(-c2nn[n-]n2)cc1F ZINC001582204627 1075908759 /nfs/dbraw/zinc/90/87/59/1075908759.db2.gz PMDJEIAGWYWOOI-SNVBAGLBSA-N -1 3 389.355 -1.591 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1COCCN1c1ncc(-c2nnn[n-]2)cc1F ZINC001582204627 1075908757 /nfs/dbraw/zinc/90/87/57/1075908757.db2.gz PMDJEIAGWYWOOI-SNVBAGLBSA-N -1 3 389.355 -1.591 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@]1(O)CCN(c2cccc(F)c2-c2nn[n-]n2)C1 ZINC001582204650 1075909330 /nfs/dbraw/zinc/90/93/30/1075909330.db2.gz PYKDEDIEANGHKG-HNNXBMFYSA-N -1 3 388.367 -1.250 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@]1(O)CCN(c2cccc(F)c2-c2nnn[n-]2)C1 ZINC001582204650 1075909325 /nfs/dbraw/zinc/90/93/25/1075909325.db2.gz PYKDEDIEANGHKG-HNNXBMFYSA-N -1 3 388.367 -1.250 20 0 GAADHM O=C(Cn1cnnn1)NC[C@]1(O)CCN(c2cccc(F)c2-c2nn[n-]n2)C1 ZINC001582204651 1075909025 /nfs/dbraw/zinc/90/90/25/1075909025.db2.gz PYKDEDIEANGHKG-OAHLLOKOSA-N -1 3 388.367 -1.250 20 0 GAADHM O=C(Cn1cnnn1)NC[C@]1(O)CCN(c2cccc(F)c2-c2nnn[n-]2)C1 ZINC001582204651 1075909021 /nfs/dbraw/zinc/90/90/21/1075909021.db2.gz PYKDEDIEANGHKG-OAHLLOKOSA-N -1 3 388.367 -1.250 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CN(Cc2cccc(-c3nn[n-]n3)c2)CCO1 ZINC001582204679 1075909190 /nfs/dbraw/zinc/90/91/90/1075909190.db2.gz QNFMGWCSZBXUGI-AWEZNQCLSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CN(Cc2cccc(-c3nnn[n-]3)c2)CCO1 ZINC001582204679 1075909183 /nfs/dbraw/zinc/90/91/83/1075909183.db2.gz QNFMGWCSZBXUGI-AWEZNQCLSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CN(Cc2cccc(-c3nn[n-]n3)c2)CCO1 ZINC001582204680 1075909110 /nfs/dbraw/zinc/90/91/10/1075909110.db2.gz QNFMGWCSZBXUGI-CQSZACIVSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CN(Cc2cccc(-c3nnn[n-]3)c2)CCO1 ZINC001582204680 1075909105 /nfs/dbraw/zinc/90/91/05/1075909105.db2.gz QNFMGWCSZBXUGI-CQSZACIVSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1cnnn1)NCC1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001582204737 1075909272 /nfs/dbraw/zinc/90/92/72/1075909272.db2.gz RKJKZCCINVGOAE-UHFFFAOYSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NCC1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001582204737 1075909266 /nfs/dbraw/zinc/90/92/66/1075909266.db2.gz RKJKZCCINVGOAE-UHFFFAOYSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CN(Cc2ccc(-c3nn[n-]n3)cc2)CCO1 ZINC001582204750 1075909214 /nfs/dbraw/zinc/90/92/14/1075909214.db2.gz SDAXBCXJYYXKPO-AWEZNQCLSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)cc2)CCO1 ZINC001582204751 1075909135 /nfs/dbraw/zinc/90/91/35/1075909135.db2.gz SDAXBCXJYYXKPO-CQSZACIVSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1CN(Cc2ccc(-c3nnn[n-]3)s2)CCO1 ZINC001582204771 1075909252 /nfs/dbraw/zinc/90/92/52/1075909252.db2.gz SSSMNFGECHQONA-JTQLQIEISA-N -1 3 390.433 -1.068 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)s2)CCO1 ZINC001582204772 1075909075 /nfs/dbraw/zinc/90/90/75/1075909075.db2.gz SSSMNFGECHQONA-SNVBAGLBSA-N -1 3 390.433 -1.068 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1[C@H]2CN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]21 ZINC001582204800 1075909697 /nfs/dbraw/zinc/90/96/97/1075909697.db2.gz UGJNZMPFIFBEOP-RTCCRHLQSA-N -1 3 385.367 -1.114 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1[C@H]2CN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]21 ZINC001582204800 1075909695 /nfs/dbraw/zinc/90/96/95/1075909695.db2.gz UGJNZMPFIFBEOP-RTCCRHLQSA-N -1 3 385.367 -1.114 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1[C@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]21 ZINC001582204873 1075909704 /nfs/dbraw/zinc/90/97/04/1075909704.db2.gz VURJJISQAMXFPX-RTCCRHLQSA-N -1 3 383.376 -1.684 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1[C@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]21 ZINC001582204873 1075909702 /nfs/dbraw/zinc/90/97/02/1075909702.db2.gz VURJJISQAMXFPX-RTCCRHLQSA-N -1 3 383.376 -1.684 20 0 GAADHM O=C(Cn1cnnn1)NC[C@H]1COCCN1Cc1ccc(-c2nnn[n-]2)s1 ZINC001582204985 1075909661 /nfs/dbraw/zinc/90/96/61/1075909661.db2.gz YZGONMDEPYWYGL-JTQLQIEISA-N -1 3 390.433 -1.068 20 0 GAADHM O=C(Cn1cnnn1)NC[C@@H]1COCCN1Cc1ccc(-c2nnn[n-]2)s1 ZINC001582204986 1075909688 /nfs/dbraw/zinc/90/96/88/1075909688.db2.gz YZGONMDEPYWYGL-SNVBAGLBSA-N -1 3 390.433 -1.068 20 0 GAADHM O=C(Cn1cnnn1)NCC1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001582204999 1075909637 /nfs/dbraw/zinc/90/96/37/1075909637.db2.gz ZWSPVNZWBWLJPB-UHFFFAOYSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)NCC1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001582204999 1075909635 /nfs/dbraw/zinc/90/96/35/1075909635.db2.gz ZWSPVNZWBWLJPB-UHFFFAOYSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CC2(C1)CCN(C(=O)c1c[nH]c(-c3nn[n-]n3)c1)C2 ZINC001582205001 1075909667 /nfs/dbraw/zinc/90/96/67/1075909667.db2.gz ADPCQIATAFVHNX-UHFFFAOYSA-N -1 3 383.376 -1.444 20 0 GAADHM O=C(Cn1ncnn1)N1CC2(C1)CCN(C(=O)c1c[nH]c(-c3nnn[n-]3)c1)C2 ZINC001582205001 1075909666 /nfs/dbraw/zinc/90/96/66/1075909666.db2.gz ADPCQIATAFVHNX-UHFFFAOYSA-N -1 3 383.376 -1.444 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2C1 ZINC001582205031 1075910021 /nfs/dbraw/zinc/91/00/21/1075910021.db2.gz BNYYMRZZAFEJFK-PHIMTYICSA-N -1 3 383.376 -1.588 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2C1 ZINC001582205031 1075910016 /nfs/dbraw/zinc/91/00/16/1075910016.db2.gz BNYYMRZZAFEJFK-PHIMTYICSA-N -1 3 383.376 -1.588 20 0 GAADHM O=C(Cn1ncnn1)N1CCC(O)(CNc2ncccc2-c2nn[n-]n2)CC1 ZINC001582205044 1075909868 /nfs/dbraw/zinc/90/98/68/1075909868.db2.gz CHRLKNLZUSVSJO-UHFFFAOYSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1ncnn1)N1CCC(O)(CNc2ncccc2-c2nnn[n-]2)CC1 ZINC001582205044 1075909865 /nfs/dbraw/zinc/90/98/65/1075909865.db2.gz CHRLKNLZUSVSJO-UHFFFAOYSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H]2C1 ZINC001582205072 1075910179 /nfs/dbraw/zinc/91/01/79/1075910179.db2.gz DSSKFLCNZMYRCY-JOYOIKCWSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@@H]2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H]2C1 ZINC001582205072 1075910172 /nfs/dbraw/zinc/91/01/72/1075910172.db2.gz DSSKFLCNZMYRCY-JOYOIKCWSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1ncnn1)N1CCCO[C@H](CNc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582205080 1075910153 /nfs/dbraw/zinc/91/01/53/1075910153.db2.gz FOAFSHNFWMYILM-GFCCVEGCSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1ncnn1)N1CCCO[C@H](CNc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582205080 1075910144 /nfs/dbraw/zinc/91/01/44/1075910144.db2.gz FOAFSHNFWMYILM-GFCCVEGCSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1ncnn1)N1CCCO[C@@H](CNc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582205081 1075909958 /nfs/dbraw/zinc/90/99/58/1075909958.db2.gz FOAFSHNFWMYILM-LBPRGKRZSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1ncnn1)N1CCCO[C@@H](CNc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582205081 1075909953 /nfs/dbraw/zinc/90/99/53/1075909953.db2.gz FOAFSHNFWMYILM-LBPRGKRZSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1ncnn1)N(CCO)CCNc1cccc(F)c1-c1nn[n-]n1 ZINC001582205105 1075909899 /nfs/dbraw/zinc/90/98/99/1075909899.db2.gz GFYHHFGYXLJGJM-UHFFFAOYSA-N -1 3 376.356 -1.075 20 0 GAADHM O=C(Cn1ncnn1)N(CCO)CCNc1cccc(F)c1-c1nnn[n-]1 ZINC001582205105 1075909894 /nfs/dbraw/zinc/90/98/94/1075909894.db2.gz GFYHHFGYXLJGJM-UHFFFAOYSA-N -1 3 376.356 -1.075 20 0 GAADHM O=C(Cn1ncnn1)N1CC[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H]2C1 ZINC001582205110 1075910044 /nfs/dbraw/zinc/91/00/44/1075910044.db2.gz GMSHWEBDEZXVEF-BXKDBHETSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1ncnn1)N1CC[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H]2C1 ZINC001582205110 1075910036 /nfs/dbraw/zinc/91/00/36/1075910036.db2.gz GMSHWEBDEZXVEF-BXKDBHETSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1ncnn1)N1CCCO[C@H](CNc2ncccc2-c2nn[n-]n2)C1 ZINC001582205130 1075909940 /nfs/dbraw/zinc/90/99/40/1075909940.db2.gz GZGLBTBLNYVWFH-LLVKDONJSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1ncnn1)N1CCCO[C@H](CNc2ncccc2-c2nnn[n-]2)C1 ZINC001582205130 1075909935 /nfs/dbraw/zinc/90/99/35/1075909935.db2.gz GZGLBTBLNYVWFH-LLVKDONJSA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1ncnn1)N1CCCO[C@@H](CNc2ncccc2-c2nn[n-]n2)C1 ZINC001582205131 1075909995 /nfs/dbraw/zinc/90/99/95/1075909995.db2.gz GZGLBTBLNYVWFH-NSHDSACASA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1ncnn1)N1CCCO[C@@H](CNc2ncccc2-c2nnn[n-]2)C1 ZINC001582205131 1075909990 /nfs/dbraw/zinc/90/99/90/1075909990.db2.gz GZGLBTBLNYVWFH-NSHDSACASA-N -1 3 385.392 -1.022 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582205192 1075910386 /nfs/dbraw/zinc/91/03/86/1075910386.db2.gz JTHGQIAIQGNZKX-PHIMTYICSA-N -1 3 383.376 -1.303 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582205192 1075910380 /nfs/dbraw/zinc/91/03/80/1075910380.db2.gz JTHGQIAIQGNZKX-PHIMTYICSA-N -1 3 383.376 -1.303 20 0 GAADHM O=C(Cn1ncnn1)N1CC[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H]2C1 ZINC001582205264 1075910637 /nfs/dbraw/zinc/91/06/37/1075910637.db2.gz MIVJFZKUUBBDKS-BXKDBHETSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1ncnn1)N1CC[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H]2C1 ZINC001582205264 1075910634 /nfs/dbraw/zinc/91/06/34/1075910634.db2.gz MIVJFZKUUBBDKS-BXKDBHETSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@](CO)(Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001582205292 1075910935 /nfs/dbraw/zinc/91/09/35/1075910935.db2.gz NNGXYLSTWHRYGJ-HNNXBMFYSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@](CO)(Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001582205292 1075910931 /nfs/dbraw/zinc/91/09/31/1075910931.db2.gz NNGXYLSTWHRYGJ-HNNXBMFYSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@@](CO)(Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001582205293 1075911068 /nfs/dbraw/zinc/91/10/68/1075911068.db2.gz NNGXYLSTWHRYGJ-OAHLLOKOSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@@](CO)(Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001582205293 1075911065 /nfs/dbraw/zinc/91/10/65/1075911065.db2.gz NNGXYLSTWHRYGJ-OAHLLOKOSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2C1 ZINC001582205300 1075911092 /nfs/dbraw/zinc/91/10/92/1075911092.db2.gz NUAKHXQNSNGOAH-AOOOYVTPSA-N -1 3 383.376 -1.588 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2C1 ZINC001582205300 1075911088 /nfs/dbraw/zinc/91/10/88/1075911088.db2.gz NUAKHXQNSNGOAH-AOOOYVTPSA-N -1 3 383.376 -1.588 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@](CO)(Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582205313 1075910977 /nfs/dbraw/zinc/91/09/77/1075910977.db2.gz OHWMUKKYUSQYOI-HNNXBMFYSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@](CO)(Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582205313 1075910973 /nfs/dbraw/zinc/91/09/73/1075910973.db2.gz OHWMUKKYUSQYOI-HNNXBMFYSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@@](CO)(Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582205314 1075910921 /nfs/dbraw/zinc/91/09/21/1075910921.db2.gz OHWMUKKYUSQYOI-OAHLLOKOSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@@](CO)(Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582205314 1075910915 /nfs/dbraw/zinc/91/09/15/1075910915.db2.gz OHWMUKKYUSQYOI-OAHLLOKOSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582205324 1075911042 /nfs/dbraw/zinc/91/10/42/1075911042.db2.gz OYVOCPRNMNZIIR-AOOOYVTPSA-N -1 3 383.376 -1.303 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582205324 1075911038 /nfs/dbraw/zinc/91/10/38/1075911038.db2.gz OYVOCPRNMNZIIR-AOOOYVTPSA-N -1 3 383.376 -1.303 20 0 GAADHM O=C(Cn1ncnn1)N(CCO)CCNc1ncc(-c2nn[n-]n2)cc1F ZINC001582205351 1075911112 /nfs/dbraw/zinc/91/11/12/1075911112.db2.gz PYMCMIIAVDBLFN-UHFFFAOYSA-N -1 3 377.344 -1.680 20 0 GAADHM O=C(Cn1ncnn1)N(CCO)CCNc1ncc(-c2nnn[n-]2)cc1F ZINC001582205351 1075911111 /nfs/dbraw/zinc/91/11/11/1075911111.db2.gz PYMCMIIAVDBLFN-UHFFFAOYSA-N -1 3 377.344 -1.680 20 0 GAADHM O=C(Cn1ncnn1)N1CCC(O)(CNc2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001582205364 1075911458 /nfs/dbraw/zinc/91/14/58/1075911458.db2.gz QFLTYMTYKYPPOD-UHFFFAOYSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1ncnn1)N1CCC(O)(CNc2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001582205364 1075911451 /nfs/dbraw/zinc/91/14/51/1075911451.db2.gz QFLTYMTYKYPPOD-UHFFFAOYSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@H]2CN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]2C1 ZINC001582205365 1075911375 /nfs/dbraw/zinc/91/13/75/1075911375.db2.gz QIOXGOMTTCIEBD-PHIMTYICSA-N -1 3 385.367 -1.018 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@H]2CN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]2C1 ZINC001582205365 1075911371 /nfs/dbraw/zinc/91/13/71/1075911371.db2.gz QIOXGOMTTCIEBD-PHIMTYICSA-N -1 3 385.367 -1.018 20 0 GAADHM O=C(Cn1ncnn1)N1CCC(O)(CNc2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001582205410 1075911388 /nfs/dbraw/zinc/91/13/88/1075911388.db2.gz SPHHCHGCEIDMRN-UHFFFAOYSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1ncnn1)N1CCC(O)(CNc2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001582205410 1075911384 /nfs/dbraw/zinc/91/13/84/1075911384.db2.gz SPHHCHGCEIDMRN-UHFFFAOYSA-N -1 3 385.392 -1.286 20 0 GAADHM O=C(Cn1ncnn1)N1CC2(C1)CCN(C(=O)c1cc(-c3nn[n-]n3)c[nH]1)C2 ZINC001582205426 1075911404 /nfs/dbraw/zinc/91/14/04/1075911404.db2.gz UETKKDNMYXXLHD-UHFFFAOYSA-N -1 3 383.376 -1.444 20 0 GAADHM O=C(Cn1ncnn1)N1CC2(C1)CCN(C(=O)c1cc(-c3nnn[n-]3)c[nH]1)C2 ZINC001582205426 1075911400 /nfs/dbraw/zinc/91/14/00/1075911400.db2.gz UETKKDNMYXXLHD-UHFFFAOYSA-N -1 3 383.376 -1.444 20 0 GAADHM O=C(Cn1ncnn1)N1CCC2(CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)C1 ZINC001582205474 1075911665 /nfs/dbraw/zinc/91/16/65/1075911665.db2.gz WJUZJTBXBHRZEU-UHFFFAOYSA-N -1 3 383.376 -1.444 20 0 GAADHM O=C(Cn1ncnn1)N1CCC2(CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)C1 ZINC001582205474 1075911662 /nfs/dbraw/zinc/91/16/62/1075911662.db2.gz WJUZJTBXBHRZEU-UHFFFAOYSA-N -1 3 383.376 -1.444 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H]2C1 ZINC001582205534 1075911995 /nfs/dbraw/zinc/91/19/95/1075911995.db2.gz ZFADKYFSBDPIPT-JOYOIKCWSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H]2C1 ZINC001582205534 1075911991 /nfs/dbraw/zinc/91/19/91/1075911991.db2.gz ZFADKYFSBDPIPT-JOYOIKCWSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@@H]2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H]2C1 ZINC001582205551 1075911924 /nfs/dbraw/zinc/91/19/24/1075911924.db2.gz ZZYXVTOFIUTEPI-JOYOIKCWSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@@H]2CCN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H]2C1 ZINC001582205551 1075911920 /nfs/dbraw/zinc/91/19/20/1075911920.db2.gz ZZYXVTOFIUTEPI-JOYOIKCWSA-N -1 3 383.376 -1.446 20 0 GAADHM O=C(Cn1ncnn1)N[C@H]1CCCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001582205616 1075911821 /nfs/dbraw/zinc/91/18/21/1075911821.db2.gz BUHYXHFGMXMKJN-JTQLQIEISA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N[C@H]1CCCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001582205616 1075911815 /nfs/dbraw/zinc/91/18/15/1075911815.db2.gz BUHYXHFGMXMKJN-JTQLQIEISA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CCCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001582205617 1075911802 /nfs/dbraw/zinc/91/18/02/1075911802.db2.gz BUHYXHFGMXMKJN-SNVBAGLBSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CCCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001582205617 1075911796 /nfs/dbraw/zinc/91/17/96/1075911796.db2.gz BUHYXHFGMXMKJN-SNVBAGLBSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CCCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001582205647 1075912625 /nfs/dbraw/zinc/91/26/25/1075912625.db2.gz CRBWIIDMYZQOHL-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CCCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001582205647 1075912617 /nfs/dbraw/zinc/91/26/17/1075912617.db2.gz CRBWIIDMYZQOHL-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N[C@H]1CCCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001582205648 1075912441 /nfs/dbraw/zinc/91/24/41/1075912441.db2.gz CRBWIIDMYZQOHL-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N[C@H]1CCCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001582205648 1075912437 /nfs/dbraw/zinc/91/24/37/1075912437.db2.gz CRBWIIDMYZQOHL-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1CCCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582205669 1075912498 /nfs/dbraw/zinc/91/24/98/1075912498.db2.gz DDZIPIPAVWZZPX-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1CCCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582205669 1075912497 /nfs/dbraw/zinc/91/24/97/1075912497.db2.gz DDZIPIPAVWZZPX-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1CCCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582205670 1075912459 /nfs/dbraw/zinc/91/24/59/1075912459.db2.gz DDZIPIPAVWZZPX-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1CCCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582205670 1075912453 /nfs/dbraw/zinc/91/24/53/1075912453.db2.gz DDZIPIPAVWZZPX-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1[C@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]21 ZINC001582205710 1075912410 /nfs/dbraw/zinc/91/24/10/1075912410.db2.gz FPPKPMLOLDDGGK-OWUUHHOZSA-N -1 3 383.376 -1.684 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1[C@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]21 ZINC001582205710 1075912407 /nfs/dbraw/zinc/91/24/07/1075912407.db2.gz FPPKPMLOLDDGGK-OWUUHHOZSA-N -1 3 383.376 -1.684 20 0 GAADHM O=C(Cn1ncnn1)NC1(CCO)CN(Cc2ccc(-c3nn[n-]n3)cc2)C1 ZINC001582205747 1075912544 /nfs/dbraw/zinc/91/25/44/1075912544.db2.gz GNTIVTPYAFRULG-UHFFFAOYSA-N -1 3 384.404 -1.394 20 0 GAADHM O=C(Cn1ncnn1)NC1(CCO)CN(Cc2ccc(-c3nnn[n-]3)cc2)C1 ZINC001582205747 1075912540 /nfs/dbraw/zinc/91/25/40/1075912540.db2.gz GNTIVTPYAFRULG-UHFFFAOYSA-N -1 3 384.404 -1.394 20 0 GAADHM O=C(Cn1ncnn1)NC1(CO)CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001582205804 1075913096 /nfs/dbraw/zinc/91/30/96/1075913096.db2.gz IBRAZIMEDMXMOI-UHFFFAOYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1ncnn1)NC1(CO)CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001582205804 1075913092 /nfs/dbraw/zinc/91/30/92/1075913092.db2.gz IBRAZIMEDMXMOI-UHFFFAOYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1ncnn1)NC1(CCO)CN(Cc2cccc(-c3nn[n-]n3)c2)C1 ZINC001582205891 1075912918 /nfs/dbraw/zinc/91/29/18/1075912918.db2.gz LCZIRPVOTHORSL-UHFFFAOYSA-N -1 3 384.404 -1.394 20 0 GAADHM O=C(Cn1ncnn1)NC1(CCO)CN(Cc2cccc(-c3nnn[n-]3)c2)C1 ZINC001582205891 1075912910 /nfs/dbraw/zinc/91/29/10/1075912910.db2.gz LCZIRPVOTHORSL-UHFFFAOYSA-N -1 3 384.404 -1.394 20 0 GAADHM O=C(Cn1ncnn1)NCC1(O)CN(Cc2ccc(-c3nnn[n-]3)s2)C1 ZINC001582205894 1075912812 /nfs/dbraw/zinc/91/28/12/1075912812.db2.gz LGAVXUXKCWOWAQ-UHFFFAOYSA-N -1 3 376.406 -1.722 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CCCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001582205898 1075913014 /nfs/dbraw/zinc/91/30/14/1075913014.db2.gz LHDQRZRPUDHWLI-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CCCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001582205898 1075913008 /nfs/dbraw/zinc/91/30/08/1075913008.db2.gz LHDQRZRPUDHWLI-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N[C@H]1CCCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001582205899 1075912888 /nfs/dbraw/zinc/91/28/88/1075912888.db2.gz LHDQRZRPUDHWLI-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N[C@H]1CCCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001582205899 1075912877 /nfs/dbraw/zinc/91/28/77/1075912877.db2.gz LHDQRZRPUDHWLI-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)NCC1(O)CN(Cc2cc(F)ccc2-c2nn[n-]n2)C1 ZINC001582205961 1075913054 /nfs/dbraw/zinc/91/30/54/1075913054.db2.gz LUVRQGDEPLJQHZ-UHFFFAOYSA-N -1 3 388.367 -1.645 20 0 GAADHM O=C(Cn1ncnn1)NCC1(O)CN(Cc2cc(F)ccc2-c2nnn[n-]2)C1 ZINC001582205961 1075913051 /nfs/dbraw/zinc/91/30/51/1075913051.db2.gz LUVRQGDEPLJQHZ-UHFFFAOYSA-N -1 3 388.367 -1.645 20 0 GAADHM O=C(Cn1ncnn1)NCC1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001582205998 1075913538 /nfs/dbraw/zinc/91/35/38/1075913538.db2.gz MCCRCNIUXBRLKJ-UHFFFAOYSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)NCC1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001582205998 1075913537 /nfs/dbraw/zinc/91/35/37/1075913537.db2.gz MCCRCNIUXBRLKJ-UHFFFAOYSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H](CO)NCc1ccc(-c2nn[n-]n2)cc1F ZINC001582206166 1075913498 /nfs/dbraw/zinc/91/34/98/1075913498.db2.gz MNVRQAIZODGTDI-LLVKDONJSA-N -1 3 376.356 -1.741 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H](CO)NCc1ccc(-c2nn[n-]n2)cc1F ZINC001582206167 1075913559 /nfs/dbraw/zinc/91/35/59/1075913559.db2.gz MNVRQAIZODGTDI-NSHDSACASA-N -1 3 376.356 -1.741 20 0 GAADHM O=C(Cn1ncnn1)NCC1(O)CN(Cc2cc(-c3nn[n-]n3)ccc2F)C1 ZINC001582206170 1075913504 /nfs/dbraw/zinc/91/35/04/1075913504.db2.gz MQWXBHCPUSFUHB-UHFFFAOYSA-N -1 3 388.367 -1.645 20 0 GAADHM O=C(Cn1ncnn1)NCC1(O)CN(Cc2cc(-c3nnn[n-]3)ccc2F)C1 ZINC001582206170 1075913502 /nfs/dbraw/zinc/91/35/02/1075913502.db2.gz MQWXBHCPUSFUHB-UHFFFAOYSA-N -1 3 388.367 -1.645 20 0 GAADHM O=C(Cn1ncnn1)NC1(CCO)CN(Cc2ccccc2-c2nn[n-]n2)C1 ZINC001582206196 1075913545 /nfs/dbraw/zinc/91/35/45/1075913545.db2.gz NGNWINIWZINNMA-UHFFFAOYSA-N -1 3 384.404 -1.394 20 0 GAADHM O=C(Cn1ncnn1)NC1(CCO)CN(Cc2ccccc2-c2nnn[n-]2)C1 ZINC001582206196 1075913544 /nfs/dbraw/zinc/91/35/44/1075913544.db2.gz NGNWINIWZINNMA-UHFFFAOYSA-N -1 3 384.404 -1.394 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1CCCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582206207 1075913524 /nfs/dbraw/zinc/91/35/24/1075913524.db2.gz NSGFUAMDYDDXCK-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1CCCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582206207 1075913522 /nfs/dbraw/zinc/91/35/22/1075913522.db2.gz NSGFUAMDYDDXCK-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1CCCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582206208 1075913485 /nfs/dbraw/zinc/91/34/85/1075913485.db2.gz NSGFUAMDYDDXCK-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1CCCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582206208 1075913481 /nfs/dbraw/zinc/91/34/81/1075913481.db2.gz NSGFUAMDYDDXCK-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)NC1(CO)CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001582206217 1075913562 /nfs/dbraw/zinc/91/35/62/1075913562.db2.gz OBPPNYKHNRJPLX-UHFFFAOYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1ncnn1)NC1(CO)CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001582206217 1075913561 /nfs/dbraw/zinc/91/35/61/1075913561.db2.gz OBPPNYKHNRJPLX-UHFFFAOYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1ncnn1)NC1(CCO)CN(Cc2ccc(-c3nnn[n-]3)s2)C1 ZINC001582206440 1075913942 /nfs/dbraw/zinc/91/39/42/1075913942.db2.gz SFXHZZFRNCONRP-UHFFFAOYSA-N -1 3 390.433 -1.332 20 0 GAADHM O=C(Cn1ncnn1)NCC1(O)CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C1 ZINC001582206553 1075913862 /nfs/dbraw/zinc/91/38/62/1075913862.db2.gz SOHQUJIHHXRIQD-UHFFFAOYSA-N -1 3 388.367 -1.645 20 0 GAADHM O=C(Cn1ncnn1)NCC1(O)CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C1 ZINC001582206553 1075913858 /nfs/dbraw/zinc/91/38/58/1075913858.db2.gz SOHQUJIHHXRIQD-UHFFFAOYSA-N -1 3 388.367 -1.645 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@]1(O)CCN(c2cccc(F)c2-c2nn[n-]n2)C1 ZINC001582206566 1075913799 /nfs/dbraw/zinc/91/37/99/1075913799.db2.gz SWARQVUIPIGZEL-HNNXBMFYSA-N -1 3 388.367 -1.250 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@]1(O)CCN(c2cccc(F)c2-c2nnn[n-]2)C1 ZINC001582206566 1075913795 /nfs/dbraw/zinc/91/37/95/1075913795.db2.gz SWARQVUIPIGZEL-HNNXBMFYSA-N -1 3 388.367 -1.250 20 0 GAADHM O=C(Cn1ncnn1)NC[C@]1(O)CCN(c2cccc(F)c2-c2nn[n-]n2)C1 ZINC001582206567 1075913879 /nfs/dbraw/zinc/91/38/79/1075913879.db2.gz SWARQVUIPIGZEL-OAHLLOKOSA-N -1 3 388.367 -1.250 20 0 GAADHM O=C(Cn1ncnn1)NC[C@]1(O)CCN(c2cccc(F)c2-c2nnn[n-]2)C1 ZINC001582206567 1075913875 /nfs/dbraw/zinc/91/38/75/1075913875.db2.gz SWARQVUIPIGZEL-OAHLLOKOSA-N -1 3 388.367 -1.250 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001582206617 1075914356 /nfs/dbraw/zinc/91/43/56/1075914356.db2.gz UWPUPXSNFMUMKT-GHMZBOCLSA-N -1 3 389.355 -1.857 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001582206617 1075914350 /nfs/dbraw/zinc/91/43/50/1075914350.db2.gz UWPUPXSNFMUMKT-GHMZBOCLSA-N -1 3 389.355 -1.857 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001582206618 1075914423 /nfs/dbraw/zinc/91/44/23/1075914423.db2.gz UWPUPXSNFMUMKT-MNOVXSKESA-N -1 3 389.355 -1.857 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001582206618 1075914420 /nfs/dbraw/zinc/91/44/20/1075914420.db2.gz UWPUPXSNFMUMKT-MNOVXSKESA-N -1 3 389.355 -1.857 20 0 GAADHM O=C(Cn1ncnn1)N[C@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001582206619 1075914297 /nfs/dbraw/zinc/91/42/97/1075914297.db2.gz UWPUPXSNFMUMKT-QWRGUYRKSA-N -1 3 389.355 -1.857 20 0 GAADHM O=C(Cn1ncnn1)N[C@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001582206619 1075914296 /nfs/dbraw/zinc/91/42/96/1075914296.db2.gz UWPUPXSNFMUMKT-QWRGUYRKSA-N -1 3 389.355 -1.857 20 0 GAADHM O=C(Cn1ncnn1)N[C@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001582206620 1075914377 /nfs/dbraw/zinc/91/43/77/1075914377.db2.gz UWPUPXSNFMUMKT-WDEREUQCSA-N -1 3 389.355 -1.857 20 0 GAADHM O=C(Cn1ncnn1)N[C@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001582206620 1075914372 /nfs/dbraw/zinc/91/43/72/1075914372.db2.gz UWPUPXSNFMUMKT-WDEREUQCSA-N -1 3 389.355 -1.857 20 0 GAADHM O=C(Cn1ncnn1)N[C@@]1(CO)CCCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001582206837 1075914471 /nfs/dbraw/zinc/91/44/71/1075914471.db2.gz XELACJCUYZYBRN-HNNXBMFYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1ncnn1)N[C@@]1(CO)CCCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001582206837 1075914467 /nfs/dbraw/zinc/91/44/67/1075914467.db2.gz XELACJCUYZYBRN-HNNXBMFYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1ncnn1)N[C@]1(CO)CCCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001582206839 1075914292 /nfs/dbraw/zinc/91/42/92/1075914292.db2.gz XELACJCUYZYBRN-OAHLLOKOSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1ncnn1)N[C@]1(CO)CCCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001582206839 1075914290 /nfs/dbraw/zinc/91/42/90/1075914290.db2.gz XELACJCUYZYBRN-OAHLLOKOSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1[C@H]2CN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]21 ZINC001582206867 1075914320 /nfs/dbraw/zinc/91/43/20/1075914320.db2.gz XIHMJNQAAOSCEW-RTCCRHLQSA-N -1 3 385.367 -1.114 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1[C@H]2CN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]21 ZINC001582206867 1075914316 /nfs/dbraw/zinc/91/43/16/1075914316.db2.gz XIHMJNQAAOSCEW-RTCCRHLQSA-N -1 3 385.367 -1.114 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001582206908 1075914263 /nfs/dbraw/zinc/91/42/63/1075914263.db2.gz XUUYIEOKXVQMNA-AWEZNQCLSA-N -1 3 389.355 -1.855 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001582206908 1075914261 /nfs/dbraw/zinc/91/42/61/1075914261.db2.gz XUUYIEOKXVQMNA-AWEZNQCLSA-N -1 3 389.355 -1.855 20 0 GAADHM O=C(Cn1ncnn1)NC[C@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001582206909 1075914870 /nfs/dbraw/zinc/91/48/70/1075914870.db2.gz XUUYIEOKXVQMNA-CQSZACIVSA-N -1 3 389.355 -1.855 20 0 GAADHM O=C(Cn1ncnn1)NC[C@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001582206909 1075914867 /nfs/dbraw/zinc/91/48/67/1075914867.db2.gz XUUYIEOKXVQMNA-CQSZACIVSA-N -1 3 389.355 -1.855 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]21 ZINC001582206926 1075914836 /nfs/dbraw/zinc/91/48/36/1075914836.db2.gz XZZKSQFFXILYJJ-RTCCRHLQSA-N -1 3 383.376 -1.684 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]21 ZINC001582206926 1075914834 /nfs/dbraw/zinc/91/48/34/1075914834.db2.gz XZZKSQFFXILYJJ-RTCCRHLQSA-N -1 3 383.376 -1.684 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1CCCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582207062 1075914861 /nfs/dbraw/zinc/91/48/61/1075914861.db2.gz YMKIHYKBIMCQPK-JTQLQIEISA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1CCCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582207062 1075914856 /nfs/dbraw/zinc/91/48/56/1075914856.db2.gz YMKIHYKBIMCQPK-JTQLQIEISA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1CCCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582207064 1075914827 /nfs/dbraw/zinc/91/48/27/1075914827.db2.gz YMKIHYKBIMCQPK-SNVBAGLBSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1CCCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582207064 1075914823 /nfs/dbraw/zinc/91/48/23/1075914823.db2.gz YMKIHYKBIMCQPK-SNVBAGLBSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)NC1(CO)CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001582207078 1075914788 /nfs/dbraw/zinc/91/47/88/1075914788.db2.gz YVMLNVQCVSTMJL-UHFFFAOYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1ncnn1)NC1(CO)CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001582207078 1075914785 /nfs/dbraw/zinc/91/47/85/1075914785.db2.gz YVMLNVQCVSTMJL-UHFFFAOYSA-N -1 3 385.392 -1.604 20 0 GAADHM O=C(Cn1ncnn1)NCC1(O)CN(Cc2ccc(-c3nn[n-]n3)cc2F)C1 ZINC001582207106 1075914943 /nfs/dbraw/zinc/91/49/43/1075914943.db2.gz ZLMLPWOTGDMIGZ-UHFFFAOYSA-N -1 3 388.367 -1.645 20 0 GAADHM O=C(Cn1ncnn1)NCC1(O)CN(Cc2ccc(-c3nnn[n-]3)cc2F)C1 ZINC001582207106 1075914936 /nfs/dbraw/zinc/91/49/36/1075914936.db2.gz ZLMLPWOTGDMIGZ-UHFFFAOYSA-N -1 3 388.367 -1.645 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C[C@H]1O ZINC001582207213 1075914771 /nfs/dbraw/zinc/91/47/71/1075914771.db2.gz CALTUHOJRZTEQM-CHWSQXEVSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C[C@H]1O ZINC001582207213 1075914766 /nfs/dbraw/zinc/91/47/66/1075914766.db2.gz CALTUHOJRZTEQM-CHWSQXEVSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001582207229 1075914720 /nfs/dbraw/zinc/91/47/20/1075914720.db2.gz CVWZETMBUVMWLL-NXEZZACHSA-N -1 3 375.328 -2.247 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001582207229 1075914714 /nfs/dbraw/zinc/91/47/14/1075914714.db2.gz CVWZETMBUVMWLL-NXEZZACHSA-N -1 3 375.328 -2.247 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1COCCN1Cc1ccc(-c2nn[n-]n2)cc1 ZINC001582207310 1075914918 /nfs/dbraw/zinc/91/49/18/1075914918.db2.gz JSSCSDBCXHWSEJ-AWEZNQCLSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1COCCN1Cc1ccc(-c2nnn[n-]2)cc1 ZINC001582207310 1075914917 /nfs/dbraw/zinc/91/49/17/1075914917.db2.gz JSSCSDBCXHWSEJ-AWEZNQCLSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1COCCN1Cc1ccc(-c2nn[n-]n2)cc1 ZINC001582207311 1075914682 /nfs/dbraw/zinc/91/46/82/1075914682.db2.gz JSSCSDBCXHWSEJ-CQSZACIVSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1COCCN1Cc1ccc(-c2nnn[n-]2)cc1 ZINC001582207311 1075914676 /nfs/dbraw/zinc/91/46/76/1075914676.db2.gz JSSCSDBCXHWSEJ-CQSZACIVSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1ncnn1)NCCN1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001582207327 1075914849 /nfs/dbraw/zinc/91/48/49/1075914849.db2.gz KLKSQJRGHAUEAK-UHFFFAOYSA-N -1 3 384.408 -1.813 20 0 GAADHM O=C(Cn1ncnn1)NCCN1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001582207327 1075914846 /nfs/dbraw/zinc/91/48/46/1075914846.db2.gz KLKSQJRGHAUEAK-UHFFFAOYSA-N -1 3 384.408 -1.813 20 0 GAADHM O=C(Cn1ncnn1)NCCN1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001582207341 1075914799 /nfs/dbraw/zinc/91/47/99/1075914799.db2.gz LESCUUQIWRNHKR-UHFFFAOYSA-N -1 3 384.408 -1.813 20 0 GAADHM O=C(Cn1ncnn1)NCCN1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001582207341 1075914798 /nfs/dbraw/zinc/91/47/98/1075914798.db2.gz LESCUUQIWRNHKR-UHFFFAOYSA-N -1 3 384.408 -1.813 20 0 GAADHM O=C(Cn1ncnn1)NCC[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582207351 1075914781 /nfs/dbraw/zinc/91/47/81/1075914781.db2.gz LPIQYVLBNORBGV-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)NCC[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582207351 1075914777 /nfs/dbraw/zinc/91/47/77/1075914777.db2.gz LPIQYVLBNORBGV-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)NCC[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582207352 1075914884 /nfs/dbraw/zinc/91/48/84/1075914884.db2.gz LPIQYVLBNORBGV-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)NCC[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582207352 1075914878 /nfs/dbraw/zinc/91/48/78/1075914878.db2.gz LPIQYVLBNORBGV-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1COCCN1Cc1ccc(-c2nnn[n-]2)s1 ZINC001582207382 1075914899 /nfs/dbraw/zinc/91/48/99/1075914899.db2.gz MSXIUMUNZAHFPA-JTQLQIEISA-N -1 3 390.433 -1.068 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1COCCN1Cc1ccc(-c2nnn[n-]2)s1 ZINC001582207383 1075914809 /nfs/dbraw/zinc/91/48/09/1075914809.db2.gz MSXIUMUNZAHFPA-SNVBAGLBSA-N -1 3 390.433 -1.068 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C[C@H]1O ZINC001582207423 1075915307 /nfs/dbraw/zinc/91/53/07/1075915307.db2.gz OFGLWRUKGCTTDC-CHWSQXEVSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C[C@H]1O ZINC001582207423 1075915305 /nfs/dbraw/zinc/91/53/05/1075915305.db2.gz OFGLWRUKGCTTDC-CHWSQXEVSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)CCCO1 ZINC001582207456 1075915374 /nfs/dbraw/zinc/91/53/74/1075915374.db2.gz QBRNCXRCTMIOJQ-GFCCVEGCSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)CCCO1 ZINC001582207456 1075915372 /nfs/dbraw/zinc/91/53/72/1075915372.db2.gz QBRNCXRCTMIOJQ-GFCCVEGCSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1CN(c2ccc(-c3nn[n-]n3)cn2)CCCO1 ZINC001582207457 1075915282 /nfs/dbraw/zinc/91/52/82/1075915282.db2.gz QBRNCXRCTMIOJQ-LBPRGKRZSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1CN(c2ccc(-c3nnn[n-]3)cn2)CCCO1 ZINC001582207457 1075915278 /nfs/dbraw/zinc/91/52/78/1075915278.db2.gz QBRNCXRCTMIOJQ-LBPRGKRZSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CN(Cc2cc(F)ccc2-c2nn[n-]n2)C[C@H]1O ZINC001582207461 1075915356 /nfs/dbraw/zinc/91/53/56/1075915356.db2.gz QHDWPEWEBYDHSS-CHWSQXEVSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CN(Cc2cc(F)ccc2-c2nn[n-]n2)C[C@@H]1O ZINC001582207462 1075915321 /nfs/dbraw/zinc/91/53/21/1075915321.db2.gz QHDWPEWEBYDHSS-OLZOCXBDSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582207485 1075915330 /nfs/dbraw/zinc/91/53/30/1075915330.db2.gz RLSBHBVZBNZPGB-FOGDFJRCSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582207485 1075915327 /nfs/dbraw/zinc/91/53/27/1075915327.db2.gz RLSBHBVZBNZPGB-FOGDFJRCSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(Cn1ncnn1)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582207486 1075915224 /nfs/dbraw/zinc/91/52/24/1075915224.db2.gz RLSBHBVZBNZPGB-SCVCMEIPSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(Cn1ncnn1)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582207486 1075915222 /nfs/dbraw/zinc/91/52/22/1075915222.db2.gz RLSBHBVZBNZPGB-SCVCMEIPSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)s2)C[C@H]1O ZINC001582207490 1075915380 /nfs/dbraw/zinc/91/53/80/1075915380.db2.gz RSSGYFJURKFFGY-NXEZZACHSA-N -1 3 376.406 -1.724 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)s2)C[C@H]1O ZINC001582207490 1075915378 /nfs/dbraw/zinc/91/53/78/1075915378.db2.gz RSSGYFJURKFFGY-NXEZZACHSA-N -1 3 376.406 -1.724 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)s2)C[C@@H]1O ZINC001582207491 1075915403 /nfs/dbraw/zinc/91/54/03/1075915403.db2.gz RSSGYFJURKFFGY-ZJUUUORDSA-N -1 3 376.406 -1.724 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)s2)C[C@@H]1O ZINC001582207491 1075915401 /nfs/dbraw/zinc/91/54/01/1075915401.db2.gz RSSGYFJURKFFGY-ZJUUUORDSA-N -1 3 376.406 -1.724 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)CCCO1 ZINC001582207492 1075915252 /nfs/dbraw/zinc/91/52/52/1075915252.db2.gz RTCJEDLTSQUTGA-GFCCVEGCSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)CCCO1 ZINC001582207492 1075915249 /nfs/dbraw/zinc/91/52/49/1075915249.db2.gz RTCJEDLTSQUTGA-GFCCVEGCSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1CN(c2ccc(-c3nn[n-]n3)nc2)CCCO1 ZINC001582207493 1075915292 /nfs/dbraw/zinc/91/52/92/1075915292.db2.gz RTCJEDLTSQUTGA-LBPRGKRZSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1CN(c2ccc(-c3nnn[n-]3)nc2)CCCO1 ZINC001582207493 1075915289 /nfs/dbraw/zinc/91/52/89/1075915289.db2.gz RTCJEDLTSQUTGA-LBPRGKRZSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1ncnn1)NCCCN(C(=O)c1c[nH]c(-c2nn[n-]n2)c1)C1CC1 ZINC001582207506 1075915387 /nfs/dbraw/zinc/91/53/87/1075915387.db2.gz SHLGLNBJVHLDQG-UHFFFAOYSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)NCCCN(C(=O)c1c[nH]c(-c2nnn[n-]2)c1)C1CC1 ZINC001582207506 1075915384 /nfs/dbraw/zinc/91/53/84/1075915384.db2.gz SHLGLNBJVHLDQG-UHFFFAOYSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)CCO1 ZINC001582207507 1075915216 /nfs/dbraw/zinc/91/52/16/1075915216.db2.gz SIWLCQFPESWMGE-JTQLQIEISA-N -1 3 389.355 -1.591 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)CCO1 ZINC001582207507 1075915213 /nfs/dbraw/zinc/91/52/13/1075915213.db2.gz SIWLCQFPESWMGE-JTQLQIEISA-N -1 3 389.355 -1.591 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)CCO1 ZINC001582207508 1075915368 /nfs/dbraw/zinc/91/53/68/1075915368.db2.gz SIWLCQFPESWMGE-SNVBAGLBSA-N -1 3 389.355 -1.591 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)CCO1 ZINC001582207508 1075915364 /nfs/dbraw/zinc/91/53/64/1075915364.db2.gz SIWLCQFPESWMGE-SNVBAGLBSA-N -1 3 389.355 -1.591 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1CN(Cc2ccc(-c3nn[n-]n3)cc2)CCO1 ZINC001582207514 1075915415 /nfs/dbraw/zinc/91/54/15/1075915415.db2.gz SQEKFJLTPOPZSL-AWEZNQCLSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)cc2)CCO1 ZINC001582207515 1075915242 /nfs/dbraw/zinc/91/52/42/1075915242.db2.gz SQEKFJLTPOPZSL-CQSZACIVSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582207532 1075915269 /nfs/dbraw/zinc/91/52/69/1075915269.db2.gz UDGTZQRGTBNYGK-FXAINCCUSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582207532 1075915262 /nfs/dbraw/zinc/91/52/62/1075915262.db2.gz UDGTZQRGTBNYGK-FXAINCCUSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(Cn1ncnn1)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582207533 1075915787 /nfs/dbraw/zinc/91/57/87/1075915787.db2.gz UDGTZQRGTBNYGK-ZHAHWJHGSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(Cn1ncnn1)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582207533 1075915782 /nfs/dbraw/zinc/91/57/82/1075915782.db2.gz UDGTZQRGTBNYGK-ZHAHWJHGSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1COCCN1c1ncc(-c2nn[n-]n2)cc1F ZINC001582207537 1075915866 /nfs/dbraw/zinc/91/58/66/1075915866.db2.gz UHSNZCROHLRCOD-JTQLQIEISA-N -1 3 389.355 -1.591 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1COCCN1c1ncc(-c2nnn[n-]2)cc1F ZINC001582207537 1075915859 /nfs/dbraw/zinc/91/58/59/1075915859.db2.gz UHSNZCROHLRCOD-JTQLQIEISA-N -1 3 389.355 -1.591 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1COCCN1c1ncc(-c2nn[n-]n2)cc1F ZINC001582207538 1075915675 /nfs/dbraw/zinc/91/56/75/1075915675.db2.gz UHSNZCROHLRCOD-SNVBAGLBSA-N -1 3 389.355 -1.591 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1COCCN1c1ncc(-c2nnn[n-]2)cc1F ZINC001582207538 1075915670 /nfs/dbraw/zinc/91/56/70/1075915670.db2.gz UHSNZCROHLRCOD-SNVBAGLBSA-N -1 3 389.355 -1.591 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1CCCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582207543 1075915803 /nfs/dbraw/zinc/91/58/03/1075915803.db2.gz UPGVOKWSMIZMSH-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1CCCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582207543 1075915800 /nfs/dbraw/zinc/91/58/00/1075915800.db2.gz UPGVOKWSMIZMSH-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1CCCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582207544 1075915833 /nfs/dbraw/zinc/91/58/33/1075915833.db2.gz UPGVOKWSMIZMSH-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1CCCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582207544 1075915827 /nfs/dbraw/zinc/91/58/27/1075915827.db2.gz UPGVOKWSMIZMSH-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1CN(Cc2ccccc2-c2nn[n-]n2)CCO1 ZINC001582207563 1075915936 /nfs/dbraw/zinc/91/59/36/1075915936.db2.gz VLOBKDJFXPATOU-CYBMUJFWSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1CN(Cc2ccccc2-c2nnn[n-]2)CCO1 ZINC001582207563 1075915928 /nfs/dbraw/zinc/91/59/28/1075915928.db2.gz VLOBKDJFXPATOU-CYBMUJFWSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1CN(Cc2ccccc2-c2nn[n-]n2)CCO1 ZINC001582207564 1075915751 /nfs/dbraw/zinc/91/57/51/1075915751.db2.gz VLOBKDJFXPATOU-ZDUSSCGKSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1CN(Cc2ccccc2-c2nnn[n-]2)CCO1 ZINC001582207564 1075915746 /nfs/dbraw/zinc/91/57/46/1075915746.db2.gz VLOBKDJFXPATOU-ZDUSSCGKSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1COCCN1Cc1ccccc1-c1nn[n-]n1 ZINC001582207599 1075915691 /nfs/dbraw/zinc/91/56/91/1075915691.db2.gz WRGYMVQBHMIKEY-CYBMUJFWSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1COCCN1Cc1ccccc1-c1nnn[n-]1 ZINC001582207599 1075915686 /nfs/dbraw/zinc/91/56/86/1075915686.db2.gz WRGYMVQBHMIKEY-CYBMUJFWSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1COCCN1Cc1ccccc1-c1nn[n-]n1 ZINC001582207600 1075915849 /nfs/dbraw/zinc/91/58/49/1075915849.db2.gz WRGYMVQBHMIKEY-ZDUSSCGKSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1COCCN1Cc1ccccc1-c1nnn[n-]1 ZINC001582207600 1075915843 /nfs/dbraw/zinc/91/58/43/1075915843.db2.gz WRGYMVQBHMIKEY-ZDUSSCGKSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CN(Cc2cc(-c3nn[n-]n3)ccc2F)C[C@@H]1O ZINC001582207615 1075915896 /nfs/dbraw/zinc/91/58/96/1075915896.db2.gz XPFNVEAHAUNYDB-OLZOCXBDSA-N -1 3 388.367 -1.646 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1COCCN1Cc1cccc(-c2nn[n-]n2)c1 ZINC001582207618 1075915724 /nfs/dbraw/zinc/91/57/24/1075915724.db2.gz XTODSRKEAYVQHR-AWEZNQCLSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1COCCN1Cc1cccc(-c2nnn[n-]2)c1 ZINC001582207618 1075915718 /nfs/dbraw/zinc/91/57/18/1075915718.db2.gz XTODSRKEAYVQHR-AWEZNQCLSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1COCCN1Cc1cccc(-c2nn[n-]n2)c1 ZINC001582207619 1075915978 /nfs/dbraw/zinc/91/59/78/1075915978.db2.gz XTODSRKEAYVQHR-CQSZACIVSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1COCCN1Cc1cccc(-c2nnn[n-]2)c1 ZINC001582207619 1075915972 /nfs/dbraw/zinc/91/59/72/1075915972.db2.gz XTODSRKEAYVQHR-CQSZACIVSA-N -1 3 384.404 -1.130 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1CN(c2ncccc2-c2nn[n-]n2)CCCO1 ZINC001582207622 1075915815 /nfs/dbraw/zinc/91/58/15/1075915815.db2.gz XVPRVRSASLFZHN-LLVKDONJSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1ncnn1)NC[C@@H]1CN(c2ncccc2-c2nnn[n-]2)CCCO1 ZINC001582207622 1075915812 /nfs/dbraw/zinc/91/58/12/1075915812.db2.gz XVPRVRSASLFZHN-LLVKDONJSA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1CN(c2ncccc2-c2nn[n-]n2)CCCO1 ZINC001582207623 1075915770 /nfs/dbraw/zinc/91/57/70/1075915770.db2.gz XVPRVRSASLFZHN-NSHDSACASA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1ncnn1)NC[C@H]1CN(c2ncccc2-c2nnn[n-]2)CCCO1 ZINC001582207623 1075915765 /nfs/dbraw/zinc/91/57/65/1075915765.db2.gz XVPRVRSASLFZHN-NSHDSACASA-N -1 3 385.392 -1.340 20 0 GAADHM O=C(Cn1ncnn1)NCCN1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001582207624 1075916004 /nfs/dbraw/zinc/91/60/04/1075916004.db2.gz XWEXMQBEHOBSLG-UHFFFAOYSA-N -1 3 384.408 -1.813 20 0 GAADHM O=C(Cn1ncnn1)NCCN1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001582207624 1075915998 /nfs/dbraw/zinc/91/59/98/1075915998.db2.gz XWEXMQBEHOBSLG-UHFFFAOYSA-N -1 3 384.408 -1.813 20 0 GAADHM O=C(Cn1ncnn1)NCC[C@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582207644 1075915662 /nfs/dbraw/zinc/91/56/62/1075915662.db2.gz ZBTBNNAJEPHWIX-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)NCC[C@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582207644 1075915658 /nfs/dbraw/zinc/91/56/58/1075915658.db2.gz ZBTBNNAJEPHWIX-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)NCC[C@@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582207645 1075915706 /nfs/dbraw/zinc/91/57/06/1075915706.db2.gz ZBTBNNAJEPHWIX-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)NCC[C@@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582207645 1075915702 /nfs/dbraw/zinc/91/57/02/1075915702.db2.gz ZBTBNNAJEPHWIX-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)NCC[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582207652 1075915958 /nfs/dbraw/zinc/91/59/58/1075915958.db2.gz ZPYNVXWYEUQHCO-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)NCC[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582207652 1075915953 /nfs/dbraw/zinc/91/59/53/1075915953.db2.gz ZPYNVXWYEUQHCO-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)NCC[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582207653 1075916152 /nfs/dbraw/zinc/91/61/52/1075916152.db2.gz ZPYNVXWYEUQHCO-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)NCC[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582207653 1075916150 /nfs/dbraw/zinc/91/61/50/1075916150.db2.gz ZPYNVXWYEUQHCO-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2Cl)C[C@H]1O ZINC001582207655 1075916195 /nfs/dbraw/zinc/91/61/95/1075916195.db2.gz ZQVSEWXEFTVKBO-NXEZZACHSA-N -1 3 391.783 -1.733 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2Cl)C[C@H]1O ZINC001582207655 1075916192 /nfs/dbraw/zinc/91/61/92/1075916192.db2.gz ZQVSEWXEFTVKBO-NXEZZACHSA-N -1 3 391.783 -1.733 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2Cl)C[C@@H]1O ZINC001582207656 1075916166 /nfs/dbraw/zinc/91/61/66/1075916166.db2.gz ZQVSEWXEFTVKBO-ZJUUUORDSA-N -1 3 391.783 -1.733 20 0 GAADHM O=C(Cn1ncnn1)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2Cl)C[C@@H]1O ZINC001582207656 1075916164 /nfs/dbraw/zinc/91/61/64/1075916164.db2.gz ZQVSEWXEFTVKBO-ZJUUUORDSA-N -1 3 391.783 -1.733 20 0 GAADHM O=C(Cn1ncnn1)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582207657 1075916277 /nfs/dbraw/zinc/91/62/77/1075916277.db2.gz ZTDMKHFQQPUCEP-SCVCMEIPSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(Cn1ncnn1)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582207657 1075916273 /nfs/dbraw/zinc/91/62/73/1075916273.db2.gz ZTDMKHFQQPUCEP-SCVCMEIPSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)c1cnc2n1CCC2)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582230328 1075916844 /nfs/dbraw/zinc/91/68/44/1075916844.db2.gz BJJSOZOLDHBOBW-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)c1cnc2n1CCC2)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582230328 1075916838 /nfs/dbraw/zinc/91/68/38/1075916838.db2.gz BJJSOZOLDHBOBW-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)c1cnc2n1CCC2)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582230329 1075916717 /nfs/dbraw/zinc/91/67/17/1075916717.db2.gz BJJSOZOLDHBOBW-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)c1cnc2n1CCC2)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582230329 1075916712 /nfs/dbraw/zinc/91/67/12/1075916712.db2.gz BJJSOZOLDHBOBW-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582230547 1075917206 /nfs/dbraw/zinc/91/72/06/1075917206.db2.gz HBTKTXKYIDQOPU-UZWSLXQKSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582230547 1075917198 /nfs/dbraw/zinc/91/71/98/1075917198.db2.gz HBTKTXKYIDQOPU-UZWSLXQKSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582230548 1075917264 /nfs/dbraw/zinc/91/72/64/1075917264.db2.gz HBTKTXKYIDQOPU-WGBDABJCSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582230548 1075917259 /nfs/dbraw/zinc/91/72/59/1075917259.db2.gz HBTKTXKYIDQOPU-WGBDABJCSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cnn(CCF)c1 ZINC001582230638 1075917074 /nfs/dbraw/zinc/91/70/74/1075917074.db2.gz ITBTYBCSYJGQAG-LLVKDONJSA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cnn(CCF)c1 ZINC001582230638 1075917070 /nfs/dbraw/zinc/91/70/70/1075917070.db2.gz ITBTYBCSYJGQAG-LLVKDONJSA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cnn(CCF)c1 ZINC001582230639 1075917245 /nfs/dbraw/zinc/91/72/45/1075917245.db2.gz ITBTYBCSYJGQAG-NSHDSACASA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cnn(CCF)c1 ZINC001582230639 1075917238 /nfs/dbraw/zinc/91/72/38/1075917238.db2.gz ITBTYBCSYJGQAG-NSHDSACASA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582230687 1075917221 /nfs/dbraw/zinc/91/72/21/1075917221.db2.gz JRPJOIPKILKJQV-PRFIWBCESA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582230687 1075917217 /nfs/dbraw/zinc/91/72/17/1075917217.db2.gz JRPJOIPKILKJQV-PRFIWBCESA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582230688 1075917051 /nfs/dbraw/zinc/91/70/51/1075917051.db2.gz JRPJOIPKILKJQV-WTBMIXGQSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582230688 1075917049 /nfs/dbraw/zinc/91/70/49/1075917049.db2.gz JRPJOIPKILKJQV-WTBMIXGQSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)c1cnc2n1CCC2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582230830 1075917132 /nfs/dbraw/zinc/91/71/32/1075917132.db2.gz MOMKDVSWURGJOY-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)c1cnc2n1CCC2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582230830 1075917127 /nfs/dbraw/zinc/91/71/27/1075917127.db2.gz MOMKDVSWURGJOY-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)c1cnc2n1CCC2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582230831 1075917119 /nfs/dbraw/zinc/91/71/19/1075917119.db2.gz MOMKDVSWURGJOY-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)c1cnc2n1CCC2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582230831 1075917113 /nfs/dbraw/zinc/91/71/13/1075917113.db2.gz MOMKDVSWURGJOY-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582230852 1075917712 /nfs/dbraw/zinc/91/77/12/1075917712.db2.gz MXHCZESIFFATAA-FKLBQPBDSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582230852 1075917710 /nfs/dbraw/zinc/91/77/10/1075917710.db2.gz MXHCZESIFFATAA-FKLBQPBDSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582230853 1075917626 /nfs/dbraw/zinc/91/76/26/1075917626.db2.gz MXHCZESIFFATAA-YSZLUBPXSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582230853 1075917620 /nfs/dbraw/zinc/91/76/20/1075917620.db2.gz MXHCZESIFFATAA-YSZLUBPXSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582231033 1075917576 /nfs/dbraw/zinc/91/75/76/1075917576.db2.gz OFWVWXQUUVBMIJ-UZWSLXQKSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582231033 1075917572 /nfs/dbraw/zinc/91/75/72/1075917572.db2.gz OFWVWXQUUVBMIJ-UZWSLXQKSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582231035 1075917654 /nfs/dbraw/zinc/91/76/54/1075917654.db2.gz OFWVWXQUUVBMIJ-WGBDABJCSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582231035 1075917650 /nfs/dbraw/zinc/91/76/50/1075917650.db2.gz OFWVWXQUUVBMIJ-WGBDABJCSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cnn(CCF)c1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582231412 1075917518 /nfs/dbraw/zinc/91/75/18/1075917518.db2.gz RAOCJHXQFSVNPM-JTQLQIEISA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cnn(CCF)c1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582231412 1075917512 /nfs/dbraw/zinc/91/75/12/1075917512.db2.gz RAOCJHXQFSVNPM-JTQLQIEISA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cnn(CCF)c1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582231413 1075917642 /nfs/dbraw/zinc/91/76/42/1075917642.db2.gz RAOCJHXQFSVNPM-SNVBAGLBSA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cnn(CCF)c1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582231413 1075917638 /nfs/dbraw/zinc/91/76/38/1075917638.db2.gz RAOCJHXQFSVNPM-SNVBAGLBSA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cc2n(n1)CCC2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582231436 1075917681 /nfs/dbraw/zinc/91/76/81/1075917681.db2.gz RRYIKMDHGREJJB-SECBINFHSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cc2n(n1)CCC2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582231436 1075917678 /nfs/dbraw/zinc/91/76/78/1075917678.db2.gz RRYIKMDHGREJJB-SECBINFHSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cc2n(n1)CCC2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582231437 1075917736 /nfs/dbraw/zinc/91/77/36/1075917736.db2.gz RRYIKMDHGREJJB-VIFPVBQESA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cc2n(n1)CCC2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582231437 1075917732 /nfs/dbraw/zinc/91/77/32/1075917732.db2.gz RRYIKMDHGREJJB-VIFPVBQESA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582231444 1075917598 /nfs/dbraw/zinc/91/75/98/1075917598.db2.gz RWYAAJWOUAEANY-OMVNPZBFSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582231444 1075917592 /nfs/dbraw/zinc/91/75/92/1075917592.db2.gz RWYAAJWOUAEANY-OMVNPZBFSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582231445 1075917701 /nfs/dbraw/zinc/91/77/01/1075917701.db2.gz RWYAAJWOUAEANY-PUOUXSMHSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582231445 1075917695 /nfs/dbraw/zinc/91/76/95/1075917695.db2.gz RWYAAJWOUAEANY-PUOUXSMHSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(Cn1cccn1)N1CC(CCO)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582231457 1075917749 /nfs/dbraw/zinc/91/77/49/1075917749.db2.gz AGYUDVQQDJFXBP-UHFFFAOYSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(Cn1cccn1)N1CC(CCO)(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582231457 1075917744 /nfs/dbraw/zinc/91/77/44/1075917744.db2.gz AGYUDVQQDJFXBP-UHFFFAOYSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582231458 1075917668 /nfs/dbraw/zinc/91/76/68/1075917668.db2.gz AHAYURSKIFSTNP-PJXYFTJBSA-N -1 3 387.400 -1.220 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582231458 1075917664 /nfs/dbraw/zinc/91/76/64/1075917664.db2.gz AHAYURSKIFSTNP-PJXYFTJBSA-N -1 3 387.400 -1.220 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)c1cncnc1 ZINC001582231475 1075917723 /nfs/dbraw/zinc/91/77/23/1075917723.db2.gz AVNIGNAIASSEBX-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)c1cncnc1 ZINC001582231475 1075917720 /nfs/dbraw/zinc/91/77/20/1075917720.db2.gz AVNIGNAIASSEBX-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@]23C[C@H]2COC3)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582231504 1075917557 /nfs/dbraw/zinc/91/75/57/1075917557.db2.gz CCMOONQLMQPJTE-BTDLBPIBSA-N -1 3 387.400 -1.076 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@]23C[C@H]2COC3)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582231504 1075917552 /nfs/dbraw/zinc/91/75/52/1075917552.db2.gz CCMOONQLMQPJTE-BTDLBPIBSA-N -1 3 387.400 -1.076 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)C2=COCCO2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582231506 1075917539 /nfs/dbraw/zinc/91/75/39/1075917539.db2.gz CDHAQVCJOZQAJM-UHFFFAOYSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)C2=COCCO2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582231506 1075917532 /nfs/dbraw/zinc/91/75/32/1075917532.db2.gz CDHAQVCJOZQAJM-UHFFFAOYSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(Cn1cncn1)N1CC(CCO)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582231552 1075917612 /nfs/dbraw/zinc/91/76/12/1075917612.db2.gz DHMYGOMEHQWBPJ-UHFFFAOYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)N1CC(CCO)(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582231552 1075917608 /nfs/dbraw/zinc/91/76/08/1075917608.db2.gz DHMYGOMEHQWBPJ-UHFFFAOYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)c1cnccn1 ZINC001582231600 1075918079 /nfs/dbraw/zinc/91/80/79/1075918079.db2.gz FCEVPRWTGJGILG-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)c1cnccn1 ZINC001582231600 1075918076 /nfs/dbraw/zinc/91/80/76/1075918076.db2.gz FCEVPRWTGJGILG-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)c1ccncn1 ZINC001582231959 1075918236 /nfs/dbraw/zinc/91/82/36/1075918236.db2.gz FFSDVPJPDSIXKS-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)c1ccncn1 ZINC001582231959 1075918230 /nfs/dbraw/zinc/91/82/30/1075918230.db2.gz FFSDVPJPDSIXKS-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)c1cnccn1 ZINC001582231960 1075918203 /nfs/dbraw/zinc/91/82/03/1075918203.db2.gz FHQCPGHFYYVFIY-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)c1cnccn1 ZINC001582231960 1075918197 /nfs/dbraw/zinc/91/81/97/1075918197.db2.gz FHQCPGHFYYVFIY-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)c1ncccn1 ZINC001582231966 1075918188 /nfs/dbraw/zinc/91/81/88/1075918188.db2.gz FQOCHBWOUCOCAF-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)c1ncccn1 ZINC001582231966 1075918184 /nfs/dbraw/zinc/91/81/84/1075918184.db2.gz FQOCHBWOUCOCAF-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@H]2CCOC2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582231971 1075918113 /nfs/dbraw/zinc/91/81/13/1075918113.db2.gz FUMOBTMQUBONTE-JTQLQIEISA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@H]2CCOC2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582231971 1075918103 /nfs/dbraw/zinc/91/81/03/1075918103.db2.gz FUMOBTMQUBONTE-JTQLQIEISA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@@H]2CCOC2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582231972 1075918058 /nfs/dbraw/zinc/91/80/58/1075918058.db2.gz FUMOBTMQUBONTE-SNVBAGLBSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@@H]2CCOC2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582231972 1075918055 /nfs/dbraw/zinc/91/80/55/1075918055.db2.gz FUMOBTMQUBONTE-SNVBAGLBSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(Cn1nccn1)N1CC(CCO)(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582231988 1075918176 /nfs/dbraw/zinc/91/81/76/1075918176.db2.gz GLLMTORHGKGMPO-UHFFFAOYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1nccn1)N1CC(CCO)(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582231988 1075918173 /nfs/dbraw/zinc/91/81/73/1075918173.db2.gz GLLMTORHGKGMPO-UHFFFAOYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@H]1COCCO1 ZINC001582231994 1075918024 /nfs/dbraw/zinc/91/80/24/1075918024.db2.gz GRORHYUDFYSIKY-GFCCVEGCSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@H]1COCCO1 ZINC001582231994 1075918021 /nfs/dbraw/zinc/91/80/21/1075918021.db2.gz GRORHYUDFYSIKY-GFCCVEGCSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@@H]1COCCO1 ZINC001582231995 1075918220 /nfs/dbraw/zinc/91/82/20/1075918220.db2.gz GRORHYUDFYSIKY-LBPRGKRZSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@@H]1COCCO1 ZINC001582231995 1075918212 /nfs/dbraw/zinc/91/82/12/1075918212.db2.gz GRORHYUDFYSIKY-LBPRGKRZSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(Cn1cncn1)N1CC(CCO)(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582232016 1075918089 /nfs/dbraw/zinc/91/80/89/1075918089.db2.gz HNGAKXWCJAKSHO-UHFFFAOYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)N1CC(CCO)(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582232016 1075918087 /nfs/dbraw/zinc/91/80/87/1075918087.db2.gz HNGAKXWCJAKSHO-UHFFFAOYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1nccn1)N1CC(CCO)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582232021 1075918140 /nfs/dbraw/zinc/91/81/40/1075918140.db2.gz HVDPBQGZLLBIIB-UHFFFAOYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1nccn1)N1CC(CCO)(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582232021 1075918138 /nfs/dbraw/zinc/91/81/38/1075918138.db2.gz HVDPBQGZLLBIIB-UHFFFAOYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cc1cnc[nH]1)N1CC(CCO)(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582232026 1075918128 /nfs/dbraw/zinc/91/81/28/1075918128.db2.gz IDUBJSXFJOOUKR-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@H]1[C@@H]2COC[C@@H]21 ZINC001582232062 1075918004 /nfs/dbraw/zinc/91/80/04/1075918004.db2.gz JGYHRDKROPWEPE-IWIIMEHWSA-N -1 3 387.400 -1.220 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@H]1[C@@H]2COC[C@@H]21 ZINC001582232062 1075918000 /nfs/dbraw/zinc/91/80/00/1075918000.db2.gz JGYHRDKROPWEPE-IWIIMEHWSA-N -1 3 387.400 -1.220 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cc2n(n1)CCC2)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582232274 1075918034 /nfs/dbraw/zinc/91/80/34/1075918034.db2.gz UWSNFRAVFCZBOU-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cc2n(n1)CCC2)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582232274 1075918031 /nfs/dbraw/zinc/91/80/31/1075918031.db2.gz UWSNFRAVFCZBOU-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cc2n(n1)CCC2)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582232275 1075918167 /nfs/dbraw/zinc/91/81/67/1075918167.db2.gz UWSNFRAVFCZBOU-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cc2n(n1)CCC2)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582232275 1075918163 /nfs/dbraw/zinc/91/81/63/1075918163.db2.gz UWSNFRAVFCZBOU-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cn2c(n1)CCC2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582232298 1075918068 /nfs/dbraw/zinc/91/80/68/1075918068.db2.gz VMLUSROMJRLLKG-SECBINFHSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cn2c(n1)CCC2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582232298 1075918064 /nfs/dbraw/zinc/91/80/64/1075918064.db2.gz VMLUSROMJRLLKG-SECBINFHSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cn2c(n1)CCC2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582232299 1075918047 /nfs/dbraw/zinc/91/80/47/1075918047.db2.gz VMLUSROMJRLLKG-VIFPVBQESA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cn2c(n1)CCC2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582232299 1075918042 /nfs/dbraw/zinc/91/80/42/1075918042.db2.gz VMLUSROMJRLLKG-VIFPVBQESA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1cnn2c1CCC2 ZINC001582232320 1075917992 /nfs/dbraw/zinc/91/79/92/1075917992.db2.gz WAEZTKHLOSJORR-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1cnn2c1CCC2 ZINC001582232320 1075917989 /nfs/dbraw/zinc/91/79/89/1075917989.db2.gz WAEZTKHLOSJORR-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1cnn2c1CCC2 ZINC001582232321 1075918153 /nfs/dbraw/zinc/91/81/53/1075918153.db2.gz WAEZTKHLOSJORR-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1cnn2c1CCC2 ZINC001582232321 1075918149 /nfs/dbraw/zinc/91/81/49/1075918149.db2.gz WAEZTKHLOSJORR-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)c1ccncn1 ZINC001582232419 1075918623 /nfs/dbraw/zinc/91/86/23/1075918623.db2.gz JXZWMAZDFGYIBW-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)c1ccncn1 ZINC001582232419 1075918618 /nfs/dbraw/zinc/91/86/18/1075918618.db2.gz JXZWMAZDFGYIBW-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(Cn1cncn1)N1CC(CCO)(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582232427 1075918540 /nfs/dbraw/zinc/91/85/40/1075918540.db2.gz KFXQKNVYKSYQSC-UHFFFAOYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)N1CC(CCO)(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582232427 1075918533 /nfs/dbraw/zinc/91/85/33/1075918533.db2.gz KFXQKNVYKSYQSC-UHFFFAOYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cnn2c1CCC2 ZINC001582232760 1075918599 /nfs/dbraw/zinc/91/85/99/1075918599.db2.gz WYHWGCRHPYYJOF-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cnn2c1CCC2 ZINC001582232760 1075918594 /nfs/dbraw/zinc/91/85/94/1075918594.db2.gz WYHWGCRHPYYJOF-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cnn2c1CCC2 ZINC001582232761 1075918692 /nfs/dbraw/zinc/91/86/92/1075918692.db2.gz WYHWGCRHPYYJOF-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cnn2c1CCC2 ZINC001582232761 1075918687 /nfs/dbraw/zinc/91/86/87/1075918687.db2.gz WYHWGCRHPYYJOF-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)C1CCC(O)CC1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582232796 1075918634 /nfs/dbraw/zinc/91/86/34/1075918634.db2.gz XQXHFRBPRYJRBW-HSOILSAZSA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)C1CCC(O)CC1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582232796 1075918631 /nfs/dbraw/zinc/91/86/31/1075918631.db2.gz XQXHFRBPRYJRBW-HSOILSAZSA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)C1CCC(O)CC1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582232797 1075918648 /nfs/dbraw/zinc/91/86/48/1075918648.db2.gz XQXHFRBPRYJRBW-YVNMAJEFSA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)C1CCC(O)CC1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582232797 1075918644 /nfs/dbraw/zinc/91/86/44/1075918644.db2.gz XQXHFRBPRYJRBW-YVNMAJEFSA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)c1ccnnc1 ZINC001582232874 1075918490 /nfs/dbraw/zinc/91/84/90/1075918490.db2.gz OUQNGIKJHZQAQF-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)c1ccnnc1 ZINC001582232874 1075918484 /nfs/dbraw/zinc/91/84/84/1075918484.db2.gz OUQNGIKJHZQAQF-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)C2=COCCO2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582232894 1075918518 /nfs/dbraw/zinc/91/85/18/1075918518.db2.gz PIXQKPHWIVCVMM-UHFFFAOYSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)C2=COCCO2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582232894 1075918510 /nfs/dbraw/zinc/91/85/10/1075918510.db2.gz PIXQKPHWIVCVMM-UHFFFAOYSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)c1ccnnc1 ZINC001582232903 1075918470 /nfs/dbraw/zinc/91/84/70/1075918470.db2.gz PKJQPCIBBYPULX-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)c1ccnnc1 ZINC001582232903 1075918463 /nfs/dbraw/zinc/91/84/63/1075918463.db2.gz PKJQPCIBBYPULX-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(Cc1cnc[nH]1)N1CC(CCO)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582232906 1075918421 /nfs/dbraw/zinc/91/84/21/1075918421.db2.gz PMQMHVCLWDVVKW-UHFFFAOYSA-N -1 3 385.388 -1.146 20 0 GAADHM O=C(Cn1ccnc1)N1CC(CCO)(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582232981 1075918665 /nfs/dbraw/zinc/91/86/65/1075918665.db2.gz QKJNRBXXBYBEHO-UHFFFAOYSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(Cn1ccnc1)N1CC(CCO)(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582232981 1075918660 /nfs/dbraw/zinc/91/86/60/1075918660.db2.gz QKJNRBXXBYBEHO-UHFFFAOYSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@H]2COCCO2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582233022 1075918681 /nfs/dbraw/zinc/91/86/81/1075918681.db2.gz QVHBDGKCRCQCBE-GFCCVEGCSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@H]2COCCO2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582233022 1075918675 /nfs/dbraw/zinc/91/86/75/1075918675.db2.gz QVHBDGKCRCQCBE-GFCCVEGCSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@@H]2COCCO2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582233024 1075918610 /nfs/dbraw/zinc/91/86/10/1075918610.db2.gz QVHBDGKCRCQCBE-LBPRGKRZSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@@H]2COCCO2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582233024 1075918608 /nfs/dbraw/zinc/91/86/08/1075918608.db2.gz QVHBDGKCRCQCBE-LBPRGKRZSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)c1cnccn1 ZINC001582233039 1075918706 /nfs/dbraw/zinc/91/87/06/1075918706.db2.gz QZDYPRQIBNQKFD-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)c1cnccn1 ZINC001582233039 1075918701 /nfs/dbraw/zinc/91/87/01/1075918701.db2.gz QZDYPRQIBNQKFD-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(Cn1ccnc1)N1CC(CCO)(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582233053 1075918576 /nfs/dbraw/zinc/91/85/76/1075918576.db2.gz RBRMELJRHOHNGB-UHFFFAOYSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(Cn1ccnc1)N1CC(CCO)(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582233053 1075918569 /nfs/dbraw/zinc/91/85/69/1075918569.db2.gz RBRMELJRHOHNGB-UHFFFAOYSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@H]2COCCO2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582233075 1075918732 /nfs/dbraw/zinc/91/87/32/1075918732.db2.gz RMPGNSABUMBWEF-GFCCVEGCSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@H]2COCCO2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582233075 1075918728 /nfs/dbraw/zinc/91/87/28/1075918728.db2.gz RMPGNSABUMBWEF-GFCCVEGCSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@@H]2COCCO2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582233076 1075918720 /nfs/dbraw/zinc/91/87/20/1075918720.db2.gz RMPGNSABUMBWEF-LBPRGKRZSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@@H]2COCCO2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582233076 1075918716 /nfs/dbraw/zinc/91/87/16/1075918716.db2.gz RMPGNSABUMBWEF-LBPRGKRZSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)C1CCC(O)CC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582233175 1075918409 /nfs/dbraw/zinc/91/84/09/1075918409.db2.gz ZFPUOLHQQXMXSS-CKBZRRDASA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(N[C@@H](CO)CNC(=O)C1CCC(O)CC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582233175 1075918403 /nfs/dbraw/zinc/91/84/03/1075918403.db2.gz ZFPUOLHQQXMXSS-CKBZRRDASA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)C1CCC(O)CC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582233176 1075919067 /nfs/dbraw/zinc/91/90/67/1075919067.db2.gz ZFPUOLHQQXMXSS-ZYXZCXLHSA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(N[C@H](CO)CNC(=O)C1CCC(O)CC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582233176 1075919063 /nfs/dbraw/zinc/91/90/63/1075919063.db2.gz ZFPUOLHQQXMXSS-ZYXZCXLHSA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)c1cccnn1 ZINC001582233327 1075918940 /nfs/dbraw/zinc/91/89/40/1075918940.db2.gz SMUNSVSBCZRYDA-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)c1cccnn1 ZINC001582233327 1075918935 /nfs/dbraw/zinc/91/89/35/1075918935.db2.gz SMUNSVSBCZRYDA-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@H]1[C@@H]2COC[C@@H]21 ZINC001582233331 1075919077 /nfs/dbraw/zinc/91/90/77/1075919077.db2.gz SNLIFSSKJNOENT-PJXYFTJBSA-N -1 3 387.400 -1.220 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@H]1[C@@H]2COC[C@@H]21 ZINC001582233331 1075919075 /nfs/dbraw/zinc/91/90/75/1075919075.db2.gz SNLIFSSKJNOENT-PJXYFTJBSA-N -1 3 387.400 -1.220 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)C1=COCCO1 ZINC001582233337 1075918971 /nfs/dbraw/zinc/91/89/71/1075918971.db2.gz SPGXGFVVOHMNTF-UHFFFAOYSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)C1=COCCO1 ZINC001582233337 1075918967 /nfs/dbraw/zinc/91/89/67/1075918967.db2.gz SPGXGFVVOHMNTF-UHFFFAOYSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(Cn1ccnc1)N1CC(CCO)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582233341 1075918842 /nfs/dbraw/zinc/91/88/42/1075918842.db2.gz SPXYHRQWUCRRDN-UHFFFAOYSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@]23C[C@H]2COC3)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582233342 1075918989 /nfs/dbraw/zinc/91/89/89/1075918989.db2.gz STYIHJNSCURRTE-GTNSWQLSSA-N -1 3 387.400 -1.076 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@]23C[C@H]2COC3)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582233342 1075918983 /nfs/dbraw/zinc/91/89/83/1075918983.db2.gz STYIHJNSCURRTE-GTNSWQLSSA-N -1 3 387.400 -1.076 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)C1=COCCO1 ZINC001582233362 1075918861 /nfs/dbraw/zinc/91/88/61/1075918861.db2.gz TWKVRTRXBFBSPC-UHFFFAOYSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)C1=COCCO1 ZINC001582233362 1075918856 /nfs/dbraw/zinc/91/88/56/1075918856.db2.gz TWKVRTRXBFBSPC-UHFFFAOYSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(Cn1cccn1)N1CC(CCO)(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582233366 1075919021 /nfs/dbraw/zinc/91/90/21/1075919021.db2.gz UANUNUXOYVXBSX-UHFFFAOYSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(Cn1cccn1)N1CC(CCO)(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582233366 1075919017 /nfs/dbraw/zinc/91/90/17/1075919017.db2.gz UANUNUXOYVXBSX-UHFFFAOYSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@H]2COCCO2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582233389 1075918881 /nfs/dbraw/zinc/91/88/81/1075918881.db2.gz VAEBFJHDLSPWOF-GFCCVEGCSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@H]2COCCO2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582233389 1075918876 /nfs/dbraw/zinc/91/88/76/1075918876.db2.gz VAEBFJHDLSPWOF-GFCCVEGCSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@@H]2COCCO2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582233390 1075918826 /nfs/dbraw/zinc/91/88/26/1075918826.db2.gz VAEBFJHDLSPWOF-LBPRGKRZSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@@H]2COCCO2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582233390 1075918821 /nfs/dbraw/zinc/91/88/21/1075918821.db2.gz VAEBFJHDLSPWOF-LBPRGKRZSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@H]2CCOC2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582233397 1075919059 /nfs/dbraw/zinc/91/90/59/1075919059.db2.gz VHAFIOUHMCPRRO-JTQLQIEISA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@H]2CCOC2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582233397 1075919057 /nfs/dbraw/zinc/91/90/57/1075919057.db2.gz VHAFIOUHMCPRRO-JTQLQIEISA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@@H]2CCOC2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582233398 1075919034 /nfs/dbraw/zinc/91/90/34/1075919034.db2.gz VHAFIOUHMCPRRO-SNVBAGLBSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@@H]2CCOC2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582233398 1075919030 /nfs/dbraw/zinc/91/90/30/1075919030.db2.gz VHAFIOUHMCPRRO-SNVBAGLBSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@H]1CCOC1 ZINC001582233404 1075919006 /nfs/dbraw/zinc/91/90/06/1075919006.db2.gz VJUFLYOGQRKDEC-JTQLQIEISA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@H]1CCOC1 ZINC001582233404 1075919000 /nfs/dbraw/zinc/91/90/00/1075919000.db2.gz VJUFLYOGQRKDEC-JTQLQIEISA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@@H]1CCOC1 ZINC001582233405 1075919089 /nfs/dbraw/zinc/91/90/89/1075919089.db2.gz VJUFLYOGQRKDEC-SNVBAGLBSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@@H]1CCOC1 ZINC001582233405 1075919084 /nfs/dbraw/zinc/91/90/84/1075919084.db2.gz VJUFLYOGQRKDEC-SNVBAGLBSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@H]1COCCO1 ZINC001582233412 1075918956 /nfs/dbraw/zinc/91/89/56/1075918956.db2.gz VRENVJNAMPLTRT-GFCCVEGCSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@H]1COCCO1 ZINC001582233412 1075918951 /nfs/dbraw/zinc/91/89/51/1075918951.db2.gz VRENVJNAMPLTRT-GFCCVEGCSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@@H]1COCCO1 ZINC001582233413 1075919050 /nfs/dbraw/zinc/91/90/50/1075919050.db2.gz VRENVJNAMPLTRT-LBPRGKRZSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@@H]1COCCO1 ZINC001582233413 1075919046 /nfs/dbraw/zinc/91/90/46/1075919046.db2.gz VRENVJNAMPLTRT-LBPRGKRZSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)[C@H]1CCOC1 ZINC001582233418 1075918920 /nfs/dbraw/zinc/91/89/20/1075918920.db2.gz VVEVMNOZQDSIJT-JTQLQIEISA-N -1 3 375.389 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O=C(NC1(CCO)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)[C@H]1COCCO1 ZINC001582233426 1075919459 /nfs/dbraw/zinc/91/94/59/1075919459.db2.gz WBVUMELRGUXDHY-GFCCVEGCSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)[C@H]1COCCO1 ZINC001582233426 1075919455 /nfs/dbraw/zinc/91/94/55/1075919455.db2.gz WBVUMELRGUXDHY-GFCCVEGCSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)[C@@H]1COCCO1 ZINC001582233427 1075919567 /nfs/dbraw/zinc/91/95/67/1075919567.db2.gz WBVUMELRGUXDHY-LBPRGKRZSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)[C@@H]1COCCO1 ZINC001582233427 1075919561 /nfs/dbraw/zinc/91/95/61/1075919561.db2.gz WBVUMELRGUXDHY-LBPRGKRZSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582233451 1075919499 /nfs/dbraw/zinc/91/94/99/1075919499.db2.gz XGOUNBRMXXTXFF-PJXYFTJBSA-N -1 3 387.400 -1.220 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582233451 1075919493 /nfs/dbraw/zinc/91/94/93/1075919493.db2.gz XGOUNBRMXXTXFF-PJXYFTJBSA-N -1 3 387.400 -1.220 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@]23C[C@H]2COC3)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582233458 1075919553 /nfs/dbraw/zinc/91/95/53/1075919553.db2.gz XLTMALKMTGPDRB-GTNSWQLSSA-N -1 3 387.400 -1.076 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@]23C[C@H]2COC3)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582233458 1075919547 /nfs/dbraw/zinc/91/95/47/1075919547.db2.gz XLTMALKMTGPDRB-GTNSWQLSSA-N -1 3 387.400 -1.076 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582233461 1075919344 /nfs/dbraw/zinc/91/93/44/1075919344.db2.gz XMPGUCRXMQOHBO-IWIIMEHWSA-N -1 3 387.400 -1.220 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582233461 1075919339 /nfs/dbraw/zinc/91/93/39/1075919339.db2.gz XMPGUCRXMQOHBO-IWIIMEHWSA-N -1 3 387.400 -1.220 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)C2=COCCO2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582233464 1075919583 /nfs/dbraw/zinc/91/95/83/1075919583.db2.gz XNSMALGLSQCYKM-UHFFFAOYSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)C2=COCCO2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582233464 1075919577 /nfs/dbraw/zinc/91/95/77/1075919577.db2.gz XNSMALGLSQCYKM-UHFFFAOYSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)c1cccnn1 ZINC001582233468 1075919482 /nfs/dbraw/zinc/91/94/82/1075919482.db2.gz XTJDBDULMOTHEU-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)c1cccnn1 ZINC001582233468 1075919478 /nfs/dbraw/zinc/91/94/78/1075919478.db2.gz XTJDBDULMOTHEU-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)C1=COCCO1 ZINC001582233474 1075919316 /nfs/dbraw/zinc/91/93/16/1075919316.db2.gz XWFIOMDDXAHXGG-UHFFFAOYSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)C1=COCCO1 ZINC001582233474 1075919314 /nfs/dbraw/zinc/91/93/14/1075919314.db2.gz XWFIOMDDXAHXGG-UHFFFAOYSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)c1cncnc1 ZINC001582233484 1075919471 /nfs/dbraw/zinc/91/94/71/1075919471.db2.gz YEMYAUCWTNWZOO-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)c1cncnc1 ZINC001582233484 1075919467 /nfs/dbraw/zinc/91/94/67/1075919467.db2.gz YEMYAUCWTNWZOO-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(Cn1cccn1)N1CC(CCO)(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582233489 1075919372 /nfs/dbraw/zinc/91/93/72/1075919372.db2.gz YMEXDSZPKILWHX-UHFFFAOYSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(Cn1cccn1)N1CC(CCO)(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582233489 1075919368 /nfs/dbraw/zinc/91/93/68/1075919368.db2.gz YMEXDSZPKILWHX-UHFFFAOYSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)c1cncnc1 ZINC001582233493 1075919396 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ZINC001582235153 1075920262 /nfs/dbraw/zinc/92/02/62/1075920262.db2.gz ZOQKOCIGBRKFAX-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)c2cnccn2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582235153 1075920258 /nfs/dbraw/zinc/92/02/58/1075920258.db2.gz ZOQKOCIGBRKFAX-UHFFFAOYSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(CN1CCC[C@](CO)(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)N1CCC1 ZINC001582241272 1075920385 /nfs/dbraw/zinc/92/03/85/1075920385.db2.gz ATSNFVLSTWLSMN-KRWDZBQOSA-N -1 3 388.432 -1.016 20 0 GAADHM O=C(CN1CCC[C@](CO)(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)N1CCC1 ZINC001582241272 1075920382 /nfs/dbraw/zinc/92/03/82/1075920382.db2.gz ATSNFVLSTWLSMN-KRWDZBQOSA-N -1 3 388.432 -1.016 20 0 GAADHM O=C(CN1CCC[C@@](CO)(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)N1CCC1 ZINC001582241273 1075920435 /nfs/dbraw/zinc/92/04/35/1075920435.db2.gz ATSNFVLSTWLSMN-QGZVFWFLSA-N -1 3 388.432 -1.016 20 0 GAADHM O=C(CN1CCC[C@@](CO)(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)N1CCC1 ZINC001582241273 1075920428 /nfs/dbraw/zinc/92/04/28/1075920428.db2.gz ATSNFVLSTWLSMN-QGZVFWFLSA-N -1 3 388.432 -1.016 20 0 GAADHM O=C(CN1CCC[C@](CO)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)N1CCC1 ZINC001582242470 1075920298 /nfs/dbraw/zinc/92/02/98/1075920298.db2.gz SQJYZMDFYPLSNU-KRWDZBQOSA-N -1 3 388.432 -1.016 20 0 GAADHM O=C(CN1CCC[C@](CO)(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)N1CCC1 ZINC001582242470 1075920294 /nfs/dbraw/zinc/92/02/94/1075920294.db2.gz SQJYZMDFYPLSNU-KRWDZBQOSA-N -1 3 388.432 -1.016 20 0 GAADHM O=C(CN1CCC[C@@](CO)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)N1CCC1 ZINC001582242471 1075920354 /nfs/dbraw/zinc/92/03/54/1075920354.db2.gz SQJYZMDFYPLSNU-QGZVFWFLSA-N -1 3 388.432 -1.016 20 0 GAADHM O=C(CN1CCC[C@@](CO)(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)N1CCC1 ZINC001582242471 1075920350 /nfs/dbraw/zinc/92/03/50/1075920350.db2.gz SQJYZMDFYPLSNU-QGZVFWFLSA-N -1 3 388.432 -1.016 20 0 GAADHM O=C(CN1CCC[C@](CO)(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)N1CCC1 ZINC001582242896 1075920817 /nfs/dbraw/zinc/92/08/17/1075920817.db2.gz YIADMDDXWNVKCY-KRWDZBQOSA-N -1 3 388.432 -1.016 20 0 GAADHM O=C(CN1CCC[C@](CO)(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)N1CCC1 ZINC001582242896 1075920809 /nfs/dbraw/zinc/92/08/09/1075920809.db2.gz YIADMDDXWNVKCY-KRWDZBQOSA-N -1 3 388.432 -1.016 20 0 GAADHM O=C(CN1CCC[C@@](CO)(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)N1CCC1 ZINC001582242897 1075920699 /nfs/dbraw/zinc/92/06/99/1075920699.db2.gz YIADMDDXWNVKCY-QGZVFWFLSA-N -1 3 388.432 -1.016 20 0 GAADHM O=C(CN1CCC[C@@](CO)(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)N1CCC1 ZINC001582242897 1075920696 /nfs/dbraw/zinc/92/06/96/1075920696.db2.gz YIADMDDXWNVKCY-QGZVFWFLSA-N -1 3 388.432 -1.016 20 0 GAADHM O=C(CN1CCC(CO)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1)N1CCC1 ZINC001582243536 1075920942 /nfs/dbraw/zinc/92/09/42/1075920942.db2.gz OHNVTOVJUITYLG-UHFFFAOYSA-N -1 3 388.432 -1.016 20 0 GAADHM O=C(CN1CCC(CO)(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1)N1CCC1 ZINC001582243700 1075921279 /nfs/dbraw/zinc/92/12/79/1075921279.db2.gz SSRHNMYCGHJSKF-UHFFFAOYSA-N -1 3 388.432 -1.016 20 0 GAADHM O=C(CN1CCC(CO)(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1)N1CCC1 ZINC001582243700 1075921277 /nfs/dbraw/zinc/92/12/77/1075921277.db2.gz SSRHNMYCGHJSKF-UHFFFAOYSA-N -1 3 388.432 -1.016 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582290704 1075922260 /nfs/dbraw/zinc/92/22/60/1075922260.db2.gz DMBGGMBBZZVFMQ-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582290704 1075922259 /nfs/dbraw/zinc/92/22/59/1075922259.db2.gz DMBGGMBBZZVFMQ-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582290706 1075922397 /nfs/dbraw/zinc/92/23/97/1075922397.db2.gz DMBGGMBBZZVFMQ-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582290706 1075922392 /nfs/dbraw/zinc/92/23/92/1075922392.db2.gz DMBGGMBBZZVFMQ-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001582290748 1075922517 /nfs/dbraw/zinc/92/25/17/1075922517.db2.gz FISFTHOBPVASHT-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001582290748 1075922511 /nfs/dbraw/zinc/92/25/11/1075922511.db2.gz FISFTHOBPVASHT-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001582290750 1075922266 /nfs/dbraw/zinc/92/22/66/1075922266.db2.gz FISFTHOBPVASHT-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001582290750 1075922264 /nfs/dbraw/zinc/92/22/64/1075922264.db2.gz FISFTHOBPVASHT-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001582290789 1075922422 /nfs/dbraw/zinc/92/24/22/1075922422.db2.gz FVYYORUGBMOWSL-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001582290789 1075922417 /nfs/dbraw/zinc/92/24/17/1075922417.db2.gz FVYYORUGBMOWSL-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001582290791 1075922378 /nfs/dbraw/zinc/92/23/78/1075922378.db2.gz FVYYORUGBMOWSL-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001582290791 1075922372 /nfs/dbraw/zinc/92/23/72/1075922372.db2.gz FVYYORUGBMOWSL-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001582291141 1075922457 /nfs/dbraw/zinc/92/24/57/1075922457.db2.gz MDLPEEKPLWGMLB-JTQLQIEISA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001582291141 1075922451 /nfs/dbraw/zinc/92/24/51/1075922451.db2.gz MDLPEEKPLWGMLB-JTQLQIEISA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001582291142 1075922358 /nfs/dbraw/zinc/92/23/58/1075922358.db2.gz MDLPEEKPLWGMLB-SNVBAGLBSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001582291142 1075922351 /nfs/dbraw/zinc/92/23/51/1075922351.db2.gz MDLPEEKPLWGMLB-SNVBAGLBSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582291331 1075923045 /nfs/dbraw/zinc/92/30/45/1075923045.db2.gz PWRBHJHJEZTPJV-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582291331 1075923042 /nfs/dbraw/zinc/92/30/42/1075923042.db2.gz PWRBHJHJEZTPJV-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582291332 1075923066 /nfs/dbraw/zinc/92/30/66/1075923066.db2.gz PWRBHJHJEZTPJV-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582291332 1075923063 /nfs/dbraw/zinc/92/30/63/1075923063.db2.gz PWRBHJHJEZTPJV-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001582291541 1075922918 /nfs/dbraw/zinc/92/29/18/1075922918.db2.gz UWTKHQIZRCVUHE-JTQLQIEISA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001582291541 1075922914 /nfs/dbraw/zinc/92/29/14/1075922914.db2.gz UWTKHQIZRCVUHE-JTQLQIEISA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001582291542 1075922966 /nfs/dbraw/zinc/92/29/66/1075922966.db2.gz UWTKHQIZRCVUHE-SNVBAGLBSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001582291542 1075922963 /nfs/dbraw/zinc/92/29/63/1075922963.db2.gz UWTKHQIZRCVUHE-SNVBAGLBSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001582291707 1075922872 /nfs/dbraw/zinc/92/28/72/1075922872.db2.gz ZQDQPNPARAAGMN-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001582291707 1075922867 /nfs/dbraw/zinc/92/28/67/1075922867.db2.gz ZQDQPNPARAAGMN-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001582291708 1075922982 /nfs/dbraw/zinc/92/29/82/1075922982.db2.gz ZQDQPNPARAAGMN-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001582291708 1075922981 /nfs/dbraw/zinc/92/29/81/1075922981.db2.gz ZQDQPNPARAAGMN-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)C2=COCCO2)C[C@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582302308 1075923005 /nfs/dbraw/zinc/92/30/05/1075923005.db2.gz FPXWJKAKOBQZQO-BXKDBHETSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)C2=COCCO2)C[C@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582302308 1075923002 /nfs/dbraw/zinc/92/30/02/1075923002.db2.gz FPXWJKAKOBQZQO-BXKDBHETSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)C2=COCCO2)C[C@@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582302309 1075922904 /nfs/dbraw/zinc/92/29/04/1075922904.db2.gz FPXWJKAKOBQZQO-CABZTGNLSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)C2=COCCO2)C[C@@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582302309 1075922899 /nfs/dbraw/zinc/92/28/99/1075922899.db2.gz FPXWJKAKOBQZQO-CABZTGNLSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)C2=COCCO2)C[C@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582302310 1075922885 /nfs/dbraw/zinc/92/28/85/1075922885.db2.gz FPXWJKAKOBQZQO-JOYOIKCWSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)C2=COCCO2)C[C@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582302310 1075922881 /nfs/dbraw/zinc/92/28/81/1075922881.db2.gz FPXWJKAKOBQZQO-JOYOIKCWSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)C2=COCCO2)C[C@@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582302311 1075922976 /nfs/dbraw/zinc/92/29/76/1075922976.db2.gz FPXWJKAKOBQZQO-SKDRFNHKSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)C2=COCCO2)C[C@@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582302311 1075922973 /nfs/dbraw/zinc/92/29/73/1075922973.db2.gz FPXWJKAKOBQZQO-SKDRFNHKSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@H](O)C1 ZINC001582303012 1075923016 /nfs/dbraw/zinc/92/30/16/1075923016.db2.gz ACKBGWCFMPHNLZ-CMPLNLGQSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@H](O)C1 ZINC001582303012 1075923012 /nfs/dbraw/zinc/92/30/12/1075923012.db2.gz ACKBGWCFMPHNLZ-CMPLNLGQSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001582303013 1075922853 /nfs/dbraw/zinc/92/28/53/1075922853.db2.gz ACKBGWCFMPHNLZ-JQWIXIFHSA-N -1 3 386.376 -1.822 20 0 GAADHM 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O=C(CN1CCCNC1=O)N1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582303042 1075922841 /nfs/dbraw/zinc/92/28/41/1075922841.db2.gz BBYVRUFOOQHTSW-LLVKDONJSA-N -1 3 387.404 -1.059 20 0 GAADHM O=C(CN1CCCNC1=O)N1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582303042 1075922836 /nfs/dbraw/zinc/92/28/36/1075922836.db2.gz BBYVRUFOOQHTSW-LLVKDONJSA-N -1 3 387.404 -1.059 20 0 GAADHM O=C(CN1CCCNC1=O)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582303043 1075923463 /nfs/dbraw/zinc/92/34/63/1075923463.db2.gz BBYVRUFOOQHTSW-NSHDSACASA-N -1 3 387.404 -1.059 20 0 GAADHM O=C(CN1CCCNC1=O)N1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582303043 1075923459 /nfs/dbraw/zinc/92/34/59/1075923459.db2.gz BBYVRUFOOQHTSW-NSHDSACASA-N -1 3 387.404 -1.059 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)C2CS(=O)(=O)C2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582303132 1075923383 /nfs/dbraw/zinc/92/33/83/1075923383.db2.gz WRAOBTFXNBHUQJ-JTQLQIEISA-N -1 3 379.402 -1.430 20 0 GAADHM 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O=C(Cc1cnc[nH]1)N1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001582303529 1075923900 /nfs/dbraw/zinc/92/39/00/1075923900.db2.gz MAXXGUAGFMGJHH-AAEUAGOBSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1cnc[nH]1)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@H](O)C1 ZINC001582303530 1075924443 /nfs/dbraw/zinc/92/44/43/1075924443.db2.gz MAXXGUAGFMGJHH-DGCLKSJQSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1cnc[nH]1)N1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@H](O)C1 ZINC001582303531 1075924482 /nfs/dbraw/zinc/92/44/82/1075924482.db2.gz MAXXGUAGFMGJHH-WCQYABFASA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1cnc[nH]1)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001582303532 1075924404 /nfs/dbraw/zinc/92/44/04/1075924404.db2.gz MAXXGUAGFMGJHH-YPMHNXCESA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(CCn1cnnn1)N1CCC(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001582303598 1075924385 /nfs/dbraw/zinc/92/43/85/1075924385.db2.gz NQNMGGFRKQUFCA-UHFFFAOYSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)N1CCC(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001582303598 1075924381 /nfs/dbraw/zinc/92/43/81/1075924381.db2.gz NQNMGGFRKQUFCA-UHFFFAOYSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@H](O)C1 ZINC001582303727 1075924466 /nfs/dbraw/zinc/92/44/66/1075924466.db2.gz RDGBARXZRYIVMQ-CMPLNLGQSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@H](O)C1 ZINC001582303727 1075924460 /nfs/dbraw/zinc/92/44/60/1075924460.db2.gz RDGBARXZRYIVMQ-CMPLNLGQSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001582303728 1075924508 /nfs/dbraw/zinc/92/45/08/1075924508.db2.gz RDGBARXZRYIVMQ-JQWIXIFHSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001582303728 1075924503 /nfs/dbraw/zinc/92/45/03/1075924503.db2.gz RDGBARXZRYIVMQ-JQWIXIFHSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001582303729 1075924427 /nfs/dbraw/zinc/92/44/27/1075924427.db2.gz RDGBARXZRYIVMQ-PWSUYJOCSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001582303729 1075924421 /nfs/dbraw/zinc/92/44/21/1075924421.db2.gz RDGBARXZRYIVMQ-PWSUYJOCSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@H](O)C1 ZINC001582303730 1075924375 /nfs/dbraw/zinc/92/43/75/1075924375.db2.gz RDGBARXZRYIVMQ-ZYHUDNBSSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@H](O)C1 ZINC001582303730 1075924371 /nfs/dbraw/zinc/92/43/71/1075924371.db2.gz RDGBARXZRYIVMQ-ZYHUDNBSSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cn1cccn1)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001582303773 1075924311 /nfs/dbraw/zinc/92/43/11/1075924311.db2.gz SKBASGMZNFHPPD-AAEUAGOBSA-N -1 3 385.388 -1.217 20 0 GAADHM O=C(Cn1cccn1)N1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001582303773 1075924306 /nfs/dbraw/zinc/92/43/06/1075924306.db2.gz SKBASGMZNFHPPD-AAEUAGOBSA-N -1 3 385.388 -1.217 20 0 GAADHM O=C(Cn1cccn1)N1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@H](O)C1 ZINC001582303774 1075924360 /nfs/dbraw/zinc/92/43/60/1075924360.db2.gz SKBASGMZNFHPPD-DGCLKSJQSA-N -1 3 385.388 -1.217 20 0 GAADHM O=C(Cn1cccn1)N1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@H](O)C1 ZINC001582303774 1075924356 /nfs/dbraw/zinc/92/43/56/1075924356.db2.gz SKBASGMZNFHPPD-DGCLKSJQSA-N -1 3 385.388 -1.217 20 0 GAADHM O=C(Cn1cccn1)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@H](O)C1 ZINC001582303775 1075924524 /nfs/dbraw/zinc/92/45/24/1075924524.db2.gz SKBASGMZNFHPPD-WCQYABFASA-N -1 3 385.388 -1.217 20 0 GAADHM O=C(Cn1cccn1)N1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@H](O)C1 ZINC001582303775 1075924518 /nfs/dbraw/zinc/92/45/18/1075924518.db2.gz SKBASGMZNFHPPD-WCQYABFASA-N -1 3 385.388 -1.217 20 0 GAADHM O=C(Cn1cccn1)N1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001582303776 1075924344 /nfs/dbraw/zinc/92/43/44/1075924344.db2.gz SKBASGMZNFHPPD-YPMHNXCESA-N -1 3 385.388 -1.217 20 0 GAADHM O=C(Cn1cccn1)N1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001582303776 1075924340 /nfs/dbraw/zinc/92/43/40/1075924340.db2.gz SKBASGMZNFHPPD-YPMHNXCESA-N -1 3 385.388 -1.217 20 0 GAADHM O=C(CN1CCCNC1=O)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582303803 1075924294 /nfs/dbraw/zinc/92/42/94/1075924294.db2.gz TZIMWPIGIOYLBO-LLVKDONJSA-N -1 3 387.404 -1.059 20 0 GAADHM O=C(CN1CCCNC1=O)N1CC[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582303803 1075924288 /nfs/dbraw/zinc/92/42/88/1075924288.db2.gz TZIMWPIGIOYLBO-LLVKDONJSA-N -1 3 387.404 -1.059 20 0 GAADHM O=C(CN1CCCNC1=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582303804 1075924549 /nfs/dbraw/zinc/92/45/49/1075924549.db2.gz TZIMWPIGIOYLBO-NSHDSACASA-N -1 3 387.404 -1.059 20 0 GAADHM O=C(CN1CCCNC1=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582303804 1075924543 /nfs/dbraw/zinc/92/45/43/1075924543.db2.gz TZIMWPIGIOYLBO-NSHDSACASA-N -1 3 387.404 -1.059 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@H](O)C1 ZINC001582303950 1075924930 /nfs/dbraw/zinc/92/49/30/1075924930.db2.gz YGWBJDHZUFTIQM-CMPLNLGQSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@H](O)C1 ZINC001582303950 1075924928 /nfs/dbraw/zinc/92/49/28/1075924928.db2.gz YGWBJDHZUFTIQM-CMPLNLGQSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001582303951 1075924994 /nfs/dbraw/zinc/92/49/94/1075924994.db2.gz YGWBJDHZUFTIQM-JQWIXIFHSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001582303951 1075924991 /nfs/dbraw/zinc/92/49/91/1075924991.db2.gz YGWBJDHZUFTIQM-JQWIXIFHSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001582303952 1075924977 /nfs/dbraw/zinc/92/49/77/1075924977.db2.gz YGWBJDHZUFTIQM-PWSUYJOCSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001582303952 1075924973 /nfs/dbraw/zinc/92/49/73/1075924973.db2.gz YGWBJDHZUFTIQM-PWSUYJOCSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@H](O)C1 ZINC001582303953 1075924801 /nfs/dbraw/zinc/92/48/01/1075924801.db2.gz YGWBJDHZUFTIQM-ZYHUDNBSSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@H](O)C1 ZINC001582303953 1075924797 /nfs/dbraw/zinc/92/47/97/1075924797.db2.gz YGWBJDHZUFTIQM-ZYHUDNBSSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cn1ccnc1)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001582303990 1075924941 /nfs/dbraw/zinc/92/49/41/1075924941.db2.gz ZJNMYAFKVGZMCI-GWCFXTLKSA-N -1 3 385.388 -1.217 20 0 GAADHM O=C(Cn1ccnc1)N1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001582303990 1075924938 /nfs/dbraw/zinc/92/49/38/1075924938.db2.gz ZJNMYAFKVGZMCI-GWCFXTLKSA-N -1 3 385.388 -1.217 20 0 GAADHM O=C(Cn1ccnc1)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1 ZINC001582303991 1075924873 /nfs/dbraw/zinc/92/48/73/1075924873.db2.gz ZJNMYAFKVGZMCI-GXFFZTMASA-N -1 3 385.388 -1.217 20 0 GAADHM O=C(Cn1ccnc1)N1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H](O)C1 ZINC001582303991 1075924870 /nfs/dbraw/zinc/92/48/70/1075924870.db2.gz ZJNMYAFKVGZMCI-GXFFZTMASA-N -1 3 385.388 -1.217 20 0 GAADHM O=C(Cn1ccnc1)N1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001582303992 1075924842 /nfs/dbraw/zinc/92/48/42/1075924842.db2.gz ZJNMYAFKVGZMCI-MFKMUULPSA-N -1 3 385.388 -1.217 20 0 GAADHM O=C(Cn1ccnc1)N1CC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001582303992 1075924841 /nfs/dbraw/zinc/92/48/41/1075924841.db2.gz ZJNMYAFKVGZMCI-MFKMUULPSA-N -1 3 385.388 -1.217 20 0 GAADHM O=C(Cn1ccnc1)N1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1 ZINC001582303993 1075924826 /nfs/dbraw/zinc/92/48/26/1075924826.db2.gz ZJNMYAFKVGZMCI-ZWNOBZJWSA-N -1 3 385.388 -1.217 20 0 GAADHM O=C(Cn1ccnc1)N1CC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H](O)C1 ZINC001582303993 1075924823 /nfs/dbraw/zinc/92/48/23/1075924823.db2.gz ZJNMYAFKVGZMCI-ZWNOBZJWSA-N -1 3 385.388 -1.217 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1 ZINC001582304004 1075924850 /nfs/dbraw/zinc/92/48/50/1075924850.db2.gz ZPSXFKPLEYSTSW-BXKDBHETSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H](O)C1 ZINC001582304004 1075924848 /nfs/dbraw/zinc/92/48/48/1075924848.db2.gz ZPSXFKPLEYSTSW-BXKDBHETSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001582304005 1075924882 /nfs/dbraw/zinc/92/48/82/1075924882.db2.gz ZPSXFKPLEYSTSW-CABZTGNLSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001582304005 1075924879 /nfs/dbraw/zinc/92/48/79/1075924879.db2.gz ZPSXFKPLEYSTSW-CABZTGNLSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1 ZINC001582304006 1075924902 /nfs/dbraw/zinc/92/49/02/1075924902.db2.gz ZPSXFKPLEYSTSW-JOYOIKCWSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H](O)C1 ZINC001582304006 1075924899 /nfs/dbraw/zinc/92/48/99/1075924899.db2.gz ZPSXFKPLEYSTSW-JOYOIKCWSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001582304007 1075924858 /nfs/dbraw/zinc/92/48/58/1075924858.db2.gz ZPSXFKPLEYSTSW-SKDRFNHKSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001582304007 1075924855 /nfs/dbraw/zinc/92/48/55/1075924855.db2.gz ZPSXFKPLEYSTSW-SKDRFNHKSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cc1cnc[nH]1)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001582304026 1075924918 /nfs/dbraw/zinc/92/49/18/1075924918.db2.gz ZXCITXGBLAUOOT-GWCFXTLKSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1cnc[nH]1)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1 ZINC001582304027 1075925527 /nfs/dbraw/zinc/92/55/27/1075925527.db2.gz ZXCITXGBLAUOOT-GXFFZTMASA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1cnc[nH]1)N1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001582304028 1075925443 /nfs/dbraw/zinc/92/54/43/1075925443.db2.gz ZXCITXGBLAUOOT-MFKMUULPSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(Cc1cnc[nH]1)N1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1 ZINC001582304029 1075925397 /nfs/dbraw/zinc/92/53/97/1075925397.db2.gz ZXCITXGBLAUOOT-ZWNOBZJWSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C[C@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582304132 1075925574 /nfs/dbraw/zinc/92/55/74/1075925574.db2.gz CBMFEXZSZLZIAL-FUVSOYRFSA-N -1 3 387.400 -1.221 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C[C@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582304132 1075925570 /nfs/dbraw/zinc/92/55/70/1075925570.db2.gz CBMFEXZSZLZIAL-FUVSOYRFSA-N -1 3 387.400 -1.221 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C[C@@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582304133 1075925499 /nfs/dbraw/zinc/92/54/99/1075925499.db2.gz CBMFEXZSZLZIAL-GGFUIZRSSA-N -1 3 387.400 -1.221 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C[C@@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582304133 1075925496 /nfs/dbraw/zinc/92/54/96/1075925496.db2.gz CBMFEXZSZLZIAL-GGFUIZRSSA-N -1 3 387.400 -1.221 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C[C@@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582304134 1075925542 /nfs/dbraw/zinc/92/55/42/1075925542.db2.gz CBMFEXZSZLZIAL-QXJJFIIZSA-N -1 3 387.400 -1.221 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C[C@@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582304134 1075925538 /nfs/dbraw/zinc/92/55/38/1075925538.db2.gz 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CBTYDPRJRNFECS-JQWIXIFHSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O)c1ncccn1 ZINC001582304137 1075925415 /nfs/dbraw/zinc/92/54/15/1075925415.db2.gz CBTYDPRJRNFECS-JQWIXIFHSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O)c1ncccn1 ZINC001582304138 1075925197 /nfs/dbraw/zinc/92/51/97/1075925197.db2.gz CBTYDPRJRNFECS-PWSUYJOCSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O)c1ncccn1 ZINC001582304138 1075925191 /nfs/dbraw/zinc/92/51/91/1075925191.db2.gz CBTYDPRJRNFECS-PWSUYJOCSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O)c1ncccn1 ZINC001582304139 1075925212 /nfs/dbraw/zinc/92/52/12/1075925212.db2.gz CBTYDPRJRNFECS-ZYHUDNBSSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O)c1ncccn1 ZINC001582304139 1075925206 /nfs/dbraw/zinc/92/52/06/1075925206.db2.gz CBTYDPRJRNFECS-ZYHUDNBSSA-N 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O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O)c1cccnn1 ZINC001582304254 1075925455 /nfs/dbraw/zinc/92/54/55/1075925455.db2.gz GCBLIUUNSWHOQH-MFKMUULPSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O)c1cccnn1 ZINC001582304255 1075925332 /nfs/dbraw/zinc/92/53/32/1075925332.db2.gz GCBLIUUNSWHOQH-ZWNOBZJWSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O)c1cccnn1 ZINC001582304255 1075925318 /nfs/dbraw/zinc/92/53/18/1075925318.db2.gz GCBLIUUNSWHOQH-ZWNOBZJWSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C[C@@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582304428 1075925561 /nfs/dbraw/zinc/92/55/61/1075925561.db2.gz LIXIYUOSHKTPFU-AUWDCVOYSA-N -1 3 387.400 -1.221 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C[C@@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582304428 1075925555 /nfs/dbraw/zinc/92/55/55/1075925555.db2.gz LIXIYUOSHKTPFU-AUWDCVOYSA-N -1 3 387.400 -1.221 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C[C@@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582304429 1075925483 /nfs/dbraw/zinc/92/54/83/1075925483.db2.gz LIXIYUOSHKTPFU-DLHUNUQVSA-N -1 3 387.400 -1.221 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C[C@@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582304429 1075925478 /nfs/dbraw/zinc/92/54/78/1075925478.db2.gz LIXIYUOSHKTPFU-DLHUNUQVSA-N -1 3 387.400 -1.221 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C[C@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582304430 1075925294 /nfs/dbraw/zinc/92/52/94/1075925294.db2.gz LIXIYUOSHKTPFU-MBGSKLRTSA-N -1 3 387.400 -1.221 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C[C@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582304430 1075925283 /nfs/dbraw/zinc/92/52/83/1075925283.db2.gz LIXIYUOSHKTPFU-MBGSKLRTSA-N -1 3 387.400 -1.221 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C[C@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582304431 1075925249 /nfs/dbraw/zinc/92/52/49/1075925249.db2.gz LIXIYUOSHKTPFU-UHEDFLHXSA-N -1 3 387.400 -1.221 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)[C@H]2[C@@H]3COC[C@@H]32)C[C@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582304431 1075925243 /nfs/dbraw/zinc/92/52/43/1075925243.db2.gz LIXIYUOSHKTPFU-UHEDFLHXSA-N -1 3 387.400 -1.221 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O)C1=COCCO1 ZINC001582304573 1075925267 /nfs/dbraw/zinc/92/52/67/1075925267.db2.gz PBUPJXKJJXWAEC-CMPLNLGQSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O)C1=COCCO1 ZINC001582304573 1075925260 /nfs/dbraw/zinc/92/52/60/1075925260.db2.gz PBUPJXKJJXWAEC-CMPLNLGQSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O)C1=COCCO1 ZINC001582304574 1075925861 /nfs/dbraw/zinc/92/58/61/1075925861.db2.gz PBUPJXKJJXWAEC-JQWIXIFHSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O)C1=COCCO1 ZINC001582304574 1075925858 /nfs/dbraw/zinc/92/58/58/1075925858.db2.gz PBUPJXKJJXWAEC-JQWIXIFHSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O)C1=COCCO1 ZINC001582304575 1075925851 /nfs/dbraw/zinc/92/58/51/1075925851.db2.gz PBUPJXKJJXWAEC-PWSUYJOCSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O)C1=COCCO1 ZINC001582304575 1075925849 /nfs/dbraw/zinc/92/58/49/1075925849.db2.gz PBUPJXKJJXWAEC-PWSUYJOCSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O)C1=COCCO1 ZINC001582304576 1075925936 /nfs/dbraw/zinc/92/59/36/1075925936.db2.gz PBUPJXKJJXWAEC-ZYHUDNBSSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O)C1=COCCO1 ZINC001582304576 1075925929 /nfs/dbraw/zinc/92/59/29/1075925929.db2.gz PBUPJXKJJXWAEC-ZYHUDNBSSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)C1CS(=O)(=O)C1 ZINC001582304579 1075925818 /nfs/dbraw/zinc/92/58/18/1075925818.db2.gz 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3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O)c1cncnc1 ZINC001582304590 1075925799 /nfs/dbraw/zinc/92/57/99/1075925799.db2.gz PLORMWJHKSHJRY-WCQYABFASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O)c1cncnc1 ZINC001582304590 1075925798 /nfs/dbraw/zinc/92/57/98/1075925798.db2.gz PLORMWJHKSHJRY-WCQYABFASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O)c1cncnc1 ZINC001582304591 1075925796 /nfs/dbraw/zinc/92/57/96/1075925796.db2.gz PLORMWJHKSHJRY-YPMHNXCESA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O)c1cncnc1 ZINC001582304591 1075925795 /nfs/dbraw/zinc/92/57/95/1075925795.db2.gz PLORMWJHKSHJRY-YPMHNXCESA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(Cn1nccn1)N1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@H](O)C1 ZINC001582304629 1075925787 /nfs/dbraw/zinc/92/57/87/1075925787.db2.gz QRVIRLWXVIKIFZ-CMPLNLGQSA-N -1 3 386.376 -1.822 20 0 GAADHM 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O=C(N[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O)c1ccncn1 ZINC001582304650 1075925801 /nfs/dbraw/zinc/92/58/01/1075925801.db2.gz RHOCHXZSIQMOIV-GXFFZTMASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O)c1ccncn1 ZINC001582304651 1075925813 /nfs/dbraw/zinc/92/58/13/1075925813.db2.gz RHOCHXZSIQMOIV-MFKMUULPSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O)c1ccncn1 ZINC001582304651 1075925812 /nfs/dbraw/zinc/92/58/12/1075925812.db2.gz RHOCHXZSIQMOIV-MFKMUULPSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O)c1ccncn1 ZINC001582304652 1075925912 /nfs/dbraw/zinc/92/59/12/1075925912.db2.gz RHOCHXZSIQMOIV-ZWNOBZJWSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O)c1ccncn1 ZINC001582304652 1075925908 /nfs/dbraw/zinc/92/59/08/1075925908.db2.gz RHOCHXZSIQMOIV-ZWNOBZJWSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(Cn1nccn1)N1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1 ZINC001582304748 1075925808 /nfs/dbraw/zinc/92/58/08/1075925808.db2.gz UGNPHLWEXKJWPS-BXKDBHETSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1nccn1)N1CC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H](O)C1 ZINC001582304748 1075925807 /nfs/dbraw/zinc/92/58/07/1075925807.db2.gz UGNPHLWEXKJWPS-BXKDBHETSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1nccn1)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001582304749 1075925958 /nfs/dbraw/zinc/92/59/58/1075925958.db2.gz UGNPHLWEXKJWPS-CABZTGNLSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1nccn1)N1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001582304749 1075925949 /nfs/dbraw/zinc/92/59/49/1075925949.db2.gz UGNPHLWEXKJWPS-CABZTGNLSA-N -1 3 386.376 -1.822 20 0 GAADHM O=C(Cn1nccn1)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1 ZINC001582304750 1075925805 /nfs/dbraw/zinc/92/58/05/1075925805.db2.gz UGNPHLWEXKJWPS-JOYOIKCWSA-N -1 3 386.376 -1.822 20 0 GAADHM 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WICVCKNIHNYCPF-GGFUIZRSSA-N -1 3 387.400 -1.221 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O)[C@H]1[C@@H]2COC[C@@H]21 ZINC001582304820 1075926456 /nfs/dbraw/zinc/92/64/56/1075926456.db2.gz WICVCKNIHNYCPF-QXJJFIIZSA-N -1 3 387.400 -1.221 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O)[C@H]1[C@@H]2COC[C@@H]21 ZINC001582304820 1075926453 /nfs/dbraw/zinc/92/64/53/1075926453.db2.gz WICVCKNIHNYCPF-QXJJFIIZSA-N -1 3 387.400 -1.221 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O)[C@H]1[C@@H]2COC[C@@H]21 ZINC001582304821 1075926477 /nfs/dbraw/zinc/92/64/77/1075926477.db2.gz WICVCKNIHNYCPF-VGYDOTAVSA-N -1 3 387.400 -1.221 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O)[C@H]1[C@@H]2COC[C@@H]21 ZINC001582304821 1075926473 /nfs/dbraw/zinc/92/64/73/1075926473.db2.gz WICVCKNIHNYCPF-VGYDOTAVSA-N -1 3 387.400 -1.221 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O)c1ccnnc1 ZINC001582304898 1075926341 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O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O)c1ccnnc1 ZINC001582306624 1075927830 /nfs/dbraw/zinc/92/78/30/1075927830.db2.gz DLSAUQRVPPMMBV-GWCFXTLKSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O)c1ccnnc1 ZINC001582306625 1075927816 /nfs/dbraw/zinc/92/78/16/1075927816.db2.gz DLSAUQRVPPMMBV-GXFFZTMASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O)c1ccnnc1 ZINC001582306625 1075927810 /nfs/dbraw/zinc/92/78/10/1075927810.db2.gz DLSAUQRVPPMMBV-GXFFZTMASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O)c1ccnnc1 ZINC001582306626 1075927798 /nfs/dbraw/zinc/92/77/98/1075927798.db2.gz DLSAUQRVPPMMBV-MFKMUULPSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O)c1ccnnc1 ZINC001582306626 1075927792 /nfs/dbraw/zinc/92/77/92/1075927792.db2.gz DLSAUQRVPPMMBV-MFKMUULPSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O)c1ccnnc1 ZINC001582306627 1075927780 /nfs/dbraw/zinc/92/77/80/1075927780.db2.gz DLSAUQRVPPMMBV-ZWNOBZJWSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O)c1ccnnc1 ZINC001582306627 1075927774 /nfs/dbraw/zinc/92/77/74/1075927774.db2.gz DLSAUQRVPPMMBV-ZWNOBZJWSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cncnc2)C[C@@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582306772 1075927949 /nfs/dbraw/zinc/92/79/49/1075927949.db2.gz HVQWBNQKZYYKPP-GWCFXTLKSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cncnc2)C[C@@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582306772 1075927946 /nfs/dbraw/zinc/92/79/46/1075927946.db2.gz HVQWBNQKZYYKPP-GWCFXTLKSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cncnc2)C[C@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582306773 1075928049 /nfs/dbraw/zinc/92/80/49/1075928049.db2.gz HVQWBNQKZYYKPP-GXFFZTMASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cncnc2)C[C@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582306773 1075928046 /nfs/dbraw/zinc/92/80/46/1075928046.db2.gz HVQWBNQKZYYKPP-GXFFZTMASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cncnc2)C[C@@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582306774 1075928026 /nfs/dbraw/zinc/92/80/26/1075928026.db2.gz HVQWBNQKZYYKPP-MFKMUULPSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cncnc2)C[C@@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582306774 1075928023 /nfs/dbraw/zinc/92/80/23/1075928023.db2.gz HVQWBNQKZYYKPP-MFKMUULPSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cncnc2)C[C@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582306775 1075927992 /nfs/dbraw/zinc/92/79/92/1075927992.db2.gz HVQWBNQKZYYKPP-ZWNOBZJWSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cncnc2)C[C@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582306775 1075927988 /nfs/dbraw/zinc/92/79/88/1075927988.db2.gz HVQWBNQKZYYKPP-ZWNOBZJWSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O)c1ccncn1 ZINC001582306786 1075927981 /nfs/dbraw/zinc/92/79/81/1075927981.db2.gz IDVGUAKADQQFFG-NOZJJQNGSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O)c1ccncn1 ZINC001582306786 1075927979 /nfs/dbraw/zinc/92/79/79/1075927979.db2.gz IDVGUAKADQQFFG-NOZJJQNGSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O)c1ccncn1 ZINC001582306787 1075927973 /nfs/dbraw/zinc/92/79/73/1075927973.db2.gz IDVGUAKADQQFFG-RNCFNFMXSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O)c1ccncn1 ZINC001582306787 1075927968 /nfs/dbraw/zinc/92/79/68/1075927968.db2.gz IDVGUAKADQQFFG-RNCFNFMXSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O)c1ccncn1 ZINC001582306788 1075927874 /nfs/dbraw/zinc/92/78/74/1075927874.db2.gz IDVGUAKADQQFFG-TVQRCGJNSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O)c1ccncn1 ZINC001582306788 1075927869 /nfs/dbraw/zinc/92/78/69/1075927869.db2.gz IDVGUAKADQQFFG-TVQRCGJNSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O)c1ccncn1 ZINC001582306789 1075928042 /nfs/dbraw/zinc/92/80/42/1075928042.db2.gz IDVGUAKADQQFFG-ZANVPECISA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O)c1ccncn1 ZINC001582306789 1075928040 /nfs/dbraw/zinc/92/80/40/1075928040.db2.gz IDVGUAKADQQFFG-ZANVPECISA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cncnc2)C[C@@H]1O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582306841 1075928016 /nfs/dbraw/zinc/92/80/16/1075928016.db2.gz JPBDIYDYMKWPSQ-AAEUAGOBSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cncnc2)C[C@@H]1O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582306841 1075928012 /nfs/dbraw/zinc/92/80/12/1075928012.db2.gz JPBDIYDYMKWPSQ-AAEUAGOBSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cncnc2)C[C@H]1O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582306842 1075927961 /nfs/dbraw/zinc/92/79/61/1075927961.db2.gz JPBDIYDYMKWPSQ-DGCLKSJQSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cncnc2)C[C@H]1O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582306842 1075927956 /nfs/dbraw/zinc/92/79/56/1075927956.db2.gz JPBDIYDYMKWPSQ-DGCLKSJQSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cncnc2)C[C@H]1O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582306843 1075928003 /nfs/dbraw/zinc/92/80/03/1075928003.db2.gz JPBDIYDYMKWPSQ-WCQYABFASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cncnc2)C[C@H]1O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582306843 1075927999 /nfs/dbraw/zinc/92/79/99/1075927999.db2.gz JPBDIYDYMKWPSQ-WCQYABFASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cncnc2)C[C@@H]1O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582306844 1075927937 /nfs/dbraw/zinc/92/79/37/1075927937.db2.gz JPBDIYDYMKWPSQ-YPMHNXCESA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cncnc2)C[C@@H]1O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582306844 1075927932 /nfs/dbraw/zinc/92/79/32/1075927932.db2.gz JPBDIYDYMKWPSQ-YPMHNXCESA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O)c1cncnc1 ZINC001582306918 1075927857 /nfs/dbraw/zinc/92/78/57/1075927857.db2.gz LZJMEHMOXXVVSF-GWCFXTLKSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O)c1cncnc1 ZINC001582306918 1075927848 /nfs/dbraw/zinc/92/78/48/1075927848.db2.gz LZJMEHMOXXVVSF-GWCFXTLKSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O)c1cncnc1 ZINC001582306919 1075927894 /nfs/dbraw/zinc/92/78/94/1075927894.db2.gz LZJMEHMOXXVVSF-GXFFZTMASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O)c1cncnc1 ZINC001582306919 1075927888 /nfs/dbraw/zinc/92/78/88/1075927888.db2.gz LZJMEHMOXXVVSF-GXFFZTMASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O)c1cncnc1 ZINC001582306920 1075928365 /nfs/dbraw/zinc/92/83/65/1075928365.db2.gz LZJMEHMOXXVVSF-MFKMUULPSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O)c1cncnc1 ZINC001582306920 1075928361 /nfs/dbraw/zinc/92/83/61/1075928361.db2.gz LZJMEHMOXXVVSF-MFKMUULPSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O)c1cncnc1 ZINC001582306921 1075928272 /nfs/dbraw/zinc/92/82/72/1075928272.db2.gz LZJMEHMOXXVVSF-ZWNOBZJWSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O)c1cncnc1 ZINC001582306921 1075928266 /nfs/dbraw/zinc/92/82/66/1075928266.db2.gz LZJMEHMOXXVVSF-ZWNOBZJWSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccnnc2)C[C@@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582307019 1075928492 /nfs/dbraw/zinc/92/84/92/1075928492.db2.gz OONTTZJWZRFSIN-GWCFXTLKSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccnnc2)C[C@@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582307019 1075928487 /nfs/dbraw/zinc/92/84/87/1075928487.db2.gz OONTTZJWZRFSIN-GWCFXTLKSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccnnc2)C[C@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582307020 1075928408 /nfs/dbraw/zinc/92/84/08/1075928408.db2.gz OONTTZJWZRFSIN-GXFFZTMASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccnnc2)C[C@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582307020 1075928402 /nfs/dbraw/zinc/92/84/02/1075928402.db2.gz OONTTZJWZRFSIN-GXFFZTMASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccnnc2)C[C@@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582307021 1075928434 /nfs/dbraw/zinc/92/84/34/1075928434.db2.gz OONTTZJWZRFSIN-MFKMUULPSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccnnc2)C[C@@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582307021 1075928430 /nfs/dbraw/zinc/92/84/30/1075928430.db2.gz OONTTZJWZRFSIN-MFKMUULPSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccnnc2)C[C@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582307022 1075928462 /nfs/dbraw/zinc/92/84/62/1075928462.db2.gz OONTTZJWZRFSIN-ZWNOBZJWSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccnnc2)C[C@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582307022 1075928457 /nfs/dbraw/zinc/92/84/57/1075928457.db2.gz OONTTZJWZRFSIN-ZWNOBZJWSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cnccn2)C[C@@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582307038 1075928249 /nfs/dbraw/zinc/92/82/49/1075928249.db2.gz PAHMYRJYKUIUDK-GWCFXTLKSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cnccn2)C[C@@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582307038 1075928239 /nfs/dbraw/zinc/92/82/39/1075928239.db2.gz PAHMYRJYKUIUDK-GWCFXTLKSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cnccn2)C[C@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582307039 1075928448 /nfs/dbraw/zinc/92/84/48/1075928448.db2.gz PAHMYRJYKUIUDK-GXFFZTMASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cnccn2)C[C@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582307039 1075928444 /nfs/dbraw/zinc/92/84/44/1075928444.db2.gz PAHMYRJYKUIUDK-GXFFZTMASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cnccn2)C[C@@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582307040 1075928421 /nfs/dbraw/zinc/92/84/21/1075928421.db2.gz PAHMYRJYKUIUDK-MFKMUULPSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cnccn2)C[C@@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582307040 1075928417 /nfs/dbraw/zinc/92/84/17/1075928417.db2.gz PAHMYRJYKUIUDK-MFKMUULPSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cnccn2)C[C@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582307041 1075928352 /nfs/dbraw/zinc/92/83/52/1075928352.db2.gz PAHMYRJYKUIUDK-ZWNOBZJWSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cnccn2)C[C@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582307041 1075928347 /nfs/dbraw/zinc/92/83/47/1075928347.db2.gz PAHMYRJYKUIUDK-ZWNOBZJWSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O)c1cccnn1 ZINC001582307078 1075928320 /nfs/dbraw/zinc/92/83/20/1075928320.db2.gz PPUKIDDKQOHKBZ-NOZJJQNGSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O)c1cccnn1 ZINC001582307078 1075928312 /nfs/dbraw/zinc/92/83/12/1075928312.db2.gz PPUKIDDKQOHKBZ-NOZJJQNGSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O)c1cccnn1 ZINC001582307079 1075928476 /nfs/dbraw/zinc/92/84/76/1075928476.db2.gz PPUKIDDKQOHKBZ-RNCFNFMXSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O)c1cccnn1 ZINC001582307079 1075928472 /nfs/dbraw/zinc/92/84/72/1075928472.db2.gz PPUKIDDKQOHKBZ-RNCFNFMXSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O)c1cccnn1 ZINC001582307080 1075928340 /nfs/dbraw/zinc/92/83/40/1075928340.db2.gz PPUKIDDKQOHKBZ-TVQRCGJNSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O)c1cccnn1 ZINC001582307080 1075928334 /nfs/dbraw/zinc/92/83/34/1075928334.db2.gz PPUKIDDKQOHKBZ-TVQRCGJNSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O)c1cccnn1 ZINC001582307081 1075928395 /nfs/dbraw/zinc/92/83/95/1075928395.db2.gz PPUKIDDKQOHKBZ-ZANVPECISA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O)c1cccnn1 ZINC001582307081 1075928390 /nfs/dbraw/zinc/92/83/90/1075928390.db2.gz PPUKIDDKQOHKBZ-ZANVPECISA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccncn2)C[C@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582307082 1075928225 /nfs/dbraw/zinc/92/82/25/1075928225.db2.gz PWTBCRGGIUXGQW-NOZJJQNGSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccncn2)C[C@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582307082 1075928215 /nfs/dbraw/zinc/92/82/15/1075928215.db2.gz PWTBCRGGIUXGQW-NOZJJQNGSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccncn2)C[C@@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582307083 1075928299 /nfs/dbraw/zinc/92/82/99/1075928299.db2.gz PWTBCRGGIUXGQW-RNCFNFMXSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccncn2)C[C@@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582307083 1075928294 /nfs/dbraw/zinc/92/82/94/1075928294.db2.gz PWTBCRGGIUXGQW-RNCFNFMXSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccncn2)C[C@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582307084 1075928380 /nfs/dbraw/zinc/92/83/80/1075928380.db2.gz PWTBCRGGIUXGQW-TVQRCGJNSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccncn2)C[C@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582307084 1075928375 /nfs/dbraw/zinc/92/83/75/1075928375.db2.gz PWTBCRGGIUXGQW-TVQRCGJNSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccncn2)C[C@@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582307085 1075928522 /nfs/dbraw/zinc/92/85/22/1075928522.db2.gz PWTBCRGGIUXGQW-ZANVPECISA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccncn2)C[C@@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582307085 1075928518 /nfs/dbraw/zinc/92/85/18/1075928518.db2.gz PWTBCRGGIUXGQW-ZANVPECISA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cccnn2)C[C@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582307162 1075928535 /nfs/dbraw/zinc/92/85/35/1075928535.db2.gz SMOJCGFACDUHSN-NOZJJQNGSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cccnn2)C[C@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582307162 1075928530 /nfs/dbraw/zinc/92/85/30/1075928530.db2.gz SMOJCGFACDUHSN-NOZJJQNGSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cccnn2)C[C@@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582307163 1075928508 /nfs/dbraw/zinc/92/85/08/1075928508.db2.gz SMOJCGFACDUHSN-RNCFNFMXSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2cccnn2)C[C@@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582307163 1075928503 /nfs/dbraw/zinc/92/85/03/1075928503.db2.gz SMOJCGFACDUHSN-RNCFNFMXSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cccnn2)C[C@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582307164 1075928746 /nfs/dbraw/zinc/92/87/46/1075928746.db2.gz SMOJCGFACDUHSN-TVQRCGJNSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cccnn2)C[C@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582307164 1075928743 /nfs/dbraw/zinc/92/87/43/1075928743.db2.gz SMOJCGFACDUHSN-TVQRCGJNSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cccnn2)C[C@@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582307165 1075928753 /nfs/dbraw/zinc/92/87/53/1075928753.db2.gz SMOJCGFACDUHSN-ZANVPECISA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2cccnn2)C[C@@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582307165 1075928750 /nfs/dbraw/zinc/92/87/50/1075928750.db2.gz SMOJCGFACDUHSN-ZANVPECISA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O)C1=COCCO1 ZINC001582307180 1075928724 /nfs/dbraw/zinc/92/87/24/1075928724.db2.gz SVOUWUFABADNIN-BXKDBHETSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O)C1=COCCO1 ZINC001582307180 1075928722 /nfs/dbraw/zinc/92/87/22/1075928722.db2.gz SVOUWUFABADNIN-BXKDBHETSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O)C1=COCCO1 ZINC001582307181 1075928795 /nfs/dbraw/zinc/92/87/95/1075928795.db2.gz SVOUWUFABADNIN-CABZTGNLSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O)C1=COCCO1 ZINC001582307181 1075928788 /nfs/dbraw/zinc/92/87/88/1075928788.db2.gz SVOUWUFABADNIN-CABZTGNLSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O)C1=COCCO1 ZINC001582307182 1075928738 /nfs/dbraw/zinc/92/87/38/1075928738.db2.gz SVOUWUFABADNIN-JOYOIKCWSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O)C1=COCCO1 ZINC001582307182 1075928735 /nfs/dbraw/zinc/92/87/35/1075928735.db2.gz SVOUWUFABADNIN-JOYOIKCWSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O)C1=COCCO1 ZINC001582307183 1075928890 /nfs/dbraw/zinc/92/88/90/1075928890.db2.gz SVOUWUFABADNIN-SKDRFNHKSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O)C1=COCCO1 ZINC001582307183 1075928888 /nfs/dbraw/zinc/92/88/88/1075928888.db2.gz SVOUWUFABADNIN-SKDRFNHKSA-N -1 3 389.372 -1.225 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccncn2)C[C@@H]1O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582307232 1075928812 /nfs/dbraw/zinc/92/88/12/1075928812.db2.gz VAPJVSYTGAUNHT-GWCFXTLKSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccncn2)C[C@@H]1O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582307232 1075928805 /nfs/dbraw/zinc/92/88/05/1075928805.db2.gz VAPJVSYTGAUNHT-GWCFXTLKSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccncn2)C[C@H]1O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582307233 1075928853 /nfs/dbraw/zinc/92/88/53/1075928853.db2.gz VAPJVSYTGAUNHT-GXFFZTMASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccncn2)C[C@H]1O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582307233 1075928848 /nfs/dbraw/zinc/92/88/48/1075928848.db2.gz VAPJVSYTGAUNHT-GXFFZTMASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccncn2)C[C@@H]1O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582307234 1075928996 /nfs/dbraw/zinc/92/89/96/1075928996.db2.gz VAPJVSYTGAUNHT-MFKMUULPSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccncn2)C[C@@H]1O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582307234 1075928992 /nfs/dbraw/zinc/92/89/92/1075928992.db2.gz VAPJVSYTGAUNHT-MFKMUULPSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccncn2)C[C@H]1O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582307235 1075928978 /nfs/dbraw/zinc/92/89/78/1075928978.db2.gz VAPJVSYTGAUNHT-ZWNOBZJWSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccncn2)C[C@H]1O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582307235 1075928971 /nfs/dbraw/zinc/92/89/71/1075928971.db2.gz VAPJVSYTGAUNHT-ZWNOBZJWSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccnnc2)C[C@@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582307244 1075928778 /nfs/dbraw/zinc/92/87/78/1075928778.db2.gz VJCGWTAJQXNMRJ-AAEUAGOBSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccnnc2)C[C@@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582307244 1075928774 /nfs/dbraw/zinc/92/87/74/1075928774.db2.gz VJCGWTAJQXNMRJ-AAEUAGOBSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccnnc2)C[C@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582307245 1075928941 /nfs/dbraw/zinc/92/89/41/1075928941.db2.gz VJCGWTAJQXNMRJ-DGCLKSJQSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccnnc2)C[C@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582307245 1075928937 /nfs/dbraw/zinc/92/89/37/1075928937.db2.gz VJCGWTAJQXNMRJ-DGCLKSJQSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccnnc2)C[C@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582307246 1075928925 /nfs/dbraw/zinc/92/89/25/1075928925.db2.gz VJCGWTAJQXNMRJ-WCQYABFASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccnnc2)C[C@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582307246 1075928919 /nfs/dbraw/zinc/92/89/19/1075928919.db2.gz VJCGWTAJQXNMRJ-WCQYABFASA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccnnc2)C[C@@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582307247 1075928907 /nfs/dbraw/zinc/92/89/07/1075928907.db2.gz VJCGWTAJQXNMRJ-YPMHNXCESA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccnnc2)C[C@@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582307247 1075928901 /nfs/dbraw/zinc/92/89/01/1075928901.db2.gz VJCGWTAJQXNMRJ-YPMHNXCESA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O)c1cnccn1 ZINC001582307300 1075928767 /nfs/dbraw/zinc/92/87/67/1075928767.db2.gz XKIAIIWSXIYXID-NOZJJQNGSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O)c1cnccn1 ZINC001582307300 1075928765 /nfs/dbraw/zinc/92/87/65/1075928765.db2.gz XKIAIIWSXIYXID-NOZJJQNGSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O)c1cnccn1 ZINC001582307301 1075928760 /nfs/dbraw/zinc/92/87/60/1075928760.db2.gz XKIAIIWSXIYXID-RNCFNFMXSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O)c1cnccn1 ZINC001582307301 1075928758 /nfs/dbraw/zinc/92/87/58/1075928758.db2.gz XKIAIIWSXIYXID-RNCFNFMXSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O)c1cnccn1 ZINC001582307302 1075928959 /nfs/dbraw/zinc/92/89/59/1075928959.db2.gz XKIAIIWSXIYXID-TVQRCGJNSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O)c1cnccn1 ZINC001582307302 1075928955 /nfs/dbraw/zinc/92/89/55/1075928955.db2.gz XKIAIIWSXIYXID-TVQRCGJNSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O)c1cnccn1 ZINC001582307303 1075928731 /nfs/dbraw/zinc/92/87/31/1075928731.db2.gz XKIAIIWSXIYXID-ZANVPECISA-N -1 3 383.372 -1.010 20 0 GAADHM 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O=C(N[C@H]1CCN(CCNC(=O)C2CC2)C[C@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582307700 1075929423 /nfs/dbraw/zinc/92/94/23/1075929423.db2.gz IDXAUDLEDRISIQ-GXTWGEPZSA-N -1 3 388.432 -1.114 20 0 GAADHM O=C(N[C@H]1CCN(CCNC(=O)C2CC2)C[C@@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582307701 1075929306 /nfs/dbraw/zinc/92/93/06/1075929306.db2.gz IDXAUDLEDRISIQ-JSGCOSHPSA-N -1 3 388.432 -1.114 20 0 GAADHM O=C(N[C@@H]1CCN(CCNC(=O)C2CC2)C[C@@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582307702 1075929362 /nfs/dbraw/zinc/92/93/62/1075929362.db2.gz IDXAUDLEDRISIQ-OCCSQVGLSA-N -1 3 388.432 -1.114 20 0 GAADHM O=C(N[C@@H]1CCN(CCNC(=O)C2CC2)C[C@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582307703 1075929337 /nfs/dbraw/zinc/92/93/37/1075929337.db2.gz IDXAUDLEDRISIQ-TZMCWYRMSA-N -1 3 388.432 -1.114 20 0 GAADHM O=C(CN1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@H](O)C1)N1CCCC1 ZINC001582307831 1075929494 /nfs/dbraw/zinc/92/94/94/1075929494.db2.gz JAARLBMBLIECSX-GXTWGEPZSA-N -1 3 388.432 -1.018 20 0 GAADHM 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O=C(N[C@@H]1CCN(C(=O)c2ncccn2)C[C@H]1O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582309160 1075930358 /nfs/dbraw/zinc/93/03/58/1075930358.db2.gz YZIDLMBBTDYOON-ZYHUDNBSSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ncccn2)C[C@H]1O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582309160 1075930356 /nfs/dbraw/zinc/93/03/56/1075930356.db2.gz YZIDLMBBTDYOON-ZYHUDNBSSA-N -1 3 383.372 -1.010 20 0 GAADHM O=C(CN1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1)N1CCCC1 ZINC001582309169 1075930370 /nfs/dbraw/zinc/93/03/70/1075930370.db2.gz ZCRLYKMGGVZSPK-BXUZGUMPSA-N -1 3 388.432 -1.018 20 0 GAADHM O=C(CN1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1)N1CCCC1 ZINC001582309170 1075930461 /nfs/dbraw/zinc/93/04/61/1075930461.db2.gz ZCRLYKMGGVZSPK-FZMZJTMJSA-N -1 3 388.432 -1.018 20 0 GAADHM O=C(CN1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1)N1CCCC1 ZINC001582309171 1075930348 /nfs/dbraw/zinc/93/03/48/1075930348.db2.gz ZCRLYKMGGVZSPK-RISCZKNCSA-N -1 3 388.432 -1.018 20 0 GAADHM O=C(CN1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](O)C1)N1CCCC1 ZINC001582309172 1075930274 /nfs/dbraw/zinc/93/02/74/1075930274.db2.gz ZCRLYKMGGVZSPK-SMDDNHRTSA-N -1 3 388.432 -1.018 20 0 GAADHM O=C(N[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O)c1c[nH]c(=O)cn1 ZINC001582314181 1075931009 /nfs/dbraw/zinc/93/10/09/1075931009.db2.gz NFEYKLBSAGIYIT-GWCFXTLKSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O)c1c[nH]c(=O)cn1 ZINC001582314181 1075931002 /nfs/dbraw/zinc/93/10/02/1075931002.db2.gz NFEYKLBSAGIYIT-GWCFXTLKSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O)c1c[nH]c(=O)cn1 ZINC001582314182 1075931078 /nfs/dbraw/zinc/93/10/78/1075931078.db2.gz NFEYKLBSAGIYIT-GXFFZTMASA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O)c1c[nH]c(=O)cn1 ZINC001582314182 1075931075 /nfs/dbraw/zinc/93/10/75/1075931075.db2.gz NFEYKLBSAGIYIT-GXFFZTMASA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O)c1c[nH]c(=O)cn1 ZINC001582314183 1075931048 /nfs/dbraw/zinc/93/10/48/1075931048.db2.gz NFEYKLBSAGIYIT-MFKMUULPSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O)c1c[nH]c(=O)cn1 ZINC001582314183 1075931042 /nfs/dbraw/zinc/93/10/42/1075931042.db2.gz NFEYKLBSAGIYIT-MFKMUULPSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O)c1c[nH]c(=O)cn1 ZINC001582314184 1075930857 /nfs/dbraw/zinc/93/08/57/1075930857.db2.gz NFEYKLBSAGIYIT-ZWNOBZJWSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O)c1c[nH]c(=O)cn1 ZINC001582314184 1075930852 /nfs/dbraw/zinc/93/08/52/1075930852.db2.gz NFEYKLBSAGIYIT-ZWNOBZJWSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001582314719 1075930990 /nfs/dbraw/zinc/93/09/90/1075930990.db2.gz PWMRIGPGKVCCFL-BXKDBHETSA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001582314719 1075930984 /nfs/dbraw/zinc/93/09/84/1075930984.db2.gz PWMRIGPGKVCCFL-BXKDBHETSA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(N[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001582314720 1075930920 /nfs/dbraw/zinc/93/09/20/1075930920.db2.gz PWMRIGPGKVCCFL-CABZTGNLSA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(N[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001582314720 1075930914 /nfs/dbraw/zinc/93/09/14/1075930914.db2.gz PWMRIGPGKVCCFL-CABZTGNLSA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(N[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001582314721 1075930973 /nfs/dbraw/zinc/93/09/73/1075930973.db2.gz PWMRIGPGKVCCFL-JOYOIKCWSA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(N[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001582314721 1075930967 /nfs/dbraw/zinc/93/09/67/1075930967.db2.gz PWMRIGPGKVCCFL-JOYOIKCWSA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001582314722 1075931027 /nfs/dbraw/zinc/93/10/27/1075931027.db2.gz PWMRIGPGKVCCFL-SKDRFNHKSA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001582314722 1075931018 /nfs/dbraw/zinc/93/10/18/1075931018.db2.gz PWMRIGPGKVCCFL-SKDRFNHKSA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(N[C@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1O)c1c[nH]c(=O)cn1 ZINC001582315094 1075931584 /nfs/dbraw/zinc/93/15/84/1075931584.db2.gz VSHBNIARKIPPLD-CMPLNLGQSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C[C@H]1O)c1c[nH]c(=O)cn1 ZINC001582315094 1075931580 /nfs/dbraw/zinc/93/15/80/1075931580.db2.gz VSHBNIARKIPPLD-CMPLNLGQSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O)c1c[nH]c(=O)cn1 ZINC001582315095 1075931611 /nfs/dbraw/zinc/93/16/11/1075931611.db2.gz VSHBNIARKIPPLD-JQWIXIFHSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O)c1c[nH]c(=O)cn1 ZINC001582315095 1075931606 /nfs/dbraw/zinc/93/16/06/1075931606.db2.gz VSHBNIARKIPPLD-JQWIXIFHSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O)c1c[nH]c(=O)cn1 ZINC001582315096 1075931442 /nfs/dbraw/zinc/93/14/42/1075931442.db2.gz VSHBNIARKIPPLD-PWSUYJOCSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O)c1c[nH]c(=O)cn1 ZINC001582315096 1075931434 /nfs/dbraw/zinc/93/14/34/1075931434.db2.gz VSHBNIARKIPPLD-PWSUYJOCSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1O)c1c[nH]c(=O)cn1 ZINC001582315097 1075931681 /nfs/dbraw/zinc/93/16/81/1075931681.db2.gz VSHBNIARKIPPLD-ZYHUDNBSSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C[C@H]1O)c1c[nH]c(=O)cn1 ZINC001582315097 1075931674 /nfs/dbraw/zinc/93/16/74/1075931674.db2.gz VSHBNIARKIPPLD-ZYHUDNBSSA-N -1 3 383.372 -1.285 20 0 GAADHM O=C(N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001582315859 1075931599 /nfs/dbraw/zinc/93/15/99/1075931599.db2.gz LMTIORPQCBWOAY-GHMZBOCLSA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001582315859 1075931595 /nfs/dbraw/zinc/93/15/95/1075931595.db2.gz LMTIORPQCBWOAY-GHMZBOCLSA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001582315860 1075931421 /nfs/dbraw/zinc/93/14/21/1075931421.db2.gz LMTIORPQCBWOAY-MNOVXSKESA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001582315860 1075931415 /nfs/dbraw/zinc/93/14/15/1075931415.db2.gz LMTIORPQCBWOAY-MNOVXSKESA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(N[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001582325149 1075932513 /nfs/dbraw/zinc/93/25/13/1075932513.db2.gz NWOVQVDXAPKVRJ-GXSJLCMTSA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(N[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001582325149 1075932507 /nfs/dbraw/zinc/93/25/07/1075932507.db2.gz NWOVQVDXAPKVRJ-GXSJLCMTSA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(N[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001582325151 1075932414 /nfs/dbraw/zinc/93/24/14/1075932414.db2.gz NWOVQVDXAPKVRJ-KOLCDFICSA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(N[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001582325151 1075932410 /nfs/dbraw/zinc/93/24/10/1075932410.db2.gz NWOVQVDXAPKVRJ-KOLCDFICSA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(N[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001582325153 1075932609 /nfs/dbraw/zinc/93/26/09/1075932609.db2.gz NWOVQVDXAPKVRJ-MWLCHTKSSA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(N[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001582325153 1075932606 /nfs/dbraw/zinc/93/26/06/1075932606.db2.gz NWOVQVDXAPKVRJ-MWLCHTKSSA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(N[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001582325155 1075932662 /nfs/dbraw/zinc/93/26/62/1075932662.db2.gz NWOVQVDXAPKVRJ-ONGXEEELSA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(N[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001582325155 1075932658 /nfs/dbraw/zinc/93/26/58/1075932658.db2.gz NWOVQVDXAPKVRJ-ONGXEEELSA-N -1 3 378.418 -1.352 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCc3nncn3C2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582328804 1075932971 /nfs/dbraw/zinc/93/29/71/1075932971.db2.gz AAOICIZANQMHLS-SECBINFHSA-N -1 3 382.388 -1.011 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCc3nncn3C2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582328804 1075932969 /nfs/dbraw/zinc/93/29/69/1075932969.db2.gz AAOICIZANQMHLS-SECBINFHSA-N -1 3 382.388 -1.011 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCc3nncn3C2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582328805 1075933100 /nfs/dbraw/zinc/93/31/00/1075933100.db2.gz AAOICIZANQMHLS-VIFPVBQESA-N -1 3 382.388 -1.011 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCc3nncn3C2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582328805 1075933095 /nfs/dbraw/zinc/93/30/95/1075933095.db2.gz AAOICIZANQMHLS-VIFPVBQESA-N -1 3 382.388 -1.011 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCc3nncn3C2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582328851 1075933087 /nfs/dbraw/zinc/93/30/87/1075933087.db2.gz BGAYLNNZGXLPQN-SECBINFHSA-N -1 3 382.388 -1.011 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCc3nncn3C2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582328851 1075933084 /nfs/dbraw/zinc/93/30/84/1075933084.db2.gz BGAYLNNZGXLPQN-SECBINFHSA-N -1 3 382.388 -1.011 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCc3nncn3C2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582328852 1075932914 /nfs/dbraw/zinc/93/29/14/1075932914.db2.gz BGAYLNNZGXLPQN-VIFPVBQESA-N -1 3 382.388 -1.011 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCc3nncn3C2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582328852 1075932908 /nfs/dbraw/zinc/93/29/08/1075932908.db2.gz BGAYLNNZGXLPQN-VIFPVBQESA-N -1 3 382.388 -1.011 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCS(=O)(=O)N2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582328854 1075933052 /nfs/dbraw/zinc/93/30/52/1075933052.db2.gz BGOUTFCIXZKFGH-SECBINFHSA-N -1 3 380.390 -2.173 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCS(=O)(=O)N2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582328854 1075933047 /nfs/dbraw/zinc/93/30/47/1075933047.db2.gz BGOUTFCIXZKFGH-SECBINFHSA-N -1 3 380.390 -2.173 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCS(=O)(=O)N2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582328855 1075933142 /nfs/dbraw/zinc/93/31/42/1075933142.db2.gz BGOUTFCIXZKFGH-VIFPVBQESA-N -1 3 380.390 -2.173 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCS(=O)(=O)N2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582328855 1075933136 /nfs/dbraw/zinc/93/31/36/1075933136.db2.gz BGOUTFCIXZKFGH-VIFPVBQESA-N -1 3 380.390 -2.173 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCS(=O)(=O)C2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582328871 1075933154 /nfs/dbraw/zinc/93/31/54/1075933154.db2.gz BRSLERYVRVZUMT-MRVPVSSYSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCS(=O)(=O)C2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582328871 1075933151 /nfs/dbraw/zinc/93/31/51/1075933151.db2.gz BRSLERYVRVZUMT-MRVPVSSYSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCS(=O)(=O)C2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582328872 1075932987 /nfs/dbraw/zinc/93/29/87/1075932987.db2.gz BRSLERYVRVZUMT-QMMMGPOBSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCS(=O)(=O)C2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582328872 1075932983 /nfs/dbraw/zinc/93/29/83/1075932983.db2.gz BRSLERYVRVZUMT-QMMMGPOBSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(CC1CS(=O)(=O)C1)N1CC(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582329023 1075933023 /nfs/dbraw/zinc/93/30/23/1075933023.db2.gz HDXKDLMRYGTMDS-UHFFFAOYSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(CC1CS(=O)(=O)C1)N1CC(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582329023 1075933018 /nfs/dbraw/zinc/93/30/18/1075933018.db2.gz HDXKDLMRYGTMDS-UHFFFAOYSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(CC1CS(=O)(=O)C1)N1CC(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582329043 1075932935 /nfs/dbraw/zinc/93/29/35/1075932935.db2.gz HXOXCZIQKUJSNN-UHFFFAOYSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(CC1CS(=O)(=O)C1)N1CC(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582329043 1075932928 /nfs/dbraw/zinc/93/29/28/1075932928.db2.gz HXOXCZIQKUJSNN-UHFFFAOYSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCS(=O)(=O)C2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582329150 1075932881 /nfs/dbraw/zinc/93/28/81/1075932881.db2.gz KTTZTHCYIHBHBD-MRVPVSSYSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCS(=O)(=O)C2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582329150 1075932875 /nfs/dbraw/zinc/93/28/75/1075932875.db2.gz KTTZTHCYIHBHBD-MRVPVSSYSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCS(=O)(=O)C2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582329151 1075932952 /nfs/dbraw/zinc/93/29/52/1075932952.db2.gz KTTZTHCYIHBHBD-QMMMGPOBSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCS(=O)(=O)C2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582329151 1075932947 /nfs/dbraw/zinc/93/29/47/1075932947.db2.gz KTTZTHCYIHBHBD-QMMMGPOBSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCCS2(=O)=O)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582329201 1075933076 /nfs/dbraw/zinc/93/30/76/1075933076.db2.gz MCGKDSSMINEOIN-LLVKDONJSA-N -1 3 379.402 -1.287 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCCS2(=O)=O)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582329201 1075933073 /nfs/dbraw/zinc/93/30/73/1075933073.db2.gz MCGKDSSMINEOIN-LLVKDONJSA-N -1 3 379.402 -1.287 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCCS2(=O)=O)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582329202 1075933112 /nfs/dbraw/zinc/93/31/12/1075933112.db2.gz MCGKDSSMINEOIN-NSHDSACASA-N -1 3 379.402 -1.287 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCCS2(=O)=O)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582329202 1075933108 /nfs/dbraw/zinc/93/31/08/1075933108.db2.gz MCGKDSSMINEOIN-NSHDSACASA-N -1 3 379.402 -1.287 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCCS2(=O)=O)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582329300 1075933067 /nfs/dbraw/zinc/93/30/67/1075933067.db2.gz PAKBDRAQBLPEAR-LLVKDONJSA-N -1 3 379.402 -1.287 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCCS2(=O)=O)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582329300 1075933064 /nfs/dbraw/zinc/93/30/64/1075933064.db2.gz PAKBDRAQBLPEAR-LLVKDONJSA-N -1 3 379.402 -1.287 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCCS2(=O)=O)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582329301 1075933003 /nfs/dbraw/zinc/93/30/03/1075933003.db2.gz PAKBDRAQBLPEAR-NSHDSACASA-N -1 3 379.402 -1.287 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCCS2(=O)=O)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582329301 1075932998 /nfs/dbraw/zinc/93/29/98/1075932998.db2.gz PAKBDRAQBLPEAR-NSHDSACASA-N -1 3 379.402 -1.287 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCS(=O)(=O)C2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582329350 1075933038 /nfs/dbraw/zinc/93/30/38/1075933038.db2.gz QNNVPDABJVTAFQ-MRVPVSSYSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCS(=O)(=O)C2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582329350 1075933032 /nfs/dbraw/zinc/93/30/32/1075933032.db2.gz QNNVPDABJVTAFQ-MRVPVSSYSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCS(=O)(=O)C2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582329351 1075933522 /nfs/dbraw/zinc/93/35/22/1075933522.db2.gz QNNVPDABJVTAFQ-QMMMGPOBSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCS(=O)(=O)C2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582329351 1075933517 /nfs/dbraw/zinc/93/35/17/1075933517.db2.gz QNNVPDABJVTAFQ-QMMMGPOBSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCc3nncn3C2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582329393 1075933411 /nfs/dbraw/zinc/93/34/11/1075933411.db2.gz RMHZSHOAEPQRDE-SECBINFHSA-N -1 3 382.388 -1.011 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCc3nncn3C2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582329393 1075933403 /nfs/dbraw/zinc/93/34/03/1075933403.db2.gz RMHZSHOAEPQRDE-SECBINFHSA-N -1 3 382.388 -1.011 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCc3nncn3C2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582329394 1075933507 /nfs/dbraw/zinc/93/35/07/1075933507.db2.gz RMHZSHOAEPQRDE-VIFPVBQESA-N -1 3 382.388 -1.011 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCc3nncn3C2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582329394 1075933503 /nfs/dbraw/zinc/93/35/03/1075933503.db2.gz RMHZSHOAEPQRDE-VIFPVBQESA-N -1 3 382.388 -1.011 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCCS2(=O)=O)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582329493 1075933571 /nfs/dbraw/zinc/93/35/71/1075933571.db2.gz VOGGGEIZMHAZMQ-LLVKDONJSA-N -1 3 379.402 -1.287 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCCS2(=O)=O)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582329493 1075933567 /nfs/dbraw/zinc/93/35/67/1075933567.db2.gz VOGGGEIZMHAZMQ-LLVKDONJSA-N -1 3 379.402 -1.287 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCCS2(=O)=O)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582329494 1075933599 /nfs/dbraw/zinc/93/35/99/1075933599.db2.gz VOGGGEIZMHAZMQ-NSHDSACASA-N -1 3 379.402 -1.287 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCCS2(=O)=O)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582329494 1075933594 /nfs/dbraw/zinc/93/35/94/1075933594.db2.gz VOGGGEIZMHAZMQ-NSHDSACASA-N -1 3 379.402 -1.287 20 0 GAADHM O=C(CC1CS(=O)(=O)C1)N1CC(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582329515 1075933559 /nfs/dbraw/zinc/93/35/59/1075933559.db2.gz WEDLOJMSIZAPMS-UHFFFAOYSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(CC1CS(=O)(=O)C1)N1CC(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582329515 1075933555 /nfs/dbraw/zinc/93/35/55/1075933555.db2.gz WEDLOJMSIZAPMS-UHFFFAOYSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCS(=O)(=O)N2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582329518 1075933363 /nfs/dbraw/zinc/93/33/63/1075933363.db2.gz WIGNQILXUAFURG-SECBINFHSA-N -1 3 380.390 -2.173 20 0 GAADHM O=C(NC1CN(C(=O)[C@H]2CCS(=O)(=O)N2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582329518 1075933358 /nfs/dbraw/zinc/93/33/58/1075933358.db2.gz WIGNQILXUAFURG-SECBINFHSA-N -1 3 380.390 -2.173 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCS(=O)(=O)N2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582329519 1075933475 /nfs/dbraw/zinc/93/34/75/1075933475.db2.gz WIGNQILXUAFURG-VIFPVBQESA-N -1 3 380.390 -2.173 20 0 GAADHM O=C(NC1CN(C(=O)[C@@H]2CCS(=O)(=O)N2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582329519 1075933468 /nfs/dbraw/zinc/93/34/68/1075933468.db2.gz WIGNQILXUAFURG-VIFPVBQESA-N -1 3 380.390 -2.173 20 0 GAADHM O=C(NC1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001582329816 1075933535 /nfs/dbraw/zinc/93/35/35/1075933535.db2.gz CYSPYKPSNBBVKS-SECBINFHSA-N -1 3 380.390 -2.173 20 0 GAADHM O=C(NC1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001582329816 1075933532 /nfs/dbraw/zinc/93/35/32/1075933532.db2.gz CYSPYKPSNBBVKS-SECBINFHSA-N -1 3 380.390 -2.173 20 0 GAADHM O=C(NC1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001582329817 1075933547 /nfs/dbraw/zinc/93/35/47/1075933547.db2.gz CYSPYKPSNBBVKS-VIFPVBQESA-N -1 3 380.390 -2.173 20 0 GAADHM O=C(NC1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001582329817 1075933544 /nfs/dbraw/zinc/93/35/44/1075933544.db2.gz CYSPYKPSNBBVKS-VIFPVBQESA-N -1 3 380.390 -2.173 20 0 GAADHM O=C(CCn1cnccc1=O)N1CC(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582329876 1075933585 /nfs/dbraw/zinc/93/35/85/1075933585.db2.gz GNRWVKODSHNLRH-UHFFFAOYSA-N -1 3 383.372 -1.218 20 0 GAADHM O=C(CCn1cnccc1=O)N1CC(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582329876 1075933583 /nfs/dbraw/zinc/93/35/83/1075933583.db2.gz GNRWVKODSHNLRH-UHFFFAOYSA-N -1 3 383.372 -1.218 20 0 GAADHM O=C(NC1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@H]1CCCS1(=O)=O ZINC001582329903 1075933434 /nfs/dbraw/zinc/93/34/34/1075933434.db2.gz HTAKNXHFWQWNRD-LLVKDONJSA-N -1 3 379.402 -1.287 20 0 GAADHM O=C(NC1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@H]1CCCS1(=O)=O ZINC001582329903 1075933427 /nfs/dbraw/zinc/93/34/27/1075933427.db2.gz HTAKNXHFWQWNRD-LLVKDONJSA-N -1 3 379.402 -1.287 20 0 GAADHM O=C(NC1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@@H]1CCCS1(=O)=O ZINC001582329904 1075933640 /nfs/dbraw/zinc/93/36/40/1075933640.db2.gz HTAKNXHFWQWNRD-NSHDSACASA-N -1 3 379.402 -1.287 20 0 GAADHM O=C(NC1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@@H]1CCCS1(=O)=O ZINC001582329904 1075933635 /nfs/dbraw/zinc/93/36/35/1075933635.db2.gz HTAKNXHFWQWNRD-NSHDSACASA-N -1 3 379.402 -1.287 20 0 GAADHM O=C(CNC(=O)N1CCCC1)N1CC(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582330034 1075933615 /nfs/dbraw/zinc/93/36/15/1075933615.db2.gz NEHOHOVYJWYOTN-UHFFFAOYSA-N -1 3 387.404 -1.059 20 0 GAADHM O=C(CNC(=O)N1CCCC1)N1CC(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582330034 1075933609 /nfs/dbraw/zinc/93/36/09/1075933609.db2.gz NEHOHOVYJWYOTN-UHFFFAOYSA-N -1 3 387.404 -1.059 20 0 GAADHM O=C(NC1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@@H]1CCS(=O)(=O)C1 ZINC001582330073 1075933650 /nfs/dbraw/zinc/93/36/50/1075933650.db2.gz OWSHBJJCXKGHII-MRVPVSSYSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@@H]1CCS(=O)(=O)C1 ZINC001582330073 1075933646 /nfs/dbraw/zinc/93/36/46/1075933646.db2.gz OWSHBJJCXKGHII-MRVPVSSYSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@H]1CCS(=O)(=O)C1 ZINC001582330074 1075933626 /nfs/dbraw/zinc/93/36/26/1075933626.db2.gz OWSHBJJCXKGHII-QMMMGPOBSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@H]1CCS(=O)(=O)C1 ZINC001582330074 1075933624 /nfs/dbraw/zinc/93/36/24/1075933624.db2.gz OWSHBJJCXKGHII-QMMMGPOBSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(CCn1cnccc1=O)N1CC(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582330104 1075933492 /nfs/dbraw/zinc/93/34/92/1075933492.db2.gz PVCDDKQWHKMQBS-UHFFFAOYSA-N -1 3 383.372 -1.218 20 0 GAADHM O=C(CCn1cnccc1=O)N1CC(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582330104 1075933488 /nfs/dbraw/zinc/93/34/88/1075933488.db2.gz PVCDDKQWHKMQBS-UHFFFAOYSA-N -1 3 383.372 -1.218 20 0 GAADHM O=C(CCn1cnccc1=O)N1CC(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582330355 1075933382 /nfs/dbraw/zinc/93/33/82/1075933382.db2.gz ZRJQETXGQKJSOB-UHFFFAOYSA-N -1 3 383.372 -1.218 20 0 GAADHM O=C(CCn1cnccc1=O)N1CC(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582330355 1075933377 /nfs/dbraw/zinc/93/33/77/1075933377.db2.gz ZRJQETXGQKJSOB-UHFFFAOYSA-N -1 3 383.372 -1.218 20 0 GAADHM O=C(NC1CN(C(=O)c2ccc3nnnn3c2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582331422 1075933350 /nfs/dbraw/zinc/93/33/50/1075933350.db2.gz CKCDIKDBRAQOIW-UHFFFAOYSA-N -1 3 379.344 -1.113 20 0 GAADHM O=C(NC1CN(C(=O)c2ccc3nnnn3c2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582331422 1075933345 /nfs/dbraw/zinc/93/33/45/1075933345.db2.gz CKCDIKDBRAQOIW-UHFFFAOYSA-N -1 3 379.344 -1.113 20 0 GAADHM O=C(NC1CN(C(=O)c2ccn3nnnc3c2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582332010 1075933455 /nfs/dbraw/zinc/93/34/55/1075933455.db2.gz QIUDEWWZAZBYGD-UHFFFAOYSA-N -1 3 379.344 -1.113 20 0 GAADHM O=C(NC1CN(C(=O)c2ccn3nnnc3c2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582332010 1075933452 /nfs/dbraw/zinc/93/34/52/1075933452.db2.gz QIUDEWWZAZBYGD-UHFFFAOYSA-N -1 3 379.344 -1.113 20 0 GAADHM O=C(NC1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@@H]1CCS(=O)(=O)C1 ZINC001582332015 1075934092 /nfs/dbraw/zinc/93/40/92/1075934092.db2.gz QRGYJGRNJFHWIN-MRVPVSSYSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@@H]1CCS(=O)(=O)C1 ZINC001582332015 1075934088 /nfs/dbraw/zinc/93/40/88/1075934088.db2.gz QRGYJGRNJFHWIN-MRVPVSSYSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@H]1CCS(=O)(=O)C1 ZINC001582332016 1075933882 /nfs/dbraw/zinc/93/38/82/1075933882.db2.gz QRGYJGRNJFHWIN-QMMMGPOBSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@H]1CCS(=O)(=O)C1 ZINC001582332016 1075933873 /nfs/dbraw/zinc/93/38/73/1075933873.db2.gz QRGYJGRNJFHWIN-QMMMGPOBSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@H]1CCCS1(=O)=O ZINC001582332091 1075934011 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/nfs/dbraw/zinc/93/41/17/1075934117.db2.gz XNSZYIUMFSMEPT-SECBINFHSA-N -1 3 382.388 -1.011 20 0 GAADHM O=C(NC1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@H]1CCc2nncn2C1 ZINC001582332157 1075934042 /nfs/dbraw/zinc/93/40/42/1075934042.db2.gz XNSZYIUMFSMEPT-VIFPVBQESA-N -1 3 382.388 -1.011 20 0 GAADHM O=C(NC1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@H]1CCc2nncn2C1 ZINC001582332157 1075934035 /nfs/dbraw/zinc/93/40/35/1075934035.db2.gz XNSZYIUMFSMEPT-VIFPVBQESA-N -1 3 382.388 -1.011 20 0 GAADHM O=C(NC1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)[C@@H]1CCS(=O)(=O)C1 ZINC001582332359 1075933976 /nfs/dbraw/zinc/93/39/76/1075933976.db2.gz GSOJFWAVTNXNFQ-MRVPVSSYSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)[C@@H]1CCS(=O)(=O)C1 ZINC001582332359 1075933970 /nfs/dbraw/zinc/93/39/70/1075933970.db2.gz GSOJFWAVTNXNFQ-MRVPVSSYSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)[C@H]1CCS(=O)(=O)C1 ZINC001582332360 1075933943 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GAADHM O=C(NC1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)[C@@H]1CCCS1(=O)=O ZINC001582332787 1075934173 /nfs/dbraw/zinc/93/41/73/1075934173.db2.gz ZXGKUIXWPRGVJJ-NSHDSACASA-N -1 3 379.402 -1.287 20 0 GAADHM O=C(NC1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)[C@@H]1CCCS1(=O)=O ZINC001582332787 1075934169 /nfs/dbraw/zinc/93/41/69/1075934169.db2.gz ZXGKUIXWPRGVJJ-NSHDSACASA-N -1 3 379.402 -1.287 20 0 GAADHM O=C(NC1CN(CCN2CCCS2(=O)=O)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582333035 1075933994 /nfs/dbraw/zinc/93/39/94/1075933994.db2.gz LMSLPVPUIJMRDE-UHFFFAOYSA-N -1 3 380.434 -1.356 20 0 GAADHM O=C(NC1CN(CCN2CCCS2(=O)=O)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582333035 1075933988 /nfs/dbraw/zinc/93/39/88/1075933988.db2.gz LMSLPVPUIJMRDE-UHFFFAOYSA-N -1 3 380.434 -1.356 20 0 GAADHM O=C(NC1CN(CCN2CCCS2(=O)=O)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582333158 1075933915 /nfs/dbraw/zinc/93/39/15/1075933915.db2.gz QJGJMINHEHJHED-UHFFFAOYSA-N -1 3 380.434 -1.356 20 0 GAADHM O=C(NC1CN(CCN2CCCS2(=O)=O)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582333158 1075933910 /nfs/dbraw/zinc/93/39/10/1075933910.db2.gz QJGJMINHEHJHED-UHFFFAOYSA-N -1 3 380.434 -1.356 20 0 GAADHM O=C(NC1CN(C[C@@H](O)CN2C(=O)CCC2=O)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582333243 1075933929 /nfs/dbraw/zinc/93/39/29/1075933929.db2.gz TZQIMMNMQVCQGT-LLVKDONJSA-N -1 3 388.388 -1.881 20 0 GAADHM O=C(NC1CN(C[C@@H](O)CN2C(=O)CCC2=O)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582333243 1075933927 /nfs/dbraw/zinc/93/39/27/1075933927.db2.gz TZQIMMNMQVCQGT-LLVKDONJSA-N -1 3 388.388 -1.881 20 0 GAADHM O=C(NC1CN(C[C@H](O)CN2C(=O)CCC2=O)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582333244 1075933859 /nfs/dbraw/zinc/93/38/59/1075933859.db2.gz TZQIMMNMQVCQGT-NSHDSACASA-N -1 3 388.388 -1.881 20 0 GAADHM O=C(NC1CN(C[C@H](O)CN2C(=O)CCC2=O)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582333244 1075933854 /nfs/dbraw/zinc/93/38/54/1075933854.db2.gz TZQIMMNMQVCQGT-NSHDSACASA-N -1 3 388.388 -1.881 20 0 GAADHM O=C(NC1CN(CCN2CCCS2(=O)=O)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582333273 1075934633 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BRMAYHVEIKLMJG-ZDUSSCGKSA-N -1 3 377.430 -1.141 20 0 GAADHM O=C(N[C@H]1COC2(CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)C1)c1cnon1 ZINC001582337009 1075934515 /nfs/dbraw/zinc/93/45/15/1075934515.db2.gz VCRNAXQTKOKZSP-SECBINFHSA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@H]1COC2(CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)C1)c1cnon1 ZINC001582337009 1075934513 /nfs/dbraw/zinc/93/45/13/1075934513.db2.gz VCRNAXQTKOKZSP-SECBINFHSA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@@H]1COC2(CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)C1)c1cnon1 ZINC001582337010 1075934593 /nfs/dbraw/zinc/93/45/93/1075934593.db2.gz VCRNAXQTKOKZSP-VIFPVBQESA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@@H]1COC2(CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)C1)c1cnon1 ZINC001582337010 1075934589 /nfs/dbraw/zinc/93/45/89/1075934589.db2.gz VCRNAXQTKOKZSP-VIFPVBQESA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(CNC(=O)c1ccc(-c2nn[n-]n2)cc1)N1CC2(C1)C[C@@H](O)CNC2=O ZINC001582337262 1075934346 /nfs/dbraw/zinc/93/43/46/1075934346.db2.gz FKOFGLXFPZOTPU-GFCCVEGCSA-N -1 3 385.384 -1.694 20 0 GAADHM O=C(CNC(=O)c1ccc(-c2nnn[n-]2)cc1)N1CC2(C1)C[C@@H](O)CNC2=O ZINC001582337262 1075934342 /nfs/dbraw/zinc/93/43/42/1075934342.db2.gz FKOFGLXFPZOTPU-GFCCVEGCSA-N -1 3 385.384 -1.694 20 0 GAADHM O=C(CNC(=O)c1ccc(-c2nn[n-]n2)cc1)N1CC2(C1)C[C@H](O)CNC2=O ZINC001582337263 1075934447 /nfs/dbraw/zinc/93/44/47/1075934447.db2.gz FKOFGLXFPZOTPU-LBPRGKRZSA-N -1 3 385.384 -1.694 20 0 GAADHM O=C(CNC(=O)c1ccc(-c2nnn[n-]2)cc1)N1CC2(C1)C[C@H](O)CNC2=O ZINC001582337263 1075934443 /nfs/dbraw/zinc/93/44/43/1075934443.db2.gz FKOFGLXFPZOTPU-LBPRGKRZSA-N -1 3 385.384 -1.694 20 0 GAADHM O=C(CNC(=O)c1ccc(-c2nn[n-]n2)cc1)N1CCS(=O)(=O)CCO1 ZINC001582338839 1075934975 /nfs/dbraw/zinc/93/49/75/1075934975.db2.gz OMAZUIPWBYMETG-UHFFFAOYSA-N -1 3 380.386 -1.215 20 0 GAADHM O=C(CNC(=O)c1ccc(-c2nnn[n-]2)cc1)N1CCS(=O)(=O)CCO1 ZINC001582338839 1075934971 /nfs/dbraw/zinc/93/49/71/1075934971.db2.gz OMAZUIPWBYMETG-UHFFFAOYSA-N -1 3 380.386 -1.215 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1cn2c(n1)CCC2 ZINC001582339890 1075935117 /nfs/dbraw/zinc/93/51/17/1075935117.db2.gz AHZYOSLLORHMIP-SECBINFHSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1cn2c(n1)CCC2 ZINC001582339890 1075935113 /nfs/dbraw/zinc/93/51/13/1075935113.db2.gz AHZYOSLLORHMIP-SECBINFHSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1cn2c(n1)CCC2 ZINC001582339891 1075935122 /nfs/dbraw/zinc/93/51/22/1075935122.db2.gz AHZYOSLLORHMIP-VIFPVBQESA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1cn2c(n1)CCC2 ZINC001582339891 1075935119 /nfs/dbraw/zinc/93/51/19/1075935119.db2.gz AHZYOSLLORHMIP-VIFPVBQESA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582339896 1075935097 /nfs/dbraw/zinc/93/50/97/1075935097.db2.gz AKLFPIWHBFPHNG-PRFIWBCESA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582339896 1075935094 /nfs/dbraw/zinc/93/50/94/1075935094.db2.gz AKLFPIWHBFPHNG-PRFIWBCESA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582339897 1075934905 /nfs/dbraw/zinc/93/49/05/1075934905.db2.gz AKLFPIWHBFPHNG-WTBMIXGQSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582339897 1075934900 /nfs/dbraw/zinc/93/49/00/1075934900.db2.gz AKLFPIWHBFPHNG-WTBMIXGQSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cn2c(n1)CCC2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582339920 1075935020 /nfs/dbraw/zinc/93/50/20/1075935020.db2.gz AVCUCOLLCRUGCQ-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cn2c(n1)CCC2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582339920 1075935016 /nfs/dbraw/zinc/93/50/16/1075935016.db2.gz AVCUCOLLCRUGCQ-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cn2c(n1)CCC2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582339921 1075935127 /nfs/dbraw/zinc/93/51/27/1075935127.db2.gz AVCUCOLLCRUGCQ-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cn2c(n1)CCC2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582339921 1075935125 /nfs/dbraw/zinc/93/51/25/1075935125.db2.gz AVCUCOLLCRUGCQ-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582339936 1075934943 /nfs/dbraw/zinc/93/49/43/1075934943.db2.gz BBFGOCMFCOSRDV-UZWSLXQKSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582339936 1075934940 /nfs/dbraw/zinc/93/49/40/1075934940.db2.gz BBFGOCMFCOSRDV-UZWSLXQKSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582339937 1075935135 /nfs/dbraw/zinc/93/51/35/1075935135.db2.gz BBFGOCMFCOSRDV-WGBDABJCSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582339937 1075935133 /nfs/dbraw/zinc/93/51/33/1075935133.db2.gz BBFGOCMFCOSRDV-WGBDABJCSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cnc2n1CCC2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582339946 1075935106 /nfs/dbraw/zinc/93/51/06/1075935106.db2.gz BEXUIMMOYPFRBM-SECBINFHSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cnc2n1CCC2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582339946 1075935104 /nfs/dbraw/zinc/93/51/04/1075935104.db2.gz BEXUIMMOYPFRBM-SECBINFHSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cnc2n1CCC2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582339947 1075935008 /nfs/dbraw/zinc/93/50/08/1075935008.db2.gz BEXUIMMOYPFRBM-VIFPVBQESA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cnc2n1CCC2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582339947 1075935004 /nfs/dbraw/zinc/93/50/04/1075935004.db2.gz BEXUIMMOYPFRBM-VIFPVBQESA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582340080 1075935403 /nfs/dbraw/zinc/93/54/03/1075935403.db2.gz DVKYGORJZSTBAC-FKLBQPBDSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582340080 1075935395 /nfs/dbraw/zinc/93/53/95/1075935395.db2.gz DVKYGORJZSTBAC-FKLBQPBDSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582340081 1075935290 /nfs/dbraw/zinc/93/52/90/1075935290.db2.gz DVKYGORJZSTBAC-YSZLUBPXSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582340081 1075935286 /nfs/dbraw/zinc/93/52/86/1075935286.db2.gz DVKYGORJZSTBAC-YSZLUBPXSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cnn2c1CCC2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582340114 1075935441 /nfs/dbraw/zinc/93/54/41/1075935441.db2.gz FTPAKZMPEUZOTO-SECBINFHSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cnn2c1CCC2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582340114 1075935434 /nfs/dbraw/zinc/93/54/34/1075935434.db2.gz FTPAKZMPEUZOTO-SECBINFHSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cnn2c1CCC2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582340115 1075935533 /nfs/dbraw/zinc/93/55/33/1075935533.db2.gz FTPAKZMPEUZOTO-VIFPVBQESA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cnn2c1CCC2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582340115 1075935526 /nfs/dbraw/zinc/93/55/26/1075935526.db2.gz FTPAKZMPEUZOTO-VIFPVBQESA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cnn2c1CCC2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582340210 1075935506 /nfs/dbraw/zinc/93/55/06/1075935506.db2.gz HUERFJXOVLAGOV-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cnn2c1CCC2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582340210 1075935499 /nfs/dbraw/zinc/93/54/99/1075935499.db2.gz HUERFJXOVLAGOV-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cnn2c1CCC2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582340211 1075935420 /nfs/dbraw/zinc/93/54/20/1075935420.db2.gz HUERFJXOVLAGOV-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cnn2c1CCC2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582340211 1075935416 /nfs/dbraw/zinc/93/54/16/1075935416.db2.gz HUERFJXOVLAGOV-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1cnn(CCF)c1 ZINC001582340394 1075935466 /nfs/dbraw/zinc/93/54/66/1075935466.db2.gz JEWSKZNAVFZOTP-LLVKDONJSA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1cnn(CCF)c1 ZINC001582340394 1075935460 /nfs/dbraw/zinc/93/54/60/1075935460.db2.gz JEWSKZNAVFZOTP-LLVKDONJSA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1cnn(CCF)c1 ZINC001582340395 1075935320 /nfs/dbraw/zinc/93/53/20/1075935320.db2.gz JEWSKZNAVFZOTP-NSHDSACASA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1cnn(CCF)c1 ZINC001582340395 1075935314 /nfs/dbraw/zinc/93/53/14/1075935314.db2.gz JEWSKZNAVFZOTP-NSHDSACASA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582340446 1075935358 /nfs/dbraw/zinc/93/53/58/1075935358.db2.gz KEGRPVVGJUWJBT-UZWSLXQKSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582340446 1075935352 /nfs/dbraw/zinc/93/53/52/1075935352.db2.gz KEGRPVVGJUWJBT-UZWSLXQKSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582340448 1075935485 /nfs/dbraw/zinc/93/54/85/1075935485.db2.gz KEGRPVVGJUWJBT-WGBDABJCSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582340448 1075935478 /nfs/dbraw/zinc/93/54/78/1075935478.db2.gz KEGRPVVGJUWJBT-WGBDABJCSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cn2c(n1)CCC2 ZINC001582340667 1075935344 /nfs/dbraw/zinc/93/53/44/1075935344.db2.gz MSOIYCFJJFHSLG-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cn2c(n1)CCC2 ZINC001582340667 1075935338 /nfs/dbraw/zinc/93/53/38/1075935338.db2.gz MSOIYCFJJFHSLG-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cn2c(n1)CCC2 ZINC001582340668 1075935380 /nfs/dbraw/zinc/93/53/80/1075935380.db2.gz MSOIYCFJJFHSLG-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cn2c(n1)CCC2 ZINC001582340668 1075935370 /nfs/dbraw/zinc/93/53/70/1075935370.db2.gz MSOIYCFJJFHSLG-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582340814 1075935735 /nfs/dbraw/zinc/93/57/35/1075935735.db2.gz NWVSOEPORKJCPF-OMVNPZBFSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582340814 1075935727 /nfs/dbraw/zinc/93/57/27/1075935727.db2.gz NWVSOEPORKJCPF-OMVNPZBFSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582340815 1075935816 /nfs/dbraw/zinc/93/58/16/1075935816.db2.gz NWVSOEPORKJCPF-PUOUXSMHSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582340815 1075935810 /nfs/dbraw/zinc/93/58/10/1075935810.db2.gz NWVSOEPORKJCPF-PUOUXSMHSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)C1(F)CCOCC1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582340834 1075935892 /nfs/dbraw/zinc/93/58/92/1075935892.db2.gz OHFSXKMULYUIKZ-SECBINFHSA-N -1 3 381.368 -1.080 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)C1(F)CCOCC1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582340834 1075935888 /nfs/dbraw/zinc/93/58/88/1075935888.db2.gz OHFSXKMULYUIKZ-SECBINFHSA-N -1 3 381.368 -1.080 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)C1(F)CCOCC1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582340835 1075935780 /nfs/dbraw/zinc/93/57/80/1075935780.db2.gz OHFSXKMULYUIKZ-VIFPVBQESA-N -1 3 381.368 -1.080 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)C1(F)CCOCC1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582340835 1075935776 /nfs/dbraw/zinc/93/57/76/1075935776.db2.gz OHFSXKMULYUIKZ-VIFPVBQESA-N -1 3 381.368 -1.080 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)C1(F)CCOCC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582341386 1075936252 /nfs/dbraw/zinc/93/62/52/1075936252.db2.gz TUNWIWUDXLGQHG-JTQLQIEISA-N -1 3 381.368 -1.080 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)C1(F)CCOCC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582341386 1075936251 /nfs/dbraw/zinc/93/62/51/1075936251.db2.gz TUNWIWUDXLGQHG-JTQLQIEISA-N -1 3 381.368 -1.080 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)C1(F)CCOCC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582341387 1075936293 /nfs/dbraw/zinc/93/62/93/1075936293.db2.gz TUNWIWUDXLGQHG-SNVBAGLBSA-N -1 3 381.368 -1.080 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)C1(F)CCOCC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582341387 1075936286 /nfs/dbraw/zinc/93/62/86/1075936286.db2.gz TUNWIWUDXLGQHG-SNVBAGLBSA-N -1 3 381.368 -1.080 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cnn(CCF)c1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582341528 1075936169 /nfs/dbraw/zinc/93/61/69/1075936169.db2.gz VGAZZYULVJVAIS-LLVKDONJSA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cnn(CCF)c1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582341528 1075936165 /nfs/dbraw/zinc/93/61/65/1075936165.db2.gz VGAZZYULVJVAIS-LLVKDONJSA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cnn(CCF)c1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582341530 1075936200 /nfs/dbraw/zinc/93/62/00/1075936200.db2.gz VGAZZYULVJVAIS-NSHDSACASA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cnn(CCF)c1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582341530 1075936194 /nfs/dbraw/zinc/93/61/94/1075936194.db2.gz VGAZZYULVJVAIS-NSHDSACASA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cnn2c1CCC2)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582341667 1075936742 /nfs/dbraw/zinc/93/67/42/1075936742.db2.gz WQCTXIPFGJAGPT-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cnn2c1CCC2)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582341667 1075936740 /nfs/dbraw/zinc/93/67/40/1075936740.db2.gz WQCTXIPFGJAGPT-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cnn2c1CCC2)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582341668 1075936616 /nfs/dbraw/zinc/93/66/16/1075936616.db2.gz WQCTXIPFGJAGPT-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cnn2c1CCC2)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582341668 1075936610 /nfs/dbraw/zinc/93/66/10/1075936610.db2.gz WQCTXIPFGJAGPT-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582341758 1075936733 /nfs/dbraw/zinc/93/67/33/1075936733.db2.gz YCWVSUSRIQEIAQ-OMVNPZBFSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582341758 1075936730 /nfs/dbraw/zinc/93/67/30/1075936730.db2.gz YCWVSUSRIQEIAQ-OMVNPZBFSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582341759 1075936579 /nfs/dbraw/zinc/93/65/79/1075936579.db2.gz YCWVSUSRIQEIAQ-PUOUXSMHSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582341759 1075936577 /nfs/dbraw/zinc/93/65/77/1075936577.db2.gz YCWVSUSRIQEIAQ-PUOUXSMHSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)C1CCC(O)CC1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582341834 1075936679 /nfs/dbraw/zinc/93/66/79/1075936679.db2.gz YQVOROOWQIDFDY-HSOILSAZSA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)C1CCC(O)CC1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582341834 1075936675 /nfs/dbraw/zinc/93/66/75/1075936675.db2.gz YQVOROOWQIDFDY-HSOILSAZSA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)C1CCC(O)CC1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582341835 1075936600 /nfs/dbraw/zinc/93/66/00/1075936600.db2.gz YQVOROOWQIDFDY-YVNMAJEFSA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)C1CCC(O)CC1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582341835 1075936598 /nfs/dbraw/zinc/93/65/98/1075936598.db2.gz YQVOROOWQIDFDY-YVNMAJEFSA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cnc2n1CCC2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582341871 1075937038 /nfs/dbraw/zinc/93/70/38/1075937038.db2.gz ZELWUPNBMKVLED-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cnc2n1CCC2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582341871 1075937033 /nfs/dbraw/zinc/93/70/33/1075937033.db2.gz ZELWUPNBMKVLED-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cnc2n1CCC2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582341872 1075937016 /nfs/dbraw/zinc/93/70/16/1075937016.db2.gz ZELWUPNBMKVLED-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cnc2n1CCC2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582341872 1075937010 /nfs/dbraw/zinc/93/70/10/1075937010.db2.gz ZELWUPNBMKVLED-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cnc2n1CCC2)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582341923 1075937131 /nfs/dbraw/zinc/93/71/31/1075937131.db2.gz ZPYNTJXOQQBIKR-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](CO)NC(=O)c1cnc2n1CCC2)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582341923 1075937128 /nfs/dbraw/zinc/93/71/28/1075937128.db2.gz ZPYNTJXOQQBIKR-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cnc2n1CCC2)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582341924 1075937105 /nfs/dbraw/zinc/93/71/05/1075937105.db2.gz ZPYNTJXOQQBIKR-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](CO)NC(=O)c1cnc2n1CCC2)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582341924 1075937100 /nfs/dbraw/zinc/93/71/00/1075937100.db2.gz ZPYNTJXOQQBIKR-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(N[C@H]1COC2(CN(C(=O)c3cn[nH]n3)C2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582343638 1075936963 /nfs/dbraw/zinc/93/69/63/1075936963.db2.gz AMZBAVHERJBHRD-MRVPVSSYSA-N -1 3 384.360 -1.274 20 0 GAADHM O=C(N[C@@H]1COC2(CN(C(=O)c3cn[nH]n3)C2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582343639 1075937024 /nfs/dbraw/zinc/93/70/24/1075937024.db2.gz AMZBAVHERJBHRD-QMMMGPOBSA-N -1 3 384.360 -1.274 20 0 GAADHM O=C(N[C@H]1COC2(CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)C1)c1cnon1 ZINC001582343652 1075937372 /nfs/dbraw/zinc/93/73/72/1075937372.db2.gz AWJOXKQKTZBKKB-SECBINFHSA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@H]1COC2(CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)C1)c1cnon1 ZINC001582343652 1075937366 /nfs/dbraw/zinc/93/73/66/1075937366.db2.gz AWJOXKQKTZBKKB-SECBINFHSA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@@H]1COC2(CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)C1)c1cnon1 ZINC001582343653 1075937356 /nfs/dbraw/zinc/93/73/56/1075937356.db2.gz AWJOXKQKTZBKKB-VIFPVBQESA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@@H]1COC2(CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)C1)c1cnon1 ZINC001582343653 1075937349 /nfs/dbraw/zinc/93/73/49/1075937349.db2.gz AWJOXKQKTZBKKB-VIFPVBQESA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@H]1COC2(CN(C(=O)c3cn[nH]n3)C2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582343871 1075937545 /nfs/dbraw/zinc/93/75/45/1075937545.db2.gz HBYJBHGWBHYGSU-SECBINFHSA-N -1 3 384.360 -1.274 20 0 GAADHM O=C(N[C@@H]1COC2(CN(C(=O)c3cn[nH]n3)C2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582343872 1075937572 /nfs/dbraw/zinc/93/75/72/1075937572.db2.gz HBYJBHGWBHYGSU-VIFPVBQESA-N -1 3 384.360 -1.274 20 0 GAADHM O=C(N[C@H]1COC2(CN(C(=O)c3cnon3)C2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582344028 1075937459 /nfs/dbraw/zinc/93/74/59/1075937459.db2.gz IMZMVMRABYWXBL-MRVPVSSYSA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@H]1COC2(CN(C(=O)c3cnon3)C2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582344028 1075937456 /nfs/dbraw/zinc/93/74/56/1075937456.db2.gz IMZMVMRABYWXBL-MRVPVSSYSA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@@H]1COC2(CN(C(=O)c3cnon3)C2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582344029 1075937409 /nfs/dbraw/zinc/93/74/09/1075937409.db2.gz IMZMVMRABYWXBL-QMMMGPOBSA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@@H]1COC2(CN(C(=O)c3cnon3)C2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582344029 1075937405 /nfs/dbraw/zinc/93/74/05/1075937405.db2.gz IMZMVMRABYWXBL-QMMMGPOBSA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(NC[C@@H](CO)NCc1ncnn1CCF)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582344170 1075937476 /nfs/dbraw/zinc/93/74/76/1075937476.db2.gz DRVIQBPLTROGEE-JTQLQIEISA-N -1 3 378.372 -1.364 20 0 GAADHM O=C(NC[C@@H](CO)NCc1ncnn1CCF)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582344170 1075937471 /nfs/dbraw/zinc/93/74/71/1075937471.db2.gz DRVIQBPLTROGEE-JTQLQIEISA-N -1 3 378.372 -1.364 20 0 GAADHM O=C(NC[C@H](CO)NCc1ncnn1CCF)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582344171 1075937520 /nfs/dbraw/zinc/93/75/20/1075937520.db2.gz DRVIQBPLTROGEE-SNVBAGLBSA-N -1 3 378.372 -1.364 20 0 GAADHM O=C(NC[C@H](CO)NCc1ncnn1CCF)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582344171 1075937515 /nfs/dbraw/zinc/93/75/15/1075937515.db2.gz DRVIQBPLTROGEE-SNVBAGLBSA-N -1 3 378.372 -1.364 20 0 GAADHM O=C(NC[C@@H](CO)NCc1ncnn1CCF)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582344274 1075937427 /nfs/dbraw/zinc/93/74/27/1075937427.db2.gz HJEWQCVLNYSASR-JTQLQIEISA-N -1 3 378.372 -1.364 20 0 GAADHM O=C(NC[C@@H](CO)NCc1ncnn1CCF)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582344274 1075937423 /nfs/dbraw/zinc/93/74/23/1075937423.db2.gz HJEWQCVLNYSASR-JTQLQIEISA-N -1 3 378.372 -1.364 20 0 GAADHM O=C(NC[C@H](CO)NCc1ncnn1CCF)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582344275 1075937448 /nfs/dbraw/zinc/93/74/48/1075937448.db2.gz HJEWQCVLNYSASR-SNVBAGLBSA-N -1 3 378.372 -1.364 20 0 GAADHM O=C(NC[C@H](CO)NCc1ncnn1CCF)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582344275 1075937442 /nfs/dbraw/zinc/93/74/42/1075937442.db2.gz HJEWQCVLNYSASR-SNVBAGLBSA-N -1 3 378.372 -1.364 20 0 GAADHM O=C(N[C@H]1COC2(CN(C(=O)c3nc[nH]n3)C2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582344521 1075937578 /nfs/dbraw/zinc/93/75/78/1075937578.db2.gz KOWYHLVCJSFODJ-SECBINFHSA-N -1 3 384.360 -1.274 20 0 GAADHM O=C(N[C@@H]1COC2(CN(C(=O)c3nc[nH]n3)C2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582344523 1075937601 /nfs/dbraw/zinc/93/76/01/1075937601.db2.gz KOWYHLVCJSFODJ-VIFPVBQESA-N -1 3 384.360 -1.274 20 0 GAADHM O=C(NC[C@H](CO)NCc1ncnn1CCF)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582344524 1075937534 /nfs/dbraw/zinc/93/75/34/1075937534.db2.gz MJIQBBFNSLJEQC-SECBINFHSA-N -1 3 378.372 -1.364 20 0 GAADHM O=C(NC[C@H](CO)NCc1ncnn1CCF)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582344524 1075937531 /nfs/dbraw/zinc/93/75/31/1075937531.db2.gz MJIQBBFNSLJEQC-SECBINFHSA-N -1 3 378.372 -1.364 20 0 GAADHM O=C(NC[C@@H](CO)NCc1ncnn1CCF)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582344525 1075937559 /nfs/dbraw/zinc/93/75/59/1075937559.db2.gz MJIQBBFNSLJEQC-VIFPVBQESA-N -1 3 378.372 -1.364 20 0 GAADHM O=C(NC[C@@H](CO)NCc1ncnn1CCF)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582344525 1075937556 /nfs/dbraw/zinc/93/75/56/1075937556.db2.gz MJIQBBFNSLJEQC-VIFPVBQESA-N -1 3 378.372 -1.364 20 0 GAADHM O=C(NC[C@H](CO)Nc1ccc(-c2nn[n-]n2)cn1)[C@H]1CCCS1(=O)=O ZINC001582344527 1075937903 /nfs/dbraw/zinc/93/79/03/1075937903.db2.gz MKFFDLFNHVOZIB-GHMZBOCLSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@H](CO)Nc1ccc(-c2nnn[n-]2)cn1)[C@H]1CCCS1(=O)=O ZINC001582344527 1075937900 /nfs/dbraw/zinc/93/79/00/1075937900.db2.gz MKFFDLFNHVOZIB-GHMZBOCLSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@H](CO)Nc1ccc(-c2nn[n-]n2)cn1)[C@@H]1CCCS1(=O)=O ZINC001582344529 1075937983 /nfs/dbraw/zinc/93/79/83/1075937983.db2.gz MKFFDLFNHVOZIB-MNOVXSKESA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@H](CO)Nc1ccc(-c2nnn[n-]2)cn1)[C@@H]1CCCS1(=O)=O ZINC001582344529 1075937980 /nfs/dbraw/zinc/93/79/80/1075937980.db2.gz MKFFDLFNHVOZIB-MNOVXSKESA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ccc(-c2nn[n-]n2)cn1)[C@@H]1CCCS1(=O)=O ZINC001582344531 1075937953 /nfs/dbraw/zinc/93/79/53/1075937953.db2.gz MKFFDLFNHVOZIB-QWRGUYRKSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)cn1)[C@@H]1CCCS1(=O)=O ZINC001582344531 1075937950 /nfs/dbraw/zinc/93/79/50/1075937950.db2.gz MKFFDLFNHVOZIB-QWRGUYRKSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ccc(-c2nn[n-]n2)cn1)[C@H]1CCCS1(=O)=O ZINC001582344532 1075937915 /nfs/dbraw/zinc/93/79/15/1075937915.db2.gz MKFFDLFNHVOZIB-WDEREUQCSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)cn1)[C@H]1CCCS1(=O)=O ZINC001582344532 1075937913 /nfs/dbraw/zinc/93/79/13/1075937913.db2.gz MKFFDLFNHVOZIB-WDEREUQCSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(N[C@H]1COC2(CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)C1)c1cnon1 ZINC001582344694 1075937829 /nfs/dbraw/zinc/93/78/29/1075937829.db2.gz MNVUSAJTDPBFHV-MRVPVSSYSA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@H]1COC2(CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)C1)c1cnon1 ZINC001582344694 1075937822 /nfs/dbraw/zinc/93/78/22/1075937822.db2.gz MNVUSAJTDPBFHV-MRVPVSSYSA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@@H]1COC2(CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)C1)c1cnon1 ZINC001582344695 1075937890 /nfs/dbraw/zinc/93/78/90/1075937890.db2.gz MNVUSAJTDPBFHV-QMMMGPOBSA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@@H]1COC2(CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)C1)c1cnon1 ZINC001582344695 1075937889 /nfs/dbraw/zinc/93/78/89/1075937889.db2.gz MNVUSAJTDPBFHV-QMMMGPOBSA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(NC[C@H](CO)Nc1ccc(-c2nn[n-]n2)cn1)[C@@H]1CCS(=O)(=O)C1 ZINC001582344728 1075937788 /nfs/dbraw/zinc/93/77/88/1075937788.db2.gz OPRWYLJGKXBLSV-GHMZBOCLSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@H](CO)Nc1ccc(-c2nnn[n-]2)cn1)[C@@H]1CCS(=O)(=O)C1 ZINC001582344728 1075937779 /nfs/dbraw/zinc/93/77/79/1075937779.db2.gz OPRWYLJGKXBLSV-GHMZBOCLSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ccc(-c2nn[n-]n2)cn1)[C@@H]1CCS(=O)(=O)C1 ZINC001582344729 1075937849 /nfs/dbraw/zinc/93/78/49/1075937849.db2.gz OPRWYLJGKXBLSV-MNOVXSKESA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)cn1)[C@@H]1CCS(=O)(=O)C1 ZINC001582344729 1075937842 /nfs/dbraw/zinc/93/78/42/1075937842.db2.gz OPRWYLJGKXBLSV-MNOVXSKESA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ccc(-c2nn[n-]n2)cn1)[C@H]1CCS(=O)(=O)C1 ZINC001582344730 1075937866 /nfs/dbraw/zinc/93/78/66/1075937866.db2.gz OPRWYLJGKXBLSV-QWRGUYRKSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)cn1)[C@H]1CCS(=O)(=O)C1 ZINC001582344730 1075937861 /nfs/dbraw/zinc/93/78/61/1075937861.db2.gz OPRWYLJGKXBLSV-QWRGUYRKSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@H](CO)Nc1ccc(-c2nn[n-]n2)cn1)[C@H]1CCS(=O)(=O)C1 ZINC001582344731 1075937997 /nfs/dbraw/zinc/93/79/97/1075937997.db2.gz OPRWYLJGKXBLSV-WDEREUQCSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@H](CO)Nc1ccc(-c2nnn[n-]2)cn1)[C@H]1CCS(=O)(=O)C1 ZINC001582344731 1075937994 /nfs/dbraw/zinc/93/79/94/1075937994.db2.gz OPRWYLJGKXBLSV-WDEREUQCSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(N[C@H]1COC2(CN(C(=O)c3cnon3)C2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582345199 1075938175 /nfs/dbraw/zinc/93/81/75/1075938175.db2.gz OGCFFWOQPIBLPD-SECBINFHSA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@H]1COC2(CN(C(=O)c3cnon3)C2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582345199 1075938171 /nfs/dbraw/zinc/93/81/71/1075938171.db2.gz OGCFFWOQPIBLPD-SECBINFHSA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@@H]1COC2(CN(C(=O)c3cnon3)C2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582345201 1075938184 /nfs/dbraw/zinc/93/81/84/1075938184.db2.gz OGCFFWOQPIBLPD-VIFPVBQESA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@@H]1COC2(CN(C(=O)c3cnon3)C2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582345201 1075938180 /nfs/dbraw/zinc/93/81/80/1075938180.db2.gz OGCFFWOQPIBLPD-VIFPVBQESA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@H]1COC2(CN(C(=O)c3nc[nH]n3)C2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582345943 1075938226 /nfs/dbraw/zinc/93/82/26/1075938226.db2.gz PNYUTFKFVBSZQF-MRVPVSSYSA-N -1 3 384.360 -1.274 20 0 GAADHM O=C(N[C@@H]1COC2(CN(C(=O)c3nc[nH]n3)C2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582345946 1075938243 /nfs/dbraw/zinc/93/82/43/1075938243.db2.gz PNYUTFKFVBSZQF-QMMMGPOBSA-N -1 3 384.360 -1.274 20 0 GAADHM O=C(N[C@H]1COC2(CN(C(=O)c3cnon3)C2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582346507 1075938239 /nfs/dbraw/zinc/93/82/39/1075938239.db2.gz STKFNNOCJLYPSW-SECBINFHSA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@H]1COC2(CN(C(=O)c3cnon3)C2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582346507 1075938235 /nfs/dbraw/zinc/93/82/35/1075938235.db2.gz STKFNNOCJLYPSW-SECBINFHSA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@@H]1COC2(CN(C(=O)c3cnon3)C2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582346508 1075938266 /nfs/dbraw/zinc/93/82/66/1075938266.db2.gz STKFNNOCJLYPSW-VIFPVBQESA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(N[C@@H]1COC2(CN(C(=O)c3cnon3)C2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582346508 1075938261 /nfs/dbraw/zinc/93/82/61/1075938261.db2.gz STKFNNOCJLYPSW-VIFPVBQESA-N -1 3 385.344 -1.009 20 0 GAADHM O=C(NC[C@H](CO)Nc1ccc(-c2nn[n-]n2)nc1)[C@H]1CCS(=O)(=O)C1 ZINC001582348496 1075938714 /nfs/dbraw/zinc/93/87/14/1075938714.db2.gz HJNAHCKRCPTCIT-GXSJLCMTSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@H](CO)Nc1ccc(-c2nnn[n-]2)nc1)[C@H]1CCS(=O)(=O)C1 ZINC001582348496 1075938708 /nfs/dbraw/zinc/93/87/08/1075938708.db2.gz HJNAHCKRCPTCIT-GXSJLCMTSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ccc(-c2nn[n-]n2)nc1)[C@@H]1CCS(=O)(=O)C1 ZINC001582348497 1075938770 /nfs/dbraw/zinc/93/87/70/1075938770.db2.gz HJNAHCKRCPTCIT-KOLCDFICSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)nc1)[C@@H]1CCS(=O)(=O)C1 ZINC001582348497 1075938767 /nfs/dbraw/zinc/93/87/67/1075938767.db2.gz HJNAHCKRCPTCIT-KOLCDFICSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@H](CO)Nc1ccc(-c2nn[n-]n2)nc1)[C@@H]1CCS(=O)(=O)C1 ZINC001582348498 1075938697 /nfs/dbraw/zinc/93/86/97/1075938697.db2.gz HJNAHCKRCPTCIT-MWLCHTKSSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@H](CO)Nc1ccc(-c2nnn[n-]2)nc1)[C@@H]1CCS(=O)(=O)C1 ZINC001582348498 1075938691 /nfs/dbraw/zinc/93/86/91/1075938691.db2.gz HJNAHCKRCPTCIT-MWLCHTKSSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ccc(-c2nn[n-]n2)nc1)[C@H]1CCS(=O)(=O)C1 ZINC001582348499 1075938583 /nfs/dbraw/zinc/93/85/83/1075938583.db2.gz HJNAHCKRCPTCIT-ONGXEEELSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)nc1)[C@H]1CCS(=O)(=O)C1 ZINC001582348499 1075938578 /nfs/dbraw/zinc/93/85/78/1075938578.db2.gz HJNAHCKRCPTCIT-ONGXEEELSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ccc(-c2nn[n-]n2)nc1)[C@H]1CCCS1(=O)=O ZINC001582350013 1075939519 /nfs/dbraw/zinc/93/95/19/1075939519.db2.gz YBPBSNVQJHBUNH-CMPLNLGQSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)nc1)[C@H]1CCCS1(=O)=O ZINC001582350013 1075939513 /nfs/dbraw/zinc/93/95/13/1075939513.db2.gz YBPBSNVQJHBUNH-CMPLNLGQSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ccc(-c2nn[n-]n2)nc1)[C@@H]1CCCS1(=O)=O ZINC001582350015 1075939662 /nfs/dbraw/zinc/93/96/62/1075939662.db2.gz YBPBSNVQJHBUNH-JQWIXIFHSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)nc1)[C@@H]1CCCS1(=O)=O ZINC001582350015 1075939659 /nfs/dbraw/zinc/93/96/59/1075939659.db2.gz YBPBSNVQJHBUNH-JQWIXIFHSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@H](CO)Nc1ccc(-c2nn[n-]n2)nc1)[C@@H]1CCCS1(=O)=O ZINC001582350017 1075939556 /nfs/dbraw/zinc/93/95/56/1075939556.db2.gz YBPBSNVQJHBUNH-PWSUYJOCSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@H](CO)Nc1ccc(-c2nnn[n-]2)nc1)[C@@H]1CCCS1(=O)=O ZINC001582350017 1075939554 /nfs/dbraw/zinc/93/95/54/1075939554.db2.gz YBPBSNVQJHBUNH-PWSUYJOCSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@H](CO)Nc1ccc(-c2nn[n-]n2)nc1)[C@H]1CCCS1(=O)=O ZINC001582350018 1075939669 /nfs/dbraw/zinc/93/96/69/1075939669.db2.gz YBPBSNVQJHBUNH-ZYHUDNBSSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@H](CO)Nc1ccc(-c2nnn[n-]2)nc1)[C@H]1CCCS1(=O)=O ZINC001582350018 1075939667 /nfs/dbraw/zinc/93/96/67/1075939667.db2.gz YBPBSNVQJHBUNH-ZYHUDNBSSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@H](CO)Nc1cccc(F)c1-c1nn[n-]n1)C1CS(=O)(=O)C1 ZINC001582350110 1075939469 /nfs/dbraw/zinc/93/94/69/1075939469.db2.gz QPWOMESRRIZNPS-SECBINFHSA-N -1 3 384.393 -1.061 20 0 GAADHM O=C(NC[C@H](CO)Nc1cccc(F)c1-c1nnn[n-]1)C1CS(=O)(=O)C1 ZINC001582350110 1075939466 /nfs/dbraw/zinc/93/94/66/1075939466.db2.gz QPWOMESRRIZNPS-SECBINFHSA-N -1 3 384.393 -1.061 20 0 GAADHM O=C(NC[C@@H](CO)Nc1cccc(F)c1-c1nn[n-]n1)C1CS(=O)(=O)C1 ZINC001582350111 1075939486 /nfs/dbraw/zinc/93/94/86/1075939486.db2.gz QPWOMESRRIZNPS-VIFPVBQESA-N -1 3 384.393 -1.061 20 0 GAADHM O=C(NC[C@@H](CO)Nc1cccc(F)c1-c1nnn[n-]1)C1CS(=O)(=O)C1 ZINC001582350111 1075939479 /nfs/dbraw/zinc/93/94/79/1075939479.db2.gz QPWOMESRRIZNPS-VIFPVBQESA-N -1 3 384.393 -1.061 20 0 GAADHM O=C(NC[C@H](CO)Nc1ncccc1-c1nn[n-]n1)[C@@H]1CCS(=O)(=O)C1 ZINC001582352990 1075941509 /nfs/dbraw/zinc/94/15/09/1075941509.db2.gz ALGHZVFQFHFZLL-NXEZZACHSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@H](CO)Nc1ncccc1-c1nnn[n-]1)[C@@H]1CCS(=O)(=O)C1 ZINC001582352990 1075941506 /nfs/dbraw/zinc/94/15/06/1075941506.db2.gz ALGHZVFQFHFZLL-NXEZZACHSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ncccc1-c1nn[n-]n1)[C@H]1CCS(=O)(=O)C1 ZINC001582352991 1075941315 /nfs/dbraw/zinc/94/13/15/1075941315.db2.gz ALGHZVFQFHFZLL-UWVGGRQHSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ncccc1-c1nnn[n-]1)[C@H]1CCS(=O)(=O)C1 ZINC001582352991 1075941310 /nfs/dbraw/zinc/94/13/10/1075941310.db2.gz ALGHZVFQFHFZLL-UWVGGRQHSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@H](CO)Nc1ncccc1-c1nn[n-]n1)[C@H]1CCS(=O)(=O)C1 ZINC001582352992 1075941554 /nfs/dbraw/zinc/94/15/54/1075941554.db2.gz ALGHZVFQFHFZLL-VHSXEESVSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@H](CO)Nc1ncccc1-c1nnn[n-]1)[C@H]1CCS(=O)(=O)C1 ZINC001582352992 1075941551 /nfs/dbraw/zinc/94/15/51/1075941551.db2.gz ALGHZVFQFHFZLL-VHSXEESVSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ncccc1-c1nn[n-]n1)[C@@H]1CCS(=O)(=O)C1 ZINC001582352993 1075941266 /nfs/dbraw/zinc/94/12/66/1075941266.db2.gz ALGHZVFQFHFZLL-ZJUUUORDSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ncccc1-c1nnn[n-]1)[C@@H]1CCS(=O)(=O)C1 ZINC001582352993 1075941260 /nfs/dbraw/zinc/94/12/60/1075941260.db2.gz ALGHZVFQFHFZLL-ZJUUUORDSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@H](CO)Nc1ncc(-c2nn[n-]n2)cc1F)C1CS(=O)(=O)C1 ZINC001582353436 1075941431 /nfs/dbraw/zinc/94/14/31/1075941431.db2.gz GIUHYYNBZIQWDI-SECBINFHSA-N -1 3 385.381 -1.666 20 0 GAADHM O=C(NC[C@H](CO)Nc1ncc(-c2nnn[n-]2)cc1F)C1CS(=O)(=O)C1 ZINC001582353436 1075941426 /nfs/dbraw/zinc/94/14/26/1075941426.db2.gz GIUHYYNBZIQWDI-SECBINFHSA-N -1 3 385.381 -1.666 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ncc(-c2nn[n-]n2)cc1F)C1CS(=O)(=O)C1 ZINC001582353437 1075941416 /nfs/dbraw/zinc/94/14/16/1075941416.db2.gz GIUHYYNBZIQWDI-VIFPVBQESA-N -1 3 385.381 -1.666 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ncc(-c2nnn[n-]2)cc1F)C1CS(=O)(=O)C1 ZINC001582353437 1075941408 /nfs/dbraw/zinc/94/14/08/1075941408.db2.gz GIUHYYNBZIQWDI-VIFPVBQESA-N -1 3 385.381 -1.666 20 0 GAADHM O=C(NCC(F)F)C(=O)N[C@H]1C[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582356924 1075941894 /nfs/dbraw/zinc/94/18/94/1075941894.db2.gz BSBHSKQBCBYWQB-ZKCHVHJHSA-N -1 3 382.331 -1.047 20 0 GAADHM O=C(NCC(F)F)C(=O)N[C@H]1C[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582356924 1075941890 /nfs/dbraw/zinc/94/18/90/1075941890.db2.gz BSBHSKQBCBYWQB-ZKCHVHJHSA-N -1 3 382.331 -1.047 20 0 GAADHM O=C(NCC(F)F)C(=O)N[C@@H]1CN(Cc2cccc(-c3nn[n-]n3)c2)C[C@H]1O ZINC001582356956 1075941969 /nfs/dbraw/zinc/94/19/69/1075941969.db2.gz CMBFONQCBLGLBH-VXGBXAGGSA-N -1 3 395.370 -1.091 20 0 GAADHM O=C(NCC(F)F)C(=O)N1CC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582357415 1075941780 /nfs/dbraw/zinc/94/17/80/1075941780.db2.gz GMNFQXYPCJAQKU-SSDOTTSWSA-N -1 3 382.331 -1.093 20 0 GAADHM O=C(NCC(F)F)C(=O)N1CC[C@@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582357415 1075941772 /nfs/dbraw/zinc/94/17/72/1075941772.db2.gz GMNFQXYPCJAQKU-SSDOTTSWSA-N -1 3 382.331 -1.093 20 0 GAADHM O=C(NCC(F)F)C(=O)N1CC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582357418 1075941930 /nfs/dbraw/zinc/94/19/30/1075941930.db2.gz GMNFQXYPCJAQKU-ZETCQYMHSA-N -1 3 382.331 -1.093 20 0 GAADHM O=C(NCC(F)F)C(=O)N1CC[C@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582357418 1075941927 /nfs/dbraw/zinc/94/19/27/1075941927.db2.gz GMNFQXYPCJAQKU-ZETCQYMHSA-N -1 3 382.331 -1.093 20 0 GAADHM O=C(NCC(F)F)C(=O)N1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001582357456 1075941870 /nfs/dbraw/zinc/94/18/70/1075941870.db2.gz HAXPRXZCUQULEG-UHFFFAOYSA-N -1 3 382.331 -1.140 20 0 GAADHM O=C(NCC(F)F)C(=O)N1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001582357456 1075941865 /nfs/dbraw/zinc/94/18/65/1075941865.db2.gz HAXPRXZCUQULEG-UHFFFAOYSA-N -1 3 382.331 -1.140 20 0 GAADHM O=C(NCC(F)F)C(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582358737 1075941733 /nfs/dbraw/zinc/94/17/33/1075941733.db2.gz SVAXDFXYFPYMGU-RKDXNWHRSA-N -1 3 398.330 -2.122 20 0 GAADHM O=C(NCC(F)F)C(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582358737 1075941727 /nfs/dbraw/zinc/94/17/27/1075941727.db2.gz SVAXDFXYFPYMGU-RKDXNWHRSA-N -1 3 398.330 -2.122 20 0 GAADHM O=C(NCC(F)F)C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001582359319 1075941941 /nfs/dbraw/zinc/94/19/41/1075941941.db2.gz XYPWELNKYVNQJI-ZJUUUORDSA-N -1 3 382.331 -1.691 20 0 GAADHM O=C(NCC(F)F)C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001582359319 1075941939 /nfs/dbraw/zinc/94/19/39/1075941939.db2.gz XYPWELNKYVNQJI-ZJUUUORDSA-N -1 3 382.331 -1.691 20 0 GAADHM O=C(NCC(F)F)C(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001582359341 1075941823 /nfs/dbraw/zinc/94/18/23/1075941823.db2.gz YOSVSMQXRRXNJH-BDAKNGLRSA-N -1 3 382.331 -1.691 20 0 GAADHM O=C(NCC(F)F)C(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001582359341 1075941818 /nfs/dbraw/zinc/94/18/18/1075941818.db2.gz YOSVSMQXRRXNJH-BDAKNGLRSA-N -1 3 382.331 -1.691 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582366064 1075942314 /nfs/dbraw/zinc/94/23/14/1075942314.db2.gz BKJLTPLANXKXSD-FKLBQPBDSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582366064 1075942310 /nfs/dbraw/zinc/94/23/10/1075942310.db2.gz BKJLTPLANXKXSD-FKLBQPBDSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582366065 1075942298 /nfs/dbraw/zinc/94/22/98/1075942298.db2.gz BKJLTPLANXKXSD-YSZLUBPXSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582366065 1075942294 /nfs/dbraw/zinc/94/22/94/1075942294.db2.gz BKJLTPLANXKXSD-YSZLUBPXSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cnn2c1CCC2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582366080 1075942281 /nfs/dbraw/zinc/94/22/81/1075942281.db2.gz BRFZWXYJPHPGJJ-SECBINFHSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cnn2c1CCC2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582366080 1075942274 /nfs/dbraw/zinc/94/22/74/1075942274.db2.gz BRFZWXYJPHPGJJ-SECBINFHSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cnn2c1CCC2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582366081 1075942453 /nfs/dbraw/zinc/94/24/53/1075942453.db2.gz BRFZWXYJPHPGJJ-VIFPVBQESA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cnn2c1CCC2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582366081 1075942449 /nfs/dbraw/zinc/94/24/49/1075942449.db2.gz BRFZWXYJPHPGJJ-VIFPVBQESA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582366084 1075942483 /nfs/dbraw/zinc/94/24/83/1075942483.db2.gz BSARPUABEJLVHS-UZWSLXQKSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582366084 1075942478 /nfs/dbraw/zinc/94/24/78/1075942478.db2.gz BSARPUABEJLVHS-UZWSLXQKSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582366085 1075942388 /nfs/dbraw/zinc/94/23/88/1075942388.db2.gz BSARPUABEJLVHS-WGBDABJCSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582366085 1075942381 /nfs/dbraw/zinc/94/23/81/1075942381.db2.gz BSARPUABEJLVHS-WGBDABJCSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)C1CCC(O)CC1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582366132 1075942248 /nfs/dbraw/zinc/94/22/48/1075942248.db2.gz COGWZYVQFZTMQA-NHNAUAITSA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)C1CCC(O)CC1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582366132 1075942243 /nfs/dbraw/zinc/94/22/43/1075942243.db2.gz COGWZYVQFZTMQA-NHNAUAITSA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)C1CCC(O)CC1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582366133 1075942640 /nfs/dbraw/zinc/94/26/40/1075942640.db2.gz COGWZYVQFZTMQA-QEWOUOOISA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)C1CCC(O)CC1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582366133 1075942634 /nfs/dbraw/zinc/94/26/34/1075942634.db2.gz COGWZYVQFZTMQA-QEWOUOOISA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582366322 1075942669 /nfs/dbraw/zinc/94/26/69/1075942669.db2.gz FHUDJBVIKGEVRJ-OMVNPZBFSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582366322 1075942659 /nfs/dbraw/zinc/94/26/59/1075942659.db2.gz FHUDJBVIKGEVRJ-OMVNPZBFSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582366323 1075942739 /nfs/dbraw/zinc/94/27/39/1075942739.db2.gz FHUDJBVIKGEVRJ-PUOUXSMHSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582366323 1075942734 /nfs/dbraw/zinc/94/27/34/1075942734.db2.gz FHUDJBVIKGEVRJ-PUOUXSMHSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cn2c(n1)CCC2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582366326 1075942723 /nfs/dbraw/zinc/94/27/23/1075942723.db2.gz FJHMLTXHAPIXHX-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cn2c(n1)CCC2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582366326 1075942719 /nfs/dbraw/zinc/94/27/19/1075942719.db2.gz FJHMLTXHAPIXHX-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cn2c(n1)CCC2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582366327 1075942811 /nfs/dbraw/zinc/94/28/11/1075942811.db2.gz FJHMLTXHAPIXHX-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cn2c(n1)CCC2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582366327 1075942806 /nfs/dbraw/zinc/94/28/06/1075942806.db2.gz FJHMLTXHAPIXHX-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582366330 1075942708 /nfs/dbraw/zinc/94/27/08/1075942708.db2.gz FLTNDDJWWDMMPS-PRFIWBCESA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582366330 1075942701 /nfs/dbraw/zinc/94/27/01/1075942701.db2.gz FLTNDDJWWDMMPS-PRFIWBCESA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582366331 1075942618 /nfs/dbraw/zinc/94/26/18/1075942618.db2.gz FLTNDDJWWDMMPS-WTBMIXGQSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582366331 1075942609 /nfs/dbraw/zinc/94/26/09/1075942609.db2.gz FLTNDDJWWDMMPS-WTBMIXGQSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cn2c(n1)CCC2 ZINC001582366350 1075942794 /nfs/dbraw/zinc/94/27/94/1075942794.db2.gz FTHUJXZFCIICRE-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cn2c(n1)CCC2 ZINC001582366350 1075942790 /nfs/dbraw/zinc/94/27/90/1075942790.db2.gz FTHUJXZFCIICRE-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cn2c(n1)CCC2 ZINC001582366351 1075942573 /nfs/dbraw/zinc/94/25/73/1075942573.db2.gz FTHUJXZFCIICRE-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cn2c(n1)CCC2 ZINC001582366351 1075942565 /nfs/dbraw/zinc/94/25/65/1075942565.db2.gz FTHUJXZFCIICRE-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cnc2n1CCC2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582366364 1075942764 /nfs/dbraw/zinc/94/27/64/1075942764.db2.gz FYSUBAPNAOEVOO-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cnc2n1CCC2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582366364 1075942759 /nfs/dbraw/zinc/94/27/59/1075942759.db2.gz FYSUBAPNAOEVOO-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cnc2n1CCC2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582366365 1075942779 /nfs/dbraw/zinc/94/27/79/1075942779.db2.gz FYSUBAPNAOEVOO-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cnc2n1CCC2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582366365 1075942773 /nfs/dbraw/zinc/94/27/73/1075942773.db2.gz FYSUBAPNAOEVOO-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cnn(CCF)c1 ZINC001582366626 1075942593 /nfs/dbraw/zinc/94/25/93/1075942593.db2.gz JKZZQXLPGIWOFC-LLVKDONJSA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cnn(CCF)c1 ZINC001582366626 1075942587 /nfs/dbraw/zinc/94/25/87/1075942587.db2.gz JKZZQXLPGIWOFC-LLVKDONJSA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cnn(CCF)c1 ZINC001582366627 1075942827 /nfs/dbraw/zinc/94/28/27/1075942827.db2.gz JKZZQXLPGIWOFC-NSHDSACASA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cnn(CCF)c1 ZINC001582366627 1075942823 /nfs/dbraw/zinc/94/28/23/1075942823.db2.gz JKZZQXLPGIWOFC-NSHDSACASA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cnc2n1CCC2)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582366766 1075943092 /nfs/dbraw/zinc/94/30/92/1075943092.db2.gz KHAHJDKZKKTEOQ-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cnc2n1CCC2)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582366766 1075943088 /nfs/dbraw/zinc/94/30/88/1075943088.db2.gz KHAHJDKZKKTEOQ-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cnc2n1CCC2)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582366767 1075943106 /nfs/dbraw/zinc/94/31/06/1075943106.db2.gz KHAHJDKZKKTEOQ-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cnc2n1CCC2)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582366767 1075943102 /nfs/dbraw/zinc/94/31/02/1075943102.db2.gz KHAHJDKZKKTEOQ-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cnc2n1CCC2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582366834 1075943198 /nfs/dbraw/zinc/94/31/98/1075943198.db2.gz LJVXHBASBBLUAH-SECBINFHSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cnc2n1CCC2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582366834 1075943194 /nfs/dbraw/zinc/94/31/94/1075943194.db2.gz LJVXHBASBBLUAH-SECBINFHSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cnc2n1CCC2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582366835 1075943254 /nfs/dbraw/zinc/94/32/54/1075943254.db2.gz LJVXHBASBBLUAH-VIFPVBQESA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cnc2n1CCC2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582366835 1075943252 /nfs/dbraw/zinc/94/32/52/1075943252.db2.gz LJVXHBASBBLUAH-VIFPVBQESA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)C1(F)CCOCC1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582366972 1075943214 /nfs/dbraw/zinc/94/32/14/1075943214.db2.gz MEBXMOCJPSYLCE-SECBINFHSA-N -1 3 381.368 -1.080 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)C1(F)CCOCC1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582366972 1075943209 /nfs/dbraw/zinc/94/32/09/1075943209.db2.gz MEBXMOCJPSYLCE-SECBINFHSA-N -1 3 381.368 -1.080 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)C1(F)CCOCC1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582366973 1075943228 /nfs/dbraw/zinc/94/32/28/1075943228.db2.gz MEBXMOCJPSYLCE-VIFPVBQESA-N -1 3 381.368 -1.080 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)C1(F)CCOCC1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582366973 1075943223 /nfs/dbraw/zinc/94/32/23/1075943223.db2.gz MEBXMOCJPSYLCE-VIFPVBQESA-N -1 3 381.368 -1.080 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)C1CCC(O)CC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582367194 1075943184 /nfs/dbraw/zinc/94/31/84/1075943184.db2.gz NVSOMNLEDRHJFR-NHNAUAITSA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)C1CCC(O)CC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582367194 1075943177 /nfs/dbraw/zinc/94/31/77/1075943177.db2.gz NVSOMNLEDRHJFR-NHNAUAITSA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)C1CCC(O)CC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582367195 1075943153 /nfs/dbraw/zinc/94/31/53/1075943153.db2.gz NVSOMNLEDRHJFR-QEWOUOOISA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)C1CCC(O)CC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582367195 1075943146 /nfs/dbraw/zinc/94/31/46/1075943146.db2.gz NVSOMNLEDRHJFR-QEWOUOOISA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)C1(F)CCOCC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582367232 1075943282 /nfs/dbraw/zinc/94/32/82/1075943282.db2.gz OOMGJJSKHPKWRO-JTQLQIEISA-N -1 3 381.368 -1.080 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)C1(F)CCOCC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582367232 1075943278 /nfs/dbraw/zinc/94/32/78/1075943278.db2.gz OOMGJJSKHPKWRO-JTQLQIEISA-N -1 3 381.368 -1.080 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)C1(F)CCOCC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582367233 1075943306 /nfs/dbraw/zinc/94/33/06/1075943306.db2.gz OOMGJJSKHPKWRO-SNVBAGLBSA-N -1 3 381.368 -1.080 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)C1(F)CCOCC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582367233 1075943300 /nfs/dbraw/zinc/94/33/00/1075943300.db2.gz OOMGJJSKHPKWRO-SNVBAGLBSA-N -1 3 381.368 -1.080 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cc2n(n1)CCC2 ZINC001582367238 1075943136 /nfs/dbraw/zinc/94/31/36/1075943136.db2.gz OQFLSBMLJLDPOQ-LLVKDONJSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cc2n(n1)CCC2 ZINC001582367238 1075943131 /nfs/dbraw/zinc/94/31/31/1075943131.db2.gz OQFLSBMLJLDPOQ-LLVKDONJSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)c1cc2n(n1)CCC2 ZINC001582367239 1075943122 /nfs/dbraw/zinc/94/31/22/1075943122.db2.gz OQFLSBMLJLDPOQ-NSHDSACASA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)c1cc2n(n1)CCC2 ZINC001582367239 1075943117 /nfs/dbraw/zinc/94/31/17/1075943117.db2.gz OQFLSBMLJLDPOQ-NSHDSACASA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)C1CCC(O)CC1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582367419 1075943167 /nfs/dbraw/zinc/94/31/67/1075943167.db2.gz PRHNMOALNGYQMF-ILDUYXDCSA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)C1CCC(O)CC1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582367419 1075943162 /nfs/dbraw/zinc/94/31/62/1075943162.db2.gz PRHNMOALNGYQMF-ILDUYXDCSA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)C1CCC(O)CC1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582367421 1075943240 /nfs/dbraw/zinc/94/32/40/1075943240.db2.gz PRHNMOALNGYQMF-VQXHTEKXSA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)C1CCC(O)CC1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582367421 1075943238 /nfs/dbraw/zinc/94/32/38/1075943238.db2.gz PRHNMOALNGYQMF-VQXHTEKXSA-N -1 3 377.405 -1.047 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1cc2n(n1)CCC2 ZINC001582367534 1075943602 /nfs/dbraw/zinc/94/36/02/1075943602.db2.gz QXCNRABTGUXCAV-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1cc2n(n1)CCC2 ZINC001582367534 1075943598 /nfs/dbraw/zinc/94/35/98/1075943598.db2.gz QXCNRABTGUXCAV-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1cc2n(n1)CCC2 ZINC001582367536 1075943655 /nfs/dbraw/zinc/94/36/55/1075943655.db2.gz QXCNRABTGUXCAV-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1cc2n(n1)CCC2 ZINC001582367536 1075943650 /nfs/dbraw/zinc/94/36/50/1075943650.db2.gz QXCNRABTGUXCAV-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582367756 1075943675 /nfs/dbraw/zinc/94/36/75/1075943675.db2.gz SYPWIEZFNGYVFC-UZWSLXQKSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582367756 1075943672 /nfs/dbraw/zinc/94/36/72/1075943672.db2.gz SYPWIEZFNGYVFC-UZWSLXQKSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582367758 1075943586 /nfs/dbraw/zinc/94/35/86/1075943586.db2.gz SYPWIEZFNGYVFC-WGBDABJCSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582367758 1075943582 /nfs/dbraw/zinc/94/35/82/1075943582.db2.gz SYPWIEZFNGYVFC-WGBDABJCSA-N -1 3 375.389 -1.031 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1cnn(CCF)c1 ZINC001582367970 1075943538 /nfs/dbraw/zinc/94/35/38/1075943538.db2.gz UIPGXIPURFCWMQ-LLVKDONJSA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1cnn(CCF)c1 ZINC001582367970 1075943536 /nfs/dbraw/zinc/94/35/36/1075943536.db2.gz UIPGXIPURFCWMQ-LLVKDONJSA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)c1cnn(CCF)c1 ZINC001582367971 1075944043 /nfs/dbraw/zinc/94/40/43/1075944043.db2.gz UIPGXIPURFCWMQ-NSHDSACASA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)c1cnn(CCF)c1 ZINC001582367971 1075944039 /nfs/dbraw/zinc/94/40/39/1075944039.db2.gz UIPGXIPURFCWMQ-NSHDSACASA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1cnn(CCF)c1 ZINC001582368050 1075944118 /nfs/dbraw/zinc/94/41/18/1075944118.db2.gz WCOILXMELLEMJQ-JTQLQIEISA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1cnn(CCF)c1 ZINC001582368050 1075944114 /nfs/dbraw/zinc/94/41/14/1075944114.db2.gz WCOILXMELLEMJQ-JTQLQIEISA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)c1cnn(CCF)c1 ZINC001582368051 1075944029 /nfs/dbraw/zinc/94/40/29/1075944029.db2.gz WCOILXMELLEMJQ-SNVBAGLBSA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)c1cnn(CCF)c1 ZINC001582368051 1075944023 /nfs/dbraw/zinc/94/40/23/1075944023.db2.gz WCOILXMELLEMJQ-SNVBAGLBSA-N -1 3 391.367 -1.119 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582368466 1075943956 /nfs/dbraw/zinc/94/39/56/1075943956.db2.gz XVPRHWNFELBJRZ-OMVNPZBFSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582368466 1075943950 /nfs/dbraw/zinc/94/39/50/1075943950.db2.gz XVPRHWNFELBJRZ-OMVNPZBFSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582368469 1075944129 /nfs/dbraw/zinc/94/41/29/1075944129.db2.gz XVPRHWNFELBJRZ-PUOUXSMHSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582368469 1075944125 /nfs/dbraw/zinc/94/41/25/1075944125.db2.gz XVPRHWNFELBJRZ-PUOUXSMHSA-N -1 3 387.400 -1.175 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cc2n(n1)CCC2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582368683 1075944437 /nfs/dbraw/zinc/94/44/37/1075944437.db2.gz ZKFLZCBUAIGGFC-LLVKDONJSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cc2n(n1)CCC2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582368683 1075944434 /nfs/dbraw/zinc/94/44/34/1075944434.db2.gz ZKFLZCBUAIGGFC-LLVKDONJSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cc2n(n1)CCC2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582368684 1075944444 /nfs/dbraw/zinc/94/44/44/1075944444.db2.gz ZKFLZCBUAIGGFC-NSHDSACASA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cc2n(n1)CCC2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582368684 1075944442 /nfs/dbraw/zinc/94/44/42/1075944442.db2.gz ZKFLZCBUAIGGFC-NSHDSACASA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cnn2c1CCC2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582368691 1075944406 /nfs/dbraw/zinc/94/44/06/1075944406.db2.gz ZOBYORJKWYQVSK-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](O)CNC(=O)c1cnn2c1CCC2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582368691 1075944405 /nfs/dbraw/zinc/94/44/05/1075944405.db2.gz ZOBYORJKWYQVSK-JTQLQIEISA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cnn2c1CCC2)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582368693 1075944399 /nfs/dbraw/zinc/94/43/99/1075944399.db2.gz ZOBYORJKWYQVSK-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@@H](O)CNC(=O)c1cnn2c1CCC2)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582368693 1075944398 /nfs/dbraw/zinc/94/43/98/1075944398.db2.gz ZOBYORJKWYQVSK-SNVBAGLBSA-N -1 3 385.388 -1.142 20 0 GAADHM O=C(NC[C@H](O)CNc1ccc(-c2nn[n-]n2)cn1)[C@H]1CCCS1(=O)=O ZINC001582372268 1075944967 /nfs/dbraw/zinc/94/49/67/1075944967.db2.gz KSSVQSCLASSOGC-GHMZBOCLSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@H](O)CNc1ccc(-c2nnn[n-]2)cn1)[C@H]1CCCS1(=O)=O ZINC001582372268 1075944960 /nfs/dbraw/zinc/94/49/60/1075944960.db2.gz KSSVQSCLASSOGC-GHMZBOCLSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@H](O)CNc1ccc(-c2nn[n-]n2)cn1)[C@@H]1CCCS1(=O)=O ZINC001582372269 1075944713 /nfs/dbraw/zinc/94/47/13/1075944713.db2.gz KSSVQSCLASSOGC-MNOVXSKESA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@H](O)CNc1ccc(-c2nnn[n-]2)cn1)[C@@H]1CCCS1(=O)=O ZINC001582372269 1075944709 /nfs/dbraw/zinc/94/47/09/1075944709.db2.gz KSSVQSCLASSOGC-MNOVXSKESA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@@H](O)CNc1ccc(-c2nn[n-]n2)cn1)[C@@H]1CCCS1(=O)=O ZINC001582372270 1075944862 /nfs/dbraw/zinc/94/48/62/1075944862.db2.gz KSSVQSCLASSOGC-QWRGUYRKSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@@H](O)CNc1ccc(-c2nnn[n-]2)cn1)[C@@H]1CCCS1(=O)=O ZINC001582372270 1075944852 /nfs/dbraw/zinc/94/48/52/1075944852.db2.gz KSSVQSCLASSOGC-QWRGUYRKSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@@H](O)CNc1ccc(-c2nn[n-]n2)cn1)[C@H]1CCCS1(=O)=O ZINC001582372271 1075944938 /nfs/dbraw/zinc/94/49/38/1075944938.db2.gz KSSVQSCLASSOGC-WDEREUQCSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@@H](O)CNc1ccc(-c2nnn[n-]2)cn1)[C@H]1CCCS1(=O)=O ZINC001582372271 1075944931 /nfs/dbraw/zinc/94/49/31/1075944931.db2.gz KSSVQSCLASSOGC-WDEREUQCSA-N -1 3 381.418 -1.272 20 0 GAADHM O=C(NC[C@H](O)CNc1ccc(-c2nn[n-]n2)cn1)[C@@H]1CCS(=O)(=O)C1 ZINC001582372312 1075944788 /nfs/dbraw/zinc/94/47/88/1075944788.db2.gz LROCXBJMUAXECD-GHMZBOCLSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@H](O)CNc1ccc(-c2nnn[n-]2)cn1)[C@@H]1CCS(=O)(=O)C1 ZINC001582372312 1075944783 /nfs/dbraw/zinc/94/47/83/1075944783.db2.gz LROCXBJMUAXECD-GHMZBOCLSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](O)CNc1ccc(-c2nn[n-]n2)cn1)[C@@H]1CCS(=O)(=O)C1 ZINC001582372313 1075945015 /nfs/dbraw/zinc/94/50/15/1075945015.db2.gz LROCXBJMUAXECD-MNOVXSKESA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](O)CNc1ccc(-c2nnn[n-]2)cn1)[C@@H]1CCS(=O)(=O)C1 ZINC001582372313 1075945011 /nfs/dbraw/zinc/94/50/11/1075945011.db2.gz LROCXBJMUAXECD-MNOVXSKESA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](O)CNc1ccc(-c2nn[n-]n2)cn1)[C@H]1CCS(=O)(=O)C1 ZINC001582372314 1075945001 /nfs/dbraw/zinc/94/50/01/1075945001.db2.gz LROCXBJMUAXECD-QWRGUYRKSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](O)CNc1ccc(-c2nnn[n-]2)cn1)[C@H]1CCS(=O)(=O)C1 ZINC001582372314 1075944994 /nfs/dbraw/zinc/94/49/94/1075944994.db2.gz LROCXBJMUAXECD-QWRGUYRKSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@H](O)CNc1ccc(-c2nn[n-]n2)cn1)[C@H]1CCS(=O)(=O)C1 ZINC001582372315 1075945304 /nfs/dbraw/zinc/94/53/04/1075945304.db2.gz LROCXBJMUAXECD-WDEREUQCSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@H](O)CNc1ccc(-c2nnn[n-]2)cn1)[C@H]1CCS(=O)(=O)C1 ZINC001582372315 1075945302 /nfs/dbraw/zinc/94/53/02/1075945302.db2.gz LROCXBJMUAXECD-WDEREUQCSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@H](O)CNc1ccc(-c2nn[n-]n2)nc1)[C@H]1CCS(=O)(=O)C1 ZINC001582372926 1075945336 /nfs/dbraw/zinc/94/53/36/1075945336.db2.gz PVZLMRRUTOKFIB-GXSJLCMTSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@H](O)CNc1ccc(-c2nnn[n-]2)nc1)[C@H]1CCS(=O)(=O)C1 ZINC001582372926 1075945332 /nfs/dbraw/zinc/94/53/32/1075945332.db2.gz PVZLMRRUTOKFIB-GXSJLCMTSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](O)CNc1ccc(-c2nn[n-]n2)nc1)[C@@H]1CCS(=O)(=O)C1 ZINC001582372927 1075945277 /nfs/dbraw/zinc/94/52/77/1075945277.db2.gz PVZLMRRUTOKFIB-KOLCDFICSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](O)CNc1ccc(-c2nnn[n-]2)nc1)[C@@H]1CCS(=O)(=O)C1 ZINC001582372927 1075945272 /nfs/dbraw/zinc/94/52/72/1075945272.db2.gz PVZLMRRUTOKFIB-KOLCDFICSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@H](O)CNc1ccc(-c2nn[n-]n2)nc1)[C@@H]1CCS(=O)(=O)C1 ZINC001582372929 1075945203 /nfs/dbraw/zinc/94/52/03/1075945203.db2.gz PVZLMRRUTOKFIB-MWLCHTKSSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@H](O)CNc1ccc(-c2nnn[n-]2)nc1)[C@@H]1CCS(=O)(=O)C1 ZINC001582372929 1075945198 /nfs/dbraw/zinc/94/51/98/1075945198.db2.gz PVZLMRRUTOKFIB-MWLCHTKSSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](O)CNc1ccc(-c2nn[n-]n2)nc1)[C@H]1CCS(=O)(=O)C1 ZINC001582372930 1075945326 /nfs/dbraw/zinc/94/53/26/1075945326.db2.gz PVZLMRRUTOKFIB-ONGXEEELSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@@H](O)CNc1ccc(-c2nnn[n-]2)nc1)[C@H]1CCS(=O)(=O)C1 ZINC001582372930 1075945323 /nfs/dbraw/zinc/94/53/23/1075945323.db2.gz PVZLMRRUTOKFIB-ONGXEEELSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(NC[C@H](O)CNCc1ncnn1CCF)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582372968 1075945404 /nfs/dbraw/zinc/94/54/04/1075945404.db2.gz QHXVVMFSYMTRQY-SECBINFHSA-N -1 3 378.372 -1.364 20 0 GAADHM O=C(NC[C@@H](O)CNCc1ncnn1CCF)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582372969 1075945395 /nfs/dbraw/zinc/94/53/95/1075945395.db2.gz QHXVVMFSYMTRQY-VIFPVBQESA-N -1 3 378.372 -1.364 20 0 GAADHM O=C(NC[C@@H](O)CNCc1ncnn1CCF)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582373610 1075945186 /nfs/dbraw/zinc/94/51/86/1075945186.db2.gz UTPQVVXZIKNNNB-JTQLQIEISA-N -1 3 378.372 -1.364 20 0 GAADHM O=C(NC[C@@H](O)CNCc1ncnn1CCF)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582373610 1075945179 /nfs/dbraw/zinc/94/51/79/1075945179.db2.gz UTPQVVXZIKNNNB-JTQLQIEISA-N -1 3 378.372 -1.364 20 0 GAADHM O=C(NC[C@H](O)CNCc1ncnn1CCF)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582373611 1075945262 /nfs/dbraw/zinc/94/52/62/1075945262.db2.gz UTPQVVXZIKNNNB-SNVBAGLBSA-N -1 3 378.372 -1.364 20 0 GAADHM O=C(NC[C@H](O)CNCc1ncnn1CCF)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582373611 1075945256 /nfs/dbraw/zinc/94/52/56/1075945256.db2.gz UTPQVVXZIKNNNB-SNVBAGLBSA-N -1 3 378.372 -1.364 20 0 GAADHM O=C(NC[C@H](O)CNc1cccc(F)c1-c1nn[n-]n1)C1CS(=O)(=O)C1 ZINC001582374432 1075945153 /nfs/dbraw/zinc/94/51/53/1075945153.db2.gz FUNXBAAEHMPILO-SECBINFHSA-N -1 3 384.393 -1.061 20 0 GAADHM O=C(NC[C@H](O)CNc1cccc(F)c1-c1nnn[n-]1)C1CS(=O)(=O)C1 ZINC001582374432 1075945147 /nfs/dbraw/zinc/94/51/47/1075945147.db2.gz FUNXBAAEHMPILO-SECBINFHSA-N -1 3 384.393 -1.061 20 0 GAADHM O=C(NC[C@@H](O)CNc1cccc(F)c1-c1nn[n-]n1)C1CS(=O)(=O)C1 ZINC001582374433 1075945221 /nfs/dbraw/zinc/94/52/21/1075945221.db2.gz FUNXBAAEHMPILO-VIFPVBQESA-N -1 3 384.393 -1.061 20 0 GAADHM O=C(NC[C@@H](O)CNc1cccc(F)c1-c1nnn[n-]1)C1CS(=O)(=O)C1 ZINC001582374433 1075945216 /nfs/dbraw/zinc/94/52/16/1075945216.db2.gz FUNXBAAEHMPILO-VIFPVBQESA-N -1 3 384.393 -1.061 20 0 GAADHM O=C(NC[C@H](O)CNc1ncc(-c2nn[n-]n2)cc1F)C1CS(=O)(=O)C1 ZINC001582379870 1075948727 /nfs/dbraw/zinc/94/87/27/1075948727.db2.gz VEQWYYVFYDIDLE-SECBINFHSA-N -1 3 385.381 -1.666 20 0 GAADHM O=C(NC[C@H](O)CNc1ncc(-c2nnn[n-]2)cc1F)C1CS(=O)(=O)C1 ZINC001582379870 1075948726 /nfs/dbraw/zinc/94/87/26/1075948726.db2.gz VEQWYYVFYDIDLE-SECBINFHSA-N -1 3 385.381 -1.666 20 0 GAADHM O=C(NC[C@@H](O)CNc1ncc(-c2nn[n-]n2)cc1F)C1CS(=O)(=O)C1 ZINC001582379871 1075948534 /nfs/dbraw/zinc/94/85/34/1075948534.db2.gz VEQWYYVFYDIDLE-VIFPVBQESA-N -1 3 385.381 -1.666 20 0 GAADHM O=C(NC[C@@H](O)CNc1ncc(-c2nnn[n-]2)cc1F)C1CS(=O)(=O)C1 ZINC001582379871 1075948533 /nfs/dbraw/zinc/94/85/33/1075948533.db2.gz VEQWYYVFYDIDLE-VIFPVBQESA-N -1 3 385.381 -1.666 20 0 GAADHM O=C(NCC1(NC(=O)C2CS(=O)(=O)C2)CC1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582383245 1075948514 /nfs/dbraw/zinc/94/85/14/1075948514.db2.gz CRQCIQJJBZGASU-UHFFFAOYSA-N -1 3 379.402 -1.382 20 0 GAADHM O=C(NCC1(NC(=O)C2CS(=O)(=O)C2)CC1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582383245 1075948510 /nfs/dbraw/zinc/94/85/10/1075948510.db2.gz CRQCIQJJBZGASU-UHFFFAOYSA-N -1 3 379.402 -1.382 20 0 GAADHM O=C(NCC1(NC(=O)C2CS(=O)(=O)C2)CC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582383613 1075948720 /nfs/dbraw/zinc/94/87/20/1075948720.db2.gz KMUWWUBUEVWXRV-UHFFFAOYSA-N -1 3 379.402 -1.382 20 0 GAADHM O=C(NCC1(NC(=O)C2CS(=O)(=O)C2)CC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582383613 1075948713 /nfs/dbraw/zinc/94/87/13/1075948713.db2.gz KMUWWUBUEVWXRV-UHFFFAOYSA-N -1 3 379.402 -1.382 20 0 GAADHM O=C(Cn1cccn1)N1CC[C@](O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582404728 1075949564 /nfs/dbraw/zinc/94/95/64/1075949564.db2.gz AIKASJRNCFBQEU-INIZCTEOSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(Cn1cccn1)N1CC[C@](O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582404728 1075949559 /nfs/dbraw/zinc/94/95/59/1075949559.db2.gz AIKASJRNCFBQEU-INIZCTEOSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(Cn1cccn1)N1CC[C@@](O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582404729 1075949549 /nfs/dbraw/zinc/94/95/49/1075949549.db2.gz AIKASJRNCFBQEU-MRXNPFEDSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(Cn1cccn1)N1CC[C@@](O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582404729 1075949546 /nfs/dbraw/zinc/94/95/46/1075949546.db2.gz AIKASJRNCFBQEU-MRXNPFEDSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)c1ccnnc1 ZINC001582404739 1075949534 /nfs/dbraw/zinc/94/95/34/1075949534.db2.gz ANEMHRDRSJOXFW-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)c1ccnnc1 ZINC001582404739 1075949523 /nfs/dbraw/zinc/94/95/23/1075949523.db2.gz ANEMHRDRSJOXFW-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)c1ccnnc1 ZINC001582404740 1075949685 /nfs/dbraw/zinc/94/96/85/1075949685.db2.gz ANEMHRDRSJOXFW-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)c1ccnnc1 ZINC001582404740 1075949681 /nfs/dbraw/zinc/94/96/81/1075949681.db2.gz ANEMHRDRSJOXFW-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@H]1[C@@H]2COC[C@@H]21 ZINC001582404766 1075949399 /nfs/dbraw/zinc/94/93/99/1075949399.db2.gz AWVXFSDCKHWPIH-JRUYNEJOSA-N -1 3 387.400 -1.220 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@H]1[C@@H]2COC[C@@H]21 ZINC001582404766 1075949384 /nfs/dbraw/zinc/94/93/84/1075949384.db2.gz AWVXFSDCKHWPIH-JRUYNEJOSA-N -1 3 387.400 -1.220 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@H]1[C@@H]2COC[C@@H]21 ZINC001582404768 1075949435 /nfs/dbraw/zinc/94/94/35/1075949435.db2.gz AWVXFSDCKHWPIH-LOVKBYSESA-N -1 3 387.400 -1.220 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@H]1[C@@H]2COC[C@@H]21 ZINC001582404768 1075949419 /nfs/dbraw/zinc/94/94/19/1075949419.db2.gz AWVXFSDCKHWPIH-LOVKBYSESA-N -1 3 387.400 -1.220 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@]23C[C@H]2COC3)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582404802 1075949698 /nfs/dbraw/zinc/94/96/98/1075949698.db2.gz BSOQXHFCIXVAHE-HKJPBSJPSA-N -1 3 387.400 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@]23C[C@H]2COC3)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582404802 1075949695 /nfs/dbraw/zinc/94/96/95/1075949695.db2.gz BSOQXHFCIXVAHE-HKJPBSJPSA-N -1 3 387.400 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@]23C[C@H]2COC3)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582404805 1075949469 /nfs/dbraw/zinc/94/94/69/1075949469.db2.gz BSOQXHFCIXVAHE-POJUEXTFSA-N -1 3 387.400 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@]23C[C@H]2COC3)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582404805 1075949451 /nfs/dbraw/zinc/94/94/51/1075949451.db2.gz BSOQXHFCIXVAHE-POJUEXTFSA-N -1 3 387.400 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)C1=COCCO1 ZINC001582404819 1075949673 /nfs/dbraw/zinc/94/96/73/1075949673.db2.gz CAAVCKQLKMQEJM-INIZCTEOSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)C1=COCCO1 ZINC001582404819 1075949668 /nfs/dbraw/zinc/94/96/68/1075949668.db2.gz CAAVCKQLKMQEJM-INIZCTEOSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)C1=COCCO1 ZINC001582404820 1075949612 /nfs/dbraw/zinc/94/96/12/1075949612.db2.gz CAAVCKQLKMQEJM-MRXNPFEDSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)C1=COCCO1 ZINC001582404820 1075949605 /nfs/dbraw/zinc/94/96/05/1075949605.db2.gz CAAVCKQLKMQEJM-MRXNPFEDSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)c1ccnnc1 ZINC001582404821 1075949625 /nfs/dbraw/zinc/94/96/25/1075949625.db2.gz CBECEGZTHDYSPM-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)c1ccnnc1 ZINC001582404821 1075949620 /nfs/dbraw/zinc/94/96/20/1075949620.db2.gz CBECEGZTHDYSPM-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)c1ccnnc1 ZINC001582404822 1075949321 /nfs/dbraw/zinc/94/93/21/1075949321.db2.gz CBECEGZTHDYSPM-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)c1ccnnc1 ZINC001582404822 1075949319 /nfs/dbraw/zinc/94/93/19/1075949319.db2.gz CBECEGZTHDYSPM-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)c1cccnn1 ZINC001582405006 1075949642 /nfs/dbraw/zinc/94/96/42/1075949642.db2.gz CSAVTPDMXKTATI-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)c1cccnn1 ZINC001582405006 1075949636 /nfs/dbraw/zinc/94/96/36/1075949636.db2.gz CSAVTPDMXKTATI-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)c1cccnn1 ZINC001582405009 1075949657 /nfs/dbraw/zinc/94/96/57/1075949657.db2.gz CSAVTPDMXKTATI-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)c1cccnn1 ZINC001582405009 1075949651 /nfs/dbraw/zinc/94/96/51/1075949651.db2.gz CSAVTPDMXKTATI-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)c1cncnc1 ZINC001582405028 1075949594 /nfs/dbraw/zinc/94/95/94/1075949594.db2.gz DCXPXAVDJLPIRV-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)c1cncnc1 ZINC001582405028 1075949588 /nfs/dbraw/zinc/94/95/88/1075949588.db2.gz DCXPXAVDJLPIRV-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)c1cncnc1 ZINC001582405029 1075949581 /nfs/dbraw/zinc/94/95/81/1075949581.db2.gz DCXPXAVDJLPIRV-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)c1cncnc1 ZINC001582405029 1075949577 /nfs/dbraw/zinc/94/95/77/1075949577.db2.gz DCXPXAVDJLPIRV-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)c1ccnnc1 ZINC001582405038 1075949347 /nfs/dbraw/zinc/94/93/47/1075949347.db2.gz DKDYULJKSCMCEM-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)c1ccnnc1 ZINC001582405038 1075949345 /nfs/dbraw/zinc/94/93/45/1075949345.db2.gz DKDYULJKSCMCEM-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)c1ccnnc1 ZINC001582405039 1075949510 /nfs/dbraw/zinc/94/95/10/1075949510.db2.gz DKDYULJKSCMCEM-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)c1ccnnc1 ZINC001582405039 1075949501 /nfs/dbraw/zinc/94/95/01/1075949501.db2.gz DKDYULJKSCMCEM-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)C2=COCCO2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582405040 1075949492 /nfs/dbraw/zinc/94/94/92/1075949492.db2.gz DMFOUNKOWXCHCD-INIZCTEOSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)C2=COCCO2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582405040 1075949486 /nfs/dbraw/zinc/94/94/86/1075949486.db2.gz DMFOUNKOWXCHCD-INIZCTEOSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)C2=COCCO2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582405041 1075950031 /nfs/dbraw/zinc/95/00/31/1075950031.db2.gz DMFOUNKOWXCHCD-MRXNPFEDSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)C2=COCCO2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582405041 1075950024 /nfs/dbraw/zinc/95/00/24/1075950024.db2.gz DMFOUNKOWXCHCD-MRXNPFEDSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(Cc1cc[nH]n1)N1CC[C@](O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582405045 1075949936 /nfs/dbraw/zinc/94/99/36/1075949936.db2.gz DTBHKKPZCOYPMI-INIZCTEOSA-N -1 3 385.388 -1.146 20 0 GAADHM O=C(Cc1cc[nH]n1)N1CC[C@@](O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582405046 1075950131 /nfs/dbraw/zinc/95/01/31/1075950131.db2.gz DTBHKKPZCOYPMI-MRXNPFEDSA-N -1 3 385.388 -1.146 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@@H]2COCCO2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582405055 1075950164 /nfs/dbraw/zinc/95/01/64/1075950164.db2.gz FBPZNDZQWUHMIX-BLLLJJGKSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@@H]2COCCO2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582405055 1075950156 /nfs/dbraw/zinc/95/01/56/1075950156.db2.gz FBPZNDZQWUHMIX-BLLLJJGKSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@@H]2COCCO2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582405056 1075950010 /nfs/dbraw/zinc/95/00/10/1075950010.db2.gz FBPZNDZQWUHMIX-LRDDRELGSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@@H]2COCCO2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582405056 1075950004 /nfs/dbraw/zinc/95/00/04/1075950004.db2.gz FBPZNDZQWUHMIX-LRDDRELGSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@H]2COCCO2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582405057 1075950052 /nfs/dbraw/zinc/95/00/52/1075950052.db2.gz FBPZNDZQWUHMIX-MLGOLLRUSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@H]2COCCO2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582405057 1075950045 /nfs/dbraw/zinc/95/00/45/1075950045.db2.gz FBPZNDZQWUHMIX-MLGOLLRUSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@H]2COCCO2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582405058 1075949918 /nfs/dbraw/zinc/94/99/18/1075949918.db2.gz FBPZNDZQWUHMIX-WBMJQRKESA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@H]2COCCO2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582405058 1075949915 /nfs/dbraw/zinc/94/99/15/1075949915.db2.gz FBPZNDZQWUHMIX-WBMJQRKESA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@](O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582405113 1075949908 /nfs/dbraw/zinc/94/99/08/1075949908.db2.gz GHMALMJIUNWSFA-HNNXBMFYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@](O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582405113 1075949906 /nfs/dbraw/zinc/94/99/06/1075949906.db2.gz GHMALMJIUNWSFA-HNNXBMFYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@@](O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582405214 1075950078 /nfs/dbraw/zinc/95/00/78/1075950078.db2.gz GHMALMJIUNWSFA-OAHLLOKOSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@@](O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582405214 1075950068 /nfs/dbraw/zinc/95/00/68/1075950068.db2.gz GHMALMJIUNWSFA-OAHLLOKOSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)c1cnccn1 ZINC001582405229 1075949928 /nfs/dbraw/zinc/94/99/28/1075949928.db2.gz GQCQBTCLVWKYCR-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)c1cnccn1 ZINC001582405229 1075949924 /nfs/dbraw/zinc/94/99/24/1075949924.db2.gz GQCQBTCLVWKYCR-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)c1cnccn1 ZINC001582405230 1075949994 /nfs/dbraw/zinc/94/99/94/1075949994.db2.gz GQCQBTCLVWKYCR-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)c1cnccn1 ZINC001582405230 1075949990 /nfs/dbraw/zinc/94/99/90/1075949990.db2.gz GQCQBTCLVWKYCR-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@]23C[C@H]2COC3)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582405275 1075949982 /nfs/dbraw/zinc/94/99/82/1075949982.db2.gz IKJJWQGTIUILPZ-GOPGUHFVSA-N -1 3 387.400 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@]23C[C@H]2COC3)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582405275 1075949980 /nfs/dbraw/zinc/94/99/80/1075949980.db2.gz IKJJWQGTIUILPZ-GOPGUHFVSA-N -1 3 387.400 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@]23C[C@H]2COC3)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582405276 1075949947 /nfs/dbraw/zinc/94/99/47/1075949947.db2.gz IKJJWQGTIUILPZ-JECHBYEQSA-N -1 3 387.400 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@]23C[C@H]2COC3)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582405276 1075949945 /nfs/dbraw/zinc/94/99/45/1075949945.db2.gz IKJJWQGTIUILPZ-JECHBYEQSA-N -1 3 387.400 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)c1cnccn1 ZINC001582405278 1075950145 /nfs/dbraw/zinc/95/01/45/1075950145.db2.gz INRUVBMJYYRRJF-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)c1cnccn1 ZINC001582405278 1075950138 /nfs/dbraw/zinc/95/01/38/1075950138.db2.gz INRUVBMJYYRRJF-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)c1cnccn1 ZINC001582405279 1075949972 /nfs/dbraw/zinc/94/99/72/1075949972.db2.gz INRUVBMJYYRRJF-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)c1cnccn1 ZINC001582405279 1075949969 /nfs/dbraw/zinc/94/99/69/1075949969.db2.gz INRUVBMJYYRRJF-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)c1cccnn1 ZINC001582405427 1075949894 /nfs/dbraw/zinc/94/98/94/1075949894.db2.gz JXJKYUMYQXKLTD-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)c1cccnn1 ZINC001582405427 1075949891 /nfs/dbraw/zinc/94/98/91/1075949891.db2.gz JXJKYUMYQXKLTD-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)c1cccnn1 ZINC001582405428 1075950527 /nfs/dbraw/zinc/95/05/27/1075950527.db2.gz JXJKYUMYQXKLTD-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)c1cccnn1 ZINC001582405428 1075950518 /nfs/dbraw/zinc/95/05/18/1075950518.db2.gz JXJKYUMYQXKLTD-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)c1ncccn1 ZINC001582405433 1075950630 /nfs/dbraw/zinc/95/06/30/1075950630.db2.gz KBZHLFDXJGJQNX-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)c1ncccn1 ZINC001582405433 1075950627 /nfs/dbraw/zinc/95/06/27/1075950627.db2.gz KBZHLFDXJGJQNX-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)c1ncccn1 ZINC001582405434 1075950621 /nfs/dbraw/zinc/95/06/21/1075950621.db2.gz KBZHLFDXJGJQNX-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)c1ncccn1 ZINC001582405434 1075950620 /nfs/dbraw/zinc/95/06/20/1075950620.db2.gz KBZHLFDXJGJQNX-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)c1ccncn1 ZINC001582405450 1075950427 /nfs/dbraw/zinc/95/04/27/1075950427.db2.gz KRWWANBAJBIQRM-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)c1ccncn1 ZINC001582405450 1075950422 /nfs/dbraw/zinc/95/04/22/1075950422.db2.gz KRWWANBAJBIQRM-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)c1ccncn1 ZINC001582405451 1075950615 /nfs/dbraw/zinc/95/06/15/1075950615.db2.gz KRWWANBAJBIQRM-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)c1ccncn1 ZINC001582405451 1075950611 /nfs/dbraw/zinc/95/06/11/1075950611.db2.gz KRWWANBAJBIQRM-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)c1cccnn1 ZINC001582405465 1075950647 /nfs/dbraw/zinc/95/06/47/1075950647.db2.gz LBKFTRVGEKLPMH-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)c1cccnn1 ZINC001582405465 1075950645 /nfs/dbraw/zinc/95/06/45/1075950645.db2.gz LBKFTRVGEKLPMH-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)c1cccnn1 ZINC001582405466 1075950503 /nfs/dbraw/zinc/95/05/03/1075950503.db2.gz LBKFTRVGEKLPMH-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)c1cccnn1 ZINC001582405466 1075950499 /nfs/dbraw/zinc/95/04/99/1075950499.db2.gz LBKFTRVGEKLPMH-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@@H]2CCOC2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582405471 1075950562 /nfs/dbraw/zinc/95/05/62/1075950562.db2.gz LECHMJZNPMMBDN-HWPZZCPQSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@@H]2CCOC2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582405471 1075950560 /nfs/dbraw/zinc/95/05/60/1075950560.db2.gz LECHMJZNPMMBDN-HWPZZCPQSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@H]2CCOC2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582405472 1075950581 /nfs/dbraw/zinc/95/05/81/1075950581.db2.gz LECHMJZNPMMBDN-MGPLVRAMSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@H]2CCOC2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582405472 1075950578 /nfs/dbraw/zinc/95/05/78/1075950578.db2.gz LECHMJZNPMMBDN-MGPLVRAMSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@H]2CCOC2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582405473 1075950587 /nfs/dbraw/zinc/95/05/87/1075950587.db2.gz LECHMJZNPMMBDN-QFYYESIMSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@H]2CCOC2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582405473 1075950585 /nfs/dbraw/zinc/95/05/85/1075950585.db2.gz LECHMJZNPMMBDN-QFYYESIMSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@@H]2CCOC2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582405474 1075950486 /nfs/dbraw/zinc/95/04/86/1075950486.db2.gz LECHMJZNPMMBDN-QLJPJBMISA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@@H]2CCOC2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582405474 1075950481 /nfs/dbraw/zinc/95/04/81/1075950481.db2.gz LECHMJZNPMMBDN-QLJPJBMISA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)C2=COCCO2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582405477 1075950546 /nfs/dbraw/zinc/95/05/46/1075950546.db2.gz LFXPLEBDHYPPBO-INIZCTEOSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)C2=COCCO2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582405477 1075950541 /nfs/dbraw/zinc/95/05/41/1075950541.db2.gz LFXPLEBDHYPPBO-INIZCTEOSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)C2=COCCO2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582405478 1075950596 /nfs/dbraw/zinc/95/05/96/1075950596.db2.gz LFXPLEBDHYPPBO-MRXNPFEDSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)C2=COCCO2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582405478 1075950593 /nfs/dbraw/zinc/95/05/93/1075950593.db2.gz LFXPLEBDHYPPBO-MRXNPFEDSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@](O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582405480 1075950401 /nfs/dbraw/zinc/95/04/01/1075950401.db2.gz LGMBVQJWHZOABB-INIZCTEOSA-N -1 3 385.388 -1.146 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@](O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582405480 1075950392 /nfs/dbraw/zinc/95/03/92/1075950392.db2.gz LGMBVQJWHZOABB-INIZCTEOSA-N -1 3 385.388 -1.146 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@@](O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582405481 1075950659 /nfs/dbraw/zinc/95/06/59/1075950659.db2.gz LGMBVQJWHZOABB-MRXNPFEDSA-N -1 3 385.388 -1.146 20 0 GAADHM O=C(Cc1ncc[nH]1)N1CC[C@@](O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582405481 1075950655 /nfs/dbraw/zinc/95/06/55/1075950655.db2.gz LGMBVQJWHZOABB-MRXNPFEDSA-N -1 3 385.388 -1.146 20 0 GAADHM O=C(Cn1nccn1)N1CC[C@](O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582405490 1075950605 /nfs/dbraw/zinc/95/06/05/1075950605.db2.gz LKEQCNACDWIZAG-HNNXBMFYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1nccn1)N1CC[C@](O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582405490 1075950602 /nfs/dbraw/zinc/95/06/02/1075950602.db2.gz LKEQCNACDWIZAG-HNNXBMFYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1nccn1)N1CC[C@@](O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582405491 1075950572 /nfs/dbraw/zinc/95/05/72/1075950572.db2.gz LKEQCNACDWIZAG-OAHLLOKOSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1nccn1)N1CC[C@@](O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582405491 1075950568 /nfs/dbraw/zinc/95/05/68/1075950568.db2.gz LKEQCNACDWIZAG-OAHLLOKOSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1ccnc1)N1CC[C@](O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582405528 1075950472 /nfs/dbraw/zinc/95/04/72/1075950472.db2.gz MAZFVGZVPWOPOM-INIZCTEOSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(Cn1ccnc1)N1CC[C@](O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582405528 1075950465 /nfs/dbraw/zinc/95/04/65/1075950465.db2.gz MAZFVGZVPWOPOM-INIZCTEOSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(Cn1ccnc1)N1CC[C@@](O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582405618 1075950640 /nfs/dbraw/zinc/95/06/40/1075950640.db2.gz MAZFVGZVPWOPOM-MRXNPFEDSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(Cn1ccnc1)N1CC[C@@](O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582405618 1075950637 /nfs/dbraw/zinc/95/06/37/1075950637.db2.gz MAZFVGZVPWOPOM-MRXNPFEDSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(Cn1ccnc1)N1CC[C@](O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582405634 1075950451 /nfs/dbraw/zinc/95/04/51/1075950451.db2.gz MMYDREQQFWIYEI-INIZCTEOSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(Cn1ccnc1)N1CC[C@](O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582405634 1075950446 /nfs/dbraw/zinc/95/04/46/1075950446.db2.gz MMYDREQQFWIYEI-INIZCTEOSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(Cn1ccnc1)N1CC[C@@](O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582405635 1075950924 /nfs/dbraw/zinc/95/09/24/1075950924.db2.gz MMYDREQQFWIYEI-MRXNPFEDSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(Cn1ccnc1)N1CC[C@@](O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582405635 1075950918 /nfs/dbraw/zinc/95/09/18/1075950918.db2.gz MMYDREQQFWIYEI-MRXNPFEDSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)c1cncnc1 ZINC001582405644 1075951040 /nfs/dbraw/zinc/95/10/40/1075951040.db2.gz MRUNHYRXJNPZPC-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)c1cncnc1 ZINC001582405644 1075951036 /nfs/dbraw/zinc/95/10/36/1075951036.db2.gz MRUNHYRXJNPZPC-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)c1cncnc1 ZINC001582405645 1075950968 /nfs/dbraw/zinc/95/09/68/1075950968.db2.gz MRUNHYRXJNPZPC-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)c1cncnc1 ZINC001582405645 1075950966 /nfs/dbraw/zinc/95/09/66/1075950966.db2.gz MRUNHYRXJNPZPC-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@](O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582405686 1075951074 /nfs/dbraw/zinc/95/10/74/1075951074.db2.gz ODMPBETWNBVGQJ-HNNXBMFYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@](O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582405686 1075951069 /nfs/dbraw/zinc/95/10/69/1075951069.db2.gz ODMPBETWNBVGQJ-HNNXBMFYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@@](O)(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582405687 1075950891 /nfs/dbraw/zinc/95/08/91/1075950891.db2.gz ODMPBETWNBVGQJ-OAHLLOKOSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@@](O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582405687 1075950886 /nfs/dbraw/zinc/95/08/86/1075950886.db2.gz ODMPBETWNBVGQJ-OAHLLOKOSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)c1cncnc1 ZINC001582405689 1075951058 /nfs/dbraw/zinc/95/10/58/1075951058.db2.gz OETDLKLNSJWGSA-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)c1cncnc1 ZINC001582405689 1075951052 /nfs/dbraw/zinc/95/10/52/1075951052.db2.gz OETDLKLNSJWGSA-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)c1cncnc1 ZINC001582405690 1075950842 /nfs/dbraw/zinc/95/08/42/1075950842.db2.gz OETDLKLNSJWGSA-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM 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O=C(NC[C@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@H]1CCOC1 ZINC001582405906 1075951687 /nfs/dbraw/zinc/95/16/87/1075951687.db2.gz URPXFDJSYYIBEM-MGPLVRAMSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@H]1CCOC1 ZINC001582405907 1075951932 /nfs/dbraw/zinc/95/19/32/1075951932.db2.gz URPXFDJSYYIBEM-QFYYESIMSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@H]1CCOC1 ZINC001582405907 1075951931 /nfs/dbraw/zinc/95/19/31/1075951931.db2.gz URPXFDJSYYIBEM-QFYYESIMSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@@H]1CCOC1 ZINC001582405908 1075951718 /nfs/dbraw/zinc/95/17/18/1075951718.db2.gz URPXFDJSYYIBEM-QLJPJBMISA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@@H]1CCOC1 ZINC001582405908 1075951715 /nfs/dbraw/zinc/95/17/15/1075951715.db2.gz URPXFDJSYYIBEM-QLJPJBMISA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(Cn1nccn1)N1CC[C@](O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582405922 1075951874 /nfs/dbraw/zinc/95/18/74/1075951874.db2.gz VGDQEFONBWEPAL-HNNXBMFYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1nccn1)N1CC[C@](O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582405922 1075951869 /nfs/dbraw/zinc/95/18/69/1075951869.db2.gz VGDQEFONBWEPAL-HNNXBMFYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1nccn1)N1CC[C@@](O)(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582405923 1075951832 /nfs/dbraw/zinc/95/18/32/1075951832.db2.gz VGDQEFONBWEPAL-OAHLLOKOSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1nccn1)N1CC[C@@](O)(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582405923 1075951826 /nfs/dbraw/zinc/95/18/26/1075951826.db2.gz VGDQEFONBWEPAL-OAHLLOKOSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@@H]1CCOC1 ZINC001582405932 1075951927 /nfs/dbraw/zinc/95/19/27/1075951927.db2.gz VGOTWMHZULUDPQ-HWPZZCPQSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@@H]1CCOC1 ZINC001582405932 1075951922 /nfs/dbraw/zinc/95/19/22/1075951922.db2.gz VGOTWMHZULUDPQ-HWPZZCPQSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@H]1CCOC1 ZINC001582405933 1075951914 /nfs/dbraw/zinc/95/19/14/1075951914.db2.gz VGOTWMHZULUDPQ-MGPLVRAMSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@H]1CCOC1 ZINC001582405933 1075951908 /nfs/dbraw/zinc/95/19/08/1075951908.db2.gz VGOTWMHZULUDPQ-MGPLVRAMSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@H]1CCOC1 ZINC001582405934 1075951814 /nfs/dbraw/zinc/95/18/14/1075951814.db2.gz VGOTWMHZULUDPQ-QFYYESIMSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@H]1CCOC1 ZINC001582405934 1075951808 /nfs/dbraw/zinc/95/18/08/1075951808.db2.gz VGOTWMHZULUDPQ-QFYYESIMSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@@H]1CCOC1 ZINC001582405935 1075951733 /nfs/dbraw/zinc/95/17/33/1075951733.db2.gz VGOTWMHZULUDPQ-QLJPJBMISA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@@H]1CCOC1 ZINC001582405935 1075951728 /nfs/dbraw/zinc/95/17/28/1075951728.db2.gz VGOTWMHZULUDPQ-QLJPJBMISA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@H]1[C@@H]2COC[C@@H]21 ZINC001582405967 1075951705 /nfs/dbraw/zinc/95/17/05/1075951705.db2.gz WIRZISIAGWDGHD-JJTUWOBKSA-N -1 3 387.400 -1.220 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@H]1[C@@H]2COC[C@@H]21 ZINC001582405967 1075951701 /nfs/dbraw/zinc/95/17/01/1075951701.db2.gz WIRZISIAGWDGHD-JJTUWOBKSA-N -1 3 387.400 -1.220 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@H]1[C@@H]2COC[C@@H]21 ZINC001582405968 1075951767 /nfs/dbraw/zinc/95/17/67/1075951767.db2.gz WIRZISIAGWDGHD-ZKAWZIJESA-N -1 3 387.400 -1.220 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@H]1[C@@H]2COC[C@@H]21 ZINC001582405968 1075951761 /nfs/dbraw/zinc/95/17/61/1075951761.db2.gz WIRZISIAGWDGHD-ZKAWZIJESA-N -1 3 387.400 -1.220 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@@H]2COCCO2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582405991 1075951782 /nfs/dbraw/zinc/95/17/82/1075951782.db2.gz XFTJFYCRHFCNOR-BLLLJJGKSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@@H]2COCCO2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582405991 1075951777 /nfs/dbraw/zinc/95/17/77/1075951777.db2.gz XFTJFYCRHFCNOR-BLLLJJGKSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@@H]2COCCO2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582405992 1075951862 /nfs/dbraw/zinc/95/18/62/1075951862.db2.gz XFTJFYCRHFCNOR-LRDDRELGSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@@H]2COCCO2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582405992 1075951856 /nfs/dbraw/zinc/95/18/56/1075951856.db2.gz XFTJFYCRHFCNOR-LRDDRELGSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@H]2COCCO2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582405993 1075951886 /nfs/dbraw/zinc/95/18/86/1075951886.db2.gz XFTJFYCRHFCNOR-MLGOLLRUSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@H]2COCCO2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582405993 1075951881 /nfs/dbraw/zinc/95/18/81/1075951881.db2.gz XFTJFYCRHFCNOR-MLGOLLRUSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@H]2COCCO2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582405994 1075951950 /nfs/dbraw/zinc/95/19/50/1075951950.db2.gz XFTJFYCRHFCNOR-WBMJQRKESA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@H]2COCCO2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582405994 1075951948 /nfs/dbraw/zinc/95/19/48/1075951948.db2.gz XFTJFYCRHFCNOR-WBMJQRKESA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@]23C[C@H]2COC3)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582405997 1075951903 /nfs/dbraw/zinc/95/19/03/1075951903.db2.gz XGHJHDQVEPFVQV-GOPGUHFVSA-N -1 3 387.400 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@]23C[C@H]2COC3)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582405997 1075951898 /nfs/dbraw/zinc/95/18/98/1075951898.db2.gz XGHJHDQVEPFVQV-GOPGUHFVSA-N -1 3 387.400 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@]23C[C@H]2COC3)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582405998 1075951849 /nfs/dbraw/zinc/95/18/49/1075951849.db2.gz XGHJHDQVEPFVQV-JECHBYEQSA-N -1 3 387.400 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@]23C[C@H]2COC3)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582405998 1075951844 /nfs/dbraw/zinc/95/18/44/1075951844.db2.gz XGHJHDQVEPFVQV-JECHBYEQSA-N -1 3 387.400 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)C2=COCCO2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582406015 1075951939 /nfs/dbraw/zinc/95/19/39/1075951939.db2.gz XUAGLDMOMRZDTG-INIZCTEOSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)C2=COCCO2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582406015 1075951936 /nfs/dbraw/zinc/95/19/36/1075951936.db2.gz XUAGLDMOMRZDTG-INIZCTEOSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)C2=COCCO2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582406016 1075952402 /nfs/dbraw/zinc/95/24/02/1075952402.db2.gz XUAGLDMOMRZDTG-MRXNPFEDSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)C2=COCCO2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582406016 1075952400 /nfs/dbraw/zinc/95/24/00/1075952400.db2.gz XUAGLDMOMRZDTG-MRXNPFEDSA-N -1 3 389.372 -1.224 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@@H]2CCOC2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582406040 1075952355 /nfs/dbraw/zinc/95/23/55/1075952355.db2.gz YKVKSCCKOWKBAD-HWPZZCPQSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@@H]2CCOC2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582406040 1075952351 /nfs/dbraw/zinc/95/23/51/1075952351.db2.gz YKVKSCCKOWKBAD-HWPZZCPQSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@H]2CCOC2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582406041 1075952271 /nfs/dbraw/zinc/95/22/71/1075952271.db2.gz YKVKSCCKOWKBAD-MGPLVRAMSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@H]2CCOC2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582406041 1075952267 /nfs/dbraw/zinc/95/22/67/1075952267.db2.gz YKVKSCCKOWKBAD-MGPLVRAMSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@H]2CCOC2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582406042 1075952312 /nfs/dbraw/zinc/95/23/12/1075952312.db2.gz YKVKSCCKOWKBAD-QFYYESIMSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@H]2CCOC2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582406042 1075952308 /nfs/dbraw/zinc/95/23/08/1075952308.db2.gz YKVKSCCKOWKBAD-QFYYESIMSA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@@H]2CCOC2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582406043 1075952367 /nfs/dbraw/zinc/95/23/67/1075952367.db2.gz YKVKSCCKOWKBAD-QLJPJBMISA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@@H]2CCOC2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582406043 1075952364 /nfs/dbraw/zinc/95/23/64/1075952364.db2.gz YKVKSCCKOWKBAD-QLJPJBMISA-N -1 3 375.389 -1.076 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)c1cnccn1 ZINC001582406075 1075952387 /nfs/dbraw/zinc/95/23/87/1075952387.db2.gz YXOFPJNLBQDUDY-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)c1cnccn1 ZINC001582406075 1075952384 /nfs/dbraw/zinc/95/23/84/1075952384.db2.gz YXOFPJNLBQDUDY-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)c1cnccn1 ZINC001582406076 1075952254 /nfs/dbraw/zinc/95/22/54/1075952254.db2.gz YXOFPJNLBQDUDY-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)c1cnccn1 ZINC001582406076 1075952248 /nfs/dbraw/zinc/95/22/48/1075952248.db2.gz YXOFPJNLBQDUDY-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(Cn1cccn1)N1CC[C@](O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582406081 1075952290 /nfs/dbraw/zinc/95/22/90/1075952290.db2.gz ZBPBSJOYNWTGTG-INIZCTEOSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(Cn1cccn1)N1CC[C@](O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582406081 1075952284 /nfs/dbraw/zinc/95/22/84/1075952284.db2.gz ZBPBSJOYNWTGTG-INIZCTEOSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(Cn1cccn1)N1CC[C@@](O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582406082 1075952326 /nfs/dbraw/zinc/95/23/26/1075952326.db2.gz ZBPBSJOYNWTGTG-MRXNPFEDSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(Cn1cccn1)N1CC[C@@](O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582406082 1075952323 /nfs/dbraw/zinc/95/23/23/1075952323.db2.gz ZBPBSJOYNWTGTG-MRXNPFEDSA-N -1 3 385.388 -1.215 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@@H]1COCCO1 ZINC001582406083 1075952230 /nfs/dbraw/zinc/95/22/30/1075952230.db2.gz ZDOSRBSOADIVHD-BLLLJJGKSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@@H]1COCCO1 ZINC001582406083 1075952226 /nfs/dbraw/zinc/95/22/26/1075952226.db2.gz ZDOSRBSOADIVHD-BLLLJJGKSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@@H]1COCCO1 ZINC001582406084 1075952113 /nfs/dbraw/zinc/95/21/13/1075952113.db2.gz ZDOSRBSOADIVHD-LRDDRELGSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@@H]1COCCO1 ZINC001582406084 1075952103 /nfs/dbraw/zinc/95/21/03/1075952103.db2.gz ZDOSRBSOADIVHD-LRDDRELGSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@H]1COCCO1 ZINC001582406085 1075952160 /nfs/dbraw/zinc/95/21/60/1075952160.db2.gz ZDOSRBSOADIVHD-MLGOLLRUSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@H]1COCCO1 ZINC001582406085 1075952153 /nfs/dbraw/zinc/95/21/53/1075952153.db2.gz ZDOSRBSOADIVHD-MLGOLLRUSA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@H]1COCCO1 ZINC001582406086 1075952377 /nfs/dbraw/zinc/95/23/77/1075952377.db2.gz ZDOSRBSOADIVHD-WBMJQRKESA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@H]1COCCO1 ZINC001582406086 1075952374 /nfs/dbraw/zinc/95/23/74/1075952374.db2.gz ZDOSRBSOADIVHD-WBMJQRKESA-N -1 3 391.388 -1.697 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)c1ccncn1 ZINC001582406095 1075952136 /nfs/dbraw/zinc/95/21/36/1075952136.db2.gz ZLLRERRWXOSQIV-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)c1ccncn1 ZINC001582406095 1075952127 /nfs/dbraw/zinc/95/21/27/1075952127.db2.gz ZLLRERRWXOSQIV-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)c1ccncn1 ZINC001582406096 1075952338 /nfs/dbraw/zinc/95/23/38/1075952338.db2.gz ZLLRERRWXOSQIV-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)c1ccncn1 ZINC001582406096 1075952334 /nfs/dbraw/zinc/95/23/34/1075952334.db2.gz ZLLRERRWXOSQIV-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@](O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582406110 1075952188 /nfs/dbraw/zinc/95/21/88/1075952188.db2.gz ZRNHPAUZLUBWSH-HNNXBMFYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@](O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582406110 1075952180 /nfs/dbraw/zinc/95/21/80/1075952180.db2.gz ZRNHPAUZLUBWSH-HNNXBMFYSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@@](O)(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582406111 1075952412 /nfs/dbraw/zinc/95/24/12/1075952412.db2.gz ZRNHPAUZLUBWSH-OAHLLOKOSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(Cn1cncn1)N1CC[C@@](O)(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582406111 1075952409 /nfs/dbraw/zinc/95/24/09/1075952409.db2.gz ZRNHPAUZLUBWSH-OAHLLOKOSA-N -1 3 386.376 -1.820 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cncnc2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582406303 1075952605 /nfs/dbraw/zinc/95/26/05/1075952605.db2.gz DQBHQARGNIJOBA-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cncnc2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582406303 1075952601 /nfs/dbraw/zinc/95/26/01/1075952601.db2.gz DQBHQARGNIJOBA-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cncnc2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582406304 1075952899 /nfs/dbraw/zinc/95/28/99/1075952899.db2.gz DQBHQARGNIJOBA-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cncnc2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582406304 1075952892 /nfs/dbraw/zinc/95/28/92/1075952892.db2.gz DQBHQARGNIJOBA-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ncccn2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582406305 1075952799 /nfs/dbraw/zinc/95/27/99/1075952799.db2.gz DQEPCIVNNXKRKH-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ncccn2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582406305 1075952788 /nfs/dbraw/zinc/95/27/88/1075952788.db2.gz DQEPCIVNNXKRKH-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ncccn2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582406306 1075952883 /nfs/dbraw/zinc/95/28/83/1075952883.db2.gz DQEPCIVNNXKRKH-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ncccn2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582406306 1075952877 /nfs/dbraw/zinc/95/28/77/1075952877.db2.gz DQEPCIVNNXKRKH-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cccnn2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582406368 1075952660 /nfs/dbraw/zinc/95/26/60/1075952660.db2.gz FOSBCZUAEIIZIO-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cccnn2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582406368 1075952656 /nfs/dbraw/zinc/95/26/56/1075952656.db2.gz FOSBCZUAEIIZIO-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cccnn2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582406369 1075952691 /nfs/dbraw/zinc/95/26/91/1075952691.db2.gz FOSBCZUAEIIZIO-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cccnn2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582406369 1075952687 /nfs/dbraw/zinc/95/26/87/1075952687.db2.gz FOSBCZUAEIIZIO-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ncccn2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582406595 1075952680 /nfs/dbraw/zinc/95/26/80/1075952680.db2.gz KYQVYRKSZXEWQO-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ncccn2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582406595 1075952677 /nfs/dbraw/zinc/95/26/77/1075952677.db2.gz KYQVYRKSZXEWQO-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ncccn2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582406596 1075952866 /nfs/dbraw/zinc/95/28/66/1075952866.db2.gz KYQVYRKSZXEWQO-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ncccn2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582406596 1075952859 /nfs/dbraw/zinc/95/28/59/1075952859.db2.gz KYQVYRKSZXEWQO-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cnccn2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582406601 1075952709 /nfs/dbraw/zinc/95/27/09/1075952709.db2.gz LBKAEEJJBHADBL-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cnccn2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582406601 1075952701 /nfs/dbraw/zinc/95/27/01/1075952701.db2.gz LBKAEEJJBHADBL-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cnccn2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582406602 1075952637 /nfs/dbraw/zinc/95/26/37/1075952637.db2.gz LBKAEEJJBHADBL-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cnccn2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582406602 1075952633 /nfs/dbraw/zinc/95/26/33/1075952633.db2.gz LBKAEEJJBHADBL-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ncccn2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582406621 1075952731 /nfs/dbraw/zinc/95/27/31/1075952731.db2.gz LLVQFIDMCIOUOZ-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ncccn2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582406621 1075952725 /nfs/dbraw/zinc/95/27/25/1075952725.db2.gz LLVQFIDMCIOUOZ-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ncccn2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582406622 1075953316 /nfs/dbraw/zinc/95/33/16/1075953316.db2.gz LLVQFIDMCIOUOZ-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ncccn2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582406622 1075953313 /nfs/dbraw/zinc/95/33/13/1075953313.db2.gz LLVQFIDMCIOUOZ-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cccnn2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582406771 1075953295 /nfs/dbraw/zinc/95/32/95/1075953295.db2.gz NVQLIAJZLOJZFM-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cccnn2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582406771 1075953293 /nfs/dbraw/zinc/95/32/93/1075953293.db2.gz NVQLIAJZLOJZFM-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cccnn2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582406772 1075953178 /nfs/dbraw/zinc/95/31/78/1075953178.db2.gz NVQLIAJZLOJZFM-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cccnn2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582406772 1075953174 /nfs/dbraw/zinc/95/31/74/1075953174.db2.gz NVQLIAJZLOJZFM-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccnnc2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582406837 1075953348 /nfs/dbraw/zinc/95/33/48/1075953348.db2.gz PMHQKVHPEINNDX-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccnnc2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582406837 1075953346 /nfs/dbraw/zinc/95/33/46/1075953346.db2.gz PMHQKVHPEINNDX-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccnnc2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582406838 1075953278 /nfs/dbraw/zinc/95/32/78/1075953278.db2.gz PMHQKVHPEINNDX-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccnnc2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582406838 1075953273 /nfs/dbraw/zinc/95/32/73/1075953273.db2.gz PMHQKVHPEINNDX-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccncn2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582406845 1075953339 /nfs/dbraw/zinc/95/33/39/1075953339.db2.gz PQNFWPKKXSJDQJ-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccncn2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582406845 1075953335 /nfs/dbraw/zinc/95/33/35/1075953335.db2.gz PQNFWPKKXSJDQJ-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccncn2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582406846 1075953288 /nfs/dbraw/zinc/95/32/88/1075953288.db2.gz PQNFWPKKXSJDQJ-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccncn2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582406846 1075953285 /nfs/dbraw/zinc/95/32/85/1075953285.db2.gz PQNFWPKKXSJDQJ-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cccnn2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582406861 1075953161 /nfs/dbraw/zinc/95/31/61/1075953161.db2.gz PWBHDBJNMNOXRF-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cccnn2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582406861 1075953153 /nfs/dbraw/zinc/95/31/53/1075953153.db2.gz PWBHDBJNMNOXRF-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cccnn2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582406862 1075953328 /nfs/dbraw/zinc/95/33/28/1075953328.db2.gz PWBHDBJNMNOXRF-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cccnn2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582406862 1075953323 /nfs/dbraw/zinc/95/33/23/1075953323.db2.gz PWBHDBJNMNOXRF-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cnccn2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582406877 1075953375 /nfs/dbraw/zinc/95/33/75/1075953375.db2.gz QCQFSSUZBLAXDI-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cnccn2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582406877 1075953374 /nfs/dbraw/zinc/95/33/74/1075953374.db2.gz QCQFSSUZBLAXDI-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cnccn2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582406878 1075953307 /nfs/dbraw/zinc/95/33/07/1075953307.db2.gz QCQFSSUZBLAXDI-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cnccn2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582406878 1075953306 /nfs/dbraw/zinc/95/33/06/1075953306.db2.gz QCQFSSUZBLAXDI-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccncn2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582406979 1075953231 /nfs/dbraw/zinc/95/32/31/1075953231.db2.gz SSKAJUJZAFMZFU-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccncn2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582406979 1075953226 /nfs/dbraw/zinc/95/32/26/1075953226.db2.gz SSKAJUJZAFMZFU-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccncn2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582406980 1075953733 /nfs/dbraw/zinc/95/37/33/1075953733.db2.gz SSKAJUJZAFMZFU-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccncn2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582406980 1075953727 /nfs/dbraw/zinc/95/37/27/1075953727.db2.gz SSKAJUJZAFMZFU-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cncnc2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582407027 1075953809 /nfs/dbraw/zinc/95/38/09/1075953809.db2.gz USKRESSFUPFSHN-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cncnc2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582407027 1075953800 /nfs/dbraw/zinc/95/38/00/1075953800.db2.gz USKRESSFUPFSHN-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cncnc2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582407028 1075953964 /nfs/dbraw/zinc/95/39/64/1075953964.db2.gz USKRESSFUPFSHN-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cncnc2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582407028 1075953959 /nfs/dbraw/zinc/95/39/59/1075953959.db2.gz USKRESSFUPFSHN-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ccc(-c3nn[n-]n3)cn2)C1)c1c[nH]c(=O)cn1 ZINC001582407120 1075953948 /nfs/dbraw/zinc/95/39/48/1075953948.db2.gz CFAYQDGHBKSDAP-INIZCTEOSA-N -1 3 383.372 -1.284 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ccc(-c3nnn[n-]3)cn2)C1)c1c[nH]c(=O)cn1 ZINC001582407120 1075953941 /nfs/dbraw/zinc/95/39/41/1075953941.db2.gz CFAYQDGHBKSDAP-INIZCTEOSA-N -1 3 383.372 -1.284 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ccc(-c3nn[n-]n3)cn2)C1)c1c[nH]c(=O)cn1 ZINC001582407121 1075953849 /nfs/dbraw/zinc/95/38/49/1075953849.db2.gz CFAYQDGHBKSDAP-MRXNPFEDSA-N -1 3 383.372 -1.284 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ccc(-c3nnn[n-]3)cn2)C1)c1c[nH]c(=O)cn1 ZINC001582407121 1075953845 /nfs/dbraw/zinc/95/38/45/1075953845.db2.gz CFAYQDGHBKSDAP-MRXNPFEDSA-N -1 3 383.372 -1.284 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cnccn2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582407142 1075953930 /nfs/dbraw/zinc/95/39/30/1075953930.db2.gz VAMUJPTXALNGIH-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cnccn2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582407142 1075953924 /nfs/dbraw/zinc/95/39/24/1075953924.db2.gz VAMUJPTXALNGIH-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cnccn2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582407143 1075954001 /nfs/dbraw/zinc/95/40/01/1075954001.db2.gz VAMUJPTXALNGIH-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cnccn2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582407143 1075953997 /nfs/dbraw/zinc/95/39/97/1075953997.db2.gz VAMUJPTXALNGIH-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ccc(-c3nn[n-]n3)nc2)C1)c1c[nH]c(=O)cn1 ZINC001582407290 1075953831 /nfs/dbraw/zinc/95/38/31/1075953831.db2.gz DJNRANWQISRDLV-INIZCTEOSA-N -1 3 383.372 -1.284 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ccc(-c3nnn[n-]3)nc2)C1)c1c[nH]c(=O)cn1 ZINC001582407290 1075953825 /nfs/dbraw/zinc/95/38/25/1075953825.db2.gz DJNRANWQISRDLV-INIZCTEOSA-N -1 3 383.372 -1.284 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ccc(-c3nn[n-]n3)nc2)C1)c1c[nH]c(=O)cn1 ZINC001582407291 1075953911 /nfs/dbraw/zinc/95/39/11/1075953911.db2.gz DJNRANWQISRDLV-MRXNPFEDSA-N -1 3 383.372 -1.284 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ccc(-c3nnn[n-]3)nc2)C1)c1c[nH]c(=O)cn1 ZINC001582407291 1075953906 /nfs/dbraw/zinc/95/39/06/1075953906.db2.gz DJNRANWQISRDLV-MRXNPFEDSA-N -1 3 383.372 -1.284 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cncnc2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582407385 1075953771 /nfs/dbraw/zinc/95/37/71/1075953771.db2.gz YQBUGSWUAHXMCX-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2cncnc2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582407385 1075953766 /nfs/dbraw/zinc/95/37/66/1075953766.db2.gz YQBUGSWUAHXMCX-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cncnc2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582407386 1075953872 /nfs/dbraw/zinc/95/38/72/1075953872.db2.gz YQBUGSWUAHXMCX-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2cncnc2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582407386 1075953861 /nfs/dbraw/zinc/95/38/61/1075953861.db2.gz YQBUGSWUAHXMCX-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccncn2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582407411 1075953890 /nfs/dbraw/zinc/95/38/90/1075953890.db2.gz YZTNVDSLOUIBCM-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2ccncn2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582407411 1075953884 /nfs/dbraw/zinc/95/38/84/1075953884.db2.gz YZTNVDSLOUIBCM-INIZCTEOSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccncn2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582407412 1075953683 /nfs/dbraw/zinc/95/36/83/1075953683.db2.gz YZTNVDSLOUIBCM-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2ccncn2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582407412 1075953674 /nfs/dbraw/zinc/95/36/74/1075953674.db2.gz YZTNVDSLOUIBCM-MRXNPFEDSA-N -1 3 383.372 -1.008 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@@H]1COCCO1 ZINC001582407660 1075954154 /nfs/dbraw/zinc/95/41/54/1075954154.db2.gz IIQJIKRNVSQSDZ-BBRMVZONSA-N -1 3 375.389 -1.266 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@@H]1COCCO1 ZINC001582407660 1075954149 /nfs/dbraw/zinc/95/41/49/1075954149.db2.gz IIQJIKRNVSQSDZ-BBRMVZONSA-N -1 3 375.389 -1.266 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@H]1COCCO1 ZINC001582407661 1075954371 /nfs/dbraw/zinc/95/43/71/1075954371.db2.gz IIQJIKRNVSQSDZ-CJNGLKHVSA-N -1 3 375.389 -1.266 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@H]1COCCO1 ZINC001582407661 1075954368 /nfs/dbraw/zinc/95/43/68/1075954368.db2.gz IIQJIKRNVSQSDZ-CJNGLKHVSA-N -1 3 375.389 -1.266 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@H]1COCCO1 ZINC001582407662 1075954303 /nfs/dbraw/zinc/95/43/03/1075954303.db2.gz IIQJIKRNVSQSDZ-CZUORRHYSA-N -1 3 375.389 -1.266 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@H]1COCCO1 ZINC001582407662 1075954301 /nfs/dbraw/zinc/95/43/01/1075954301.db2.gz IIQJIKRNVSQSDZ-CZUORRHYSA-N -1 3 375.389 -1.266 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@@H]1COCCO1 ZINC001582407663 1075954171 /nfs/dbraw/zinc/95/41/71/1075954171.db2.gz IIQJIKRNVSQSDZ-XJKSGUPXSA-N -1 3 375.389 -1.266 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@@H]1COCCO1 ZINC001582407663 1075954164 /nfs/dbraw/zinc/95/41/64/1075954164.db2.gz IIQJIKRNVSQSDZ-XJKSGUPXSA-N -1 3 375.389 -1.266 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1)[C@@H]1COCCO1 ZINC001582408080 1075954244 /nfs/dbraw/zinc/95/42/44/1075954244.db2.gz CZOZAJOUYSJWJA-BLLLJJGKSA-N -1 3 375.389 -1.266 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1)[C@@H]1COCCO1 ZINC001582408080 1075954243 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ZINC001582414732 1075959978 /nfs/dbraw/zinc/95/99/78/1075959978.db2.gz SBFBHHSIVCBSBK-PBHICJAKSA-N -1 3 388.384 -1.356 20 0 GAADHM O=C(NC[C@@]12COCCN1C(=O)COC2)[C@H](O)c1ccc(-c2nnn[n-]2)cc1 ZINC001582414732 1075959973 /nfs/dbraw/zinc/95/99/73/1075959973.db2.gz SBFBHHSIVCBSBK-PBHICJAKSA-N -1 3 388.384 -1.356 20 0 GAADHM O=C(NC[C@]12COCCN1C(=O)COC2)[C@H](O)c1ccc(-c2nn[n-]n2)cc1 ZINC001582414733 1075960035 /nfs/dbraw/zinc/96/00/35/1075960035.db2.gz SBFBHHSIVCBSBK-RHSMWYFYSA-N -1 3 388.384 -1.356 20 0 GAADHM O=C(NC[C@]12COCCN1C(=O)COC2)[C@H](O)c1ccc(-c2nnn[n-]2)cc1 ZINC001582414733 1075960030 /nfs/dbraw/zinc/96/00/30/1075960030.db2.gz SBFBHHSIVCBSBK-RHSMWYFYSA-N -1 3 388.384 -1.356 20 0 GAADHM O=C(NC[C@]12COCCN1C(=O)COC2)[C@@H](O)c1ccc(-c2nn[n-]n2)cc1 ZINC001582414734 1075960019 /nfs/dbraw/zinc/96/00/19/1075960019.db2.gz SBFBHHSIVCBSBK-WMLDXEAASA-N -1 3 388.384 -1.356 20 0 GAADHM O=C(NC[C@]12COCCN1C(=O)COC2)[C@@H](O)c1ccc(-c2nnn[n-]2)cc1 ZINC001582414734 1075960014 /nfs/dbraw/zinc/96/00/14/1075960014.db2.gz SBFBHHSIVCBSBK-WMLDXEAASA-N -1 3 388.384 -1.356 20 0 GAADHM O=C(NC[C@@]12COCCN1C(=O)COC2)[C@@H](O)c1ccc(-c2nn[n-]n2)cc1 ZINC001582414735 1075960100 /nfs/dbraw/zinc/96/01/00/1075960100.db2.gz SBFBHHSIVCBSBK-YOEHRIQHSA-N -1 3 388.384 -1.356 20 0 GAADHM O=C(NC[C@@]12COCCN1C(=O)COC2)[C@@H](O)c1ccc(-c2nnn[n-]2)cc1 ZINC001582414735 1075960093 /nfs/dbraw/zinc/96/00/93/1075960093.db2.gz SBFBHHSIVCBSBK-YOEHRIQHSA-N -1 3 388.384 -1.356 20 0 GAADHM O=C(NCC1(O)CN(Cc2ncnn2CCF)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582414752 1075960005 /nfs/dbraw/zinc/96/00/05/1075960005.db2.gz STHGYDXEMNOUDR-UHFFFAOYSA-N -1 3 390.383 -1.268 20 0 GAADHM O=C(NCC1(O)CN(Cc2ncnn2CCF)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582414752 1075959999 /nfs/dbraw/zinc/95/99/99/1075959999.db2.gz STHGYDXEMNOUDR-UHFFFAOYSA-N -1 3 390.383 -1.268 20 0 GAADHM O=C(NCC1(O)CN(Cc2ccccc2-c2nn[n-]n2)C1)C1CS(=O)(=O)C1 ZINC001582414798 1075960083 /nfs/dbraw/zinc/96/00/83/1075960083.db2.gz VLNQIKQBOJDRSR-UHFFFAOYSA-N -1 3 392.441 -1.426 20 0 GAADHM O=C(NCC1(O)CN(Cc2ccccc2-c2nnn[n-]2)C1)C1CS(=O)(=O)C1 ZINC001582414798 1075960077 /nfs/dbraw/zinc/96/00/77/1075960077.db2.gz VLNQIKQBOJDRSR-UHFFFAOYSA-N -1 3 392.441 -1.426 20 0 GAADHM O=C(NCC1(O)CN(Cc2ncnn2CCF)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582414800 1075960118 /nfs/dbraw/zinc/96/01/18/1075960118.db2.gz VOPWPROFRWIDHX-UHFFFAOYSA-N -1 3 390.383 -1.268 20 0 GAADHM O=C(NCC1(O)CN(Cc2ncnn2CCF)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582414800 1075960112 /nfs/dbraw/zinc/96/01/12/1075960112.db2.gz VOPWPROFRWIDHX-UHFFFAOYSA-N -1 3 390.383 -1.268 20 0 GAADHM O=C(Cn1nccn1)N1C[C@@H]2[C@@H](CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H]2C1 ZINC001582414942 1075960068 /nfs/dbraw/zinc/96/00/68/1075960068.db2.gz AHXKJLSMXKUZFS-CNDDSTCGSA-N -1 3 382.388 -1.079 20 0 GAADHM O=C(Cn1nccn1)N1C[C@@H]2[C@@H](CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H]2C1 ZINC001582414942 1075960062 /nfs/dbraw/zinc/96/00/62/1075960062.db2.gz AHXKJLSMXKUZFS-CNDDSTCGSA-N -1 3 382.388 -1.079 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@@H]2[C@@H](CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H]2C1 ZINC001582415336 1075960132 /nfs/dbraw/zinc/96/01/32/1075960132.db2.gz IISZLNATNUNUSR-RTCCRHLQSA-N -1 3 383.376 -1.684 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@@H]2[C@@H](CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H]2C1 ZINC001582415336 1075960128 /nfs/dbraw/zinc/96/01/28/1075960128.db2.gz IISZLNATNUNUSR-RTCCRHLQSA-N -1 3 383.376 -1.684 20 0 GAADHM O=C(Cn1cnnn1)N1C[C@@H]2[C@@H](CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H]2C1 ZINC001582415725 1075960050 /nfs/dbraw/zinc/96/00/50/1075960050.db2.gz QDYWXIRGAPLWHX-RTCCRHLQSA-N -1 3 383.376 -1.684 20 0 GAADHM O=C(Cn1cnnn1)N1C[C@@H]2[C@@H](CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H]2C1 ZINC001582415725 1075960047 /nfs/dbraw/zinc/96/00/47/1075960047.db2.gz QDYWXIRGAPLWHX-RTCCRHLQSA-N -1 3 383.376 -1.684 20 0 GAADHM O=C(Cc1nnc[nH]1)N1C[C@@H]2[C@@H](CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H]2C1 ZINC001582415785 1075960308 /nfs/dbraw/zinc/96/03/08/1075960308.db2.gz RCZLZAZOACDZLQ-RTCCRHLQSA-N -1 3 382.388 -1.010 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@@H]2[C@@H](CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H]2C1 ZINC001582415825 1075960319 /nfs/dbraw/zinc/96/03/19/1075960319.db2.gz RTHYYCVVYJTDMD-OWUUHHOZSA-N -1 3 383.376 -1.684 20 0 GAADHM O=C(Cn1ncnn1)N1C[C@@H]2[C@@H](CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H]2C1 ZINC001582415825 1075960314 /nfs/dbraw/zinc/96/03/14/1075960314.db2.gz RTHYYCVVYJTDMD-OWUUHHOZSA-N -1 3 383.376 -1.684 20 0 GAADHM O=C(Cn1cncn1)N1C[C@@H]2[C@@H](CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H]2C1 ZINC001582415870 1075960374 /nfs/dbraw/zinc/96/03/74/1075960374.db2.gz SXCPYZPYWIHCSW-CNDDSTCGSA-N -1 3 382.388 -1.079 20 0 GAADHM O=C(Cn1cncn1)N1C[C@@H]2[C@@H](CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H]2C1 ZINC001582415870 1075960366 /nfs/dbraw/zinc/96/03/66/1075960366.db2.gz SXCPYZPYWIHCSW-CNDDSTCGSA-N -1 3 382.388 -1.079 20 0 GAADHM O=C(Cn1cnnn1)N1C[C@@H]2[C@@H](CNC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H]2C1 ZINC001582416095 1075960339 /nfs/dbraw/zinc/96/03/39/1075960339.db2.gz YLPQEECYBYCEFZ-RTCCRHLQSA-N -1 3 383.376 -1.684 20 0 GAADHM O=C(Cn1cnnn1)N1C[C@@H]2[C@@H](CNC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H]2C1 ZINC001582416095 1075960336 /nfs/dbraw/zinc/96/03/36/1075960336.db2.gz YLPQEECYBYCEFZ-RTCCRHLQSA-N -1 3 383.376 -1.684 20 0 GAADHM O=C(NCC1CC1)C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582425667 1075961022 /nfs/dbraw/zinc/96/10/22/1075961022.db2.gz ASDVPTHSROARQG-IWIIMEHWSA-N -1 3 384.400 -1.092 20 0 GAADHM O=C(NCC1CC1)C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582425667 1075961021 /nfs/dbraw/zinc/96/10/21/1075961021.db2.gz ASDVPTHSROARQG-IWIIMEHWSA-N -1 3 384.400 -1.092 20 0 GAADHM O=C(NCC1CC1)C(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O ZINC001582425710 1075960996 /nfs/dbraw/zinc/96/09/96/1075960996.db2.gz CCHMQHRODNODHP-VXGBXAGGSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(NCC1CC1)C(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O ZINC001582425710 1075960994 /nfs/dbraw/zinc/96/09/94/1075960994.db2.gz CCHMQHRODNODHP-VXGBXAGGSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(NCC1CC1)C(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O ZINC001582425809 1075961031 /nfs/dbraw/zinc/96/10/31/1075961031.db2.gz HAEVNZFGPWDHKE-GXTWGEPZSA-N -1 3 386.416 -1.156 20 0 GAADHM O=C(NCC1CC1)C(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O ZINC001582425809 1075961030 /nfs/dbraw/zinc/96/10/30/1075961030.db2.gz HAEVNZFGPWDHKE-GXTWGEPZSA-N -1 3 386.416 -1.156 20 0 GAADHM O=C(NCC1CC1)C(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001582425810 1075960981 /nfs/dbraw/zinc/96/09/81/1075960981.db2.gz HAEVNZFGPWDHKE-JSGCOSHPSA-N -1 3 386.416 -1.156 20 0 GAADHM O=C(NCC1CC1)C(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001582425810 1075960979 /nfs/dbraw/zinc/96/09/79/1075960979.db2.gz HAEVNZFGPWDHKE-JSGCOSHPSA-N -1 3 386.416 -1.156 20 0 GAADHM O=C(NCC1CC1)C(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001582425811 1075961001 /nfs/dbraw/zinc/96/10/01/1075961001.db2.gz HAEVNZFGPWDHKE-OCCSQVGLSA-N -1 3 386.416 -1.156 20 0 GAADHM O=C(NCC1CC1)C(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001582425811 1075960999 /nfs/dbraw/zinc/96/09/99/1075960999.db2.gz HAEVNZFGPWDHKE-OCCSQVGLSA-N -1 3 386.416 -1.156 20 0 GAADHM O=C(NCC1CC1)C(=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O ZINC001582425812 1075961064 /nfs/dbraw/zinc/96/10/64/1075961064.db2.gz HAEVNZFGPWDHKE-TZMCWYRMSA-N -1 3 386.416 -1.156 20 0 GAADHM O=C(NCC1CC1)C(=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O ZINC001582425812 1075961061 /nfs/dbraw/zinc/96/10/61/1075961061.db2.gz HAEVNZFGPWDHKE-TZMCWYRMSA-N -1 3 386.416 -1.156 20 0 GAADHM O=C(NCC1CC1)C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582425942 1075961048 /nfs/dbraw/zinc/96/10/48/1075961048.db2.gz LIENWZOVESHRSF-UHFFFAOYSA-N -1 3 388.388 -1.976 20 0 GAADHM O=C(NCC1CC1)C(=O)NCC1(O)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582425942 1075961046 /nfs/dbraw/zinc/96/10/46/1075961046.db2.gz LIENWZOVESHRSF-UHFFFAOYSA-N -1 3 388.388 -1.976 20 0 GAADHM O=C(NCC1CC1)C(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001582425945 1075961028 /nfs/dbraw/zinc/96/10/28/1075961028.db2.gz LRXVLOBNJUPPPE-NEPJUHHUSA-N -1 3 390.379 -1.407 20 0 GAADHM O=C(NCC1CC1)C(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001582425945 1075961027 /nfs/dbraw/zinc/96/10/27/1075961027.db2.gz LRXVLOBNJUPPPE-NEPJUHHUSA-N -1 3 390.379 -1.407 20 0 GAADHM O=C(NCC1CC1)C(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582425994 1075961004 /nfs/dbraw/zinc/96/10/04/1075961004.db2.gz OGQZWQWOAFEJJS-VXGBXAGGSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(NCC1CC1)C(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582425994 1075961003 /nfs/dbraw/zinc/96/10/03/1075961003.db2.gz OGQZWQWOAFEJJS-VXGBXAGGSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(NCC1CC1)C(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O ZINC001582426060 1075961042 /nfs/dbraw/zinc/96/10/42/1075961042.db2.gz QSDMTYYBQSYOHH-VXGBXAGGSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(NCC1CC1)C(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O ZINC001582426060 1075961040 /nfs/dbraw/zinc/96/10/40/1075961040.db2.gz QSDMTYYBQSYOHH-VXGBXAGGSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ncc(-c2nn[n-]n2)cc1F)C(=O)NCC1CC1 ZINC001582426080 1075960986 /nfs/dbraw/zinc/96/09/86/1075960986.db2.gz ROCRXXMDWSGSLX-JTQLQIEISA-N -1 3 378.368 -1.184 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ncc(-c2nnn[n-]2)cc1F)C(=O)NCC1CC1 ZINC001582426080 1075960985 /nfs/dbraw/zinc/96/09/85/1075960985.db2.gz ROCRXXMDWSGSLX-JTQLQIEISA-N -1 3 378.368 -1.184 20 0 GAADHM O=C(NC[C@H](CO)Nc1ncc(-c2nn[n-]n2)cc1F)C(=O)NCC1CC1 ZINC001582426081 1075961016 /nfs/dbraw/zinc/96/10/16/1075961016.db2.gz ROCRXXMDWSGSLX-SNVBAGLBSA-N -1 3 378.368 -1.184 20 0 GAADHM O=C(NC[C@H](CO)Nc1ncc(-c2nnn[n-]2)cc1F)C(=O)NCC1CC1 ZINC001582426081 1075961015 /nfs/dbraw/zinc/96/10/15/1075961015.db2.gz ROCRXXMDWSGSLX-SNVBAGLBSA-N -1 3 378.368 -1.184 20 0 GAADHM O=C(Cn1cnnn1)N1CCCC[C@@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582430467 1075961447 /nfs/dbraw/zinc/96/14/47/1075961447.db2.gz GSKJHATXVASEGG-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCCC[C@@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582430467 1075961443 /nfs/dbraw/zinc/96/14/43/1075961443.db2.gz GSKJHATXVASEGG-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCCC[C@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582430468 1075961609 /nfs/dbraw/zinc/96/16/09/1075961609.db2.gz GSKJHATXVASEGG-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCCC[C@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582430468 1075961606 /nfs/dbraw/zinc/96/16/06/1075961606.db2.gz GSKJHATXVASEGG-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCCC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582430655 1075961741 /nfs/dbraw/zinc/96/17/41/1075961741.db2.gz KJTCACHQYHLDQV-JTQLQIEISA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCCC[C@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582430655 1075961736 /nfs/dbraw/zinc/96/17/36/1075961736.db2.gz KJTCACHQYHLDQV-JTQLQIEISA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCCC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582430656 1075961706 /nfs/dbraw/zinc/96/17/06/1075961706.db2.gz KJTCACHQYHLDQV-SNVBAGLBSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCCC[C@@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582430656 1075961702 /nfs/dbraw/zinc/96/17/02/1075961702.db2.gz KJTCACHQYHLDQV-SNVBAGLBSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCCC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582430711 1075961650 /nfs/dbraw/zinc/96/16/50/1075961650.db2.gz LRSULFSNBMIMOZ-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCCC[C@@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582430711 1075961642 /nfs/dbraw/zinc/96/16/42/1075961642.db2.gz LRSULFSNBMIMOZ-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCCC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582430712 1075961681 /nfs/dbraw/zinc/96/16/81/1075961681.db2.gz LRSULFSNBMIMOZ-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCCC[C@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582430712 1075961678 /nfs/dbraw/zinc/96/16/78/1075961678.db2.gz LRSULFSNBMIMOZ-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCCC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582431383 1075961671 /nfs/dbraw/zinc/96/16/71/1075961671.db2.gz VGYCJIWLXOXYNT-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCCC[C@@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582431383 1075961668 /nfs/dbraw/zinc/96/16/68/1075961668.db2.gz VGYCJIWLXOXYNT-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCCC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582431384 1075961494 /nfs/dbraw/zinc/96/14/94/1075961494.db2.gz VGYCJIWLXOXYNT-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N1CCCC[C@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582431384 1075961489 /nfs/dbraw/zinc/96/14/89/1075961489.db2.gz VGYCJIWLXOXYNT-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCCC[C@@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582431713 1075961560 /nfs/dbraw/zinc/96/15/60/1075961560.db2.gz YKQQBTHQHXQGBS-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCCC[C@@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582431713 1075961553 /nfs/dbraw/zinc/96/15/53/1075961553.db2.gz YKQQBTHQHXQGBS-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCCC[C@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582431714 1075961662 /nfs/dbraw/zinc/96/16/62/1075961662.db2.gz YKQQBTHQHXQGBS-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCCC[C@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582431714 1075961660 /nfs/dbraw/zinc/96/16/60/1075961660.db2.gz YKQQBTHQHXQGBS-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582435507 1075961728 /nfs/dbraw/zinc/96/17/28/1075961728.db2.gz CPEXEFNIRCUWBZ-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@@H](CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582435507 1075961724 /nfs/dbraw/zinc/96/17/24/1075961724.db2.gz CPEXEFNIRCUWBZ-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582435508 1075961469 /nfs/dbraw/zinc/96/14/69/1075961469.db2.gz CPEXEFNIRCUWBZ-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@H](CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582435508 1075961465 /nfs/dbraw/zinc/96/14/65/1075961465.db2.gz CPEXEFNIRCUWBZ-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582436413 1075961519 /nfs/dbraw/zinc/96/15/19/1075961519.db2.gz JNXRORBZGUYYLE-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582436413 1075961511 /nfs/dbraw/zinc/96/15/11/1075961511.db2.gz JNXRORBZGUYYLE-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582436415 1075961541 /nfs/dbraw/zinc/96/15/41/1075961541.db2.gz JNXRORBZGUYYLE-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CCC[C@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582436415 1075961534 /nfs/dbraw/zinc/96/15/34/1075961534.db2.gz JNXRORBZGUYYLE-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582436799 1075961693 /nfs/dbraw/zinc/96/16/93/1075961693.db2.gz MQPGGHVRISBDHC-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@@H](CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582436799 1075961688 /nfs/dbraw/zinc/96/16/88/1075961688.db2.gz MQPGGHVRISBDHC-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582436800 1075961581 /nfs/dbraw/zinc/96/15/81/1075961581.db2.gz MQPGGHVRISBDHC-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@H](CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582436800 1075961574 /nfs/dbraw/zinc/96/15/74/1075961574.db2.gz MQPGGHVRISBDHC-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582437531 1075961596 /nfs/dbraw/zinc/96/15/96/1075961596.db2.gz SPCMJBLODPOENT-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582437531 1075961592 /nfs/dbraw/zinc/96/15/92/1075961592.db2.gz SPCMJBLODPOENT-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582437532 1075961716 /nfs/dbraw/zinc/96/17/16/1075961716.db2.gz SPCMJBLODPOENT-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CCC[C@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582437532 1075961713 /nfs/dbraw/zinc/96/17/13/1075961713.db2.gz SPCMJBLODPOENT-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582439167 1075961973 /nfs/dbraw/zinc/96/19/73/1075961973.db2.gz AHASXWPNEMGLRD-JTQLQIEISA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582439167 1075961970 /nfs/dbraw/zinc/96/19/70/1075961970.db2.gz AHASXWPNEMGLRD-JTQLQIEISA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582439168 1075962075 /nfs/dbraw/zinc/96/20/75/1075962075.db2.gz AHASXWPNEMGLRD-SNVBAGLBSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582439168 1075962068 /nfs/dbraw/zinc/96/20/68/1075962068.db2.gz AHASXWPNEMGLRD-SNVBAGLBSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582439191 1075962053 /nfs/dbraw/zinc/96/20/53/1075962053.db2.gz AYYHTUBFFSEXBF-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582439191 1075962045 /nfs/dbraw/zinc/96/20/45/1075962045.db2.gz AYYHTUBFFSEXBF-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582439192 1075962200 /nfs/dbraw/zinc/96/22/00/1075962200.db2.gz AYYHTUBFFSEXBF-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582439192 1075962196 /nfs/dbraw/zinc/96/21/96/1075962196.db2.gz AYYHTUBFFSEXBF-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582439295 1075961962 /nfs/dbraw/zinc/96/19/62/1075961962.db2.gz DZDLSFWHBLJEOV-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582439295 1075961958 /nfs/dbraw/zinc/96/19/58/1075961958.db2.gz DZDLSFWHBLJEOV-LLVKDONJSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582439296 1075962226 /nfs/dbraw/zinc/96/22/26/1075962226.db2.gz DZDLSFWHBLJEOV-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CCn1cnnn1)N1CCC[C@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582439296 1075962220 /nfs/dbraw/zinc/96/22/20/1075962220.db2.gz DZDLSFWHBLJEOV-NSHDSACASA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(CN1CN=NC1=O)N1CCC[C@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582439497 1075962016 /nfs/dbraw/zinc/96/20/16/1075962016.db2.gz JLNVRQQLBXPHBY-JTQLQIEISA-N -1 3 386.376 -1.087 20 0 GAADHM O=C(CN1CN=NC1=O)N1CCC[C@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582439497 1075962011 /nfs/dbraw/zinc/96/20/11/1075962011.db2.gz JLNVRQQLBXPHBY-JTQLQIEISA-N -1 3 386.376 -1.087 20 0 GAADHM O=C(CN1CN=NC1=O)N1CCC[C@@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582439498 1075962210 /nfs/dbraw/zinc/96/22/10/1075962210.db2.gz JLNVRQQLBXPHBY-SNVBAGLBSA-N -1 3 386.376 -1.087 20 0 GAADHM O=C(CN1CN=NC1=O)N1CCC[C@@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582439498 1075962206 /nfs/dbraw/zinc/96/22/06/1075962206.db2.gz JLNVRQQLBXPHBY-SNVBAGLBSA-N -1 3 386.376 -1.087 20 0 GAADHM O=C(CN1CN=NC1=O)N1CCC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582439611 1075962143 /nfs/dbraw/zinc/96/21/43/1075962143.db2.gz LUFRPLAMUJMOMK-JTQLQIEISA-N -1 3 386.376 -1.087 20 0 GAADHM O=C(CN1CN=NC1=O)N1CCC[C@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582439611 1075962138 /nfs/dbraw/zinc/96/21/38/1075962138.db2.gz LUFRPLAMUJMOMK-JTQLQIEISA-N -1 3 386.376 -1.087 20 0 GAADHM O=C(CN1CN=NC1=O)N1CCC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582439612 1075962162 /nfs/dbraw/zinc/96/21/62/1075962162.db2.gz LUFRPLAMUJMOMK-SNVBAGLBSA-N -1 3 386.376 -1.087 20 0 GAADHM O=C(CN1CN=NC1=O)N1CCC[C@@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582439612 1075962154 /nfs/dbraw/zinc/96/21/54/1075962154.db2.gz LUFRPLAMUJMOMK-SNVBAGLBSA-N -1 3 386.376 -1.087 20 0 GAADHM O=C(CN1CN=NC1=O)N1CCC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582440602 1075962185 /nfs/dbraw/zinc/96/21/85/1075962185.db2.gz ZHQLROLXCCMCBM-SECBINFHSA-N -1 3 386.376 -1.087 20 0 GAADHM O=C(CN1CN=NC1=O)N1CCC[C@@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582440602 1075962176 /nfs/dbraw/zinc/96/21/76/1075962176.db2.gz ZHQLROLXCCMCBM-SECBINFHSA-N -1 3 386.376 -1.087 20 0 GAADHM O=C(CN1CN=NC1=O)N1CCC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582440605 1075962260 /nfs/dbraw/zinc/96/22/60/1075962260.db2.gz ZHQLROLXCCMCBM-VIFPVBQESA-N -1 3 386.376 -1.087 20 0 GAADHM O=C(CN1CN=NC1=O)N1CCC[C@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582440605 1075962256 /nfs/dbraw/zinc/96/22/56/1075962256.db2.gz ZHQLROLXCCMCBM-VIFPVBQESA-N -1 3 386.376 -1.087 20 0 GAADHM O=C(CCn1cnnn1)N1CC[C@@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582451192 1075962736 /nfs/dbraw/zinc/96/27/36/1075962736.db2.gz CXFDQRNGHAKYDX-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(CCn1cnnn1)N1CC[C@@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582451192 1075962731 /nfs/dbraw/zinc/96/27/31/1075962731.db2.gz CXFDQRNGHAKYDX-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(CCn1cnnn1)N1CC[C@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582451193 1075962528 /nfs/dbraw/zinc/96/25/28/1075962528.db2.gz CXFDQRNGHAKYDX-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(CCn1cnnn1)N1CC[C@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582451193 1075962526 /nfs/dbraw/zinc/96/25/26/1075962526.db2.gz CXFDQRNGHAKYDX-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CCC(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001582451270 1075962535 /nfs/dbraw/zinc/96/25/35/1075962535.db2.gz FPIQCKYYGCVYMD-UHFFFAOYSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CCC(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001582451270 1075962532 /nfs/dbraw/zinc/96/25/32/1075962532.db2.gz FPIQCKYYGCVYMD-UHFFFAOYSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CCC(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001582451278 1075962622 /nfs/dbraw/zinc/96/26/22/1075962622.db2.gz FSFHEATVNMWEAR-UHFFFAOYSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CCC(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001582451278 1075962618 /nfs/dbraw/zinc/96/26/18/1075962618.db2.gz FSFHEATVNMWEAR-UHFFFAOYSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CCC(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001582451281 1075962592 /nfs/dbraw/zinc/96/25/92/1075962592.db2.gz FVXDHPJWFYZEJN-UHFFFAOYSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CCC(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001582451281 1075962590 /nfs/dbraw/zinc/96/25/90/1075962590.db2.gz FVXDHPJWFYZEJN-UHFFFAOYSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CCC(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001582451439 1075962603 /nfs/dbraw/zinc/96/26/03/1075962603.db2.gz HQUFKJQZQKRGGM-UHFFFAOYSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CCC(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001582451439 1075962599 /nfs/dbraw/zinc/96/25/99/1075962599.db2.gz HQUFKJQZQKRGGM-UHFFFAOYSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(CCn1cnnn1)N1CC[C@@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582451856 1075962644 /nfs/dbraw/zinc/96/26/44/1075962644.db2.gz MWOGJHQTNZZWQT-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(CCn1cnnn1)N1CC[C@@H](CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582451856 1075962639 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392.445 -1.104 20 0 GAADHM O=C(NC[C@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001582456589 1075962683 /nfs/dbraw/zinc/96/26/83/1075962683.db2.gz JTESELCONFBHMV-ZYHUDNBSSA-N -1 3 392.445 -1.104 20 0 GAADHM O=C(NC[C@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001582456589 1075962677 /nfs/dbraw/zinc/96/26/77/1075962677.db2.gz JTESELCONFBHMV-ZYHUDNBSSA-N -1 3 392.445 -1.104 20 0 GAADHM O=C(NC[C@@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001582459697 1075962571 /nfs/dbraw/zinc/96/25/71/1075962571.db2.gz NVINDOKGXBYYFB-GWCFXTLKSA-N -1 3 392.445 -1.104 20 0 GAADHM O=C(NC[C@@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001582459697 1075962567 /nfs/dbraw/zinc/96/25/67/1075962567.db2.gz NVINDOKGXBYYFB-GWCFXTLKSA-N -1 3 392.445 -1.104 20 0 GAADHM O=C(NC[C@@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001582459698 1075962580 /nfs/dbraw/zinc/96/25/80/1075962580.db2.gz NVINDOKGXBYYFB-GXFFZTMASA-N -1 3 392.445 -1.104 20 0 GAADHM O=C(NC[C@@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001582459698 1075962579 /nfs/dbraw/zinc/96/25/79/1075962579.db2.gz NVINDOKGXBYYFB-GXFFZTMASA-N -1 3 392.445 -1.104 20 0 GAADHM O=C(NC[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001582459699 1075962546 /nfs/dbraw/zinc/96/25/46/1075962546.db2.gz NVINDOKGXBYYFB-MFKMUULPSA-N -1 3 392.445 -1.104 20 0 GAADHM O=C(NC[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001582459699 1075962545 /nfs/dbraw/zinc/96/25/45/1075962545.db2.gz NVINDOKGXBYYFB-MFKMUULPSA-N -1 3 392.445 -1.104 20 0 GAADHM O=C(NC[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001582459700 1075963227 /nfs/dbraw/zinc/96/32/27/1075963227.db2.gz NVINDOKGXBYYFB-ZWNOBZJWSA-N -1 3 392.445 -1.104 20 0 GAADHM O=C(NC[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001582459700 1075963225 /nfs/dbraw/zinc/96/32/25/1075963225.db2.gz NVINDOKGXBYYFB-ZWNOBZJWSA-N -1 3 392.445 -1.104 20 0 GAADHM O=C(CN1CCOCC1=O)N1CC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582465118 1075963175 /nfs/dbraw/zinc/96/31/75/1075963175.db2.gz DKUIUGDZQSZRBL-LLVKDONJSA-N -1 3 388.388 -1.616 20 0 GAADHM O=C(CN1CCOCC1=O)N1CC[C@@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582465118 1075963172 /nfs/dbraw/zinc/96/31/72/1075963172.db2.gz DKUIUGDZQSZRBL-LLVKDONJSA-N -1 3 388.388 -1.616 20 0 GAADHM O=C(CN1CCOCC1=O)N1CC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582465120 1075963205 /nfs/dbraw/zinc/96/32/05/1075963205.db2.gz DKUIUGDZQSZRBL-NSHDSACASA-N -1 3 388.388 -1.616 20 0 GAADHM O=C(CN1CCOCC1=O)N1CC[C@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582465120 1075963204 /nfs/dbraw/zinc/96/32/04/1075963204.db2.gz DKUIUGDZQSZRBL-NSHDSACASA-N -1 3 388.388 -1.616 20 0 GAADHM O=C(CN1CCCNC1=O)N1CC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582465127 1075963101 /nfs/dbraw/zinc/96/31/01/1075963101.db2.gz DMNVWHSAIWFFMS-LLVKDONJSA-N -1 3 387.404 -1.059 20 0 GAADHM O=C(CN1CCCNC1=O)N1CC[C@@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582465127 1075963099 /nfs/dbraw/zinc/96/30/99/1075963099.db2.gz DMNVWHSAIWFFMS-LLVKDONJSA-N -1 3 387.404 -1.059 20 0 GAADHM O=C(CN1CCCNC1=O)N1CC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582465129 1075963221 /nfs/dbraw/zinc/96/32/21/1075963221.db2.gz DMNVWHSAIWFFMS-NSHDSACASA-N -1 3 387.404 -1.059 20 0 GAADHM O=C(CN1CCCNC1=O)N1CC[C@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582465129 1075963220 /nfs/dbraw/zinc/96/32/20/1075963220.db2.gz DMNVWHSAIWFFMS-NSHDSACASA-N -1 3 387.404 -1.059 20 0 GAADHM O=C(NC[C@@H]1CCN1C(=O)C1CS(=O)(=O)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582465612 1075963006 /nfs/dbraw/zinc/96/30/06/1075963006.db2.gz MFKRFORVGQZSRN-JTQLQIEISA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC[C@@H]1CCN1C(=O)C1CS(=O)(=O)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582465612 1075963000 /nfs/dbraw/zinc/96/30/00/1075963000.db2.gz MFKRFORVGQZSRN-JTQLQIEISA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC[C@H]1CCN1C(=O)C1CS(=O)(=O)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582465613 1075963201 /nfs/dbraw/zinc/96/32/01/1075963201.db2.gz MFKRFORVGQZSRN-SNVBAGLBSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC[C@H]1CCN1C(=O)C1CS(=O)(=O)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582465613 1075963199 /nfs/dbraw/zinc/96/31/99/1075963199.db2.gz MFKRFORVGQZSRN-SNVBAGLBSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC[C@@H]1CCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1)C1CS(=O)(=O)C1 ZINC001582465831 1075963078 /nfs/dbraw/zinc/96/30/78/1075963078.db2.gz CVRCHFSLSNUUNT-JTQLQIEISA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC[C@@H]1CCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1)C1CS(=O)(=O)C1 ZINC001582465831 1075963073 /nfs/dbraw/zinc/96/30/73/1075963073.db2.gz CVRCHFSLSNUUNT-JTQLQIEISA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC[C@H]1CCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1)C1CS(=O)(=O)C1 ZINC001582465832 1075963040 /nfs/dbraw/zinc/96/30/40/1075963040.db2.gz CVRCHFSLSNUUNT-SNVBAGLBSA-N -1 3 379.402 -1.430 20 0 GAADHM O=C(NC[C@H]1CCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1)C1CS(=O)(=O)C1 ZINC001582465832 1075963034 /nfs/dbraw/zinc/96/30/34/1075963034.db2.gz 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GAADHM O=C(CN1CCOCC1=O)N1CC[C@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582466459 1075963054 /nfs/dbraw/zinc/96/30/54/1075963054.db2.gz UBCQIDFHLCXROP-JTQLQIEISA-N -1 3 388.388 -1.616 20 0 GAADHM O=C(CN1CCOCC1=O)N1CC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582466460 1075963189 /nfs/dbraw/zinc/96/31/89/1075963189.db2.gz UBCQIDFHLCXROP-SNVBAGLBSA-N -1 3 388.388 -1.616 20 0 GAADHM O=C(CN1CCOCC1=O)N1CC[C@@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582466460 1075963186 /nfs/dbraw/zinc/96/31/86/1075963186.db2.gz UBCQIDFHLCXROP-SNVBAGLBSA-N -1 3 388.388 -1.616 20 0 GAADHM O=C(CN1CCCNC1=O)N1CC[C@@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582466605 1075963216 /nfs/dbraw/zinc/96/32/16/1075963216.db2.gz VGXSQBUVDVBTQT-LLVKDONJSA-N -1 3 387.404 -1.059 20 0 GAADHM O=C(CN1CCCNC1=O)N1CC[C@@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582466605 1075963214 /nfs/dbraw/zinc/96/32/14/1075963214.db2.gz VGXSQBUVDVBTQT-LLVKDONJSA-N -1 3 387.404 -1.059 20 0 GAADHM 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ZINC001582488591 1075967884 /nfs/dbraw/zinc/96/78/84/1075967884.db2.gz VQDVGQXJPCABJL-NSHDSACASA-N -1 3 383.372 -1.020 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ccc(-c2nnn[n-]2)nc1)c1c[nH]c(=O)cn1 ZINC001582488591 1075967878 /nfs/dbraw/zinc/96/78/78/1075967878.db2.gz VQDVGQXJPCABJL-NSHDSACASA-N -1 3 383.372 -1.020 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ccc(-c2nn[n-]n2)nc1)[C@H]1COCCO1 ZINC001582488848 1075967760 /nfs/dbraw/zinc/96/77/60/1075967760.db2.gz YKEXYNUBZMHVQP-GXTWGEPZSA-N -1 3 375.389 -1.002 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ccc(-c2nnn[n-]2)nc1)[C@H]1COCCO1 ZINC001582488848 1075967756 /nfs/dbraw/zinc/96/77/56/1075967756.db2.gz YKEXYNUBZMHVQP-GXTWGEPZSA-N -1 3 375.389 -1.002 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ccc(-c2nn[n-]n2)nc1)[C@@H]1COCCO1 ZINC001582488849 1075967747 /nfs/dbraw/zinc/96/77/47/1075967747.db2.gz YKEXYNUBZMHVQP-JSGCOSHPSA-N -1 3 375.389 -1.002 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ccc(-c2nnn[n-]2)nc1)[C@@H]1COCCO1 ZINC001582488849 1075967742 /nfs/dbraw/zinc/96/77/42/1075967742.db2.gz YKEXYNUBZMHVQP-JSGCOSHPSA-N -1 3 375.389 -1.002 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ccc(-c2nn[n-]n2)nc1)[C@@H]1COCCO1 ZINC001582488850 1075967867 /nfs/dbraw/zinc/96/78/67/1075967867.db2.gz YKEXYNUBZMHVQP-OCCSQVGLSA-N -1 3 375.389 -1.002 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ccc(-c2nnn[n-]2)nc1)[C@@H]1COCCO1 ZINC001582488850 1075967861 /nfs/dbraw/zinc/96/78/61/1075967861.db2.gz YKEXYNUBZMHVQP-OCCSQVGLSA-N -1 3 375.389 -1.002 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ccc(-c2nn[n-]n2)nc1)[C@H]1COCCO1 ZINC001582488851 1075967849 /nfs/dbraw/zinc/96/78/49/1075967849.db2.gz YKEXYNUBZMHVQP-TZMCWYRMSA-N -1 3 375.389 -1.002 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ccc(-c2nnn[n-]2)nc1)[C@H]1COCCO1 ZINC001582488851 1075967845 /nfs/dbraw/zinc/96/78/45/1075967845.db2.gz YKEXYNUBZMHVQP-TZMCWYRMSA-N -1 3 375.389 -1.002 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ncccc1-c1nn[n-]n1)[C@@H]1COCCO1 ZINC001582489068 1075967681 /nfs/dbraw/zinc/96/76/81/1075967681.db2.gz DXXOMEJMVQVCCN-AAEUAGOBSA-N -1 3 375.389 -1.002 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ncccc1-c1nnn[n-]1)[C@@H]1COCCO1 ZINC001582489068 1075967679 /nfs/dbraw/zinc/96/76/79/1075967679.db2.gz DXXOMEJMVQVCCN-AAEUAGOBSA-N -1 3 375.389 -1.002 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ncccc1-c1nn[n-]n1)[C@H]1COCCO1 ZINC001582489069 1075967723 /nfs/dbraw/zinc/96/77/23/1075967723.db2.gz DXXOMEJMVQVCCN-DGCLKSJQSA-N -1 3 375.389 -1.002 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ncccc1-c1nnn[n-]1)[C@H]1COCCO1 ZINC001582489069 1075967719 /nfs/dbraw/zinc/96/77/19/1075967719.db2.gz DXXOMEJMVQVCCN-DGCLKSJQSA-N -1 3 375.389 -1.002 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ncccc1-c1nn[n-]n1)[C@H]1COCCO1 ZINC001582489070 1075967911 /nfs/dbraw/zinc/96/79/11/1075967911.db2.gz DXXOMEJMVQVCCN-WCQYABFASA-N -1 3 375.389 -1.002 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ncccc1-c1nnn[n-]1)[C@H]1COCCO1 ZINC001582489070 1075967906 /nfs/dbraw/zinc/96/79/06/1075967906.db2.gz DXXOMEJMVQVCCN-WCQYABFASA-N -1 3 375.389 -1.002 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ncccc1-c1nn[n-]n1)[C@@H]1COCCO1 ZINC001582489071 1075967710 /nfs/dbraw/zinc/96/77/10/1075967710.db2.gz DXXOMEJMVQVCCN-YPMHNXCESA-N -1 3 375.389 -1.002 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ncccc1-c1nnn[n-]1)[C@@H]1COCCO1 ZINC001582489071 1075967706 /nfs/dbraw/zinc/96/77/06/1075967706.db2.gz DXXOMEJMVQVCCN-YPMHNXCESA-N -1 3 375.389 -1.002 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ncccc1-c1nn[n-]n1)c1c[nH]c(=O)cn1 ZINC001582490231 1075968777 /nfs/dbraw/zinc/96/87/77/1075968777.db2.gz HSRHVBLTHSTYLS-JTQLQIEISA-N -1 3 383.372 -1.020 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ncccc1-c1nnn[n-]1)c1c[nH]c(=O)cn1 ZINC001582490231 1075968774 /nfs/dbraw/zinc/96/87/74/1075968774.db2.gz HSRHVBLTHSTYLS-JTQLQIEISA-N -1 3 383.372 -1.020 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ncccc1-c1nn[n-]n1)c1c[nH]c(=O)cn1 ZINC001582490232 1075968631 /nfs/dbraw/zinc/96/86/31/1075968631.db2.gz HSRHVBLTHSTYLS-SNVBAGLBSA-N -1 3 383.372 -1.020 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ncccc1-c1nnn[n-]1)c1c[nH]c(=O)cn1 ZINC001582490232 1075968627 /nfs/dbraw/zinc/96/86/27/1075968627.db2.gz HSRHVBLTHSTYLS-SNVBAGLBSA-N -1 3 383.372 -1.020 20 0 GAADHM O=C(NC/C=C/CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)C(=O)NCC(F)F ZINC001582491409 1075968701 /nfs/dbraw/zinc/96/87/01/1075968701.db2.gz LPBCLHNDVBJGJJ-OWOJBTEDSA-N -1 3 382.331 -1.022 20 0 GAADHM O=C(NC/C=C/CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)C(=O)NCC(F)F ZINC001582491409 1075968697 /nfs/dbraw/zinc/96/86/97/1075968697.db2.gz LPBCLHNDVBJGJJ-OWOJBTEDSA-N -1 3 382.331 -1.022 20 0 GAADHM O=C(NC/C=C\CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)C(=O)NCC(F)F ZINC001582491410 1075968715 /nfs/dbraw/zinc/96/87/15/1075968715.db2.gz LPBCLHNDVBJGJJ-UPHRSURJSA-N -1 3 382.331 -1.022 20 0 GAADHM O=C(NC/C=C\CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)C(=O)NCC(F)F ZINC001582491410 1075968711 /nfs/dbraw/zinc/96/87/11/1075968711.db2.gz LPBCLHNDVBJGJJ-UPHRSURJSA-N -1 3 382.331 -1.022 20 0 GAADHM O=C(NCC=CCNC(=O)C1CS(=O)(=O)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582491471 1075969060 /nfs/dbraw/zinc/96/90/60/1075969060.db2.gz MMLILADQIKULGU-OWOJBTEDSA-N -1 3 379.402 -1.358 20 0 GAADHM O=C(NCC=CCNC(=O)C1CS(=O)(=O)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582491471 1075969058 /nfs/dbraw/zinc/96/90/58/1075969058.db2.gz MMLILADQIKULGU-OWOJBTEDSA-N -1 3 379.402 -1.358 20 0 GAADHM O=C(NCC=CCNC(=O)C1CS(=O)(=O)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582491472 1075969101 /nfs/dbraw/zinc/96/91/01/1075969101.db2.gz MMLILADQIKULGU-UPHRSURJSA-N -1 3 379.402 -1.358 20 0 GAADHM O=C(NCC=CCNC(=O)C1CS(=O)(=O)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582491472 1075969096 /nfs/dbraw/zinc/96/90/96/1075969096.db2.gz MMLILADQIKULGU-UPHRSURJSA-N -1 3 379.402 -1.358 20 0 GAADHM O=C(Cn1cnnn1)N1CC[C@H](CCNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582497700 1075969125 /nfs/dbraw/zinc/96/91/25/1075969125.db2.gz HNWOMHQSDALZCR-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CC[C@H](CCNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582497700 1075969123 /nfs/dbraw/zinc/96/91/23/1075969123.db2.gz HNWOMHQSDALZCR-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CC[C@@H](CCNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582497701 1075969117 /nfs/dbraw/zinc/96/91/17/1075969117.db2.gz HNWOMHQSDALZCR-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CC[C@@H](CCNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582497701 1075969113 /nfs/dbraw/zinc/96/91/13/1075969113.db2.gz HNWOMHQSDALZCR-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CC[C@H](CCNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582498868 1075969234 /nfs/dbraw/zinc/96/92/34/1075969234.db2.gz UYLFEHMCQOXOAF-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CC[C@H](CCNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582498868 1075969230 /nfs/dbraw/zinc/96/92/30/1075969230.db2.gz UYLFEHMCQOXOAF-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CC[C@@H](CCNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582498870 1075969170 /nfs/dbraw/zinc/96/91/70/1075969170.db2.gz UYLFEHMCQOXOAF-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CC[C@@H](CCNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582498870 1075969165 /nfs/dbraw/zinc/96/91/65/1075969165.db2.gz UYLFEHMCQOXOAF-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CC[C@H](CCNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582498889 1075969051 /nfs/dbraw/zinc/96/90/51/1075969051.db2.gz VHDWBEKDFRHYBL-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CC[C@H](CCNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582498889 1075969046 /nfs/dbraw/zinc/96/90/46/1075969046.db2.gz VHDWBEKDFRHYBL-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CC[C@@H](CCNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582498890 1075969081 /nfs/dbraw/zinc/96/90/81/1075969081.db2.gz VHDWBEKDFRHYBL-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CC[C@@H](CCNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582498890 1075969076 /nfs/dbraw/zinc/96/90/76/1075969076.db2.gz VHDWBEKDFRHYBL-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CC[C@H](CCNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582498952 1075969264 /nfs/dbraw/zinc/96/92/64/1075969264.db2.gz VZYRHSQPYGQFIK-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CC[C@H](CCNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582498952 1075969259 /nfs/dbraw/zinc/96/92/59/1075969259.db2.gz VZYRHSQPYGQFIK-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CC[C@@H](CCNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582498953 1075969024 /nfs/dbraw/zinc/96/90/24/1075969024.db2.gz VZYRHSQPYGQFIK-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1ncnn1)N1CC[C@@H](CCNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582498953 1075969023 /nfs/dbraw/zinc/96/90/23/1075969023.db2.gz VZYRHSQPYGQFIK-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CC[C@H](CCNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582499217 1075969152 /nfs/dbraw/zinc/96/91/52/1075969152.db2.gz ZGNFPDUAZSNCDS-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CC[C@H](CCNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582499217 1075969146 /nfs/dbraw/zinc/96/91/46/1075969146.db2.gz ZGNFPDUAZSNCDS-JTQLQIEISA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CC[C@@H](CCNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582499218 1075969038 /nfs/dbraw/zinc/96/90/38/1075969038.db2.gz ZGNFPDUAZSNCDS-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(Cn1cnnn1)N1CC[C@@H](CCNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582499218 1075969034 /nfs/dbraw/zinc/96/90/34/1075969034.db2.gz ZGNFPDUAZSNCDS-SNVBAGLBSA-N -1 3 385.392 -1.150 20 0 GAADHM O=C(NCC[C@@H]1CN(CCO)CCS1(=O)=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582504292 1075969135 /nfs/dbraw/zinc/96/91/35/1075969135.db2.gz NZFODUMMBFGIPS-LLVKDONJSA-N -1 3 383.434 -1.594 20 0 GAADHM O=C(NCC[C@@H]1CN(CCO)CCS1(=O)=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582504292 1075969132 /nfs/dbraw/zinc/96/91/32/1075969132.db2.gz NZFODUMMBFGIPS-LLVKDONJSA-N -1 3 383.434 -1.594 20 0 GAADHM O=C(NCC[C@H]1CN(CCO)CCS1(=O)=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582504296 1075969250 /nfs/dbraw/zinc/96/92/50/1075969250.db2.gz NZFODUMMBFGIPS-NSHDSACASA-N -1 3 383.434 -1.594 20 0 GAADHM 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O=C(N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nn2)C[C@@H]1O)c1csc(=O)[nH]1 ZINC001582580587 1075983030 /nfs/dbraw/zinc/98/30/30/1075983030.db2.gz SAKUMCJBVFERIJ-APPZFPTMSA-N -1 3 375.374 -1.202 20 0 GAADHM O=C(N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nn2)C[C@H]1O)c1csc(=O)[nH]1 ZINC001582580588 1075982912 /nfs/dbraw/zinc/98/29/12/1075982912.db2.gz SAKUMCJBVFERIJ-VXNVDRBHSA-N -1 3 375.374 -1.202 20 0 GAADHM O=C(N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O)C1=COCCO1 ZINC001582580867 1075983370 /nfs/dbraw/zinc/98/33/70/1075983370.db2.gz HKGWZAZIDYXHGL-GHMZBOCLSA-N -1 3 377.336 -1.045 20 0 GAADHM O=C(N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O)C1=COCCO1 ZINC001582580867 1075983366 /nfs/dbraw/zinc/98/33/66/1075983366.db2.gz HKGWZAZIDYXHGL-GHMZBOCLSA-N -1 3 377.336 -1.045 20 0 GAADHM O=C(N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O)C1=COCCO1 ZINC001582580868 1075983312 /nfs/dbraw/zinc/98/33/12/1075983312.db2.gz HKGWZAZIDYXHGL-MNOVXSKESA-N -1 3 377.336 -1.045 20 0 GAADHM O=C(N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O)C1=COCCO1 ZINC001582580868 1075983308 /nfs/dbraw/zinc/98/33/08/1075983308.db2.gz HKGWZAZIDYXHGL-MNOVXSKESA-N -1 3 377.336 -1.045 20 0 GAADHM O=C(N[C@@H]1CN(c2cncc(-c3nn[n-]n3)n2)C[C@H]1O)[C@@H]1C[C@H]1c1c[nH]cn1 ZINC001582581071 1075983835 /nfs/dbraw/zinc/98/38/35/1075983835.db2.gz MERBNGLSZRUNPR-NRMKKVEVSA-N -1 3 382.388 -1.151 20 0 GAADHM O=C(N[C@@H]1CN(c2cncc(-c3nnn[n-]3)n2)C[C@H]1O)[C@@H]1C[C@H]1c1c[nH]cn1 ZINC001582581071 1075983832 /nfs/dbraw/zinc/98/38/32/1075983832.db2.gz MERBNGLSZRUNPR-NRMKKVEVSA-N -1 3 382.388 -1.151 20 0 GAADHM O=C(N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O)[C@H]1[C@@H]2COC[C@@H]21 ZINC001582581087 1075983929 /nfs/dbraw/zinc/98/39/29/1075983929.db2.gz NSGVCHUMPJJHCN-BNPPUKTJSA-N -1 3 375.364 -1.041 20 0 GAADHM O=C(N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O)[C@H]1[C@@H]2COC[C@@H]21 ZINC001582581087 1075983923 /nfs/dbraw/zinc/98/39/23/1075983923.db2.gz NSGVCHUMPJJHCN-BNPPUKTJSA-N -1 3 375.364 -1.041 20 0 GAADHM 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O=C(N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O)c1c[nH]c(=O)cn1 ZINC001582581388 1075984048 /nfs/dbraw/zinc/98/40/48/1075984048.db2.gz XADUFAKGNYZDFG-MNOVXSKESA-N -1 3 387.335 -1.536 20 0 GAADHM O=C(N[C@@H]1CN(c2cnc(-c3nnn[n-]3)cn2)C[C@@H]1O)c1n[nH]c2c1CCC2 ZINC001582581588 1075983864 /nfs/dbraw/zinc/98/38/64/1075983864.db2.gz BNWVOGOKUKPPLT-NEPJUHHUSA-N -1 3 382.388 -1.152 20 0 GAADHM O=C(N[C@@H]1CN(c2cnc(-c3nnn[n-]3)cn2)C[C@H]1O)c1n[nH]c2c1CCC2 ZINC001582581589 1075983949 /nfs/dbraw/zinc/98/39/49/1075983949.db2.gz BNWVOGOKUKPPLT-VXGBXAGGSA-N -1 3 382.388 -1.152 20 0 GAADHM O=C(N[C@@H]1CN(c2cncc(-c3nn[n-]n3)n2)C[C@@H]1O)[C@@H]1C[C@H]1c1c[nH]cn1 ZINC001582581918 1075984479 /nfs/dbraw/zinc/98/44/79/1075984479.db2.gz MERBNGLSZRUNPR-RQSQLSILSA-N -1 3 382.388 -1.151 20 0 GAADHM O=C(N[C@@H]1CN(c2cncc(-c3nnn[n-]3)n2)C[C@@H]1O)[C@@H]1C[C@H]1c1c[nH]cn1 ZINC001582581918 1075984473 /nfs/dbraw/zinc/98/44/73/1075984473.db2.gz MERBNGLSZRUNPR-RQSQLSILSA-N -1 3 382.388 -1.151 20 0 GAADHM O=C(N[C@@H]1CN(c2cnc(-c3nnn[n-]3)cn2)C[C@@H]1O)c1csc(=O)[nH]1 ZINC001582582177 1075984942 /nfs/dbraw/zinc/98/49/42/1075984942.db2.gz SSQNSJZQWQMJLL-APPZFPTMSA-N -1 3 375.374 -1.202 20 0 GAADHM O=C(N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@H]1O)C1CS(=O)(=O)C1 ZINC001582582604 1075984844 /nfs/dbraw/zinc/98/48/44/1075984844.db2.gz DRSMYPOQSMDQFW-GHMZBOCLSA-N -1 3 379.402 -2.028 20 0 GAADHM O=C(N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@H]1O)C1CS(=O)(=O)C1 ZINC001582582604 1075984841 /nfs/dbraw/zinc/98/48/41/1075984841.db2.gz DRSMYPOQSMDQFW-GHMZBOCLSA-N -1 3 379.402 -2.028 20 0 GAADHM O=C(N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O)C1CS(=O)(=O)C1 ZINC001582582605 1075984853 /nfs/dbraw/zinc/98/48/53/1075984853.db2.gz DRSMYPOQSMDQFW-MNOVXSKESA-N -1 3 379.402 -2.028 20 0 GAADHM O=C(N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O)C1CS(=O)(=O)C1 ZINC001582582605 1075984850 /nfs/dbraw/zinc/98/48/50/1075984850.db2.gz DRSMYPOQSMDQFW-MNOVXSKESA-N -1 3 379.402 -2.028 20 0 GAADHM O=C(N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@H]1O)c1cn2c(n1)COCC2 ZINC001582582686 1075984926 /nfs/dbraw/zinc/98/49/26/1075984926.db2.gz IJAAKLGDFUUDFO-DGCLKSJQSA-N -1 3 397.399 -1.032 20 0 GAADHM O=C(N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@H]1O)c1cn2c(n1)COCC2 ZINC001582582686 1075984922 /nfs/dbraw/zinc/98/49/22/1075984922.db2.gz IJAAKLGDFUUDFO-DGCLKSJQSA-N -1 3 397.399 -1.032 20 0 GAADHM O=C(N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@H]1O)c1cc2n(n1)CCO2 ZINC001582582788 1075985446 /nfs/dbraw/zinc/98/54/46/1075985446.db2.gz NYANMMXTZRZPMI-VXGBXAGGSA-N -1 3 383.372 -1.170 20 0 GAADHM O=C(N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@H]1O)c1cc2n(n1)CCO2 ZINC001582582788 1075985440 /nfs/dbraw/zinc/98/54/40/1075985440.db2.gz NYANMMXTZRZPMI-VXGBXAGGSA-N -1 3 383.372 -1.170 20 0 GAADHM O=C(N[C@@H]1CN(c2nccnc2-c2nn[n-]n2)C[C@@H]1O)[C@@H]1C[C@H]1c1c[nH]cn1 ZINC001582582797 1075985430 /nfs/dbraw/zinc/98/54/30/1075985430.db2.gz OFYZMWKREAAGBY-IQIPOGNMSA-N -1 3 382.388 -1.151 20 0 GAADHM 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GAADHM O=C(Cn1cnnn1)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c[nH]c(-c3nnn[n-]3)c1)C2 ZINC001582618467 1075987123 /nfs/dbraw/zinc/98/71/23/1075987123.db2.gz WFJQFTIIIHTMCU-SCVCMEIPSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(Cn1ncnn1)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c[nH]c(-c3nn[n-]n3)c1)C2 ZINC001582618476 1075987025 /nfs/dbraw/zinc/98/70/25/1075987025.db2.gz WSFPTCJFSKZGEV-SCVCMEIPSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(Cn1ncnn1)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c[nH]c(-c3nnn[n-]3)c1)C2 ZINC001582618476 1075987020 /nfs/dbraw/zinc/98/70/20/1075987020.db2.gz WSFPTCJFSKZGEV-SCVCMEIPSA-N -1 3 383.376 -1.257 20 0 GAADHM O=C(N[C@@H]1[C@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]21)C1CS(=O)(=O)C1 ZINC001582620523 1075987067 /nfs/dbraw/zinc/98/70/67/1075987067.db2.gz FUKOZKYPJKNDMR-GDGBQDQQSA-N -1 3 391.413 -1.574 20 0 GAADHM O=C(N[C@@H]1[C@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]21)C1CS(=O)(=O)C1 ZINC001582620523 1075987060 /nfs/dbraw/zinc/98/70/60/1075987060.db2.gz FUKOZKYPJKNDMR-GDGBQDQQSA-N -1 3 391.413 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ZINC001582749478 1075993049 /nfs/dbraw/zinc/99/30/49/1075993049.db2.gz AZFUHTPRLVHVRY-MRVPVSSYSA-N -1 3 384.809 -1.111 20 0 GAADHM O=C(c1ncc(-c2nnn[n-]2)cc1Cl)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001582749478 1075993047 /nfs/dbraw/zinc/99/30/47/1075993047.db2.gz AZFUHTPRLVHVRY-MRVPVSSYSA-N -1 3 384.809 -1.111 20 0 GAADHM O=C(c1ncc(-c2nn[n-]n2)cc1Cl)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001582749479 1075992864 /nfs/dbraw/zinc/99/28/64/1075992864.db2.gz AZFUHTPRLVHVRY-QMMMGPOBSA-N -1 3 384.809 -1.111 20 0 GAADHM O=C(c1ncc(-c2nnn[n-]2)cc1Cl)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001582749479 1075992856 /nfs/dbraw/zinc/99/28/56/1075992856.db2.gz AZFUHTPRLVHVRY-QMMMGPOBSA-N -1 3 384.809 -1.111 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1CC2(C1)CN(C(=O)c1nc[nH]n1)CCO2 ZINC001582750331 1075992998 /nfs/dbraw/zinc/99/29/98/1075992998.db2.gz VTDHBFYHWZUBKW-UHFFFAOYSA-N -1 3 384.360 -1.320 20 0 GAADHM O=C(NCC1(O)CN(C(=O)[C@@H]2CCNC(=O)C2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582755682 1075993431 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/nfs/dbraw/zinc/99/34/58/1075993458.db2.gz LDQFOINMPFOVJS-SECBINFHSA-N -1 3 388.388 -1.976 20 0 GAADHM O=C(NCC1(O)CN(C(=O)[C@H]2CCNC(=O)C2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582755946 1075993398 /nfs/dbraw/zinc/99/33/98/1075993398.db2.gz LDQFOINMPFOVJS-VIFPVBQESA-N -1 3 388.388 -1.976 20 0 GAADHM O=C(NCC1(O)CN(C(=O)[C@H]2CCNC(=O)C2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582755946 1075993395 /nfs/dbraw/zinc/99/33/95/1075993395.db2.gz LDQFOINMPFOVJS-VIFPVBQESA-N -1 3 388.388 -1.976 20 0 GAADHM O=C(NCCN(CCO)C(=O)[C@H]1CCNC(=O)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582755975 1075993450 /nfs/dbraw/zinc/99/34/50/1075993450.db2.gz LRTLEJZECOHWIG-JTQLQIEISA-N -1 3 390.404 -1.728 20 0 GAADHM O=C(NCCN(CCO)C(=O)[C@H]1CCNC(=O)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582755975 1075993446 /nfs/dbraw/zinc/99/34/46/1075993446.db2.gz LRTLEJZECOHWIG-JTQLQIEISA-N -1 3 390.404 -1.728 20 0 GAADHM O=C(NCCN(CCO)C(=O)[C@@H]1CCNC(=O)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582755976 1075993331 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20 0 GAADHM O=C(NCCN(CCO)C(=O)[C@@H]1CCNC(=O)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582756362 1075993948 /nfs/dbraw/zinc/99/39/48/1075993948.db2.gz WFWIDAVOBRUKHC-SNVBAGLBSA-N -1 3 390.404 -1.728 20 0 GAADHM O=C(NCC1(O)CN(C(=O)[C@@H]2CCNC(=O)C2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582756399 1075993850 /nfs/dbraw/zinc/99/38/50/1075993850.db2.gz WPZYFKPKTLDGFC-SECBINFHSA-N -1 3 388.388 -1.976 20 0 GAADHM O=C(NCC1(O)CN(C(=O)[C@@H]2CCNC(=O)C2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582756399 1075993844 /nfs/dbraw/zinc/99/38/44/1075993844.db2.gz WPZYFKPKTLDGFC-SECBINFHSA-N -1 3 388.388 -1.976 20 0 GAADHM O=C(NCC1(O)CN(C(=O)[C@H]2CCNC(=O)C2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582756400 1075993905 /nfs/dbraw/zinc/99/39/05/1075993905.db2.gz WPZYFKPKTLDGFC-VIFPVBQESA-N -1 3 388.388 -1.976 20 0 GAADHM O=C(NCC1(O)CN(C(=O)[C@H]2CCNC(=O)C2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582756400 1075993900 /nfs/dbraw/zinc/99/39/00/1075993900.db2.gz WPZYFKPKTLDGFC-VIFPVBQESA-N -1 3 388.388 -1.976 20 0 GAADHM 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O=C(NCCN(CCO)C(=O)[C@H]1CCCC(=O)N1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582768354 1076007787 /nfs/dbraw/zinc/00/77/87/1076007787.db2.gz SPQDFDWSHUMOAI-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(NCCN(CCO)C(=O)[C@H]1CCCC(=O)N1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582768354 1076007786 /nfs/dbraw/zinc/00/77/86/1076007786.db2.gz SPQDFDWSHUMOAI-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(NCCN(CCO)C(=O)[C@H]1CCCC(=O)N1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582768503 1076007813 /nfs/dbraw/zinc/00/78/13/1076007813.db2.gz WCHNTDSANMDJGM-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(NCCN(CCO)C(=O)[C@H]1CCCC(=O)N1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582768503 1076007812 /nfs/dbraw/zinc/00/78/12/1076007812.db2.gz WCHNTDSANMDJGM-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)[C@H]2CCCC(=O)N2)C[C@@H]1O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582768507 1076007668 /nfs/dbraw/zinc/00/76/68/1076007668.db2.gz WMHLZMUOOPMLSH-JLLWLGSASA-N -1 3 388.388 -1.835 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)[C@H]2CCCC(=O)N2)C[C@@H]1O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582768507 1076007663 /nfs/dbraw/zinc/00/76/63/1076007663.db2.gz WMHLZMUOOPMLSH-JLLWLGSASA-N -1 3 388.388 -1.835 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)[C@H]2CCCC(=O)N2)C[C@@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582768509 1076008034 /nfs/dbraw/zinc/00/80/34/1076008034.db2.gz WNCKQLHRDSFZPC-JLLWLGSASA-N -1 3 388.388 -1.835 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)[C@H]2CCCC(=O)N2)C[C@@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582768509 1076008027 /nfs/dbraw/zinc/00/80/27/1076008027.db2.gz WNCKQLHRDSFZPC-JLLWLGSASA-N -1 3 388.388 -1.835 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)[C@H]2CCCC(=O)N2)C[C@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582768510 1076008205 /nfs/dbraw/zinc/00/82/05/1076008205.db2.gz WNCKQLHRDSFZPC-YUSALJHKSA-N -1 3 388.388 -1.835 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)[C@H]2CCCC(=O)N2)C[C@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582768510 1076008202 /nfs/dbraw/zinc/00/82/02/1076008202.db2.gz WNCKQLHRDSFZPC-YUSALJHKSA-N -1 3 388.388 -1.835 20 0 GAADHM O=C(NCC1(O)CN(C(=O)[C@H]2CCCC(=O)N2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582768567 1076007993 /nfs/dbraw/zinc/00/79/93/1076007993.db2.gz ZJKHNZBAVKECCL-SNVBAGLBSA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NCC1(O)CN(C(=O)[C@H]2CCCC(=O)N2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582768567 1076007987 /nfs/dbraw/zinc/00/79/87/1076007987.db2.gz ZJKHNZBAVKECCL-SNVBAGLBSA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O)[C@H]1CCCC(=O)N1 ZINC001582768895 1076008162 /nfs/dbraw/zinc/00/81/62/1076008162.db2.gz AHBXERAHFJOORU-JLLWLGSASA-N -1 3 388.388 -1.835 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O)[C@H]1CCCC(=O)N1 ZINC001582768895 1076008158 /nfs/dbraw/zinc/00/81/58/1076008158.db2.gz AHBXERAHFJOORU-JLLWLGSASA-N -1 3 388.388 -1.835 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1)[C@H]1CCCC(=O)N1 ZINC001582768898 1076008252 /nfs/dbraw/zinc/00/82/52/1076008252.db2.gz ANUQCMCZILIWLR-PXAZEXFGSA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1)[C@H]1CCCC(=O)N1 ZINC001582768898 1076008249 /nfs/dbraw/zinc/00/82/49/1076008249.db2.gz ANUQCMCZILIWLR-PXAZEXFGSA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1)[C@H]1CCCC(=O)N1 ZINC001582768899 1076008110 /nfs/dbraw/zinc/00/81/10/1076008110.db2.gz ANUQCMCZILIWLR-SJKOYZFVSA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1)[C@H]1CCCC(=O)N1 ZINC001582768899 1076008105 /nfs/dbraw/zinc/00/81/05/1076008105.db2.gz ANUQCMCZILIWLR-SJKOYZFVSA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O)[C@H]1CCCC(=O)N1 ZINC001582768909 1076008013 /nfs/dbraw/zinc/00/80/13/1076008013.db2.gz BANYCKKXNXDGQD-UTUOFQBUSA-N -1 3 390.379 -1.265 20 0 GAADHM O=C(N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O)[C@H]1CCCC(=O)N1 ZINC001582768909 1076008007 /nfs/dbraw/zinc/00/80/07/1076008007.db2.gz BANYCKKXNXDGQD-UTUOFQBUSA-N -1 3 390.379 -1.265 20 0 GAADHM O=C(NCC1(O)CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@H]1CCCC(=O)N1 ZINC001582768954 1076008127 /nfs/dbraw/zinc/00/81/27/1076008127.db2.gz DMUPBLVQOLPDLR-SNVBAGLBSA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NCC1(O)CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@H]1CCCC(=O)N1 ZINC001582768954 1076008122 /nfs/dbraw/zinc/00/81/22/1076008122.db2.gz DMUPBLVQOLPDLR-SNVBAGLBSA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NCCN(CCO)C(=O)c1cc(-c2nn[n-]n2)c[nH]1)[C@H]1CCCC(=O)N1 ZINC001582769010 1076008096 /nfs/dbraw/zinc/00/80/96/1076008096.db2.gz GYKQQQYVIYSCKF-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(NCCN(CCO)C(=O)c1cc(-c2nnn[n-]2)c[nH]1)[C@H]1CCCC(=O)N1 ZINC001582769010 1076008090 /nfs/dbraw/zinc/00/80/90/1076008090.db2.gz GYKQQQYVIYSCKF-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ccc(-c3nn[n-]n3)cn2)C1)[C@H]1CCCC(=O)N1 ZINC001582769061 1076008192 /nfs/dbraw/zinc/00/81/92/1076008192.db2.gz JBRZFLHMWXRLDP-PXAZEXFGSA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ccc(-c3nnn[n-]3)cn2)C1)[C@H]1CCCC(=O)N1 ZINC001582769061 1076008189 /nfs/dbraw/zinc/00/81/89/1076008189.db2.gz JBRZFLHMWXRLDP-PXAZEXFGSA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ccc(-c3nn[n-]n3)cn2)C1)[C@H]1CCCC(=O)N1 ZINC001582769062 1076008179 /nfs/dbraw/zinc/00/81/79/1076008179.db2.gz JBRZFLHMWXRLDP-SJKOYZFVSA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ccc(-c3nnn[n-]3)cn2)C1)[C@H]1CCCC(=O)N1 ZINC001582769062 1076008175 /nfs/dbraw/zinc/00/81/75/1076008175.db2.gz JBRZFLHMWXRLDP-SJKOYZFVSA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O)[C@H]1CCCC(=O)N1 ZINC001582769075 1076008149 /nfs/dbraw/zinc/00/81/49/1076008149.db2.gz JNKJIQLJMLLZSC-JLLWLGSASA-N -1 3 388.388 -1.835 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O)[C@H]1CCCC(=O)N1 ZINC001582769075 1076008141 /nfs/dbraw/zinc/00/81/41/1076008141.db2.gz JNKJIQLJMLLZSC-JLLWLGSASA-N -1 3 388.388 -1.835 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1O)[C@H]1CCCC(=O)N1 ZINC001582769076 1076008058 /nfs/dbraw/zinc/00/80/58/1076008058.db2.gz JNKJIQLJMLLZSC-YUSALJHKSA-N -1 3 388.388 -1.835 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1O)[C@H]1CCCC(=O)N1 ZINC001582769076 1076008048 /nfs/dbraw/zinc/00/80/48/1076008048.db2.gz JNKJIQLJMLLZSC-YUSALJHKSA-N -1 3 388.388 -1.835 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O)[C@H]1CCCC(=O)N1 ZINC001582769121 1076008243 /nfs/dbraw/zinc/00/82/43/1076008243.db2.gz LGDGTJOHGUMBTL-JLLWLGSASA-N -1 3 388.388 -1.835 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O)[C@H]1CCCC(=O)N1 ZINC001582769121 1076008241 /nfs/dbraw/zinc/00/82/41/1076008241.db2.gz LGDGTJOHGUMBTL-JLLWLGSASA-N -1 3 388.388 -1.835 20 0 GAADHM O=C(NCCN(CCO)C(=O)c1c[nH]c(-c2nn[n-]n2)c1)[C@H]1CCCC(=O)N1 ZINC001582769129 1076008235 /nfs/dbraw/zinc/00/82/35/1076008235.db2.gz LQUGKJDYVVSOSS-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(NCCN(CCO)C(=O)c1c[nH]c(-c2nnn[n-]2)c1)[C@H]1CCCC(=O)N1 ZINC001582769129 1076008234 /nfs/dbraw/zinc/00/82/34/1076008234.db2.gz LQUGKJDYVVSOSS-LLVKDONJSA-N -1 3 390.404 -1.586 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ncc(-c2nn[n-]n2)cc1F)[C@H]1CCCC(=O)N1 ZINC001582769233 1076008675 /nfs/dbraw/zinc/00/86/75/1076008675.db2.gz PCLMWCSVWRMFKL-GXSJLCMTSA-N -1 3 378.368 -1.042 20 0 GAADHM O=C(NC[C@@H](CO)Nc1ncc(-c2nnn[n-]2)cc1F)[C@H]1CCCC(=O)N1 ZINC001582769233 1076008670 /nfs/dbraw/zinc/00/86/70/1076008670.db2.gz PCLMWCSVWRMFKL-GXSJLCMTSA-N -1 3 378.368 -1.042 20 0 GAADHM O=C(NC[C@H](CO)Nc1ncc(-c2nn[n-]n2)cc1F)[C@H]1CCCC(=O)N1 ZINC001582769234 1076008490 /nfs/dbraw/zinc/00/84/90/1076008490.db2.gz PCLMWCSVWRMFKL-MWLCHTKSSA-N -1 3 378.368 -1.042 20 0 GAADHM O=C(NC[C@H](CO)Nc1ncc(-c2nnn[n-]2)cc1F)[C@H]1CCCC(=O)N1 ZINC001582769234 1076008486 /nfs/dbraw/zinc/00/84/86/1076008486.db2.gz PCLMWCSVWRMFKL-MWLCHTKSSA-N -1 3 378.368 -1.042 20 0 GAADHM O=C(NCC1(O)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)[C@H]1CCCC(=O)N1 ZINC001582769266 1076008562 /nfs/dbraw/zinc/00/85/62/1076008562.db2.gz QPUAHJGWPQGBNJ-SNVBAGLBSA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NCC1(O)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)[C@H]1CCCC(=O)N1 ZINC001582769266 1076008559 /nfs/dbraw/zinc/00/85/59/1076008559.db2.gz QPUAHJGWPQGBNJ-SNVBAGLBSA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NCC1(O)CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@H]1CCCC(=O)N1 ZINC001582769272 1076008535 /nfs/dbraw/zinc/00/85/35/1076008535.db2.gz QXNRHDRJNWAENF-SNVBAGLBSA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NCC1(O)CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@H]1CCCC(=O)N1 ZINC001582769272 1076008532 /nfs/dbraw/zinc/00/85/32/1076008532.db2.gz QXNRHDRJNWAENF-SNVBAGLBSA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@H]1CCCC(=O)N1 ZINC001582769468 1076009012 /nfs/dbraw/zinc/00/90/12/1076009012.db2.gz XRTGZOJULSHEJK-CXAGYDPISA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@H]1CCCC(=O)N1 ZINC001582769468 1076009008 /nfs/dbraw/zinc/00/90/08/1076009008.db2.gz XRTGZOJULSHEJK-CXAGYDPISA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@H]1CCCC(=O)N1 ZINC001582769469 1076009031 /nfs/dbraw/zinc/00/90/31/1076009031.db2.gz XRTGZOJULSHEJK-DYVFJYSZSA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@H]1CCCC(=O)N1 ZINC001582769469 1076009026 /nfs/dbraw/zinc/00/90/26/1076009026.db2.gz XRTGZOJULSHEJK-DYVFJYSZSA-N -1 3 386.416 -1.012 20 0 GAADHM O=C(NC[C@@H](O)CNc1ncc(-c2nn[n-]n2)cc1F)[C@H]1CCCC(=O)N1 ZINC001582769523 1076008949 /nfs/dbraw/zinc/00/89/49/1076008949.db2.gz ZZBIYSNMCGPMFD-GXSJLCMTSA-N -1 3 378.368 -1.042 20 0 GAADHM O=C(NC[C@@H](O)CNc1ncc(-c2nnn[n-]2)cc1F)[C@H]1CCCC(=O)N1 ZINC001582769523 1076008944 /nfs/dbraw/zinc/00/89/44/1076008944.db2.gz ZZBIYSNMCGPMFD-GXSJLCMTSA-N -1 3 378.368 -1.042 20 0 GAADHM O=C(NC[C@H](O)CNc1ncc(-c2nn[n-]n2)cc1F)[C@H]1CCCC(=O)N1 ZINC001582769524 1076008872 /nfs/dbraw/zinc/00/88/72/1076008872.db2.gz ZZBIYSNMCGPMFD-MWLCHTKSSA-N -1 3 378.368 -1.042 20 0 GAADHM O=C(NC[C@H](O)CNc1ncc(-c2nnn[n-]2)cc1F)[C@H]1CCCC(=O)N1 ZINC001582769524 1076008869 /nfs/dbraw/zinc/00/88/69/1076008869.db2.gz ZZBIYSNMCGPMFD-MWLCHTKSSA-N -1 3 378.368 -1.042 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@@H]2CCC(=O)N2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582769557 1076008961 /nfs/dbraw/zinc/00/89/61/1076008961.db2.gz BEAOMXOTBJHBAY-JTQLQIEISA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@@H]2CCC(=O)N2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582769557 1076008957 /nfs/dbraw/zinc/00/89/57/1076008957.db2.gz BEAOMXOTBJHBAY-JTQLQIEISA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@@H]2CCC(=O)N2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582769579 1076008862 /nfs/dbraw/zinc/00/88/62/1076008862.db2.gz CKIDGUPPRDFTDX-MEDUHNTESA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@@H]2CCC(=O)N2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582769579 1076008859 /nfs/dbraw/zinc/00/88/59/1076008859.db2.gz CKIDGUPPRDFTDX-MEDUHNTESA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@@H]2CCC(=O)N2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582769580 1076009061 /nfs/dbraw/zinc/00/90/61/1076009061.db2.gz CKIDGUPPRDFTDX-ZBEGNZNMSA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@@H]2CCC(=O)N2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582769580 1076009057 /nfs/dbraw/zinc/00/90/57/1076009057.db2.gz CKIDGUPPRDFTDX-ZBEGNZNMSA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(CNC(=O)c1ccc(-c2nn[n-]n2)cc1)N1CCC(=O)NCC12COC2 ZINC001582769582 1076009092 /nfs/dbraw/zinc/00/90/92/1076009092.db2.gz CMYKBWLYOPHGMB-UHFFFAOYSA-N -1 3 385.384 -1.286 20 0 GAADHM O=C(CNC(=O)c1ccc(-c2nnn[n-]2)cc1)N1CCC(=O)NCC12COC2 ZINC001582769582 1076009085 /nfs/dbraw/zinc/00/90/85/1076009085.db2.gz CMYKBWLYOPHGMB-UHFFFAOYSA-N -1 3 385.384 -1.286 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)N1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001582769584 1076008888 /nfs/dbraw/zinc/00/88/88/1076008888.db2.gz CNRUEBXXCXJSJZ-UHFFFAOYSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)N1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001582769584 1076008885 /nfs/dbraw/zinc/00/88/85/1076008885.db2.gz CNRUEBXXCXJSJZ-UHFFFAOYSA-N -1 3 385.388 -1.148 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)N1CC(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582769662 1076009508 /nfs/dbraw/zinc/00/95/08/1076009508.db2.gz HBVCBJMIDKTCLQ-UHFFFAOYSA-N -1 3 387.360 -1.923 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)N1CC(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582769662 1076009505 /nfs/dbraw/zinc/00/95/05/1076009505.db2.gz HBVCBJMIDKTCLQ-UHFFFAOYSA-N -1 3 387.360 -1.923 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)N1CC(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582769678 1076009442 /nfs/dbraw/zinc/00/94/42/1076009442.db2.gz HOMIUJOHVCSNMK-UHFFFAOYSA-N -1 3 387.360 -1.923 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)N1CC(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582769678 1076009440 /nfs/dbraw/zinc/00/94/40/1076009440.db2.gz HOMIUJOHVCSNMK-UHFFFAOYSA-N -1 3 387.360 -1.923 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582769683 1076009457 /nfs/dbraw/zinc/00/94/57/1076009457.db2.gz HSPRLPICNVGZMA-JTQLQIEISA-N -1 3 385.388 -1.102 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582769683 1076009454 /nfs/dbraw/zinc/00/94/54/1076009454.db2.gz HSPRLPICNVGZMA-JTQLQIEISA-N -1 3 385.388 -1.102 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)N[C@@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582769684 1076009426 /nfs/dbraw/zinc/00/94/26/1076009426.db2.gz HSPRLPICNVGZMA-SNVBAGLBSA-N -1 3 385.388 -1.102 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)N[C@@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582769684 1076009424 /nfs/dbraw/zinc/00/94/24/1076009424.db2.gz HSPRLPICNVGZMA-SNVBAGLBSA-N -1 3 385.388 -1.102 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)NC1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582769717 1076009343 /nfs/dbraw/zinc/00/93/43/1076009343.db2.gz IVMQGELUUSOQET-UHFFFAOYSA-N -1 3 387.360 -1.923 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)NC1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582769717 1076009338 /nfs/dbraw/zinc/00/93/38/1076009338.db2.gz IVMQGELUUSOQET-UHFFFAOYSA-N -1 3 387.360 -1.923 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@@H]3CCC(=O)N3)C[C@H]21)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582769751 1076009359 /nfs/dbraw/zinc/00/93/59/1076009359.db2.gz KLGMRYREYWKJCG-YFKTTZPYSA-N -1 3 384.400 -1.092 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@@H]3CCC(=O)N3)C[C@H]21)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582769751 1076009354 /nfs/dbraw/zinc/00/93/54/1076009354.db2.gz KLGMRYREYWKJCG-YFKTTZPYSA-N -1 3 384.400 -1.092 20 0 GAADHM O=C(NCCN(CCO)C(=O)[C@@H]1CCC(=O)N1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582769766 1076009465 /nfs/dbraw/zinc/00/94/65/1076009465.db2.gz LGTZDBSGMATXFP-JTQLQIEISA-N -1 3 376.377 -1.976 20 0 GAADHM O=C(NCCN(CCO)C(=O)[C@@H]1CCC(=O)N1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582769766 1076009462 /nfs/dbraw/zinc/00/94/62/1076009462.db2.gz LGTZDBSGMATXFP-JTQLQIEISA-N -1 3 376.377 -1.976 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)NC1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582769771 1076009477 /nfs/dbraw/zinc/00/94/77/1076009477.db2.gz LKYAOWKGQVPNHP-UHFFFAOYSA-N -1 3 387.360 -1.923 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)NC1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582769771 1076009474 /nfs/dbraw/zinc/00/94/74/1076009474.db2.gz LKYAOWKGQVPNHP-UHFFFAOYSA-N -1 3 387.360 -1.923 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@@H]2CCC(=O)N2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582769789 1076009497 /nfs/dbraw/zinc/00/94/97/1076009497.db2.gz MHZMXLUSUSIXKA-MGPLVRAMSA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@@H]2CCC(=O)N2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582769789 1076009494 /nfs/dbraw/zinc/00/94/94/1076009494.db2.gz MHZMXLUSUSIXKA-MGPLVRAMSA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@@H]2CCC(=O)N2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582769790 1076009327 /nfs/dbraw/zinc/00/93/27/1076009327.db2.gz MHZMXLUSUSIXKA-QFYYESIMSA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@@H]2CCC(=O)N2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582769790 1076009323 /nfs/dbraw/zinc/00/93/23/1076009323.db2.gz MHZMXLUSUSIXKA-QFYYESIMSA-N -1 3 388.388 -1.833 20 0 GAADHM O=C1CCN(CCS(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)C2(COC2)CN1 ZINC001582769799 1076009409 /nfs/dbraw/zinc/00/94/09/1076009409.db2.gz MOKNSBDUTTYYQQ-UHFFFAOYSA-N -1 3 393.429 -1.374 20 0 GAADHM O=C1CCN(CCS(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)C2(COC2)CN1 ZINC001582769799 1076009407 /nfs/dbraw/zinc/00/94/07/1076009407.db2.gz MOKNSBDUTTYYQQ-UHFFFAOYSA-N -1 3 393.429 -1.374 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001582769831 1076009981 /nfs/dbraw/zinc/00/99/81/1076009981.db2.gz NVBQMYTWPOFAFN-NSHDSACASA-N -1 3 385.388 -1.102 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001582769831 1076009975 /nfs/dbraw/zinc/00/99/75/1076009975.db2.gz NVBQMYTWPOFAFN-NSHDSACASA-N -1 3 385.388 -1.102 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)N1CC(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582769872 1076009965 /nfs/dbraw/zinc/00/99/65/1076009965.db2.gz OYPRMNZXBQRDTI-UHFFFAOYSA-N -1 3 387.360 -1.923 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)N1CC(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582769872 1076009962 /nfs/dbraw/zinc/00/99/62/1076009962.db2.gz OYPRMNZXBQRDTI-UHFFFAOYSA-N -1 3 387.360 -1.923 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@@H]2CCC(=O)N2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582769916 1076009751 /nfs/dbraw/zinc/00/97/51/1076009751.db2.gz QVBICKQCMCZXLR-NSHDSACASA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@@H]2CCC(=O)N2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582769916 1076009747 /nfs/dbraw/zinc/00/97/47/1076009747.db2.gz QVBICKQCMCZXLR-NSHDSACASA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@@H]3CCC(=O)N3)C[C@H]21)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582769975 1076009709 /nfs/dbraw/zinc/00/97/09/1076009709.db2.gz UDIFIKDJPBZYKP-YFKTTZPYSA-N -1 3 384.400 -1.092 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@@H]3CCC(=O)N3)C[C@H]21)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582769975 1076009705 /nfs/dbraw/zinc/00/97/05/1076009705.db2.gz UDIFIKDJPBZYKP-YFKTTZPYSA-N -1 3 384.400 -1.092 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)NC1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582769985 1076010202 /nfs/dbraw/zinc/01/02/02/1076010202.db2.gz UQLDISCLLUOOSW-UHFFFAOYSA-N -1 3 387.360 -1.923 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)NC1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582769985 1076010196 /nfs/dbraw/zinc/01/01/96/1076010196.db2.gz UQLDISCLLUOOSW-UHFFFAOYSA-N -1 3 387.360 -1.923 20 0 GAADHM O=C(NCCN(CCO)C(=O)[C@@H]1CCC(=O)N1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582770013 1076010133 /nfs/dbraw/zinc/01/01/33/1076010133.db2.gz VZNILNRQSKJPET-NSHDSACASA-N -1 3 376.377 -1.976 20 0 GAADHM O=C(NCCN(CCO)C(=O)[C@@H]1CCC(=O)N1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582770013 1076010128 /nfs/dbraw/zinc/01/01/28/1076010128.db2.gz VZNILNRQSKJPET-NSHDSACASA-N -1 3 376.377 -1.976 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)N[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001582770025 1076010241 /nfs/dbraw/zinc/01/02/41/1076010241.db2.gz WOTPZJHHJPBCOK-JTQLQIEISA-N -1 3 385.388 -1.102 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)N[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001582770025 1076010236 /nfs/dbraw/zinc/01/02/36/1076010236.db2.gz WOTPZJHHJPBCOK-JTQLQIEISA-N -1 3 385.388 -1.102 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)N[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001582770026 1076010315 /nfs/dbraw/zinc/01/03/15/1076010315.db2.gz WOTPZJHHJPBCOK-SNVBAGLBSA-N -1 3 385.388 -1.102 20 0 GAADHM O=C(CN1CCC(=O)NC1=O)N[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001582770026 1076010311 /nfs/dbraw/zinc/01/03/11/1076010311.db2.gz WOTPZJHHJPBCOK-SNVBAGLBSA-N -1 3 385.388 -1.102 20 0 GAADHM O=C(NCCN(CCO)C(=O)[C@@H]1CCC(=O)N1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582770044 1076010340 /nfs/dbraw/zinc/01/03/40/1076010340.db2.gz XQZBAVGJXQZNSJ-JTQLQIEISA-N -1 3 376.377 -1.976 20 0 GAADHM O=C(NCCN(CCO)C(=O)[C@@H]1CCC(=O)N1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582770044 1076010337 /nfs/dbraw/zinc/01/03/37/1076010337.db2.gz XQZBAVGJXQZNSJ-JTQLQIEISA-N -1 3 376.377 -1.976 20 0 GAADHM O=C([C@@H]1CCC(=O)N1)N(CCO)CCNc1ncc(-c2nn[n-]n2)cc1F ZINC001582770055 1076010144 /nfs/dbraw/zinc/01/01/44/1076010144.db2.gz YFIYZSVZFSSFJQ-NSHDSACASA-N -1 3 378.368 -1.088 20 0 GAADHM O=C([C@@H]1CCC(=O)N1)N(CCO)CCNc1ncc(-c2nnn[n-]2)cc1F ZINC001582770055 1076010140 /nfs/dbraw/zinc/01/01/40/1076010140.db2.gz YFIYZSVZFSSFJQ-NSHDSACASA-N -1 3 378.368 -1.088 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1)[C@@H]1CCC(=O)N1 ZINC001582770492 1076010227 /nfs/dbraw/zinc/01/02/27/1076010227.db2.gz ABFKNPYVVZDSLH-MNOVXSKESA-N -1 3 388.388 -1.569 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1)[C@@H]1CCC(=O)N1 ZINC001582770492 1076010222 /nfs/dbraw/zinc/01/02/22/1076010222.db2.gz ABFKNPYVVZDSLH-MNOVXSKESA-N -1 3 388.388 -1.569 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1)[C@@H]1CCC(=O)N1 ZINC001582770493 1076010280 /nfs/dbraw/zinc/01/02/80/1076010280.db2.gz ABFKNPYVVZDSLH-QWRGUYRKSA-N -1 3 388.388 -1.569 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1)[C@@H]1CCC(=O)N1 ZINC001582770493 1076010276 /nfs/dbraw/zinc/01/02/76/1076010276.db2.gz ABFKNPYVVZDSLH-QWRGUYRKSA-N -1 3 388.388 -1.569 20 0 GAADHM O=C(NCCN1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1)[C@@H]1CCC(=O)N1 ZINC001582770541 1076010522 /nfs/dbraw/zinc/01/05/22/1076010522.db2.gz CAHZGXYCBFPEGC-ZDUSSCGKSA-N -1 3 385.432 -1.222 20 0 GAADHM O=C(NCCN1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1)[C@@H]1CCC(=O)N1 ZINC001582770541 1076010516 /nfs/dbraw/zinc/01/05/16/1076010516.db2.gz CAHZGXYCBFPEGC-ZDUSSCGKSA-N -1 3 385.432 -1.222 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]21)[C@@H]1CCC(=O)N1 ZINC001582770571 1076010679 /nfs/dbraw/zinc/01/06/79/1076010679.db2.gz DIORQQDSSOHALF-GUDRVLHUSA-N -1 3 384.400 -1.092 20 0 GAADHM 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O=C(NC1(CCO)CN(C(=O)[C@H]2CCC(=O)N2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582771858 1076012942 /nfs/dbraw/zinc/01/29/42/1076012942.db2.gz BEAOMXOTBJHBAY-SNVBAGLBSA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NC1(CCO)CN(C(=O)[C@H]2CCC(=O)N2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582771858 1076012939 /nfs/dbraw/zinc/01/29/39/1076012939.db2.gz BEAOMXOTBJHBAY-SNVBAGLBSA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2Cl)C[C@H]1O)[C@@H]1CCC(=O)N1 ZINC001582771903 1076012850 /nfs/dbraw/zinc/01/28/50/1076012850.db2.gz DEYGIWBINRURAA-HBNTYKKESA-N -1 3 392.807 -1.141 20 0 GAADHM O=C(N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2Cl)C[C@H]1O)[C@@H]1CCC(=O)N1 ZINC001582771903 1076012844 /nfs/dbraw/zinc/01/28/44/1076012844.db2.gz DEYGIWBINRURAA-HBNTYKKESA-N -1 3 392.807 -1.141 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C[C@@H]1O)[C@@H]1CCC(=O)N1 ZINC001582771957 1076012991 /nfs/dbraw/zinc/01/29/91/1076012991.db2.gz FLOLPDHJRKAXMT-MJBXVCDLSA-N -1 3 389.391 -1.054 20 0 GAADHM 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GAADHM O=C(NC[C@@]1(O)CCN(C(=O)[C@H]2CCC(=O)N2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582772366 1076013259 /nfs/dbraw/zinc/01/32/59/1076013259.db2.gz VWXVDZTUSUEGSS-HWPZZCPQSA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@H]2CCC(=O)N2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582772367 1076013439 /nfs/dbraw/zinc/01/34/39/1076013439.db2.gz VWXVDZTUSUEGSS-QLJPJBMISA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)[C@H]2CCC(=O)N2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582772367 1076013432 /nfs/dbraw/zinc/01/34/32/1076013432.db2.gz VWXVDZTUSUEGSS-QLJPJBMISA-N -1 3 388.388 -1.833 20 0 GAADHM O=C(NCCN(CCO)C(=O)[C@H]1CCC(=O)N1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582772370 1076013280 /nfs/dbraw/zinc/01/32/80/1076013280.db2.gz VZNILNRQSKJPET-LLVKDONJSA-N -1 3 376.377 -1.976 20 0 GAADHM O=C(NCCN(CCO)C(=O)[C@H]1CCC(=O)N1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582772370 1076013276 /nfs/dbraw/zinc/01/32/76/1076013276.db2.gz VZNILNRQSKJPET-LLVKDONJSA-N -1 3 376.377 -1.976 20 0 GAADHM 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ZINC001582775733 1076019099 /nfs/dbraw/zinc/01/90/99/1076019099.db2.gz IJHSTZHAAULYCO-JTQLQIEISA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@@H]1CCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582775733 1076019092 /nfs/dbraw/zinc/01/90/92/1076019092.db2.gz IJHSTZHAAULYCO-JTQLQIEISA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@H]1CCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582775734 1076019082 /nfs/dbraw/zinc/01/90/82/1076019082.db2.gz IJHSTZHAAULYCO-SNVBAGLBSA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@H]1CCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582775734 1076019076 /nfs/dbraw/zinc/01/90/76/1076019076.db2.gz IJHSTZHAAULYCO-SNVBAGLBSA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)NCC1CN(Cc2ccc(-c3nnn[n-]3)s2)C1 ZINC001582775735 1076019062 /nfs/dbraw/zinc/01/90/62/1076019062.db2.gz ILDZHTBMAMAULX-UHFFFAOYSA-N -1 3 390.473 -1.092 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@H](CO)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001582775741 1076019041 /nfs/dbraw/zinc/01/90/41/1076019041.db2.gz IQGAYWMVJFUYRH-LLVKDONJSA-N -1 3 375.393 -2.418 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@H](CO)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001582775741 1076019036 /nfs/dbraw/zinc/01/90/36/1076019036.db2.gz IQGAYWMVJFUYRH-LLVKDONJSA-N -1 3 375.393 -2.418 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@@H](CO)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001582775742 1076019010 /nfs/dbraw/zinc/01/90/10/1076019010.db2.gz IQGAYWMVJFUYRH-NSHDSACASA-N -1 3 375.393 -2.418 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001582775742 1076019003 /nfs/dbraw/zinc/01/90/03/1076019003.db2.gz IQGAYWMVJFUYRH-NSHDSACASA-N -1 3 375.393 -2.418 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nn[n-]n2)nc1 ZINC001582775751 1076019178 /nfs/dbraw/zinc/01/91/78/1076019178.db2.gz IZVNZCNIIFLUFO-STQMWFEESA-N -1 3 383.416 -1.517 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nnn[n-]2)nc1 ZINC001582775751 1076019175 /nfs/dbraw/zinc/01/91/75/1076019175.db2.gz IZVNZCNIIFLUFO-STQMWFEESA-N -1 3 383.416 -1.517 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@H]1CCCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582775754 1076019192 /nfs/dbraw/zinc/01/91/92/1076019192.db2.gz JAKXELAHWSLWAO-LBPRGKRZSA-N -1 3 385.432 -1.222 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@H]1CCCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582775754 1076019187 /nfs/dbraw/zinc/01/91/87/1076019187.db2.gz JAKXELAHWSLWAO-LBPRGKRZSA-N -1 3 385.432 -1.222 20 0 GAADHM O=C(CN1CCNC(=O)C1)NCCN(c1ncccc1-c1nn[n-]n1)C1CC1 ZINC001582775755 1076018913 /nfs/dbraw/zinc/01/89/13/1076018913.db2.gz JAOUJMQZSHDHPW-UHFFFAOYSA-N -1 3 385.432 -1.222 20 0 GAADHM O=C(CN1CCNC(=O)C1)NCCN(c1ncccc1-c1nnn[n-]1)C1CC1 ZINC001582775755 1076018906 /nfs/dbraw/zinc/01/89/06/1076018906.db2.gz JAOUJMQZSHDHPW-UHFFFAOYSA-N -1 3 385.432 -1.222 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1CC[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582775759 1076018935 /nfs/dbraw/zinc/01/89/35/1076018935.db2.gz JCJDDNLLWFROGX-JTQLQIEISA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1CC[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582775759 1076018929 /nfs/dbraw/zinc/01/89/29/1076018929.db2.gz JCJDDNLLWFROGX-JTQLQIEISA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1CC[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582775760 1076019223 /nfs/dbraw/zinc/01/92/23/1076019223.db2.gz JCJDDNLLWFROGX-SNVBAGLBSA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1CC[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582775760 1076019216 /nfs/dbraw/zinc/01/92/16/1076019216.db2.gz JCJDDNLLWFROGX-SNVBAGLBSA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@@H](O)CNc1cccc(F)c1-c1nn[n-]n1 ZINC001582775772 1076019244 /nfs/dbraw/zinc/01/92/44/1076019244.db2.gz JRONRMKXRNIFBN-JTQLQIEISA-N -1 3 392.395 -1.673 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@@H](O)CNc1cccc(F)c1-c1nnn[n-]1 ZINC001582775772 1076019236 /nfs/dbraw/zinc/01/92/36/1076019236.db2.gz JRONRMKXRNIFBN-JTQLQIEISA-N -1 3 392.395 -1.673 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@H](O)CNc1cccc(F)c1-c1nn[n-]n1 ZINC001582775773 1076019139 /nfs/dbraw/zinc/01/91/39/1076019139.db2.gz JRONRMKXRNIFBN-SNVBAGLBSA-N -1 3 392.395 -1.673 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@H](O)CNc1cccc(F)c1-c1nnn[n-]1 ZINC001582775773 1076019136 /nfs/dbraw/zinc/01/91/36/1076019136.db2.gz JRONRMKXRNIFBN-SNVBAGLBSA-N -1 3 392.395 -1.673 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@H]1CCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582775775 1076019497 /nfs/dbraw/zinc/01/94/97/1076019497.db2.gz JVYIVLTWGXSXMG-LLVKDONJSA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@H]1CCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582775775 1076019487 /nfs/dbraw/zinc/01/94/87/1076019487.db2.gz JVYIVLTWGXSXMG-LLVKDONJSA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@@H]1CCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582775776 1076019626 /nfs/dbraw/zinc/01/96/26/1076019626.db2.gz JVYIVLTWGXSXMG-NSHDSACASA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@@H]1CCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582775776 1076019619 /nfs/dbraw/zinc/01/96/19/1076019619.db2.gz JVYIVLTWGXSXMG-NSHDSACASA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@H]1C[C@H]2CC[C@@H]1N2c1ccc(-c2nn[n-]n2)nc1 ZINC001582775782 1076019375 /nfs/dbraw/zinc/01/93/75/1076019375.db2.gz KGKPBJSRYDDMRM-UGFHNGPFSA-N -1 3 397.443 -1.081 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@H]1C[C@H]2CC[C@@H]1N2c1ccc(-c2nnn[n-]2)nc1 ZINC001582775782 1076019370 /nfs/dbraw/zinc/01/93/70/1076019370.db2.gz KGKPBJSRYDDMRM-UGFHNGPFSA-N -1 3 397.443 -1.081 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O ZINC001582775792 1076019391 /nfs/dbraw/zinc/01/93/91/1076019391.db2.gz KXUHCTYCQBAPSX-CHWSQXEVSA-N -1 3 387.404 -2.641 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O ZINC001582775792 1076019387 /nfs/dbraw/zinc/01/93/87/1076019387.db2.gz KXUHCTYCQBAPSX-CHWSQXEVSA-N -1 3 387.404 -2.641 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001582775793 1076019680 /nfs/dbraw/zinc/01/96/80/1076019680.db2.gz KXUHCTYCQBAPSX-OLZOCXBDSA-N -1 3 387.404 -2.641 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001582775793 1076019675 /nfs/dbraw/zinc/01/96/75/1076019675.db2.gz KXUHCTYCQBAPSX-OLZOCXBDSA-N -1 3 387.404 -2.641 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC1(CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001582775804 1076019585 /nfs/dbraw/zinc/01/95/85/1076019585.db2.gz LDMZJNOYXAZMDY-UHFFFAOYSA-N -1 3 387.404 -1.995 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC1(CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001582775804 1076019576 /nfs/dbraw/zinc/01/95/76/1076019576.db2.gz LDMZJNOYXAZMDY-UHFFFAOYSA-N -1 3 387.404 -1.995 20 0 GAADHM O=C(CN1CCNC(=O)C1)NCCN(c1ccc(-c2nn[n-]n2)cn1)C1CC1 ZINC001582775808 1076019607 /nfs/dbraw/zinc/01/96/07/1076019607.db2.gz LHBHXOINOGWYHC-UHFFFAOYSA-N -1 3 385.432 -1.222 20 0 GAADHM O=C(CN1CCNC(=O)C1)NCCN(c1ccc(-c2nnn[n-]2)cn1)C1CC1 ZINC001582775808 1076019599 /nfs/dbraw/zinc/01/95/99/1076019599.db2.gz LHBHXOINOGWYHC-UHFFFAOYSA-N -1 3 385.432 -1.222 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@H]1CCCN1c1ccc(-c2nn[n-]n2)nc1 ZINC001582775809 1076019363 /nfs/dbraw/zinc/01/93/63/1076019363.db2.gz LHUGSZWHRQHMGF-GFCCVEGCSA-N -1 3 385.432 -1.222 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@H]1CCCN1c1ccc(-c2nnn[n-]2)nc1 ZINC001582775809 1076019359 /nfs/dbraw/zinc/01/93/59/1076019359.db2.gz LHUGSZWHRQHMGF-GFCCVEGCSA-N -1 3 385.432 -1.222 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@@H]1CCCN1c1ccc(-c2nn[n-]n2)nc1 ZINC001582775810 1076020149 /nfs/dbraw/zinc/02/01/49/1076020149.db2.gz LHUGSZWHRQHMGF-LBPRGKRZSA-N -1 3 385.432 -1.222 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@@H]1CCCN1c1ccc(-c2nnn[n-]2)nc1 ZINC001582775810 1076020143 /nfs/dbraw/zinc/02/01/43/1076020143.db2.gz LHUGSZWHRQHMGF-LBPRGKRZSA-N -1 3 385.432 -1.222 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@@H](CO)Nc1ncccc1-c1nn[n-]n1 ZINC001582775819 1076019996 /nfs/dbraw/zinc/01/99/96/1076019996.db2.gz LNEVKQISQGGNJC-JTQLQIEISA-N -1 3 375.393 -2.418 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@@H](CO)Nc1ncccc1-c1nnn[n-]1 ZINC001582775819 1076019992 /nfs/dbraw/zinc/01/99/92/1076019992.db2.gz LNEVKQISQGGNJC-JTQLQIEISA-N -1 3 375.393 -2.418 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@H](CO)Nc1ncccc1-c1nn[n-]n1 ZINC001582775820 1076020131 /nfs/dbraw/zinc/02/01/31/1076020131.db2.gz LNEVKQISQGGNJC-SNVBAGLBSA-N -1 3 375.393 -2.418 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@H](CO)Nc1ncccc1-c1nnn[n-]1 ZINC001582775820 1076020125 /nfs/dbraw/zinc/02/01/25/1076020125.db2.gz LNEVKQISQGGNJC-SNVBAGLBSA-N -1 3 375.393 -2.418 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001582775823 1076020013 /nfs/dbraw/zinc/02/00/13/1076020013.db2.gz LPGFJICPLLSEQX-GFCCVEGCSA-N -1 3 385.432 -1.364 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001582775823 1076020006 /nfs/dbraw/zinc/02/00/06/1076020006.db2.gz LPGFJICPLLSEQX-GFCCVEGCSA-N -1 3 385.432 -1.364 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001582775824 1076019981 /nfs/dbraw/zinc/01/99/81/1076019981.db2.gz LPGFJICPLLSEQX-LBPRGKRZSA-N -1 3 385.432 -1.364 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001582775824 1076019976 /nfs/dbraw/zinc/01/99/76/1076019976.db2.gz LPGFJICPLLSEQX-LBPRGKRZSA-N -1 3 385.432 -1.364 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC1(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001582775831 1076020098 /nfs/dbraw/zinc/02/00/98/1076020098.db2.gz LVWJWWNVMBJMCN-UHFFFAOYSA-N -1 3 387.404 -1.995 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC1(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001582775831 1076020093 /nfs/dbraw/zinc/02/00/93/1076020093.db2.gz LVWJWWNVMBJMCN-UHFFFAOYSA-N -1 3 387.404 -1.995 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001582775845 1076019945 /nfs/dbraw/zinc/01/99/45/1076019945.db2.gz MJKXEVGHXAJKJN-UHFFFAOYSA-N -1 3 387.404 -2.089 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001582775845 1076019939 /nfs/dbraw/zinc/01/99/39/1076019939.db2.gz MJKXEVGHXAJKJN-UHFFFAOYSA-N -1 3 387.404 -2.089 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001582775847 1076019889 /nfs/dbraw/zinc/01/98/89/1076019889.db2.gz MLLALUDLSYVDKK-LLVKDONJSA-N -1 3 389.395 -1.473 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001582775847 1076019881 /nfs/dbraw/zinc/01/98/81/1076019881.db2.gz MLLALUDLSYVDKK-LLVKDONJSA-N -1 3 389.395 -1.473 20 0 GAADHM O=C(CN1CCNC(=O)C1)NCC1(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001582775850 1076020542 /nfs/dbraw/zinc/02/05/42/1076020542.db2.gz MVBLOEOWDPRYTJ-UHFFFAOYSA-N -1 3 387.404 -1.995 20 0 GAADHM O=C(CN1CCNC(=O)C1)NCC1(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001582775850 1076020534 /nfs/dbraw/zinc/02/05/34/1076020534.db2.gz MVBLOEOWDPRYTJ-UHFFFAOYSA-N -1 3 387.404 -1.995 20 0 GAADHM O=C(CN1CCNC(=O)C1)NCC1(Nc2ncc(-c3nn[n-]n3)cc2F)CC1 ZINC001582775861 1076020296 /nfs/dbraw/zinc/02/02/96/1076020296.db2.gz NDSXXLUGKQXODZ-UHFFFAOYSA-N -1 3 389.395 -1.107 20 0 GAADHM O=C(CN1CCNC(=O)C1)NCC1(Nc2ncc(-c3nnn[n-]3)cc2F)CC1 ZINC001582775861 1076020292 /nfs/dbraw/zinc/02/02/92/1076020292.db2.gz NDSXXLUGKQXODZ-UHFFFAOYSA-N -1 3 389.395 -1.107 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001582775862 1076020562 /nfs/dbraw/zinc/02/05/62/1076020562.db2.gz NFODVDUCMKIYSA-NEPJUHHUSA-N -1 3 387.404 -2.641 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001582775862 1076020556 /nfs/dbraw/zinc/02/05/56/1076020556.db2.gz NFODVDUCMKIYSA-NEPJUHHUSA-N -1 3 387.404 -2.641 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1O ZINC001582775863 1076020517 /nfs/dbraw/zinc/02/05/17/1076020517.db2.gz NFODVDUCMKIYSA-VXGBXAGGSA-N -1 3 387.404 -2.641 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@H]1O ZINC001582775863 1076020510 /nfs/dbraw/zinc/02/05/10/1076020510.db2.gz NFODVDUCMKIYSA-VXGBXAGGSA-N -1 3 387.404 -2.641 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@H]1C[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582775864 1076020308 /nfs/dbraw/zinc/02/03/08/1076020308.db2.gz NIELRBKQWYGEHI-XYPYZODXSA-N -1 3 387.404 -1.996 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@H]1C[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582775864 1076020304 /nfs/dbraw/zinc/02/03/04/1076020304.db2.gz NIELRBKQWYGEHI-XYPYZODXSA-N -1 3 387.404 -1.996 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001582775869 1076020456 /nfs/dbraw/zinc/02/04/56/1076020456.db2.gz NPKRYCKOKOUWEI-NEPJUHHUSA-N -1 3 387.404 -2.641 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001582775869 1076020448 /nfs/dbraw/zinc/02/04/48/1076020448.db2.gz NPKRYCKOKOUWEI-NEPJUHHUSA-N -1 3 387.404 -2.641 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@H]1O ZINC001582775870 1076020402 /nfs/dbraw/zinc/02/04/02/1076020402.db2.gz NPKRYCKOKOUWEI-VXGBXAGGSA-N -1 3 387.404 -2.641 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@H]1O ZINC001582775870 1076020395 /nfs/dbraw/zinc/02/03/95/1076020395.db2.gz NPKRYCKOKOUWEI-VXGBXAGGSA-N -1 3 387.404 -2.641 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001582775879 1076020325 /nfs/dbraw/zinc/02/03/25/1076020325.db2.gz NVGODPWLGMRKDK-UHFFFAOYSA-N -1 3 385.432 -1.222 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001582775879 1076020321 /nfs/dbraw/zinc/02/03/21/1076020321.db2.gz NVGODPWLGMRKDK-UHFFFAOYSA-N -1 3 385.432 -1.222 20 0 GAADHM O=C(CN1CCNC(=O)C1)NCC1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582775909 1076020812 /nfs/dbraw/zinc/02/08/12/1076020812.db2.gz PHBRXEPIIGRFGR-UHFFFAOYSA-N -1 3 387.404 -2.185 20 0 GAADHM O=C(CN1CCNC(=O)C1)NCC1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582775909 1076020806 /nfs/dbraw/zinc/02/08/06/1076020806.db2.gz PHBRXEPIIGRFGR-UHFFFAOYSA-N -1 3 387.404 -2.185 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1CC[C@H](Nc2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001582775917 1076020941 /nfs/dbraw/zinc/02/09/41/1076020941.db2.gz PUNFOLLCJVTPEG-NSHDSACASA-N -1 3 389.395 -1.155 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1CC[C@H](Nc2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001582775917 1076020935 /nfs/dbraw/zinc/02/09/35/1076020935.db2.gz PUNFOLLCJVTPEG-NSHDSACASA-N -1 3 389.395 -1.155 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1[C@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]21 ZINC001582775937 1076021132 /nfs/dbraw/zinc/02/11/32/1076021132.db2.gz QOUCLEPJKQVJIL-JYAVWHMHSA-N -1 3 383.416 -1.756 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1[C@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]21 ZINC001582775937 1076021129 /nfs/dbraw/zinc/02/11/29/1076021129.db2.gz QOUCLEPJKQVJIL-JYAVWHMHSA-N -1 3 383.416 -1.756 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC1CN(Cc2ccc(-c3nn[n-]n3)cc2F)C1 ZINC001582775941 1076021387 /nfs/dbraw/zinc/02/13/87/1076021387.db2.gz QUSCEKANOBIBPF-UHFFFAOYSA-N -1 3 388.407 -1.262 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC1CN(Cc2ccc(-c3nnn[n-]3)cc2F)C1 ZINC001582775941 1076021380 /nfs/dbraw/zinc/02/13/80/1076021380.db2.gz QUSCEKANOBIBPF-UHFFFAOYSA-N -1 3 388.407 -1.262 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001582775942 1076021250 /nfs/dbraw/zinc/02/12/50/1076021250.db2.gz QVOPNBHEBWJKEW-UHFFFAOYSA-N -1 3 387.404 -2.089 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001582775942 1076021245 /nfs/dbraw/zinc/02/12/45/1076021245.db2.gz QVOPNBHEBWJKEW-UHFFFAOYSA-N -1 3 387.404 -2.089 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@H]1CCCN1c1ncccc1-c1nn[n-]n1 ZINC001582775949 1076021189 /nfs/dbraw/zinc/02/11/89/1076021189.db2.gz RJGUFBFDNOSLII-GFCCVEGCSA-N -1 3 385.432 -1.222 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@H]1CCCN1c1ncccc1-c1nnn[n-]1 ZINC001582775949 1076021182 /nfs/dbraw/zinc/02/11/82/1076021182.db2.gz RJGUFBFDNOSLII-GFCCVEGCSA-N -1 3 385.432 -1.222 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@@H]1CCCN1c1ncccc1-c1nn[n-]n1 ZINC001582775950 1076021402 /nfs/dbraw/zinc/02/14/02/1076021402.db2.gz RJGUFBFDNOSLII-LBPRGKRZSA-N -1 3 385.432 -1.222 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@@H]1CCCN1c1ncccc1-c1nnn[n-]1 ZINC001582775950 1076021396 /nfs/dbraw/zinc/02/13/96/1076021396.db2.gz RJGUFBFDNOSLII-LBPRGKRZSA-N -1 3 385.432 -1.222 20 0 GAADHM O=C(CN1CCNC(=O)C1)NCC1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582775975 1076021692 /nfs/dbraw/zinc/02/16/92/1076021692.db2.gz SKBFQGBVDKLKTL-UHFFFAOYSA-N -1 3 387.404 -2.185 20 0 GAADHM O=C(CN1CCNC(=O)C1)NCC1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582775975 1076021685 /nfs/dbraw/zinc/02/16/85/1076021685.db2.gz SKBFQGBVDKLKTL-UHFFFAOYSA-N -1 3 387.404 -2.185 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582776006 1076021811 /nfs/dbraw/zinc/02/18/11/1076021811.db2.gz VBEFBVJJWPKNHQ-LLVKDONJSA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582776006 1076021807 /nfs/dbraw/zinc/02/18/07/1076021807.db2.gz VBEFBVJJWPKNHQ-LLVKDONJSA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582776007 1076021802 /nfs/dbraw/zinc/02/18/02/1076021802.db2.gz VBEFBVJJWPKNHQ-NSHDSACASA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582776007 1076021798 /nfs/dbraw/zinc/02/17/98/1076021798.db2.gz VBEFBVJJWPKNHQ-NSHDSACASA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1CC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582776013 1076022149 /nfs/dbraw/zinc/02/21/49/1076022149.db2.gz VFLLCBAPKMXJES-JTQLQIEISA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1CC[C@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582776013 1076022144 /nfs/dbraw/zinc/02/21/44/1076022144.db2.gz VFLLCBAPKMXJES-JTQLQIEISA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1CC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582776014 1076022057 /nfs/dbraw/zinc/02/20/57/1076022057.db2.gz VFLLCBAPKMXJES-SNVBAGLBSA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1CC[C@@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582776014 1076022050 /nfs/dbraw/zinc/02/20/50/1076022050.db2.gz VFLLCBAPKMXJES-SNVBAGLBSA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582776029 1076022227 /nfs/dbraw/zinc/02/22/27/1076022227.db2.gz VRWGXIPLEQJPQG-JTQLQIEISA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582776029 1076022224 /nfs/dbraw/zinc/02/22/24/1076022224.db2.gz VRWGXIPLEQJPQG-JTQLQIEISA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001582776030 1076022011 /nfs/dbraw/zinc/02/20/11/1076022011.db2.gz VRWGXIPLEQJPQG-SNVBAGLBSA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001582776030 1076022007 /nfs/dbraw/zinc/02/20/07/1076022007.db2.gz VRWGXIPLEQJPQG-SNVBAGLBSA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC1(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001582776042 1076022198 /nfs/dbraw/zinc/02/21/98/1076022198.db2.gz WEWIGOKCAWRYOE-UHFFFAOYSA-N -1 3 387.404 -1.995 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC1(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001582776042 1076022193 /nfs/dbraw/zinc/02/21/93/1076022193.db2.gz WEWIGOKCAWRYOE-UHFFFAOYSA-N -1 3 387.404 -1.995 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@H](O)CNc1ncccc1-c1nn[n-]n1 ZINC001582776043 1076022209 /nfs/dbraw/zinc/02/22/09/1076022209.db2.gz WEZYUUVJNDAZRO-JTQLQIEISA-N -1 3 375.393 -2.418 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@H](O)CNc1ncccc1-c1nnn[n-]1 ZINC001582776043 1076022205 /nfs/dbraw/zinc/02/22/05/1076022205.db2.gz WEZYUUVJNDAZRO-JTQLQIEISA-N -1 3 375.393 -2.418 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@@H](O)CNc1ncccc1-c1nn[n-]n1 ZINC001582776044 1076021987 /nfs/dbraw/zinc/02/19/87/1076021987.db2.gz WEZYUUVJNDAZRO-SNVBAGLBSA-N -1 3 375.393 -2.418 20 0 GAADHM O=C(CN1CCNC(=O)C1)NC[C@@H](O)CNc1ncccc1-c1nnn[n-]1 ZINC001582776044 1076021980 /nfs/dbraw/zinc/02/19/80/1076021980.db2.gz WEZYUUVJNDAZRO-SNVBAGLBSA-N -1 3 375.393 -2.418 20 0 GAADHM O=C(CN1CCNC(=O)C1)NCC1(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001582776053 1076022125 /nfs/dbraw/zinc/02/21/25/1076022125.db2.gz WUDIOCPLRXNRMF-UHFFFAOYSA-N -1 3 387.404 -1.995 20 0 GAADHM O=C(CN1CCNC(=O)C1)NCC1(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001582776053 1076022118 /nfs/dbraw/zinc/02/21/18/1076022118.db2.gz WUDIOCPLRXNRMF-UHFFFAOYSA-N -1 3 387.404 -1.995 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@H]1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582776058 1076022095 /nfs/dbraw/zinc/02/20/95/1076022095.db2.gz XCVWMZBPMMFZHX-PHIMTYICSA-N -1 3 387.404 -1.996 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@H]1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582776058 1076022091 /nfs/dbraw/zinc/02/20/91/1076022091.db2.gz XCVWMZBPMMFZHX-PHIMTYICSA-N -1 3 387.404 -1.996 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@H]1C[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001582776059 1076022037 /nfs/dbraw/zinc/02/20/37/1076022037.db2.gz XCVWMZBPMMFZHX-XYPYZODXSA-N -1 3 387.404 -1.996 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@H]1C[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001582776059 1076022029 /nfs/dbraw/zinc/02/20/29/1076022029.db2.gz XCVWMZBPMMFZHX-XYPYZODXSA-N -1 3 387.404 -1.996 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582776060 1076022080 /nfs/dbraw/zinc/02/20/80/1076022080.db2.gz XEHGHNUNJVYRAP-LLVKDONJSA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582776060 1076022072 /nfs/dbraw/zinc/02/20/72/1076022072.db2.gz XEHGHNUNJVYRAP-LLVKDONJSA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001582776061 1076022539 /nfs/dbraw/zinc/02/25/39/1076022539.db2.gz XEHGHNUNJVYRAP-NSHDSACASA-N -1 3 387.404 -2.043 20 0 GAADHM O=C(CN1CCNC(=O)C1)N1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001582776061 1076022537 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385.388 -1.198 20 0 GAADHM O=C(NC[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776370 1076023032 /nfs/dbraw/zinc/02/30/32/1076023032.db2.gz CWOPLWFKQCDVJN-SKDRFNHKSA-N -1 3 385.388 -1.198 20 0 GAADHM O=C(NC[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776370 1076023025 /nfs/dbraw/zinc/02/30/25/1076023025.db2.gz CWOPLWFKQCDVJN-SKDRFNHKSA-N -1 3 385.388 -1.198 20 0 GAADHM O=C([C@@H]1CC(=O)NC(=O)N1)N1CCCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001582776433 1076022867 /nfs/dbraw/zinc/02/28/67/1076022867.db2.gz FVXCUUHGWXFKJH-NSHDSACASA-N -1 3 385.388 -1.102 20 0 GAADHM O=C([C@@H]1CC(=O)NC(=O)N1)N1CCCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001582776433 1076022860 /nfs/dbraw/zinc/02/28/60/1076022860.db2.gz FVXCUUHGWXFKJH-NSHDSACASA-N -1 3 385.388 -1.102 20 0 GAADHM O=C(NCCN(c1ncccc1-c1nn[n-]n1)C1CC1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776654 1076023053 /nfs/dbraw/zinc/02/30/53/1076023053.db2.gz JKEWDPUPIWDSIR-NSHDSACASA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(NCCN(c1ncccc1-c1nnn[n-]1)C1CC1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776654 1076023048 /nfs/dbraw/zinc/02/30/48/1076023048.db2.gz JKEWDPUPIWDSIR-NSHDSACASA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(N[C@@H]1[C@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]21)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776714 1076022844 /nfs/dbraw/zinc/02/28/44/1076022844.db2.gz LTQCKJNUVOZQAR-IZWKTGJZSA-N -1 3 383.372 -1.589 20 0 GAADHM O=C(N[C@@H]1[C@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]21)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776714 1076022839 /nfs/dbraw/zinc/02/28/39/1076022839.db2.gz LTQCKJNUVOZQAR-IZWKTGJZSA-N -1 3 383.372 -1.589 20 0 GAADHM O=C([C@@H]1CC(=O)NC(=O)N1)N1C[C@@H]2C[C@H]1CN2c1ncccc1-c1nn[n-]n1 ZINC001582776719 1076023203 /nfs/dbraw/zinc/02/32/03/1076023203.db2.gz MAVOPVGETJIQBM-QXEWZRGKSA-N -1 3 383.372 -1.351 20 0 GAADHM O=C([C@@H]1CC(=O)NC(=O)N1)N1C[C@@H]2C[C@H]1CN2c1ncccc1-c1nnn[n-]1 ZINC001582776719 1076023196 /nfs/dbraw/zinc/02/31/96/1076023196.db2.gz MAVOPVGETJIQBM-QXEWZRGKSA-N -1 3 383.372 -1.351 20 0 GAADHM O=C([C@@H]1CS(=O)(=O)CC(=O)N1)N1CCCc2nc(-c3nnn[n-]3)ccc21 ZINC001582776721 1076023286 /nfs/dbraw/zinc/02/32/86/1076023286.db2.gz MBUIQANIBRPROQ-JTQLQIEISA-N -1 3 377.386 -1.546 20 0 GAADHM O=C(N[C@@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776724 1076023438 /nfs/dbraw/zinc/02/34/38/1076023438.db2.gz MGJGPKYWQOFXFT-SCZZXKLOSA-N -1 3 389.351 -1.306 20 0 GAADHM O=C(N[C@@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776724 1076023433 /nfs/dbraw/zinc/02/34/33/1076023433.db2.gz MGJGPKYWQOFXFT-SCZZXKLOSA-N -1 3 389.351 -1.306 20 0 GAADHM O=C(N[C@H]1CCN(c2ncc(-c3nn[n-]n3)cc2F)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776725 1076023414 /nfs/dbraw/zinc/02/34/14/1076023414.db2.gz MGJGPKYWQOFXFT-WPRPVWTQSA-N -1 3 389.351 -1.306 20 0 GAADHM O=C(N[C@H]1CCN(c2ncc(-c3nnn[n-]3)cc2F)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776725 1076023409 /nfs/dbraw/zinc/02/34/09/1076023409.db2.gz MGJGPKYWQOFXFT-WPRPVWTQSA-N -1 3 389.351 -1.306 20 0 GAADHM O=C([C@@H]1CC(=O)NC(=O)N1)N1CCCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001582776727 1076023453 /nfs/dbraw/zinc/02/34/53/1076023453.db2.gz MHFCBUNGPFZGPD-NSHDSACASA-N -1 3 385.388 -1.102 20 0 GAADHM O=C([C@@H]1CC(=O)NC(=O)N1)N1CCCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001582776727 1076023448 /nfs/dbraw/zinc/02/34/48/1076023448.db2.gz MHFCBUNGPFZGPD-NSHDSACASA-N -1 3 385.388 -1.102 20 0 GAADHM O=C(NC1CCN(c2ncccc2-c2nn[n-]n2)CC1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776735 1076023398 /nfs/dbraw/zinc/02/33/98/1076023398.db2.gz MRAZKMWZXFHQMH-NSHDSACASA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(NC1CCN(c2ncccc2-c2nnn[n-]2)CC1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776735 1076023395 /nfs/dbraw/zinc/02/33/95/1076023395.db2.gz MRAZKMWZXFHQMH-NSHDSACASA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(N[C@@H]1CCCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776757 1076023241 /nfs/dbraw/zinc/02/32/41/1076023241.db2.gz NWTKJDDMKPHAOV-SKDRFNHKSA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(N[C@@H]1CCCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776757 1076023233 /nfs/dbraw/zinc/02/32/33/1076023233.db2.gz NWTKJDDMKPHAOV-SKDRFNHKSA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(NCCN(c1ccc(-c2nn[n-]n2)cn1)C1CC1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776806 1076023386 /nfs/dbraw/zinc/02/33/86/1076023386.db2.gz QCFJPMXYQLGCNQ-NSHDSACASA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(NCCN(c1ccc(-c2nnn[n-]2)cn1)C1CC1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776806 1076023381 /nfs/dbraw/zinc/02/33/81/1076023381.db2.gz QCFJPMXYQLGCNQ-NSHDSACASA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(c1cc(-c2nn[n-]n2)c[nH]1)N1CCN(C(=O)[C@@H]2CC(=O)NC(=O)N2)CC1 ZINC001582776823 1076023370 /nfs/dbraw/zinc/02/33/70/1076023370.db2.gz QUWSTGPKTNSMCK-JTQLQIEISA-N -1 3 387.360 -1.923 20 0 GAADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1CCN(C(=O)[C@@H]2CC(=O)NC(=O)N2)CC1 ZINC001582776823 1076023364 /nfs/dbraw/zinc/02/33/64/1076023364.db2.gz QUWSTGPKTNSMCK-JTQLQIEISA-N -1 3 387.360 -1.923 20 0 GAADHM O=C(N[C@H]1CCCN(c2ccc(-c3nn[n-]n3)cn2)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776842 1076023327 /nfs/dbraw/zinc/02/33/27/1076023327.db2.gz RKGHZFMREBVOAK-QWRGUYRKSA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(N[C@H]1CCCN(c2ccc(-c3nnn[n-]3)cn2)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776842 1076023322 /nfs/dbraw/zinc/02/33/22/1076023322.db2.gz RKGHZFMREBVOAK-QWRGUYRKSA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(NCCN(c1ccc(-c2nn[n-]n2)nc1)C1CC1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776864 1076023308 /nfs/dbraw/zinc/02/33/08/1076023308.db2.gz SSYDCTDCMPKOLD-LBPRGKRZSA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(NCCN(c1ccc(-c2nnn[n-]2)nc1)C1CC1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776864 1076023302 /nfs/dbraw/zinc/02/33/02/1076023302.db2.gz SSYDCTDCMPKOLD-LBPRGKRZSA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(NC[C@H]1CCCN1c1ccc(-c2nn[n-]n2)cn1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776877 1076023781 /nfs/dbraw/zinc/02/37/81/1076023781.db2.gz ULYAQGWJFAATAV-MNOVXSKESA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(NC[C@H]1CCCN1c1ccc(-c2nnn[n-]2)cn1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776877 1076023775 /nfs/dbraw/zinc/02/37/75/1076023775.db2.gz ULYAQGWJFAATAV-MNOVXSKESA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(NC[C@@H]1CCCN1c1ccc(-c2nn[n-]n2)cn1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776878 1076023807 /nfs/dbraw/zinc/02/38/07/1076023807.db2.gz ULYAQGWJFAATAV-QWRGUYRKSA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(NC[C@@H]1CCCN1c1ccc(-c2nnn[n-]2)cn1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776878 1076023801 /nfs/dbraw/zinc/02/38/01/1076023801.db2.gz ULYAQGWJFAATAV-QWRGUYRKSA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1CCN(C(=O)[C@@H]2CC(=O)NC(=O)N2)CC1 ZINC001582776904 1076023766 /nfs/dbraw/zinc/02/37/66/1076023766.db2.gz VLARCFORXPSDOA-JTQLQIEISA-N -1 3 387.360 -1.923 20 0 GAADHM O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1CCN(C(=O)[C@@H]2CC(=O)NC(=O)N2)CC1 ZINC001582776904 1076023761 /nfs/dbraw/zinc/02/37/61/1076023761.db2.gz VLARCFORXPSDOA-JTQLQIEISA-N -1 3 387.360 -1.923 20 0 GAADHM O=C(NC1CN(Cc2cc(-c3nn[n-]n3)ccc2F)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776913 1076023666 /nfs/dbraw/zinc/02/36/66/1076023666.db2.gz WBFNFRBUFLPZNW-LBPRGKRZSA-N -1 3 388.363 -1.096 20 0 GAADHM O=C(NC1CN(Cc2cc(-c3nnn[n-]3)ccc2F)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776913 1076023659 /nfs/dbraw/zinc/02/36/59/1076023659.db2.gz WBFNFRBUFLPZNW-LBPRGKRZSA-N -1 3 388.363 -1.096 20 0 GAADHM O=C(Nc1nc2c(cc1-c1nn[n-]n1)CCCC2)[C@@H]1CS(=O)(=O)CC(=O)N1 ZINC001582776923 1076023881 /nfs/dbraw/zinc/02/38/81/1076023881.db2.gz WLSFZIZTKLTOTP-NSHDSACASA-N -1 3 391.413 -1.008 20 0 GAADHM O=C(Nc1nc2c(cc1-c1nnn[n-]1)CCCC2)[C@@H]1CS(=O)(=O)CC(=O)N1 ZINC001582776923 1076023876 /nfs/dbraw/zinc/02/38/76/1076023876.db2.gz WLSFZIZTKLTOTP-NSHDSACASA-N -1 3 391.413 -1.008 20 0 GAADHM O=C([C@@H]1CC(=O)NC(=O)N1)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nn[n-]n2)nc1 ZINC001582776931 1076023910 /nfs/dbraw/zinc/02/39/10/1076023910.db2.gz WZROWBUMWHECLI-NHCYSSNCSA-N -1 3 383.372 -1.351 20 0 GAADHM O=C([C@@H]1CC(=O)NC(=O)N1)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nnn[n-]2)nc1 ZINC001582776931 1076023907 /nfs/dbraw/zinc/02/39/07/1076023907.db2.gz WZROWBUMWHECLI-NHCYSSNCSA-N -1 3 383.372 -1.351 20 0 GAADHM O=C(NC1CN(Cc2cc(F)ccc2-c2nn[n-]n2)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776932 1076023683 /nfs/dbraw/zinc/02/36/83/1076023683.db2.gz XBPZLWBXNJBWME-LBPRGKRZSA-N -1 3 388.363 -1.096 20 0 GAADHM O=C(NC1CN(Cc2cc(F)ccc2-c2nnn[n-]2)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776932 1076023678 /nfs/dbraw/zinc/02/36/78/1076023678.db2.gz XBPZLWBXNJBWME-LBPRGKRZSA-N -1 3 388.363 -1.096 20 0 GAADHM O=C(Nc1nc2n(c1-c1nn[n-]n1)CCS2)[C@@H]1CS(=O)(=O)CC(=O)N1 ZINC001582776941 1076023844 /nfs/dbraw/zinc/02/38/44/1076023844.db2.gz XRGJVXBSJPHTII-YFKPBYRVSA-N -1 3 384.403 -1.979 20 0 GAADHM O=C(Nc1nc2n(c1-c1nnn[n-]1)CCS2)[C@@H]1CS(=O)(=O)CC(=O)N1 ZINC001582776941 1076023839 /nfs/dbraw/zinc/02/38/39/1076023839.db2.gz XRGJVXBSJPHTII-YFKPBYRVSA-N -1 3 384.403 -1.979 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1CCN(C(=O)[C@@H]2CC(=O)NC(=O)N2)CC1 ZINC001582776949 1076023894 /nfs/dbraw/zinc/02/38/94/1076023894.db2.gz YDFYATBIEVMFQP-JTQLQIEISA-N -1 3 387.360 -1.923 20 0 GAADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1CCN(C(=O)[C@@H]2CC(=O)NC(=O)N2)CC1 ZINC001582776949 1076023892 /nfs/dbraw/zinc/02/38/92/1076023892.db2.gz YDFYATBIEVMFQP-JTQLQIEISA-N -1 3 387.360 -1.923 20 0 GAADHM O=C(NC[C@@H]1CCCN1c1ccc(-c2nn[n-]n2)nc1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776956 1076023829 /nfs/dbraw/zinc/02/38/29/1076023829.db2.gz YMJLULHSLPEOIQ-CABZTGNLSA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(NC[C@@H]1CCCN1c1ccc(-c2nnn[n-]2)nc1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776956 1076023826 /nfs/dbraw/zinc/02/38/26/1076023826.db2.gz YMJLULHSLPEOIQ-CABZTGNLSA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(NC[C@H]1CCCN1c1ccc(-c2nn[n-]n2)nc1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776957 1076023740 /nfs/dbraw/zinc/02/37/40/1076023740.db2.gz YMJLULHSLPEOIQ-SKDRFNHKSA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(NC[C@H]1CCCN1c1ccc(-c2nnn[n-]2)nc1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776957 1076023737 /nfs/dbraw/zinc/02/37/37/1076023737.db2.gz YMJLULHSLPEOIQ-SKDRFNHKSA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(NC1CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776958 1076023754 /nfs/dbraw/zinc/02/37/54/1076023754.db2.gz YMKLAHMLJGNUTG-LBPRGKRZSA-N -1 3 388.363 -1.096 20 0 GAADHM O=C(NC1CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776958 1076023750 /nfs/dbraw/zinc/02/37/50/1076023750.db2.gz YMKLAHMLJGNUTG-LBPRGKRZSA-N -1 3 388.363 -1.096 20 0 GAADHM O=C(NC[C@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776959 1076023698 /nfs/dbraw/zinc/02/36/98/1076023698.db2.gz YNKRZIWYBKUDME-KOLCDFICSA-N -1 3 385.388 -1.198 20 0 GAADHM O=C(NC[C@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776959 1076023693 /nfs/dbraw/zinc/02/36/93/1076023693.db2.gz YNKRZIWYBKUDME-KOLCDFICSA-N -1 3 385.388 -1.198 20 0 GAADHM O=C(NC[C@@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776960 1076023791 /nfs/dbraw/zinc/02/37/91/1076023791.db2.gz YNKRZIWYBKUDME-ONGXEEELSA-N -1 3 385.388 -1.198 20 0 GAADHM O=C(NC[C@@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)C1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776960 1076023787 /nfs/dbraw/zinc/02/37/87/1076023787.db2.gz YNKRZIWYBKUDME-ONGXEEELSA-N -1 3 385.388 -1.198 20 0 GAADHM O=C(NC1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776972 1076024169 /nfs/dbraw/zinc/02/41/69/1076024169.db2.gz ZCFHEBKNNVXRFL-NSHDSACASA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(NC1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1)[C@@H]1CC(=O)NC(=O)N1 ZINC001582776972 1076024163 /nfs/dbraw/zinc/02/41/63/1076024163.db2.gz ZCFHEBKNNVXRFL-NSHDSACASA-N -1 3 385.388 -1.055 20 0 GAADHM O=C(CNC(=O)c1ccc(-c2nn[n-]n2)cc1)N1CC[C@H]2OCC(=O)N[C@@H]2C1 ZINC001582777330 1076024698 /nfs/dbraw/zinc/02/46/98/1076024698.db2.gz QNELROKYIWGPEA-CHWSQXEVSA-N -1 3 385.384 -1.288 20 0 GAADHM O=C(CNC(=O)c1ccc(-c2nnn[n-]2)cc1)N1CC[C@H]2OCC(=O)N[C@@H]2C1 ZINC001582777330 1076024692 /nfs/dbraw/zinc/02/46/92/1076024692.db2.gz QNELROKYIWGPEA-CHWSQXEVSA-N -1 3 385.384 -1.288 20 0 GAADHM O=C(CN1CCOCC1=O)N1C[C@@H]2C[C@H]1CN2c1ncccc1-c1nn[n-]n1 ZINC001582777368 1076024495 /nfs/dbraw/zinc/02/44/95/1076024495.db2.gz RYDIKXJYJIHWRS-RYUDHWBXSA-N -1 3 384.400 -1.090 20 0 GAADHM O=C(CN1CCOCC1=O)N1C[C@@H]2C[C@H]1CN2c1ncccc1-c1nnn[n-]1 ZINC001582777368 1076024492 /nfs/dbraw/zinc/02/44/92/1076024492.db2.gz RYDIKXJYJIHWRS-RYUDHWBXSA-N -1 3 384.400 -1.090 20 0 GAADHM O=C([C@H]1COC(=O)N1)N1CC2(C1)CCN(C(=O)c1c[nH]c(-c3nn[n-]n3)c1)C2 ZINC001582777589 1076025007 /nfs/dbraw/zinc/02/50/07/1076025007.db2.gz DBNSFHAVEKCBOY-LLVKDONJSA-N -1 3 386.372 -1.022 20 0 GAADHM O=C([C@H]1COC(=O)N1)N1CC2(C1)CCN(C(=O)c1c[nH]c(-c3nnn[n-]3)c1)C2 ZINC001582777589 1076025004 /nfs/dbraw/zinc/02/50/04/1076025004.db2.gz DBNSFHAVEKCBOY-LLVKDONJSA-N -1 3 386.372 -1.022 20 0 GAADHM O=C([C@@H]1COC(=O)N1)N1CC2(C1)CCN(C(=O)c1c[nH]c(-c3nn[n-]n3)c1)C2 ZINC001582777590 1076025141 /nfs/dbraw/zinc/02/51/41/1076025141.db2.gz DBNSFHAVEKCBOY-NSHDSACASA-N -1 3 386.372 -1.022 20 0 GAADHM O=C([C@@H]1COC(=O)N1)N1CC2(C1)CCN(C(=O)c1c[nH]c(-c3nnn[n-]3)c1)C2 ZINC001582777590 1076025137 /nfs/dbraw/zinc/02/51/37/1076025137.db2.gz DBNSFHAVEKCBOY-NSHDSACASA-N -1 3 386.372 -1.022 20 0 GAADHM O=C1NC(=O)C2(CN(S(=O)(=O)Cc3cc(-c4nn[n-]n4)ccc3F)C2)N1 ZINC001582777645 1076025063 /nfs/dbraw/zinc/02/50/63/1076025063.db2.gz GJYRWKNRDGTHGF-UHFFFAOYSA-N -1 3 381.349 -1.271 20 0 GAADHM O=C([C@H]1COC(=O)N1)N1CC2(C1)CCN(C(=O)c1cc(-c3nn[n-]n3)c[nH]1)C2 ZINC001582777778 1076025021 /nfs/dbraw/zinc/02/50/21/1076025021.db2.gz KWAMFDNZNWAHQX-LLVKDONJSA-N -1 3 386.372 -1.022 20 0 GAADHM O=C([C@H]1COC(=O)N1)N1CC2(C1)CCN(C(=O)c1cc(-c3nnn[n-]3)c[nH]1)C2 ZINC001582777778 1076025017 /nfs/dbraw/zinc/02/50/17/1076025017.db2.gz KWAMFDNZNWAHQX-LLVKDONJSA-N -1 3 386.372 -1.022 20 0 GAADHM O=C([C@@H]1COC(=O)N1)N1CC2(C1)CCN(C(=O)c1cc(-c3nn[n-]n3)c[nH]1)C2 ZINC001582777779 1076025034 /nfs/dbraw/zinc/02/50/34/1076025034.db2.gz KWAMFDNZNWAHQX-NSHDSACASA-N -1 3 386.372 -1.022 20 0 GAADHM O=C([C@@H]1COC(=O)N1)N1CC2(C1)CCN(C(=O)c1cc(-c3nnn[n-]3)c[nH]1)C2 ZINC001582777779 1076025030 /nfs/dbraw/zinc/02/50/30/1076025030.db2.gz KWAMFDNZNWAHQX-NSHDSACASA-N -1 3 386.372 -1.022 20 0 GAADHM O=C(c1cc(-c2nn[n-]n2)c[nH]1)N1CC[C@@H]2CN(C(=O)[C@H]3COC(=O)N3)[C@@H]2C1 ZINC001582777801 1076024996 /nfs/dbraw/zinc/02/49/96/1076024996.db2.gz AIQZHZMHBAVPJF-GGZOMVNGSA-N -1 3 386.372 -1.024 20 0 GAADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1CC[C@@H]2CN(C(=O)[C@H]3COC(=O)N3)[C@@H]2C1 ZINC001582777801 1076024990 /nfs/dbraw/zinc/02/49/90/1076024990.db2.gz AIQZHZMHBAVPJF-GGZOMVNGSA-N -1 3 386.372 -1.024 20 0 GAADHM O=C(c1cc(-c2nn[n-]n2)c[nH]1)N1CC[C@@H]2CN(C(=O)[C@@H]3COC(=O)N3)[C@@H]2C1 ZINC001582777803 1076024919 /nfs/dbraw/zinc/02/49/19/1076024919.db2.gz AIQZHZMHBAVPJF-JFUSQASVSA-N -1 3 386.372 -1.024 20 0 GAADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1CC[C@@H]2CN(C(=O)[C@@H]3COC(=O)N3)[C@@H]2C1 ZINC001582777803 1076024916 /nfs/dbraw/zinc/02/49/16/1076024916.db2.gz AIQZHZMHBAVPJF-JFUSQASVSA-N -1 3 386.372 -1.024 20 0 GAADHM O=C(c1cc(-c2nn[n-]n2)c[nH]1)N1CC[C@H]2CN(C(=O)[C@@H]3COC(=O)N3)C[C@H]21 ZINC001582777879 1076025382 /nfs/dbraw/zinc/02/53/82/1076025382.db2.gz BWDAGNMTJLHVPY-KPXOXKRLSA-N -1 3 386.372 -1.024 20 0 GAADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1CC[C@H]2CN(C(=O)[C@@H]3COC(=O)N3)C[C@H]21 ZINC001582777879 1076025378 /nfs/dbraw/zinc/02/53/78/1076025378.db2.gz BWDAGNMTJLHVPY-KPXOXKRLSA-N -1 3 386.372 -1.024 20 0 GAADHM O=C(c1cc(-c2nn[n-]n2)c[nH]1)N1CC[C@H]2CN(C(=O)[C@H]3COC(=O)N3)C[C@H]21 ZINC001582777881 1076025345 /nfs/dbraw/zinc/02/53/45/1076025345.db2.gz BWDAGNMTJLHVPY-XXILOJSOSA-N -1 3 386.372 -1.024 20 0 GAADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1CC[C@H]2CN(C(=O)[C@H]3COC(=O)N3)C[C@H]21 ZINC001582777881 1076025342 /nfs/dbraw/zinc/02/53/42/1076025342.db2.gz BWDAGNMTJLHVPY-XXILOJSOSA-N -1 3 386.372 -1.024 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@H]3COC(=O)N3)C[C@H]21)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582777974 1076025370 /nfs/dbraw/zinc/02/53/70/1076025370.db2.gz NVQKRKYHRKKHTM-KZFFXBSXSA-N -1 3 386.372 -1.263 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@H]3COC(=O)N3)C[C@H]21)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582777974 1076025365 /nfs/dbraw/zinc/02/53/65/1076025365.db2.gz NVQKRKYHRKKHTM-KZFFXBSXSA-N -1 3 386.372 -1.263 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@@H]3COC(=O)N3)C[C@H]21)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582777976 1076025453 /nfs/dbraw/zinc/02/54/53/1076025453.db2.gz NVQKRKYHRKKHTM-UOKLYIGXSA-N -1 3 386.372 -1.263 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@@H]3COC(=O)N3)C[C@H]21)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582777976 1076025451 /nfs/dbraw/zinc/02/54/51/1076025451.db2.gz NVQKRKYHRKKHTM-UOKLYIGXSA-N -1 3 386.372 -1.263 20 0 GAADHM O=C(c1cc(-c2nn[n-]n2)c[nH]1)N1C[C@H]2CN(C(=O)[C@H]3COC(=O)N3)C[C@H]2C1 ZINC001582778010 1076025315 /nfs/dbraw/zinc/02/53/15/1076025315.db2.gz DJEGPRWRIKOXCH-JFGNBEQYSA-N -1 3 386.372 -1.166 20 0 GAADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1C[C@H]2CN(C(=O)[C@H]3COC(=O)N3)C[C@H]2C1 ZINC001582778010 1076025313 /nfs/dbraw/zinc/02/53/13/1076025313.db2.gz DJEGPRWRIKOXCH-JFGNBEQYSA-N -1 3 386.372 -1.166 20 0 GAADHM O=C(c1cc(-c2nn[n-]n2)c[nH]1)N1C[C@H]2CN(C(=O)[C@@H]3COC(=O)N3)C[C@H]2C1 ZINC001582778011 1076025333 /nfs/dbraw/zinc/02/53/33/1076025333.db2.gz DJEGPRWRIKOXCH-UMNHJUIQSA-N -1 3 386.372 -1.166 20 0 GAADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1C[C@H]2CN(C(=O)[C@@H]3COC(=O)N3)C[C@H]2C1 ZINC001582778011 1076025329 /nfs/dbraw/zinc/02/53/29/1076025329.db2.gz DJEGPRWRIKOXCH-UMNHJUIQSA-N -1 3 386.372 -1.166 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1CC2(C1)CCN(C(=O)[C@H]1COC(=O)N1)C2 ZINC001582778030 1076025479 /nfs/dbraw/zinc/02/54/79/1076025479.db2.gz DZZSYIMYSSORBM-LLVKDONJSA-N -1 3 386.372 -1.022 20 0 GAADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1CC2(C1)CCN(C(=O)[C@H]1COC(=O)N1)C2 ZINC001582778030 1076025472 /nfs/dbraw/zinc/02/54/72/1076025472.db2.gz DZZSYIMYSSORBM-LLVKDONJSA-N -1 3 386.372 -1.022 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1CC2(C1)CCN(C(=O)[C@@H]1COC(=O)N1)C2 ZINC001582778031 1076025549 /nfs/dbraw/zinc/02/55/49/1076025549.db2.gz DZZSYIMYSSORBM-NSHDSACASA-N -1 3 386.372 -1.022 20 0 GAADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1CC2(C1)CCN(C(=O)[C@@H]1COC(=O)N1)C2 ZINC001582778031 1076025541 /nfs/dbraw/zinc/02/55/41/1076025541.db2.gz DZZSYIMYSSORBM-NSHDSACASA-N -1 3 386.372 -1.022 20 0 GAADHM O=C(NC1(CO)CCN(c2ncccc2-c2nn[n-]n2)CC1)[C@H]1COC(=O)N1 ZINC001582778050 1076025421 /nfs/dbraw/zinc/02/54/21/1076025421.db2.gz FMLBXGZCHXSNCR-LLVKDONJSA-N -1 3 388.388 -1.182 20 0 GAADHM O=C(NC1(CO)CCN(c2ncccc2-c2nnn[n-]2)CC1)[C@H]1COC(=O)N1 ZINC001582778050 1076025414 /nfs/dbraw/zinc/02/54/14/1076025414.db2.gz FMLBXGZCHXSNCR-LLVKDONJSA-N -1 3 388.388 -1.182 20 0 GAADHM O=C(NC1(CO)CCN(c2ncccc2-c2nn[n-]n2)CC1)[C@@H]1COC(=O)N1 ZINC001582778051 1076025587 /nfs/dbraw/zinc/02/55/87/1076025587.db2.gz FMLBXGZCHXSNCR-NSHDSACASA-N -1 3 388.388 -1.182 20 0 GAADHM O=C(NC1(CO)CCN(c2ncccc2-c2nnn[n-]2)CC1)[C@@H]1COC(=O)N1 ZINC001582778051 1076025581 /nfs/dbraw/zinc/02/55/81/1076025581.db2.gz FMLBXGZCHXSNCR-NSHDSACASA-N -1 3 388.388 -1.182 20 0 GAADHM O=C(N[C@]1(CO)CCCN(c2ccc(-c3nn[n-]n3)cn2)C1)[C@H]1COC(=O)N1 ZINC001582778086 1076025392 /nfs/dbraw/zinc/02/53/92/1076025392.db2.gz GANOJMAKJBXDHV-BDJLRTHQSA-N -1 3 388.388 -1.182 20 0 GAADHM O=C(N[C@]1(CO)CCCN(c2ccc(-c3nnn[n-]3)cn2)C1)[C@H]1COC(=O)N1 ZINC001582778086 1076025388 /nfs/dbraw/zinc/02/53/88/1076025388.db2.gz GANOJMAKJBXDHV-BDJLRTHQSA-N -1 3 388.388 -1.182 20 0 GAADHM O=C(N[C@@]1(CO)CCCN(c2ccc(-c3nn[n-]n3)cn2)C1)[C@H]1COC(=O)N1 ZINC001582778087 1076025507 /nfs/dbraw/zinc/02/55/07/1076025507.db2.gz GANOJMAKJBXDHV-BZNIZROVSA-N -1 3 388.388 -1.182 20 0 GAADHM O=C(N[C@@]1(CO)CCCN(c2ccc(-c3nnn[n-]3)cn2)C1)[C@H]1COC(=O)N1 ZINC001582778087 1076025501 /nfs/dbraw/zinc/02/55/01/1076025501.db2.gz GANOJMAKJBXDHV-BZNIZROVSA-N -1 3 388.388 -1.182 20 0 GAADHM O=C(N[C@]1(CO)CCCN(c2ccc(-c3nn[n-]n3)cn2)C1)[C@@H]1COC(=O)N1 ZINC001582778088 1076025814 /nfs/dbraw/zinc/02/58/14/1076025814.db2.gz GANOJMAKJBXDHV-MEDUHNTESA-N -1 3 388.388 -1.182 20 0 GAADHM O=C(N[C@]1(CO)CCCN(c2ccc(-c3nnn[n-]3)cn2)C1)[C@@H]1COC(=O)N1 ZINC001582778088 1076025807 /nfs/dbraw/zinc/02/58/07/1076025807.db2.gz GANOJMAKJBXDHV-MEDUHNTESA-N -1 3 388.388 -1.182 20 0 GAADHM O=C(N[C@@]1(CO)CCCN(c2ccc(-c3nn[n-]n3)cn2)C1)[C@@H]1COC(=O)N1 ZINC001582778089 1076025878 /nfs/dbraw/zinc/02/58/78/1076025878.db2.gz GANOJMAKJBXDHV-ZBEGNZNMSA-N -1 3 388.388 -1.182 20 0 GAADHM O=C(N[C@@]1(CO)CCCN(c2ccc(-c3nnn[n-]3)cn2)C1)[C@@H]1COC(=O)N1 ZINC001582778089 1076025872 /nfs/dbraw/zinc/02/58/72/1076025872.db2.gz GANOJMAKJBXDHV-ZBEGNZNMSA-N -1 3 388.388 -1.182 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@@H]3COC(=O)N3)C[C@H]21)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582778119 1076025895 /nfs/dbraw/zinc/02/58/95/1076025895.db2.gz PDKJABRQDQTLNQ-GUDRVLHUSA-N -1 3 386.372 -1.263 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@@H]3COC(=O)N3)C[C@H]21)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582778119 1076025891 /nfs/dbraw/zinc/02/58/91/1076025891.db2.gz PDKJABRQDQTLNQ-GUDRVLHUSA-N -1 3 386.372 -1.263 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@H]3COC(=O)N3)C[C@H]21)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582778120 1076025776 /nfs/dbraw/zinc/02/57/76/1076025776.db2.gz PDKJABRQDQTLNQ-MWGHHZFTSA-N -1 3 386.372 -1.263 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@H]3COC(=O)N3)C[C@H]21)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582778120 1076025769 /nfs/dbraw/zinc/02/57/69/1076025769.db2.gz PDKJABRQDQTLNQ-MWGHHZFTSA-N -1 3 386.372 -1.263 20 0 GAADHM O=C1NC(=O)C2(CN(S(=O)(=O)Cc3ccc(F)cc3-c3nn[n-]n3)C2)N1 ZINC001582778126 1076025922 /nfs/dbraw/zinc/02/59/22/1076025922.db2.gz PLGLDHUKQGPNTP-UHFFFAOYSA-N -1 3 381.349 -1.271 20 0 GAADHM O=C1NC(=O)C2(CN(S(=O)(=O)Cc3ccc(F)cc3-c3nnn[n-]3)C2)N1 ZINC001582778126 1076025919 /nfs/dbraw/zinc/02/59/19/1076025919.db2.gz PLGLDHUKQGPNTP-UHFFFAOYSA-N -1 3 381.349 -1.271 20 0 GAADHM O=C([C@H]1COC(=O)N1)N1CC2(C1)CCN(C(=O)c1ccc(-c3nn[n-]n3)[nH]1)C2 ZINC001582778161 1076025974 /nfs/dbraw/zinc/02/59/74/1076025974.db2.gz RAMKZHIYVTUFKH-LLVKDONJSA-N -1 3 386.372 -1.022 20 0 GAADHM O=C([C@H]1COC(=O)N1)N1CC2(C1)CCN(C(=O)c1ccc(-c3nnn[n-]3)[nH]1)C2 ZINC001582778161 1076025970 /nfs/dbraw/zinc/02/59/70/1076025970.db2.gz RAMKZHIYVTUFKH-LLVKDONJSA-N -1 3 386.372 -1.022 20 0 GAADHM O=C([C@@H]1COC(=O)N1)N1CC2(C1)CCN(C(=O)c1ccc(-c3nn[n-]n3)[nH]1)C2 ZINC001582778162 1076025909 /nfs/dbraw/zinc/02/59/09/1076025909.db2.gz RAMKZHIYVTUFKH-NSHDSACASA-N -1 3 386.372 -1.022 20 0 GAADHM O=C([C@@H]1COC(=O)N1)N1CC2(C1)CCN(C(=O)c1ccc(-c3nnn[n-]3)[nH]1)C2 ZINC001582778162 1076025904 /nfs/dbraw/zinc/02/59/04/1076025904.db2.gz RAMKZHIYVTUFKH-NSHDSACASA-N -1 3 386.372 -1.022 20 0 GAADHM O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1CC[C@@H]2CN(C(=O)[C@H]3COC(=O)N3)[C@@H]2C1 ZINC001582778252 1076025857 /nfs/dbraw/zinc/02/58/57/1076025857.db2.gz HTXLMTPAEAGQSH-GGZOMVNGSA-N -1 3 386.372 -1.024 20 0 GAADHM O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1CC[C@@H]2CN(C(=O)[C@H]3COC(=O)N3)[C@@H]2C1 ZINC001582778252 1076025852 /nfs/dbraw/zinc/02/58/52/1076025852.db2.gz HTXLMTPAEAGQSH-GGZOMVNGSA-N -1 3 386.372 -1.024 20 0 GAADHM O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1CC[C@@H]2CN(C(=O)[C@@H]3COC(=O)N3)[C@@H]2C1 ZINC001582778253 1076025752 /nfs/dbraw/zinc/02/57/52/1076025752.db2.gz HTXLMTPAEAGQSH-JFUSQASVSA-N -1 3 386.372 -1.024 20 0 GAADHM O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1CC[C@@H]2CN(C(=O)[C@@H]3COC(=O)N3)[C@@H]2C1 ZINC001582778253 1076025747 /nfs/dbraw/zinc/02/57/47/1076025747.db2.gz HTXLMTPAEAGQSH-JFUSQASVSA-N -1 3 386.372 -1.024 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@H]1COC(=O)N1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582778461 1076026450 /nfs/dbraw/zinc/02/64/50/1076026450.db2.gz KZHYDHJBMBVNQA-GXSJLCMTSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@H]1COC(=O)N1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582778461 1076026443 /nfs/dbraw/zinc/02/64/43/1076026443.db2.gz KZHYDHJBMBVNQA-GXSJLCMTSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@@H]1COC(=O)N1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582778462 1076026428 /nfs/dbraw/zinc/02/64/28/1076026428.db2.gz KZHYDHJBMBVNQA-KOLCDFICSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@@H]1COC(=O)N1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582778462 1076026422 /nfs/dbraw/zinc/02/64/22/1076026422.db2.gz KZHYDHJBMBVNQA-KOLCDFICSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@H]1COC(=O)N1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582778463 1076026366 /nfs/dbraw/zinc/02/63/66/1076026366.db2.gz KZHYDHJBMBVNQA-MWLCHTKSSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@H]1COC(=O)N1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582778463 1076026362 /nfs/dbraw/zinc/02/63/62/1076026362.db2.gz KZHYDHJBMBVNQA-MWLCHTKSSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@@H]1COC(=O)N1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582778465 1076026229 /nfs/dbraw/zinc/02/62/29/1076026229.db2.gz KZHYDHJBMBVNQA-ONGXEEELSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@@H]1COC(=O)N1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582778465 1076026226 /nfs/dbraw/zinc/02/62/26/1076026226.db2.gz KZHYDHJBMBVNQA-ONGXEEELSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@H]1COC(=O)N1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582778524 1076026399 /nfs/dbraw/zinc/02/63/99/1076026399.db2.gz LCSGNTZSFKKIRT-GXSJLCMTSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@H]1COC(=O)N1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582778524 1076026392 /nfs/dbraw/zinc/02/63/92/1076026392.db2.gz LCSGNTZSFKKIRT-GXSJLCMTSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@@H]1COC(=O)N1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582778525 1076026163 /nfs/dbraw/zinc/02/61/63/1076026163.db2.gz LCSGNTZSFKKIRT-KOLCDFICSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@@H]1COC(=O)N1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582778525 1076026157 /nfs/dbraw/zinc/02/61/57/1076026157.db2.gz LCSGNTZSFKKIRT-KOLCDFICSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@H]1COC(=O)N1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582778527 1076026349 /nfs/dbraw/zinc/02/63/49/1076026349.db2.gz LCSGNTZSFKKIRT-MWLCHTKSSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@H]1COC(=O)N1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582778527 1076026342 /nfs/dbraw/zinc/02/63/42/1076026342.db2.gz LCSGNTZSFKKIRT-MWLCHTKSSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@@H]1COC(=O)N1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582778530 1076026283 /nfs/dbraw/zinc/02/62/83/1076026283.db2.gz LCSGNTZSFKKIRT-ONGXEEELSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@@H]1COC(=O)N1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582778530 1076026276 /nfs/dbraw/zinc/02/62/76/1076026276.db2.gz LCSGNTZSFKKIRT-ONGXEEELSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1CC[C@H]2CN(C(=O)[C@@H]3COC(=O)N3)C[C@H]21 ZINC001582778549 1076026327 /nfs/dbraw/zinc/02/63/27/1076026327.db2.gz LDYRVFAHYGQVOJ-KPXOXKRLSA-N -1 3 386.372 -1.024 20 0 GAADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1CC[C@H]2CN(C(=O)[C@@H]3COC(=O)N3)C[C@H]21 ZINC001582778549 1076026319 /nfs/dbraw/zinc/02/63/19/1076026319.db2.gz LDYRVFAHYGQVOJ-KPXOXKRLSA-N -1 3 386.372 -1.024 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1CC[C@H]2CN(C(=O)[C@H]3COC(=O)N3)C[C@H]21 ZINC001582778551 1076026264 /nfs/dbraw/zinc/02/62/64/1076026264.db2.gz LDYRVFAHYGQVOJ-XXILOJSOSA-N -1 3 386.372 -1.024 20 0 GAADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1CC[C@H]2CN(C(=O)[C@H]3COC(=O)N3)C[C@H]21 ZINC001582778551 1076026260 /nfs/dbraw/zinc/02/62/60/1076026260.db2.gz LDYRVFAHYGQVOJ-XXILOJSOSA-N -1 3 386.372 -1.024 20 0 GAADHM O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1C[C@@H]2CN(C(=O)[C@H]3COC(=O)N3)C[C@@H]2C1 ZINC001582778574 1076026245 /nfs/dbraw/zinc/02/62/45/1076026245.db2.gz LIPXUMZTEAJRMP-JFGNBEQYSA-N -1 3 386.372 -1.166 20 0 GAADHM O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1C[C@@H]2CN(C(=O)[C@H]3COC(=O)N3)C[C@@H]2C1 ZINC001582778574 1076026239 /nfs/dbraw/zinc/02/62/39/1076026239.db2.gz LIPXUMZTEAJRMP-JFGNBEQYSA-N -1 3 386.372 -1.166 20 0 GAADHM O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1C[C@@H]2CN(C(=O)[C@@H]3COC(=O)N3)C[C@@H]2C1 ZINC001582778575 1076026143 /nfs/dbraw/zinc/02/61/43/1076026143.db2.gz LIPXUMZTEAJRMP-UMNHJUIQSA-N -1 3 386.372 -1.166 20 0 GAADHM O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1C[C@@H]2CN(C(=O)[C@@H]3COC(=O)N3)C[C@@H]2C1 ZINC001582778575 1076026137 /nfs/dbraw/zinc/02/61/37/1076026137.db2.gz LIPXUMZTEAJRMP-UMNHJUIQSA-N -1 3 386.372 -1.166 20 0 GAADHM O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1C[C@H]2CCN(C(=O)[C@H]3COC(=O)N3)C[C@H]21 ZINC001582778625 1076026215 /nfs/dbraw/zinc/02/62/15/1076026215.db2.gz MEZGDQWFWGQVOZ-GGZOMVNGSA-N -1 3 386.372 -1.024 20 0 GAADHM O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1C[C@H]2CCN(C(=O)[C@H]3COC(=O)N3)C[C@H]21 ZINC001582778625 1076026209 /nfs/dbraw/zinc/02/62/09/1076026209.db2.gz MEZGDQWFWGQVOZ-GGZOMVNGSA-N -1 3 386.372 -1.024 20 0 GAADHM O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1C[C@H]2CCN(C(=O)[C@@H]3COC(=O)N3)C[C@H]21 ZINC001582778626 1076026797 /nfs/dbraw/zinc/02/67/97/1076026797.db2.gz 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GAADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1C[C@@H]2CCN(C(=O)[C@H]3COC(=O)N3)[C@@H]2C1 ZINC001582779143 1076027770 /nfs/dbraw/zinc/02/77/70/1076027770.db2.gz XXELHHPBZAFWFW-XXILOJSOSA-N -1 3 386.372 -1.024 20 0 GAADHM O=C(N[C@]1(CO)CCCN(c2ncccc2-c2nn[n-]n2)C1)[C@H]1COC(=O)N1 ZINC001582779228 1076027491 /nfs/dbraw/zinc/02/74/91/1076027491.db2.gz ZXZCEXAPAPGONH-BDJLRTHQSA-N -1 3 388.388 -1.182 20 0 GAADHM O=C(N[C@]1(CO)CCCN(c2ncccc2-c2nnn[n-]2)C1)[C@H]1COC(=O)N1 ZINC001582779228 1076027484 /nfs/dbraw/zinc/02/74/84/1076027484.db2.gz ZXZCEXAPAPGONH-BDJLRTHQSA-N -1 3 388.388 -1.182 20 0 GAADHM O=C(N[C@@]1(CO)CCCN(c2ncccc2-c2nn[n-]n2)C1)[C@H]1COC(=O)N1 ZINC001582779229 1076027704 /nfs/dbraw/zinc/02/77/04/1076027704.db2.gz ZXZCEXAPAPGONH-BZNIZROVSA-N -1 3 388.388 -1.182 20 0 GAADHM O=C(N[C@@]1(CO)CCCN(c2ncccc2-c2nnn[n-]2)C1)[C@H]1COC(=O)N1 ZINC001582779229 1076027700 /nfs/dbraw/zinc/02/77/00/1076027700.db2.gz ZXZCEXAPAPGONH-BZNIZROVSA-N -1 3 388.388 -1.182 20 0 GAADHM 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GAADHM O=C(NCC1(O)CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C1)[C@@H]1COC(=O)N1 ZINC001582779881 1076028510 /nfs/dbraw/zinc/02/85/10/1076028510.db2.gz FUHNFQFBHBDVKO-LBPRGKRZSA-N -1 3 391.363 -1.223 20 0 GAADHM O=C(NCC1(O)CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C1)[C@@H]1COC(=O)N1 ZINC001582779881 1076028506 /nfs/dbraw/zinc/02/85/06/1076028506.db2.gz FUHNFQFBHBDVKO-LBPRGKRZSA-N -1 3 391.363 -1.223 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]21)[C@@H]1COC(=O)N1 ZINC001582779887 1076028570 /nfs/dbraw/zinc/02/85/70/1076028570.db2.gz FYHWNVLKYBRUSO-GUDRVLHUSA-N -1 3 386.372 -1.263 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]21)[C@@H]1COC(=O)N1 ZINC001582779887 1076028564 /nfs/dbraw/zinc/02/85/64/1076028564.db2.gz FYHWNVLKYBRUSO-GUDRVLHUSA-N -1 3 386.372 -1.263 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]21)[C@H]1COC(=O)N1 ZINC001582779888 1076028549 /nfs/dbraw/zinc/02/85/49/1076028549.db2.gz FYHWNVLKYBRUSO-MWGHHZFTSA-N -1 3 386.372 -1.263 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O=C(NCCN1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1)[C@H]1COC(=O)N1 ZINC001582779918 1076028591 /nfs/dbraw/zinc/02/85/91/1076028591.db2.gz GQWQBRYOGMKEGC-CYBMUJFWSA-N -1 3 387.404 -1.392 20 0 GAADHM O=C(NCCN1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1)[C@H]1COC(=O)N1 ZINC001582779918 1076028586 /nfs/dbraw/zinc/02/85/86/1076028586.db2.gz GQWQBRYOGMKEGC-CYBMUJFWSA-N -1 3 387.404 -1.392 20 0 GAADHM O=C(NCCN1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1)[C@@H]1COC(=O)N1 ZINC001582779919 1076028494 /nfs/dbraw/zinc/02/84/94/1076028494.db2.gz GQWQBRYOGMKEGC-ZDUSSCGKSA-N -1 3 387.404 -1.392 20 0 GAADHM O=C(NCCN1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1)[C@@H]1COC(=O)N1 ZINC001582779919 1076028492 /nfs/dbraw/zinc/02/84/92/1076028492.db2.gz GQWQBRYOGMKEGC-ZDUSSCGKSA-N -1 3 387.404 -1.392 20 0 GAADHM O=C(NC[C@H](O)CNc1ncc(-c2nn[n-]n2)cc1Cl)[C@@H]1COC(=O)N1 ZINC001582779960 1076028534 /nfs/dbraw/zinc/02/85/34/1076028534.db2.gz HIKCTWTULZBSNP-APPZFPTMSA-N -1 3 382.768 -1.088 20 0 GAADHM O=C(NC[C@H](O)CNc1ncc(-c2nnn[n-]2)cc1Cl)[C@@H]1COC(=O)N1 ZINC001582779960 1076028528 /nfs/dbraw/zinc/02/85/28/1076028528.db2.gz HIKCTWTULZBSNP-APPZFPTMSA-N -1 3 382.768 -1.088 20 0 GAADHM O=C(NC[C@@H](O)CNc1ncc(-c2nn[n-]n2)cc1Cl)[C@@H]1COC(=O)N1 ZINC001582779961 1076028610 /nfs/dbraw/zinc/02/86/10/1076028610.db2.gz HIKCTWTULZBSNP-CBAPKCEASA-N -1 3 382.768 -1.088 20 0 GAADHM O=C(NC[C@@H](O)CNc1ncc(-c2nnn[n-]2)cc1Cl)[C@@H]1COC(=O)N1 ZINC001582779961 1076028605 /nfs/dbraw/zinc/02/86/05/1076028605.db2.gz HIKCTWTULZBSNP-CBAPKCEASA-N -1 3 382.768 -1.088 20 0 GAADHM O=C(NC[C@@H](O)CNc1ncc(-c2nn[n-]n2)cc1Cl)[C@H]1COC(=O)N1 ZINC001582779962 1076028433 /nfs/dbraw/zinc/02/84/33/1076028433.db2.gz HIKCTWTULZBSNP-IONNQARKSA-N -1 3 382.768 -1.088 20 0 GAADHM O=C(NC[C@@H](O)CNc1ncc(-c2nnn[n-]2)cc1Cl)[C@H]1COC(=O)N1 ZINC001582779962 1076028431 /nfs/dbraw/zinc/02/84/31/1076028431.db2.gz HIKCTWTULZBSNP-IONNQARKSA-N -1 3 382.768 -1.088 20 0 GAADHM O=C(NC[C@H](O)CNc1ncc(-c2nn[n-]n2)cc1Cl)[C@H]1COC(=O)N1 ZINC001582779963 1076028898 /nfs/dbraw/zinc/02/88/98/1076028898.db2.gz HIKCTWTULZBSNP-VXNVDRBHSA-N -1 3 382.768 -1.088 20 0 GAADHM O=C(NC[C@H](O)CNc1ncc(-c2nnn[n-]2)cc1Cl)[C@H]1COC(=O)N1 ZINC001582779963 1076028892 /nfs/dbraw/zinc/02/88/92/1076028892.db2.gz HIKCTWTULZBSNP-VXNVDRBHSA-N -1 3 382.768 -1.088 20 0 GAADHM O=C(NCCN1CCN(c2ncccc2-c2nn[n-]n2)CC1)[C@H]1COC(=O)N1 ZINC001582780062 1076029078 /nfs/dbraw/zinc/02/90/78/1076029078.db2.gz IILBXRXAMANDQG-GFCCVEGCSA-N -1 3 387.404 -1.392 20 0 GAADHM O=C(NCCN1CCN(c2ncccc2-c2nnn[n-]2)CC1)[C@H]1COC(=O)N1 ZINC001582780062 1076029073 /nfs/dbraw/zinc/02/90/73/1076029073.db2.gz IILBXRXAMANDQG-GFCCVEGCSA-N -1 3 387.404 -1.392 20 0 GAADHM O=C(NCCN1CCN(c2ncccc2-c2nn[n-]n2)CC1)[C@@H]1COC(=O)N1 ZINC001582780063 1076029028 /nfs/dbraw/zinc/02/90/28/1076029028.db2.gz IILBXRXAMANDQG-LBPRGKRZSA-N -1 3 387.404 -1.392 20 0 GAADHM O=C(NCCN1CCN(c2ncccc2-c2nnn[n-]2)CC1)[C@@H]1COC(=O)N1 ZINC001582780063 1076029022 /nfs/dbraw/zinc/02/90/22/1076029022.db2.gz IILBXRXAMANDQG-LBPRGKRZSA-N -1 3 387.404 -1.392 20 0 GAADHM O=C(NCC1(O)CN(Cc2ccc(-c3nn[n-]n3)cc2F)C1)[C@H]1COC(=O)N1 ZINC001582780112 1076029104 /nfs/dbraw/zinc/02/91/04/1076029104.db2.gz JENAUUVPZBLYHM-GFCCVEGCSA-N -1 3 391.363 -1.223 20 0 GAADHM O=C(NCC1(O)CN(Cc2ccc(-c3nnn[n-]3)cc2F)C1)[C@H]1COC(=O)N1 ZINC001582780112 1076029101 /nfs/dbraw/zinc/02/91/01/1076029101.db2.gz JENAUUVPZBLYHM-GFCCVEGCSA-N -1 3 391.363 -1.223 20 0 GAADHM O=C(NCC1(O)CN(Cc2ccc(-c3nn[n-]n3)cc2F)C1)[C@@H]1COC(=O)N1 ZINC001582780113 1076028794 /nfs/dbraw/zinc/02/87/94/1076028794.db2.gz JENAUUVPZBLYHM-LBPRGKRZSA-N -1 3 391.363 -1.223 20 0 GAADHM O=C(NCC1(O)CN(Cc2ccc(-c3nnn[n-]3)cc2F)C1)[C@@H]1COC(=O)N1 ZINC001582780113 1076028786 /nfs/dbraw/zinc/02/87/86/1076028786.db2.gz JENAUUVPZBLYHM-LBPRGKRZSA-N -1 3 391.363 -1.223 20 0 GAADHM O=C(NCCN1CCN(c2cnc(-c3nnn[n-]3)cn2)CC1)[C@H]1COC(=O)N1 ZINC001582780262 1076028858 /nfs/dbraw/zinc/02/88/58/1076028858.db2.gz LONXVUTYMPICSE-LLVKDONJSA-N -1 3 388.392 -1.997 20 0 GAADHM O=C(NCCN1CCN(c2cnc(-c3nnn[n-]3)cn2)CC1)[C@@H]1COC(=O)N1 ZINC001582780263 1076029518 /nfs/dbraw/zinc/02/95/18/1076029518.db2.gz LONXVUTYMPICSE-NSHDSACASA-N -1 3 388.392 -1.997 20 0 GAADHM O=C(NCC1(O)CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C1)[C@H]1COC(=O)N1 ZINC001582780282 1076029265 /nfs/dbraw/zinc/02/92/65/1076029265.db2.gz LWVGCPGKAZSONI-GFCCVEGCSA-N -1 3 391.363 -1.223 20 0 GAADHM O=C(NCC1(O)CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C1)[C@H]1COC(=O)N1 ZINC001582780282 1076029259 /nfs/dbraw/zinc/02/92/59/1076029259.db2.gz LWVGCPGKAZSONI-GFCCVEGCSA-N -1 3 391.363 -1.223 20 0 GAADHM O=C(NCC1(O)CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C1)[C@@H]1COC(=O)N1 ZINC001582780283 1076029279 /nfs/dbraw/zinc/02/92/79/1076029279.db2.gz LWVGCPGKAZSONI-LBPRGKRZSA-N -1 3 391.363 -1.223 20 0 GAADHM O=C(NCC1(O)CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C1)[C@@H]1COC(=O)N1 ZINC001582780283 1076029275 /nfs/dbraw/zinc/02/92/75/1076029275.db2.gz LWVGCPGKAZSONI-LBPRGKRZSA-N -1 3 391.363 -1.223 20 0 GAADHM O=C(NC[C@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1)[C@H]1COC(=O)N1 ZINC001582780396 1076029247 /nfs/dbraw/zinc/02/92/47/1076029247.db2.gz NZDVNASRULIPCU-GXSJLCMTSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1)[C@H]1COC(=O)N1 ZINC001582780396 1076029241 /nfs/dbraw/zinc/02/92/41/1076029241.db2.gz NZDVNASRULIPCU-GXSJLCMTSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1)[C@@H]1COC(=O)N1 ZINC001582780397 1076029433 /nfs/dbraw/zinc/02/94/33/1076029433.db2.gz NZDVNASRULIPCU-KOLCDFICSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1)[C@@H]1COC(=O)N1 ZINC001582780397 1076029426 /nfs/dbraw/zinc/02/94/26/1076029426.db2.gz NZDVNASRULIPCU-KOLCDFICSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1)[C@H]1COC(=O)N1 ZINC001582780398 1076029322 /nfs/dbraw/zinc/02/93/22/1076029322.db2.gz NZDVNASRULIPCU-MWLCHTKSSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1)[C@H]1COC(=O)N1 ZINC001582780398 1076029317 /nfs/dbraw/zinc/02/93/17/1076029317.db2.gz NZDVNASRULIPCU-MWLCHTKSSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1)[C@@H]1COC(=O)N1 ZINC001582780399 1076029552 /nfs/dbraw/zinc/02/95/52/1076029552.db2.gz NZDVNASRULIPCU-ONGXEEELSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1)[C@@H]1COC(=O)N1 ZINC001582780399 1076029547 /nfs/dbraw/zinc/02/95/47/1076029547.db2.gz NZDVNASRULIPCU-ONGXEEELSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1)[C@H]1COC(=O)N1 ZINC001582780422 1076029742 /nfs/dbraw/zinc/02/97/42/1076029742.db2.gz OIVZDDKXUAYKET-GXSJLCMTSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1)[C@H]1COC(=O)N1 ZINC001582780422 1076029738 /nfs/dbraw/zinc/02/97/38/1076029738.db2.gz OIVZDDKXUAYKET-GXSJLCMTSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1)[C@@H]1COC(=O)N1 ZINC001582780423 1076029797 /nfs/dbraw/zinc/02/97/97/1076029797.db2.gz OIVZDDKXUAYKET-KOLCDFICSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1)[C@@H]1COC(=O)N1 ZINC001582780423 1076029794 /nfs/dbraw/zinc/02/97/94/1076029794.db2.gz OIVZDDKXUAYKET-KOLCDFICSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1)[C@H]1COC(=O)N1 ZINC001582780424 1076029768 /nfs/dbraw/zinc/02/97/68/1076029768.db2.gz OIVZDDKXUAYKET-MWLCHTKSSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1)[C@H]1COC(=O)N1 ZINC001582780424 1076029764 /nfs/dbraw/zinc/02/97/64/1076029764.db2.gz OIVZDDKXUAYKET-MWLCHTKSSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1)[C@@H]1COC(=O)N1 ZINC001582780425 1076029929 /nfs/dbraw/zinc/02/99/29/1076029929.db2.gz OIVZDDKXUAYKET-ONGXEEELSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1)[C@@H]1COC(=O)N1 ZINC001582780425 1076029923 /nfs/dbraw/zinc/02/99/23/1076029923.db2.gz OIVZDDKXUAYKET-ONGXEEELSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NCC1(O)CN(Cc2ccc(-c3nnn[n-]3)s2)C1)[C@H]1COC(=O)N1 ZINC001582780528 1076030323 /nfs/dbraw/zinc/03/03/23/1076030323.db2.gz PXBQSSPTSOELQF-SECBINFHSA-N -1 3 379.402 -1.301 20 0 GAADHM O=C(NCC1(O)CN(Cc2ccc(-c3nnn[n-]3)s2)C1)[C@@H]1COC(=O)N1 ZINC001582780529 1076030257 /nfs/dbraw/zinc/03/02/57/1076030257.db2.gz PXBQSSPTSOELQF-VIFPVBQESA-N -1 3 379.402 -1.301 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1)[C@H]1COC(=O)N1 ZINC001582780814 1076030628 /nfs/dbraw/zinc/03/06/28/1076030628.db2.gz VIZOVMRMVHGMAQ-BMIGLBTASA-N -1 3 392.351 -1.433 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1)[C@H]1COC(=O)N1 ZINC001582780814 1076030623 /nfs/dbraw/zinc/03/06/23/1076030623.db2.gz VIZOVMRMVHGMAQ-BMIGLBTASA-N -1 3 392.351 -1.433 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1)[C@@H]1COC(=O)N1 ZINC001582780815 1076030749 /nfs/dbraw/zinc/03/07/49/1076030749.db2.gz VIZOVMRMVHGMAQ-BONVTDFDSA-N -1 3 392.351 -1.433 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1)[C@@H]1COC(=O)N1 ZINC001582780815 1076030742 /nfs/dbraw/zinc/03/07/42/1076030742.db2.gz VIZOVMRMVHGMAQ-BONVTDFDSA-N -1 3 392.351 -1.433 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1)[C@H]1COC(=O)N1 ZINC001582780816 1076030662 /nfs/dbraw/zinc/03/06/62/1076030662.db2.gz VIZOVMRMVHGMAQ-MEBBXXQBSA-N -1 3 392.351 -1.433 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1)[C@H]1COC(=O)N1 ZINC001582780816 1076030658 /nfs/dbraw/zinc/03/06/58/1076030658.db2.gz VIZOVMRMVHGMAQ-MEBBXXQBSA-N -1 3 392.351 -1.433 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1)[C@@H]1COC(=O)N1 ZINC001582780817 1076030613 /nfs/dbraw/zinc/03/06/13/1076030613.db2.gz VIZOVMRMVHGMAQ-ZUZCIYMTSA-N -1 3 392.351 -1.433 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1)[C@@H]1COC(=O)N1 ZINC001582780817 1076030610 /nfs/dbraw/zinc/03/06/10/1076030610.db2.gz VIZOVMRMVHGMAQ-ZUZCIYMTSA-N -1 3 392.351 -1.433 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ncc(-c2nn[n-]n2)cc1F)[C@H]1COC(=O)N1 ZINC001582780822 1076030648 /nfs/dbraw/zinc/03/06/48/1076030648.db2.gz VPYPHBUWQWGSDR-GXSJLCMTSA-N -1 3 392.351 -1.169 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ncc(-c2nnn[n-]2)cc1F)[C@H]1COC(=O)N1 ZINC001582780822 1076030643 /nfs/dbraw/zinc/03/06/43/1076030643.db2.gz VPYPHBUWQWGSDR-GXSJLCMTSA-N -1 3 392.351 -1.169 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ncc(-c2nn[n-]n2)cc1F)[C@@H]1COC(=O)N1 ZINC001582780823 1076030725 /nfs/dbraw/zinc/03/07/25/1076030725.db2.gz VPYPHBUWQWGSDR-KOLCDFICSA-N -1 3 392.351 -1.169 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ncc(-c2nnn[n-]2)cc1F)[C@@H]1COC(=O)N1 ZINC001582780823 1076030720 /nfs/dbraw/zinc/03/07/20/1076030720.db2.gz VPYPHBUWQWGSDR-KOLCDFICSA-N -1 3 392.351 -1.169 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ncc(-c2nn[n-]n2)cc1F)[C@H]1COC(=O)N1 ZINC001582780824 1076030770 /nfs/dbraw/zinc/03/07/70/1076030770.db2.gz VPYPHBUWQWGSDR-MWLCHTKSSA-N -1 3 392.351 -1.169 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ncc(-c2nnn[n-]2)cc1F)[C@H]1COC(=O)N1 ZINC001582780824 1076030764 /nfs/dbraw/zinc/03/07/64/1076030764.db2.gz VPYPHBUWQWGSDR-MWLCHTKSSA-N -1 3 392.351 -1.169 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ncc(-c2nn[n-]n2)cc1F)[C@@H]1COC(=O)N1 ZINC001582780825 1076031238 /nfs/dbraw/zinc/03/12/38/1076031238.db2.gz VPYPHBUWQWGSDR-ONGXEEELSA-N -1 3 392.351 -1.169 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ncc(-c2nnn[n-]2)cc1F)[C@@H]1COC(=O)N1 ZINC001582780825 1076031230 /nfs/dbraw/zinc/03/12/30/1076031230.db2.gz VPYPHBUWQWGSDR-ONGXEEELSA-N -1 3 392.351 -1.169 20 0 GAADHM O=C(NCC1(O)CN(Cc2cc(-c3nn[n-]n3)ccc2F)C1)[C@H]1COC(=O)N1 ZINC001582780880 1076031218 /nfs/dbraw/zinc/03/12/18/1076031218.db2.gz WOBUTHNQSWVGOC-GFCCVEGCSA-N -1 3 391.363 -1.223 20 0 GAADHM O=C(NCC1(O)CN(Cc2cc(-c3nnn[n-]3)ccc2F)C1)[C@H]1COC(=O)N1 ZINC001582780880 1076031212 /nfs/dbraw/zinc/03/12/12/1076031212.db2.gz WOBUTHNQSWVGOC-GFCCVEGCSA-N -1 3 391.363 -1.223 20 0 GAADHM O=C(NCC1(O)CN(Cc2cc(-c3nn[n-]n3)ccc2F)C1)[C@@H]1COC(=O)N1 ZINC001582780881 1076031320 /nfs/dbraw/zinc/03/13/20/1076031320.db2.gz WOBUTHNQSWVGOC-LBPRGKRZSA-N -1 3 391.363 -1.223 20 0 GAADHM O=C(NCC1(O)CN(Cc2cc(-c3nnn[n-]3)ccc2F)C1)[C@@H]1COC(=O)N1 ZINC001582780881 1076031314 /nfs/dbraw/zinc/03/13/14/1076031314.db2.gz WOBUTHNQSWVGOC-LBPRGKRZSA-N -1 3 391.363 -1.223 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@H]1COC(=O)N1 ZINC001582780970 1076031051 /nfs/dbraw/zinc/03/10/51/1076031051.db2.gz YCVRFCFHTYUZDU-GZMMTYOYSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@H]1COC(=O)N1 ZINC001582780970 1076031046 /nfs/dbraw/zinc/03/10/46/1076031046.db2.gz YCVRFCFHTYUZDU-GZMMTYOYSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@@H]1COC(=O)N1 ZINC001582780971 1076031302 /nfs/dbraw/zinc/03/13/02/1076031302.db2.gz YCVRFCFHTYUZDU-KCJUWKMLSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@@H]1COC(=O)N1 ZINC001582780971 1076031298 /nfs/dbraw/zinc/03/12/98/1076031298.db2.gz YCVRFCFHTYUZDU-KCJUWKMLSA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@@H]1COC(=O)N1 ZINC001582780972 1076031286 /nfs/dbraw/zinc/03/12/86/1076031286.db2.gz YCVRFCFHTYUZDU-KWQFWETISA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@@H]1COC(=O)N1 ZINC001582780972 1076031280 /nfs/dbraw/zinc/03/12/80/1076031280.db2.gz YCVRFCFHTYUZDU-KWQFWETISA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@H]1COC(=O)N1 ZINC001582780973 1076031168 /nfs/dbraw/zinc/03/11/68/1076031168.db2.gz YCVRFCFHTYUZDU-LDYMZIIASA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@H]1COC(=O)N1 ZINC001582780973 1076031162 /nfs/dbraw/zinc/03/11/62/1076031162.db2.gz YCVRFCFHTYUZDU-LDYMZIIASA-N -1 3 390.360 -1.740 20 0 GAADHM O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1C[C@@H]2CN(C(=O)[C@H]3CNC(=O)N3)C[C@@H]2C1 ZINC001582781018 1076031105 /nfs/dbraw/zinc/03/11/05/1076031105.db2.gz AHQNWTUAIMUHRK-JFGNBEQYSA-N -1 3 385.388 -1.593 20 0 GAADHM O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1C[C@@H]2CN(C(=O)[C@H]3CNC(=O)N3)C[C@@H]2C1 ZINC001582781018 1076031099 /nfs/dbraw/zinc/03/10/99/1076031099.db2.gz AHQNWTUAIMUHRK-JFGNBEQYSA-N -1 3 385.388 -1.593 20 0 GAADHM O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1C[C@@H]2CN(C(=O)[C@@H]3CNC(=O)N3)C[C@@H]2C1 ZINC001582781022 1076031069 /nfs/dbraw/zinc/03/10/69/1076031069.db2.gz AHQNWTUAIMUHRK-UMNHJUIQSA-N -1 3 385.388 -1.593 20 0 GAADHM O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1C[C@@H]2CN(C(=O)[C@@H]3CNC(=O)N3)C[C@@H]2C1 ZINC001582781022 1076031065 /nfs/dbraw/zinc/03/10/65/1076031065.db2.gz AHQNWTUAIMUHRK-UMNHJUIQSA-N -1 3 385.388 -1.593 20 0 GAADHM O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1[C@@H]2CC[C@H]1CN(C(=O)[C@H]1CNC(=O)N1)C2 ZINC001582781227 1076032188 /nfs/dbraw/zinc/03/21/88/1076032188.db2.gz BUCVGDMXYBRDFA-JFGNBEQYSA-N -1 3 385.388 -1.308 20 0 GAADHM O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1[C@@H]2CC[C@H]1CN(C(=O)[C@H]1CNC(=O)N1)C2 ZINC001582781227 1076032184 /nfs/dbraw/zinc/03/21/84/1076032184.db2.gz BUCVGDMXYBRDFA-JFGNBEQYSA-N -1 3 385.388 -1.308 20 0 GAADHM O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1[C@@H]2CC[C@H]1CN(C(=O)[C@@H]1CNC(=O)N1)C2 ZINC001582781228 1076032157 /nfs/dbraw/zinc/03/21/57/1076032157.db2.gz BUCVGDMXYBRDFA-UMNHJUIQSA-N -1 3 385.388 -1.308 20 0 GAADHM O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1[C@@H]2CC[C@H]1CN(C(=O)[C@@H]1CNC(=O)N1)C2 ZINC001582781228 1076032151 /nfs/dbraw/zinc/03/21/51/1076032151.db2.gz BUCVGDMXYBRDFA-UMNHJUIQSA-N -1 3 385.388 -1.308 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1C[C@H]2CN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]2C1 ZINC001582781258 1076031616 /nfs/dbraw/zinc/03/16/16/1076031616.db2.gz CFWOSHJSHGYMFT-JFGNBEQYSA-N -1 3 387.379 -1.023 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1C[C@H]2CN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]2C1 ZINC001582781258 1076031613 /nfs/dbraw/zinc/03/16/13/1076031613.db2.gz CFWOSHJSHGYMFT-JFGNBEQYSA-N -1 3 387.379 -1.023 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1C[C@H]2CN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]2C1 ZINC001582781259 1076031989 /nfs/dbraw/zinc/03/19/89/1076031989.db2.gz CFWOSHJSHGYMFT-UMNHJUIQSA-N -1 3 387.379 -1.023 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1C[C@H]2CN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]2C1 ZINC001582781259 1076031985 /nfs/dbraw/zinc/03/19/85/1076031985.db2.gz CFWOSHJSHGYMFT-UMNHJUIQSA-N -1 3 387.379 -1.023 20 0 GAADHM O=C(c1cc(-c2nn[n-]n2)c[nH]1)N1C[C@H]2CCN(C(=O)[C@H]3CNC(=O)N3)C[C@H]21 ZINC001582781308 1076032008 /nfs/dbraw/zinc/03/20/08/1076032008.db2.gz DGXYFHBPWWCEHT-GGZOMVNGSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1C[C@H]2CCN(C(=O)[C@H]3CNC(=O)N3)C[C@H]21 ZINC001582781308 1076032004 /nfs/dbraw/zinc/03/20/04/1076032004.db2.gz DGXYFHBPWWCEHT-GGZOMVNGSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1cc(-c2nn[n-]n2)c[nH]1)N1C[C@H]2CCN(C(=O)[C@@H]3CNC(=O)N3)C[C@H]21 ZINC001582781309 1076032036 /nfs/dbraw/zinc/03/20/36/1076032036.db2.gz DGXYFHBPWWCEHT-JFUSQASVSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1C[C@H]2CCN(C(=O)[C@@H]3CNC(=O)N3)C[C@H]21 ZINC001582781309 1076032030 /nfs/dbraw/zinc/03/20/30/1076032030.db2.gz DGXYFHBPWWCEHT-JFUSQASVSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1CC[C@@H]2CN(C(=O)[C@H]3CNC(=O)N3)[C@@H]2C1 ZINC001582781316 1076032019 /nfs/dbraw/zinc/03/20/19/1076032019.db2.gz DIBCNJCAHKCBHM-GGZOMVNGSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1CC[C@@H]2CN(C(=O)[C@H]3CNC(=O)N3)[C@@H]2C1 ZINC001582781316 1076032014 /nfs/dbraw/zinc/03/20/14/1076032014.db2.gz DIBCNJCAHKCBHM-GGZOMVNGSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1CC[C@@H]2CN(C(=O)[C@@H]3CNC(=O)N3)[C@@H]2C1 ZINC001582781317 1076032080 /nfs/dbraw/zinc/03/20/80/1076032080.db2.gz DIBCNJCAHKCBHM-JFUSQASVSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1CC[C@@H]2CN(C(=O)[C@@H]3CNC(=O)N3)[C@@H]2C1 ZINC001582781317 1076032074 /nfs/dbraw/zinc/03/20/74/1076032074.db2.gz DIBCNJCAHKCBHM-JFUSQASVSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(NC1(CCO)CN(Cc2ccccc2-c2nn[n-]n2)C1)[C@H]1CNC(=O)N1 ZINC001582781342 1076032118 /nfs/dbraw/zinc/03/21/18/1076032118.db2.gz DRNMOVYVADAFNY-CYBMUJFWSA-N -1 3 386.416 -1.399 20 0 GAADHM O=C(NC1(CCO)CN(Cc2ccccc2-c2nnn[n-]2)C1)[C@H]1CNC(=O)N1 ZINC001582781342 1076032113 /nfs/dbraw/zinc/03/21/13/1076032113.db2.gz DRNMOVYVADAFNY-CYBMUJFWSA-N -1 3 386.416 -1.399 20 0 GAADHM O=C(NC1(CCO)CN(Cc2ccccc2-c2nn[n-]n2)C1)[C@@H]1CNC(=O)N1 ZINC001582781343 1076032061 /nfs/dbraw/zinc/03/20/61/1076032061.db2.gz DRNMOVYVADAFNY-ZDUSSCGKSA-N -1 3 386.416 -1.399 20 0 GAADHM O=C(NC1(CCO)CN(Cc2ccccc2-c2nnn[n-]2)C1)[C@@H]1CNC(=O)N1 ZINC001582781343 1076032056 /nfs/dbraw/zinc/03/20/56/1076032056.db2.gz DRNMOVYVADAFNY-ZDUSSCGKSA-N -1 3 386.416 -1.399 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N(CCO)CCNc1ncc(-c2nn[n-]n2)cc1F ZINC001582781369 1076031977 /nfs/dbraw/zinc/03/19/77/1076031977.db2.gz CRAZOEMOFXFBAO-JTQLQIEISA-N -1 3 379.356 -1.685 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N(CCO)CCNc1ncc(-c2nnn[n-]2)cc1F ZINC001582781369 1076031973 /nfs/dbraw/zinc/03/19/73/1076031973.db2.gz CRAZOEMOFXFBAO-JTQLQIEISA-N -1 3 379.356 -1.685 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N(CCO)CCNc1ncc(-c2nn[n-]n2)cc1F ZINC001582781370 1076032347 /nfs/dbraw/zinc/03/23/47/1076032347.db2.gz CRAZOEMOFXFBAO-SNVBAGLBSA-N -1 3 379.356 -1.685 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N(CCO)CCNc1ncc(-c2nnn[n-]2)cc1F ZINC001582781370 1076032342 /nfs/dbraw/zinc/03/23/42/1076032342.db2.gz CRAZOEMOFXFBAO-SNVBAGLBSA-N -1 3 379.356 -1.685 20 0 GAADHM O=C(NCC1CCN(C(=O)[C@H]2CNC(=O)N2)CC1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582781383 1076032411 /nfs/dbraw/zinc/03/24/11/1076032411.db2.gz DDIULADXPSENNM-GFCCVEGCSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC1CCN(C(=O)[C@H]2CNC(=O)N2)CC1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582781383 1076032405 /nfs/dbraw/zinc/03/24/05/1076032405.db2.gz DDIULADXPSENNM-GFCCVEGCSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC1CCN(C(=O)[C@@H]2CNC(=O)N2)CC1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582781384 1076032659 /nfs/dbraw/zinc/03/26/59/1076032659.db2.gz DDIULADXPSENNM-LBPRGKRZSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC1CCN(C(=O)[C@@H]2CNC(=O)N2)CC1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582781384 1076032655 /nfs/dbraw/zinc/03/26/55/1076032655.db2.gz DDIULADXPSENNM-LBPRGKRZSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)s2)C[C@@H]1O)[C@H]1COC(=O)N1 ZINC001582781413 1076032368 /nfs/dbraw/zinc/03/23/68/1076032368.db2.gz DTVMXMDOFJPWSN-BBBLOLIVSA-N -1 3 379.402 -1.302 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)s2)C[C@@H]1O)[C@H]1COC(=O)N1 ZINC001582781413 1076032366 /nfs/dbraw/zinc/03/23/66/1076032366.db2.gz DTVMXMDOFJPWSN-BBBLOLIVSA-N -1 3 379.402 -1.302 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)s2)C[C@H]1O)[C@@H]1COC(=O)N1 ZINC001582781414 1076032644 /nfs/dbraw/zinc/03/26/44/1076032644.db2.gz DTVMXMDOFJPWSN-KXUCPTDWSA-N -1 3 379.402 -1.302 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)s2)C[C@H]1O)[C@@H]1COC(=O)N1 ZINC001582781414 1076032641 /nfs/dbraw/zinc/03/26/41/1076032641.db2.gz DTVMXMDOFJPWSN-KXUCPTDWSA-N -1 3 379.402 -1.302 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)s2)C[C@H]1O)[C@H]1COC(=O)N1 ZINC001582781415 1076032540 /nfs/dbraw/zinc/03/25/40/1076032540.db2.gz DTVMXMDOFJPWSN-OPRDCNLKSA-N -1 3 379.402 -1.302 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)s2)C[C@H]1O)[C@H]1COC(=O)N1 ZINC001582781415 1076032533 /nfs/dbraw/zinc/03/25/33/1076032533.db2.gz DTVMXMDOFJPWSN-OPRDCNLKSA-N -1 3 379.402 -1.302 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)s2)C[C@@H]1O)[C@@H]1COC(=O)N1 ZINC001582781416 1076032622 /nfs/dbraw/zinc/03/26/22/1076032622.db2.gz DTVMXMDOFJPWSN-UTLUCORTSA-N -1 3 379.402 -1.302 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)s2)C[C@@H]1O)[C@@H]1COC(=O)N1 ZINC001582781416 1076032617 /nfs/dbraw/zinc/03/26/17/1076032617.db2.gz DTVMXMDOFJPWSN-UTLUCORTSA-N -1 3 379.402 -1.302 20 0 GAADHM O=C(N[C@H]1CCCN(C(=O)[C@H]2CNC(=O)N2)CC1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582781499 1076032475 /nfs/dbraw/zinc/03/24/75/1076032475.db2.gz GDNQSDOXHYUVDH-CMPLNLGQSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@H]1CCCN(C(=O)[C@H]2CNC(=O)N2)CC1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582781499 1076032467 /nfs/dbraw/zinc/03/24/67/1076032467.db2.gz GDNQSDOXHYUVDH-CMPLNLGQSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@H]1CCCN(C(=O)[C@@H]2CNC(=O)N2)CC1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582781500 1076032453 /nfs/dbraw/zinc/03/24/53/1076032453.db2.gz GDNQSDOXHYUVDH-JQWIXIFHSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@H]1CCCN(C(=O)[C@@H]2CNC(=O)N2)CC1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582781500 1076032447 /nfs/dbraw/zinc/03/24/47/1076032447.db2.gz GDNQSDOXHYUVDH-JQWIXIFHSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@@H]1CCCN(C(=O)[C@@H]2CNC(=O)N2)CC1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582781501 1076032878 /nfs/dbraw/zinc/03/28/78/1076032878.db2.gz GDNQSDOXHYUVDH-PWSUYJOCSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@@H]1CCCN(C(=O)[C@@H]2CNC(=O)N2)CC1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582781501 1076032875 /nfs/dbraw/zinc/03/28/75/1076032875.db2.gz GDNQSDOXHYUVDH-PWSUYJOCSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@@H]1CCCN(C(=O)[C@H]2CNC(=O)N2)CC1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582781502 1076032896 /nfs/dbraw/zinc/03/28/96/1076032896.db2.gz GDNQSDOXHYUVDH-ZYHUDNBSSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@@H]1CCCN(C(=O)[C@H]2CNC(=O)N2)CC1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582781502 1076032891 /nfs/dbraw/zinc/03/28/91/1076032891.db2.gz GDNQSDOXHYUVDH-ZYHUDNBSSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC1(CO)CCN(c2ccc(-c3nn[n-]n3)cn2)CC1)[C@H]1CNC(=O)N1 ZINC001582781533 1076033027 /nfs/dbraw/zinc/03/30/27/1076033027.db2.gz GVSHRMWUUZJAKH-LLVKDONJSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(NC1(CO)CCN(c2ccc(-c3nnn[n-]3)cn2)CC1)[C@H]1CNC(=O)N1 ZINC001582781533 1076033024 /nfs/dbraw/zinc/03/30/24/1076033024.db2.gz GVSHRMWUUZJAKH-LLVKDONJSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(NC1(CO)CCN(c2ccc(-c3nn[n-]n3)cn2)CC1)[C@@H]1CNC(=O)N1 ZINC001582781534 1076033122 /nfs/dbraw/zinc/03/31/22/1076033122.db2.gz GVSHRMWUUZJAKH-NSHDSACASA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(NC1(CO)CCN(c2ccc(-c3nnn[n-]3)cn2)CC1)[C@@H]1CNC(=O)N1 ZINC001582781534 1076033117 /nfs/dbraw/zinc/03/31/17/1076033117.db2.gz GVSHRMWUUZJAKH-NSHDSACASA-N -1 3 387.404 -1.609 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCC[C@@](CO)(Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582781545 1076032964 /nfs/dbraw/zinc/03/29/64/1076032964.db2.gz HFEYBGREOFDXQD-BLLLJJGKSA-N -1 3 387.404 -1.292 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCC[C@@](CO)(Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582781545 1076032961 /nfs/dbraw/zinc/03/29/61/1076032961.db2.gz HFEYBGREOFDXQD-BLLLJJGKSA-N -1 3 387.404 -1.292 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCC[C@](CO)(Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582781546 1076032862 /nfs/dbraw/zinc/03/28/62/1076032862.db2.gz HFEYBGREOFDXQD-LRDDRELGSA-N -1 3 387.404 -1.292 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCC[C@](CO)(Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582781546 1076032856 /nfs/dbraw/zinc/03/28/56/1076032856.db2.gz HFEYBGREOFDXQD-LRDDRELGSA-N -1 3 387.404 -1.292 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCC[C@@](CO)(Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582781547 1076033082 /nfs/dbraw/zinc/03/30/82/1076033082.db2.gz HFEYBGREOFDXQD-MLGOLLRUSA-N -1 3 387.404 -1.292 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCC[C@@](CO)(Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582781547 1076033073 /nfs/dbraw/zinc/03/30/73/1076033073.db2.gz HFEYBGREOFDXQD-MLGOLLRUSA-N -1 3 387.404 -1.292 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCC[C@](CO)(Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582781548 1076032951 /nfs/dbraw/zinc/03/29/51/1076032951.db2.gz HFEYBGREOFDXQD-WBMJQRKESA-N -1 3 387.404 -1.292 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCC[C@](CO)(Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582781548 1076032945 /nfs/dbraw/zinc/03/29/45/1076032945.db2.gz HFEYBGREOFDXQD-WBMJQRKESA-N -1 3 387.404 -1.292 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCC(O)(CNc2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001582781629 1076033060 /nfs/dbraw/zinc/03/30/60/1076033060.db2.gz HUGIBAAGMPAEGK-GFCCVEGCSA-N -1 3 387.404 -1.292 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCC(O)(CNc2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001582781629 1076033055 /nfs/dbraw/zinc/03/30/55/1076033055.db2.gz HUGIBAAGMPAEGK-GFCCVEGCSA-N -1 3 387.404 -1.292 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCC(O)(CNc2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001582781630 1076033041 /nfs/dbraw/zinc/03/30/41/1076033041.db2.gz HUGIBAAGMPAEGK-LBPRGKRZSA-N -1 3 387.404 -1.292 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCC(O)(CNc2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001582781630 1076033037 /nfs/dbraw/zinc/03/30/37/1076033037.db2.gz HUGIBAAGMPAEGK-LBPRGKRZSA-N -1 3 387.404 -1.292 20 0 GAADHM O=C(NC1(CCO)CN(Cc2ccc(-c3nnn[n-]3)s2)C1)[C@@H]1CNC(=O)N1 ZINC001582781633 1076033012 /nfs/dbraw/zinc/03/30/12/1076033012.db2.gz HWCCLRJXWZSYML-JTQLQIEISA-N -1 3 392.445 -1.337 20 0 GAADHM O=C(NC1(CCO)CN(Cc2ccc(-c3nnn[n-]3)s2)C1)[C@H]1CNC(=O)N1 ZINC001582781636 1076032996 /nfs/dbraw/zinc/03/29/96/1076032996.db2.gz HWCCLRJXWZSYML-SNVBAGLBSA-N -1 3 392.445 -1.337 20 0 GAADHM O=C(N[C@]1(CO)CCCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@@H]1CNC(=O)N1 ZINC001582781656 1076033104 /nfs/dbraw/zinc/03/31/04/1076033104.db2.gz IPTFVGCLPYKDQI-BLLLJJGKSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@]1(CO)CCCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@@H]1CNC(=O)N1 ZINC001582781656 1076033097 /nfs/dbraw/zinc/03/30/97/1076033097.db2.gz IPTFVGCLPYKDQI-BLLLJJGKSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@@]1(CO)CCCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@@H]1CNC(=O)N1 ZINC001582781657 1076033137 /nfs/dbraw/zinc/03/31/37/1076033137.db2.gz IPTFVGCLPYKDQI-LRDDRELGSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@@]1(CO)CCCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@@H]1CNC(=O)N1 ZINC001582781657 1076033131 /nfs/dbraw/zinc/03/31/31/1076033131.db2.gz IPTFVGCLPYKDQI-LRDDRELGSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@]1(CO)CCCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@H]1CNC(=O)N1 ZINC001582781659 1076033521 /nfs/dbraw/zinc/03/35/21/1076033521.db2.gz IPTFVGCLPYKDQI-MLGOLLRUSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@]1(CO)CCCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@H]1CNC(=O)N1 ZINC001582781659 1076033512 /nfs/dbraw/zinc/03/35/12/1076033512.db2.gz IPTFVGCLPYKDQI-MLGOLLRUSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@@]1(CO)CCCN(c2ccc(-c3nn[n-]n3)nc2)C1)[C@H]1CNC(=O)N1 ZINC001582781660 1076033566 /nfs/dbraw/zinc/03/35/66/1076033566.db2.gz IPTFVGCLPYKDQI-WBMJQRKESA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@@]1(CO)CCCN(c2ccc(-c3nnn[n-]3)nc2)C1)[C@H]1CNC(=O)N1 ZINC001582781660 1076033563 /nfs/dbraw/zinc/03/35/63/1076033563.db2.gz IPTFVGCLPYKDQI-WBMJQRKESA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(NC[C@H]1CCCCN1C(=O)[C@H]1CNC(=O)N1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582781679 1076033404 /nfs/dbraw/zinc/03/34/04/1076033404.db2.gz IVZQMDBCLSBBIM-BXKDBHETSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@H]1CCCCN1C(=O)[C@H]1CNC(=O)N1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582781679 1076033399 /nfs/dbraw/zinc/03/33/99/1076033399.db2.gz IVZQMDBCLSBBIM-BXKDBHETSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@@H]1CCCCN1C(=O)[C@@H]1CNC(=O)N1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582781680 1076033550 /nfs/dbraw/zinc/03/35/50/1076033550.db2.gz IVZQMDBCLSBBIM-CABZTGNLSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@@H]1CCCCN1C(=O)[C@@H]1CNC(=O)N1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582781680 1076033546 /nfs/dbraw/zinc/03/35/46/1076033546.db2.gz IVZQMDBCLSBBIM-CABZTGNLSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@@H]1CCCCN1C(=O)[C@H]1CNC(=O)N1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582781681 1076033580 /nfs/dbraw/zinc/03/35/80/1076033580.db2.gz IVZQMDBCLSBBIM-JOYOIKCWSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@@H]1CCCCN1C(=O)[C@H]1CNC(=O)N1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582781681 1076033576 /nfs/dbraw/zinc/03/35/76/1076033576.db2.gz IVZQMDBCLSBBIM-JOYOIKCWSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@H]1CCCCN1C(=O)[C@@H]1CNC(=O)N1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582781682 1076033349 /nfs/dbraw/zinc/03/33/49/1076033349.db2.gz IVZQMDBCLSBBIM-SKDRFNHKSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@H]1CCCCN1C(=O)[C@@H]1CNC(=O)N1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582781682 1076033342 /nfs/dbraw/zinc/03/33/42/1076033342.db2.gz IVZQMDBCLSBBIM-SKDRFNHKSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@@H]3CNC(=O)N3)C[C@H]21)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582781709 1076033500 /nfs/dbraw/zinc/03/35/00/1076033500.db2.gz HYUDQBCJSJHJCO-GUDRVLHUSA-N -1 3 385.388 -1.690 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@@H]3CNC(=O)N3)C[C@H]21)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582781709 1076033496 /nfs/dbraw/zinc/03/34/96/1076033496.db2.gz HYUDQBCJSJHJCO-GUDRVLHUSA-N -1 3 385.388 -1.690 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@H]3CNC(=O)N3)C[C@H]21)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582781715 1076033423 /nfs/dbraw/zinc/03/34/23/1076033423.db2.gz HYUDQBCJSJHJCO-MWGHHZFTSA-N -1 3 385.388 -1.690 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@H]3CNC(=O)N3)C[C@H]21)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582781715 1076033417 /nfs/dbraw/zinc/03/34/17/1076033417.db2.gz HYUDQBCJSJHJCO-MWGHHZFTSA-N -1 3 385.388 -1.690 20 0 GAADHM O=C(NC1(CCO)CN(Cc2cccc(-c3nn[n-]n3)c2)C1)[C@H]1CNC(=O)N1 ZINC001582781847 1076033862 /nfs/dbraw/zinc/03/38/62/1076033862.db2.gz LJQXLCKZGIEPSZ-CYBMUJFWSA-N -1 3 386.416 -1.399 20 0 GAADHM O=C(NC1(CCO)CN(Cc2cccc(-c3nnn[n-]3)c2)C1)[C@H]1CNC(=O)N1 ZINC001582781847 1076033858 /nfs/dbraw/zinc/03/38/58/1076033858.db2.gz LJQXLCKZGIEPSZ-CYBMUJFWSA-N -1 3 386.416 -1.399 20 0 GAADHM O=C(NC1(CCO)CN(Cc2cccc(-c3nn[n-]n3)c2)C1)[C@@H]1CNC(=O)N1 ZINC001582781848 1076033842 /nfs/dbraw/zinc/03/38/42/1076033842.db2.gz LJQXLCKZGIEPSZ-ZDUSSCGKSA-N -1 3 386.416 -1.399 20 0 GAADHM O=C(NC1(CCO)CN(Cc2cccc(-c3nnn[n-]3)c2)C1)[C@@H]1CNC(=O)N1 ZINC001582781848 1076033836 /nfs/dbraw/zinc/03/38/36/1076033836.db2.gz LJQXLCKZGIEPSZ-ZDUSSCGKSA-N -1 3 386.416 -1.399 20 0 GAADHM O=C(N[C@]1(CO)CCCN(c2ccc(-c3nn[n-]n3)cn2)C1)[C@H]1CNC(=O)N1 ZINC001582781865 1076033775 /nfs/dbraw/zinc/03/37/75/1076033775.db2.gz LWCCOKICYGBMPU-BDJLRTHQSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@]1(CO)CCCN(c2ccc(-c3nnn[n-]3)cn2)C1)[C@H]1CNC(=O)N1 ZINC001582781865 1076033772 /nfs/dbraw/zinc/03/37/72/1076033772.db2.gz LWCCOKICYGBMPU-BDJLRTHQSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@@]1(CO)CCCN(c2ccc(-c3nn[n-]n3)cn2)C1)[C@H]1CNC(=O)N1 ZINC001582781867 1076033794 /nfs/dbraw/zinc/03/37/94/1076033794.db2.gz LWCCOKICYGBMPU-BZNIZROVSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@@]1(CO)CCCN(c2ccc(-c3nnn[n-]3)cn2)C1)[C@H]1CNC(=O)N1 ZINC001582781867 1076033790 /nfs/dbraw/zinc/03/37/90/1076033790.db2.gz LWCCOKICYGBMPU-BZNIZROVSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@]1(CO)CCCN(c2ccc(-c3nn[n-]n3)cn2)C1)[C@@H]1CNC(=O)N1 ZINC001582781869 1076033821 /nfs/dbraw/zinc/03/38/21/1076033821.db2.gz LWCCOKICYGBMPU-MEDUHNTESA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@]1(CO)CCCN(c2ccc(-c3nnn[n-]3)cn2)C1)[C@@H]1CNC(=O)N1 ZINC001582781869 1076033815 /nfs/dbraw/zinc/03/38/15/1076033815.db2.gz LWCCOKICYGBMPU-MEDUHNTESA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@@]1(CO)CCCN(c2ccc(-c3nn[n-]n3)cn2)C1)[C@@H]1CNC(=O)N1 ZINC001582781871 1076033899 /nfs/dbraw/zinc/03/38/99/1076033899.db2.gz LWCCOKICYGBMPU-ZBEGNZNMSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@@]1(CO)CCCN(c2ccc(-c3nnn[n-]3)cn2)C1)[C@@H]1CNC(=O)N1 ZINC001582781871 1076033892 /nfs/dbraw/zinc/03/38/92/1076033892.db2.gz LWCCOKICYGBMPU-ZBEGNZNMSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(NC[C@@H]1CCCCN1C(=O)[C@H]1CNC(=O)N1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582781897 1076033739 /nfs/dbraw/zinc/03/37/39/1076033739.db2.gz MHNHAFNCKIWAJG-CMPLNLGQSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@@H]1CCCCN1C(=O)[C@H]1CNC(=O)N1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582781897 1076033736 /nfs/dbraw/zinc/03/37/36/1076033736.db2.gz MHNHAFNCKIWAJG-CMPLNLGQSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@@H]1CCCCN1C(=O)[C@@H]1CNC(=O)N1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582781898 1076033915 /nfs/dbraw/zinc/03/39/15/1076033915.db2.gz MHNHAFNCKIWAJG-JQWIXIFHSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@@H]1CCCCN1C(=O)[C@@H]1CNC(=O)N1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582781898 1076033909 /nfs/dbraw/zinc/03/39/09/1076033909.db2.gz MHNHAFNCKIWAJG-JQWIXIFHSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@H]1CCCCN1C(=O)[C@@H]1CNC(=O)N1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582781900 1076034434 /nfs/dbraw/zinc/03/44/34/1076034434.db2.gz MHNHAFNCKIWAJG-PWSUYJOCSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@H]1CCCCN1C(=O)[C@@H]1CNC(=O)N1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582781900 1076034430 /nfs/dbraw/zinc/03/44/30/1076034430.db2.gz MHNHAFNCKIWAJG-PWSUYJOCSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@H]1CCCCN1C(=O)[C@H]1CNC(=O)N1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582781902 1076034366 /nfs/dbraw/zinc/03/43/66/1076034366.db2.gz MHNHAFNCKIWAJG-ZYHUDNBSSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@H]1CCCCN1C(=O)[C@H]1CNC(=O)N1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582781902 1076034360 /nfs/dbraw/zinc/03/43/60/1076034360.db2.gz MHNHAFNCKIWAJG-ZYHUDNBSSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@@H]1CCCCN1C(=O)[C@H]1CNC(=O)N1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582781912 1076034405 /nfs/dbraw/zinc/03/44/05/1076034405.db2.gz MSVAFAPIWCIPKV-CMPLNLGQSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@@H]1CCCCN1C(=O)[C@H]1CNC(=O)N1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582781912 1076034399 /nfs/dbraw/zinc/03/43/99/1076034399.db2.gz MSVAFAPIWCIPKV-CMPLNLGQSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@@H]1CCCCN1C(=O)[C@@H]1CNC(=O)N1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582781913 1076034472 /nfs/dbraw/zinc/03/44/72/1076034472.db2.gz MSVAFAPIWCIPKV-JQWIXIFHSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@@H]1CCCCN1C(=O)[C@@H]1CNC(=O)N1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582781913 1076034469 /nfs/dbraw/zinc/03/44/69/1076034469.db2.gz MSVAFAPIWCIPKV-JQWIXIFHSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@H]1CCCCN1C(=O)[C@@H]1CNC(=O)N1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582781915 1076034420 /nfs/dbraw/zinc/03/44/20/1076034420.db2.gz MSVAFAPIWCIPKV-PWSUYJOCSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@H]1CCCCN1C(=O)[C@@H]1CNC(=O)N1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582781915 1076034415 /nfs/dbraw/zinc/03/44/15/1076034415.db2.gz MSVAFAPIWCIPKV-PWSUYJOCSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@H]1CCCCN1C(=O)[C@H]1CNC(=O)N1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582781916 1076034244 /nfs/dbraw/zinc/03/42/44/1076034244.db2.gz MSVAFAPIWCIPKV-ZYHUDNBSSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@H]1CCCCN1C(=O)[C@H]1CNC(=O)N1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582781916 1076034239 /nfs/dbraw/zinc/03/42/39/1076034239.db2.gz MSVAFAPIWCIPKV-ZYHUDNBSSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@H]1CCCN(C(=O)[C@H]2CNC(=O)N2)CC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582781941 1076034486 /nfs/dbraw/zinc/03/44/86/1076034486.db2.gz MYTCSCNLKXEMFY-CMPLNLGQSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@H]1CCCN(C(=O)[C@H]2CNC(=O)N2)CC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582781941 1076034481 /nfs/dbraw/zinc/03/44/81/1076034481.db2.gz MYTCSCNLKXEMFY-CMPLNLGQSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@H]1CCCN(C(=O)[C@@H]2CNC(=O)N2)CC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582781942 1076034174 /nfs/dbraw/zinc/03/41/74/1076034174.db2.gz MYTCSCNLKXEMFY-JQWIXIFHSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@H]1CCCN(C(=O)[C@@H]2CNC(=O)N2)CC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582781942 1076034169 /nfs/dbraw/zinc/03/41/69/1076034169.db2.gz MYTCSCNLKXEMFY-JQWIXIFHSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1[C@@H]2CC[C@H]1CN(C(=O)[C@@H]1CNC(=O)N1)C2 ZINC001582781961 1076034266 /nfs/dbraw/zinc/03/42/66/1076034266.db2.gz JDCAASBMEURHIT-SBMIAAHKSA-N -1 3 385.388 -1.308 20 0 GAADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1[C@@H]2CC[C@H]1CN(C(=O)[C@@H]1CNC(=O)N1)C2 ZINC001582781961 1076034261 /nfs/dbraw/zinc/03/42/61/1076034261.db2.gz JDCAASBMEURHIT-SBMIAAHKSA-N -1 3 385.388 -1.308 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1[C@@H]2CC[C@H]1CN(C(=O)[C@H]1CNC(=O)N1)C2 ZINC001582781962 1076034456 /nfs/dbraw/zinc/03/44/56/1076034456.db2.gz JDCAASBMEURHIT-VDDIYKPWSA-N -1 3 385.388 -1.308 20 0 GAADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1[C@@H]2CC[C@H]1CN(C(=O)[C@H]1CNC(=O)N1)C2 ZINC001582781962 1076034451 /nfs/dbraw/zinc/03/44/51/1076034451.db2.gz JDCAASBMEURHIT-VDDIYKPWSA-N -1 3 385.388 -1.308 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1CCC2(CN(C(=O)[C@H]3CNC(=O)N3)C2)C1 ZINC001582782013 1076034156 /nfs/dbraw/zinc/03/41/56/1076034156.db2.gz LFROJPCIBSOMDR-LLVKDONJSA-N -1 3 385.388 -1.449 20 0 GAADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1CCC2(CN(C(=O)[C@H]3CNC(=O)N3)C2)C1 ZINC001582782013 1076034151 /nfs/dbraw/zinc/03/41/51/1076034151.db2.gz LFROJPCIBSOMDR-LLVKDONJSA-N -1 3 385.388 -1.449 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1CCC2(CN(C(=O)[C@@H]3CNC(=O)N3)C2)C1 ZINC001582782014 1076034190 /nfs/dbraw/zinc/03/41/90/1076034190.db2.gz LFROJPCIBSOMDR-NSHDSACASA-N -1 3 385.388 -1.449 20 0 GAADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1CCC2(CN(C(=O)[C@@H]3CNC(=O)N3)C2)C1 ZINC001582782014 1076034185 /nfs/dbraw/zinc/03/41/85/1076034185.db2.gz LFROJPCIBSOMDR-NSHDSACASA-N -1 3 385.388 -1.449 20 0 GAADHM O=C(NCC[C@@H]1CCN(C(=O)[C@H]2CNC(=O)N2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582782015 1076034226 /nfs/dbraw/zinc/03/42/26/1076034226.db2.gz LHNCEEAVEBYVOK-BXKDBHETSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@@H]1CCN(C(=O)[C@H]2CNC(=O)N2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582782015 1076034218 /nfs/dbraw/zinc/03/42/18/1076034218.db2.gz LHNCEEAVEBYVOK-BXKDBHETSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@H]1CCN(C(=O)[C@@H]2CNC(=O)N2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582782016 1076034288 /nfs/dbraw/zinc/03/42/88/1076034288.db2.gz LHNCEEAVEBYVOK-CABZTGNLSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@H]1CCN(C(=O)[C@@H]2CNC(=O)N2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582782016 1076034282 /nfs/dbraw/zinc/03/42/82/1076034282.db2.gz LHNCEEAVEBYVOK-CABZTGNLSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@H]1CCN(C(=O)[C@H]2CNC(=O)N2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582782017 1076034653 /nfs/dbraw/zinc/03/46/53/1076034653.db2.gz LHNCEEAVEBYVOK-JOYOIKCWSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@H]1CCN(C(=O)[C@H]2CNC(=O)N2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582782017 1076034650 /nfs/dbraw/zinc/03/46/50/1076034650.db2.gz LHNCEEAVEBYVOK-JOYOIKCWSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@@H]1CCN(C(=O)[C@@H]2CNC(=O)N2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582782018 1076034773 /nfs/dbraw/zinc/03/47/73/1076034773.db2.gz LHNCEEAVEBYVOK-SKDRFNHKSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@@H]1CCN(C(=O)[C@@H]2CNC(=O)N2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582782018 1076034767 /nfs/dbraw/zinc/03/47/67/1076034767.db2.gz LHNCEEAVEBYVOK-SKDRFNHKSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(N[C@@H]1CCCN(C(=O)[C@@H]2CNC(=O)N2)CC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582782029 1076034447 /nfs/dbraw/zinc/03/44/47/1076034447.db2.gz MYTCSCNLKXEMFY-PWSUYJOCSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@@H]1CCCN(C(=O)[C@@H]2CNC(=O)N2)CC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582782029 1076034443 /nfs/dbraw/zinc/03/44/43/1076034443.db2.gz MYTCSCNLKXEMFY-PWSUYJOCSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@@H]1CCCN(C(=O)[C@H]2CNC(=O)N2)CC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582782030 1076034206 /nfs/dbraw/zinc/03/42/06/1076034206.db2.gz MYTCSCNLKXEMFY-ZYHUDNBSSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@@H]1CCCN(C(=O)[C@H]2CNC(=O)N2)CC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582782030 1076034200 /nfs/dbraw/zinc/03/42/00/1076034200.db2.gz MYTCSCNLKXEMFY-ZYHUDNBSSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@H]1CN(C(=O)[C@H]2CNC(=O)N2)CCO1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582782031 1076034689 /nfs/dbraw/zinc/03/46/89/1076034689.db2.gz NAMMTCOLFQBABR-GXSJLCMTSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@H]1CN(C(=O)[C@H]2CNC(=O)N2)CCO1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582782031 1076034687 /nfs/dbraw/zinc/03/46/87/1076034687.db2.gz NAMMTCOLFQBABR-GXSJLCMTSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1CN(C(=O)[C@@H]2CNC(=O)N2)CCO1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582782032 1076034683 /nfs/dbraw/zinc/03/46/83/1076034683.db2.gz NAMMTCOLFQBABR-KOLCDFICSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1CN(C(=O)[C@@H]2CNC(=O)N2)CCO1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582782032 1076034680 /nfs/dbraw/zinc/03/46/80/1076034680.db2.gz NAMMTCOLFQBABR-KOLCDFICSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1CN(C(=O)[C@H]2CNC(=O)N2)CCO1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582782033 1076034818 /nfs/dbraw/zinc/03/48/18/1076034818.db2.gz NAMMTCOLFQBABR-MWLCHTKSSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1CN(C(=O)[C@H]2CNC(=O)N2)CCO1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582782033 1076034813 /nfs/dbraw/zinc/03/48/13/1076034813.db2.gz NAMMTCOLFQBABR-MWLCHTKSSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@H]1CN(C(=O)[C@@H]2CNC(=O)N2)CCO1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582782034 1076034676 /nfs/dbraw/zinc/03/46/76/1076034676.db2.gz NAMMTCOLFQBABR-ONGXEEELSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@H]1CN(C(=O)[C@@H]2CNC(=O)N2)CCO1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582782034 1076034674 /nfs/dbraw/zinc/03/46/74/1076034674.db2.gz NAMMTCOLFQBABR-ONGXEEELSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(N[C@]1(CO)CCCN(c2ncccc2-c2nn[n-]n2)C1)[C@H]1CNC(=O)N1 ZINC001582782087 1076034789 /nfs/dbraw/zinc/03/47/89/1076034789.db2.gz NTEPWLUGXMRQNY-BDJLRTHQSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@]1(CO)CCCN(c2ncccc2-c2nnn[n-]2)C1)[C@H]1CNC(=O)N1 ZINC001582782087 1076034785 /nfs/dbraw/zinc/03/47/85/1076034785.db2.gz NTEPWLUGXMRQNY-BDJLRTHQSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@@]1(CO)CCCN(c2ncccc2-c2nn[n-]n2)C1)[C@H]1CNC(=O)N1 ZINC001582782088 1076034708 /nfs/dbraw/zinc/03/47/08/1076034708.db2.gz NTEPWLUGXMRQNY-BZNIZROVSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@@]1(CO)CCCN(c2ncccc2-c2nnn[n-]2)C1)[C@H]1CNC(=O)N1 ZINC001582782088 1076034705 /nfs/dbraw/zinc/03/47/05/1076034705.db2.gz NTEPWLUGXMRQNY-BZNIZROVSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@]1(CO)CCCN(c2ncccc2-c2nn[n-]n2)C1)[C@@H]1CNC(=O)N1 ZINC001582782089 1076034702 /nfs/dbraw/zinc/03/47/02/1076034702.db2.gz NTEPWLUGXMRQNY-MEDUHNTESA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@]1(CO)CCCN(c2ncccc2-c2nnn[n-]2)C1)[C@@H]1CNC(=O)N1 ZINC001582782089 1076034699 /nfs/dbraw/zinc/03/46/99/1076034699.db2.gz NTEPWLUGXMRQNY-MEDUHNTESA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@@]1(CO)CCCN(c2ncccc2-c2nn[n-]n2)C1)[C@@H]1CNC(=O)N1 ZINC001582782090 1076034695 /nfs/dbraw/zinc/03/46/95/1076034695.db2.gz NTEPWLUGXMRQNY-ZBEGNZNMSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(N[C@@]1(CO)CCCN(c2ncccc2-c2nnn[n-]2)C1)[C@@H]1CNC(=O)N1 ZINC001582782090 1076034693 /nfs/dbraw/zinc/03/46/93/1076034693.db2.gz NTEPWLUGXMRQNY-ZBEGNZNMSA-N -1 3 387.404 -1.609 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@H]3CNC(=O)N3)C[C@H]21)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582782194 1076035185 /nfs/dbraw/zinc/03/51/85/1076035185.db2.gz MXBCRRZNBPXSCK-KZFFXBSXSA-N -1 3 385.388 -1.690 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@H]3CNC(=O)N3)C[C@H]21)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582782194 1076035179 /nfs/dbraw/zinc/03/51/79/1076035179.db2.gz MXBCRRZNBPXSCK-KZFFXBSXSA-N -1 3 385.388 -1.690 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@@H]3CNC(=O)N3)C[C@H]21)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582782195 1076035364 /nfs/dbraw/zinc/03/53/64/1076035364.db2.gz MXBCRRZNBPXSCK-UOKLYIGXSA-N -1 3 385.388 -1.690 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@@H]3CNC(=O)N3)C[C@H]21)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582782195 1076035360 /nfs/dbraw/zinc/03/53/60/1076035360.db2.gz MXBCRRZNBPXSCK-UOKLYIGXSA-N -1 3 385.388 -1.690 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C[C@@H]1O)[C@@H]1COC(=O)N1 ZINC001582782206 1076035046 /nfs/dbraw/zinc/03/50/46/1076035046.db2.gz NADSIPOTFZEFGT-AGIUHOORSA-N -1 3 391.363 -1.225 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C[C@@H]1O)[C@@H]1COC(=O)N1 ZINC001582782206 1076035038 /nfs/dbraw/zinc/03/50/38/1076035038.db2.gz NADSIPOTFZEFGT-AGIUHOORSA-N -1 3 391.363 -1.225 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C[C@H]1O)[C@@H]1COC(=O)N1 ZINC001582782207 1076035349 /nfs/dbraw/zinc/03/53/49/1076035349.db2.gz NADSIPOTFZEFGT-FRRDWIJNSA-N -1 3 391.363 -1.225 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C[C@H]1O)[C@@H]1COC(=O)N1 ZINC001582782207 1076035342 /nfs/dbraw/zinc/03/53/42/1076035342.db2.gz NADSIPOTFZEFGT-FRRDWIJNSA-N -1 3 391.363 -1.225 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C[C@H]1O)[C@H]1COC(=O)N1 ZINC001582782208 1076035293 /nfs/dbraw/zinc/03/52/93/1076035293.db2.gz NADSIPOTFZEFGT-JHJVBQTASA-N -1 3 391.363 -1.225 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C[C@H]1O)[C@H]1COC(=O)N1 ZINC001582782208 1076035287 /nfs/dbraw/zinc/03/52/87/1076035287.db2.gz NADSIPOTFZEFGT-JHJVBQTASA-N -1 3 391.363 -1.225 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C[C@@H]1O)[C@H]1COC(=O)N1 ZINC001582782209 1076034987 /nfs/dbraw/zinc/03/49/87/1076034987.db2.gz NADSIPOTFZEFGT-UPJWGTAASA-N -1 3 391.363 -1.225 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C[C@@H]1O)[C@H]1COC(=O)N1 ZINC001582782209 1076034983 /nfs/dbraw/zinc/03/49/83/1076034983.db2.gz NADSIPOTFZEFGT-UPJWGTAASA-N -1 3 391.363 -1.225 20 0 GAADHM O=C(N[C@]12CCC[C@H]1CN(C(=O)[C@@H]1CNC(=O)N1)C2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582782249 1076035232 /nfs/dbraw/zinc/03/52/32/1076035232.db2.gz OWDJITMKHHLOKH-OVSFNBESSA-N -1 3 399.415 -1.013 20 0 GAADHM O=C(N[C@]12CCC[C@H]1CN(C(=O)[C@@H]1CNC(=O)N1)C2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582782249 1076035223 /nfs/dbraw/zinc/03/52/23/1076035223.db2.gz OWDJITMKHHLOKH-OVSFNBESSA-N -1 3 399.415 -1.013 20 0 GAADHM O=C(N[C@]12CCC[C@H]1CN(C(=O)[C@H]1CNC(=O)N1)C2)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582782250 1076035102 /nfs/dbraw/zinc/03/51/02/1076035102.db2.gz OWDJITMKHHLOKH-WUDNQAJYSA-N -1 3 399.415 -1.013 20 0 GAADHM O=C(N[C@]12CCC[C@H]1CN(C(=O)[C@H]1CNC(=O)N1)C2)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582782250 1076035094 /nfs/dbraw/zinc/03/50/94/1076035094.db2.gz OWDJITMKHHLOKH-WUDNQAJYSA-N -1 3 399.415 -1.013 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCCO[C@H](CNc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001582782257 1076035001 /nfs/dbraw/zinc/03/50/01/1076035001.db2.gz PATVPBAXGNPOCA-NEPJUHHUSA-N -1 3 387.404 -1.028 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCCO[C@H](CNc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001582782257 1076034998 /nfs/dbraw/zinc/03/49/98/1076034998.db2.gz PATVPBAXGNPOCA-NEPJUHHUSA-N -1 3 387.404 -1.028 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCCO[C@@H](CNc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001582782258 1076035148 /nfs/dbraw/zinc/03/51/48/1076035148.db2.gz PATVPBAXGNPOCA-NWDGAFQWSA-N -1 3 387.404 -1.028 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCCO[C@@H](CNc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001582782258 1076035137 /nfs/dbraw/zinc/03/51/37/1076035137.db2.gz PATVPBAXGNPOCA-NWDGAFQWSA-N -1 3 387.404 -1.028 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCCO[C@@H](CNc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001582782259 1076035256 /nfs/dbraw/zinc/03/52/56/1076035256.db2.gz PATVPBAXGNPOCA-RYUDHWBXSA-N -1 3 387.404 -1.028 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCCO[C@@H](CNc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001582782259 1076035249 /nfs/dbraw/zinc/03/52/49/1076035249.db2.gz PATVPBAXGNPOCA-RYUDHWBXSA-N -1 3 387.404 -1.028 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCCO[C@H](CNc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001582782260 1076035020 /nfs/dbraw/zinc/03/50/20/1076035020.db2.gz PATVPBAXGNPOCA-VXGBXAGGSA-N -1 3 387.404 -1.028 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCCO[C@H](CNc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001582782260 1076035015 /nfs/dbraw/zinc/03/50/15/1076035015.db2.gz PATVPBAXGNPOCA-VXGBXAGGSA-N -1 3 387.404 -1.028 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCC[C@@](CO)(Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001582782303 1076035127 /nfs/dbraw/zinc/03/51/27/1076035127.db2.gz PVQBFZGOOZHIMZ-BDJLRTHQSA-N -1 3 387.404 -1.292 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCC[C@@](CO)(Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001582782303 1076035120 /nfs/dbraw/zinc/03/51/20/1076035120.db2.gz PVQBFZGOOZHIMZ-BDJLRTHQSA-N -1 3 387.404 -1.292 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCC[C@](CO)(Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001582782304 1076035078 /nfs/dbraw/zinc/03/50/78/1076035078.db2.gz PVQBFZGOOZHIMZ-BZNIZROVSA-N -1 3 387.404 -1.292 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCC[C@](CO)(Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001582782304 1076035074 /nfs/dbraw/zinc/03/50/74/1076035074.db2.gz PVQBFZGOOZHIMZ-BZNIZROVSA-N -1 3 387.404 -1.292 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCC[C@@](CO)(Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001582782305 1076035165 /nfs/dbraw/zinc/03/51/65/1076035165.db2.gz PVQBFZGOOZHIMZ-MEDUHNTESA-N -1 3 387.404 -1.292 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCC[C@@](CO)(Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001582782305 1076035159 /nfs/dbraw/zinc/03/51/59/1076035159.db2.gz PVQBFZGOOZHIMZ-MEDUHNTESA-N -1 3 387.404 -1.292 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCC[C@](CO)(Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001582782306 1076035212 /nfs/dbraw/zinc/03/52/12/1076035212.db2.gz PVQBFZGOOZHIMZ-ZBEGNZNMSA-N -1 3 387.404 -1.292 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCC[C@](CO)(Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001582782306 1076035202 /nfs/dbraw/zinc/03/52/02/1076035202.db2.gz PVQBFZGOOZHIMZ-ZBEGNZNMSA-N -1 3 387.404 -1.292 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@H]1CNC(=O)N1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582782327 1076035062 /nfs/dbraw/zinc/03/50/62/1076035062.db2.gz QUOPZFKVHJOQKP-GXSJLCMTSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@H]1CNC(=O)N1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582782327 1076035060 /nfs/dbraw/zinc/03/50/60/1076035060.db2.gz QUOPZFKVHJOQKP-GXSJLCMTSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@@H]1CNC(=O)N1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582782328 1076035319 /nfs/dbraw/zinc/03/53/19/1076035319.db2.gz QUOPZFKVHJOQKP-KOLCDFICSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@@H]1CNC(=O)N1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582782328 1076035309 /nfs/dbraw/zinc/03/53/09/1076035309.db2.gz QUOPZFKVHJOQKP-KOLCDFICSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@H]1CNC(=O)N1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582782329 1076035563 /nfs/dbraw/zinc/03/55/63/1076035563.db2.gz QUOPZFKVHJOQKP-MWLCHTKSSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@H]1CNC(=O)N1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582782329 1076035556 /nfs/dbraw/zinc/03/55/56/1076035556.db2.gz QUOPZFKVHJOQKP-MWLCHTKSSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@@H]1CNC(=O)N1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582782330 1076035522 /nfs/dbraw/zinc/03/55/22/1076035522.db2.gz QUOPZFKVHJOQKP-ONGXEEELSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@@H]1CNC(=O)N1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582782330 1076035519 /nfs/dbraw/zinc/03/55/19/1076035519.db2.gz QUOPZFKVHJOQKP-ONGXEEELSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C[C@@H]1O)[C@@H]1COC(=O)N1 ZINC001582782370 1076035675 /nfs/dbraw/zinc/03/56/75/1076035675.db2.gz OAUZDPBORUONAB-AGIUHOORSA-N -1 3 391.363 -1.225 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C[C@@H]1O)[C@@H]1COC(=O)N1 ZINC001582782370 1076035670 /nfs/dbraw/zinc/03/56/70/1076035670.db2.gz OAUZDPBORUONAB-AGIUHOORSA-N -1 3 391.363 -1.225 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C[C@H]1O)[C@@H]1COC(=O)N1 ZINC001582782371 1076035752 /nfs/dbraw/zinc/03/57/52/1076035752.db2.gz OAUZDPBORUONAB-FRRDWIJNSA-N -1 3 391.363 -1.225 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C[C@H]1O)[C@@H]1COC(=O)N1 ZINC001582782371 1076035745 /nfs/dbraw/zinc/03/57/45/1076035745.db2.gz OAUZDPBORUONAB-FRRDWIJNSA-N -1 3 391.363 -1.225 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C[C@H]1O)[C@H]1COC(=O)N1 ZINC001582782372 1076035824 /nfs/dbraw/zinc/03/58/24/1076035824.db2.gz OAUZDPBORUONAB-JHJVBQTASA-N -1 3 391.363 -1.225 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C[C@H]1O)[C@H]1COC(=O)N1 ZINC001582782372 1076035819 /nfs/dbraw/zinc/03/58/19/1076035819.db2.gz OAUZDPBORUONAB-JHJVBQTASA-N -1 3 391.363 -1.225 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C[C@@H]1O)[C@H]1COC(=O)N1 ZINC001582782373 1076035699 /nfs/dbraw/zinc/03/56/99/1076035699.db2.gz OAUZDPBORUONAB-UPJWGTAASA-N -1 3 391.363 -1.225 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C[C@@H]1O)[C@H]1COC(=O)N1 ZINC001582782373 1076035694 /nfs/dbraw/zinc/03/56/94/1076035694.db2.gz OAUZDPBORUONAB-UPJWGTAASA-N -1 3 391.363 -1.225 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N(CCO)CCNc1cccc(F)c1-c1nn[n-]n1 ZINC001582782439 1076035769 /nfs/dbraw/zinc/03/57/69/1076035769.db2.gz PCKAKNYUFVDROZ-LLVKDONJSA-N -1 3 378.368 -1.080 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N(CCO)CCNc1cccc(F)c1-c1nnn[n-]1 ZINC001582782439 1076035763 /nfs/dbraw/zinc/03/57/63/1076035763.db2.gz PCKAKNYUFVDROZ-LLVKDONJSA-N -1 3 378.368 -1.080 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N(CCO)CCNc1cccc(F)c1-c1nn[n-]n1 ZINC001582782443 1076035599 /nfs/dbraw/zinc/03/55/99/1076035599.db2.gz PCKAKNYUFVDROZ-NSHDSACASA-N -1 3 378.368 -1.080 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N(CCO)CCNc1cccc(F)c1-c1nnn[n-]1 ZINC001582782443 1076035592 /nfs/dbraw/zinc/03/55/92/1076035592.db2.gz PCKAKNYUFVDROZ-NSHDSACASA-N -1 3 378.368 -1.080 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@H]1CNC(=O)N1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582782454 1076035469 /nfs/dbraw/zinc/03/54/69/1076035469.db2.gz RWXUUHAMNYXQQL-GZMMTYOYSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@H]1CNC(=O)N1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582782454 1076035465 /nfs/dbraw/zinc/03/54/65/1076035465.db2.gz RWXUUHAMNYXQQL-GZMMTYOYSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@@H]1CNC(=O)N1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582782456 1076035544 /nfs/dbraw/zinc/03/55/44/1076035544.db2.gz RWXUUHAMNYXQQL-KCJUWKMLSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@@H]1CNC(=O)N1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582782456 1076035537 /nfs/dbraw/zinc/03/55/37/1076035537.db2.gz RWXUUHAMNYXQQL-KCJUWKMLSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@@H]1CNC(=O)N1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582782457 1076035631 /nfs/dbraw/zinc/03/56/31/1076035631.db2.gz RWXUUHAMNYXQQL-KWQFWETISA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@@H]1CNC(=O)N1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582782457 1076035628 /nfs/dbraw/zinc/03/56/28/1076035628.db2.gz RWXUUHAMNYXQQL-KWQFWETISA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@H]1CNC(=O)N1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582782458 1076035724 /nfs/dbraw/zinc/03/57/24/1076035724.db2.gz RWXUUHAMNYXQQL-LDYMZIIASA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@H]1CNC(=O)N1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582782458 1076035721 /nfs/dbraw/zinc/03/57/21/1076035721.db2.gz RWXUUHAMNYXQQL-LDYMZIIASA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@H]1CNC(=O)N1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582782465 1076036286 /nfs/dbraw/zinc/03/62/86/1076036286.db2.gz SAOLXJXUNJBZGQ-GXSJLCMTSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@H]1CNC(=O)N1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582782465 1076036279 /nfs/dbraw/zinc/03/62/79/1076036279.db2.gz SAOLXJXUNJBZGQ-GXSJLCMTSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@@H]1CNC(=O)N1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582782466 1076036304 /nfs/dbraw/zinc/03/63/04/1076036304.db2.gz SAOLXJXUNJBZGQ-KOLCDFICSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@@H]1CNC(=O)N1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582782466 1076036296 /nfs/dbraw/zinc/03/62/96/1076036296.db2.gz SAOLXJXUNJBZGQ-KOLCDFICSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@H]1CNC(=O)N1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582782467 1076036241 /nfs/dbraw/zinc/03/62/41/1076036241.db2.gz SAOLXJXUNJBZGQ-MWLCHTKSSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@H]1CNC(=O)N1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582782467 1076036236 /nfs/dbraw/zinc/03/62/36/1076036236.db2.gz SAOLXJXUNJBZGQ-MWLCHTKSSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@@H]1CNC(=O)N1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582782468 1076036059 /nfs/dbraw/zinc/03/60/59/1076036059.db2.gz SAOLXJXUNJBZGQ-ONGXEEELSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@@H]1CNC(=O)N1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582782468 1076036051 /nfs/dbraw/zinc/03/60/51/1076036051.db2.gz SAOLXJXUNJBZGQ-ONGXEEELSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@H]1CN(C(=O)[C@H]2CNC(=O)N2)CCO1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582782483 1076036151 /nfs/dbraw/zinc/03/61/51/1076036151.db2.gz SHZUMWVTXYCZIQ-GXSJLCMTSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@H]1CN(C(=O)[C@H]2CNC(=O)N2)CCO1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582782483 1076036141 /nfs/dbraw/zinc/03/61/41/1076036141.db2.gz SHZUMWVTXYCZIQ-GXSJLCMTSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1CN(C(=O)[C@@H]2CNC(=O)N2)CCO1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582782484 1076036006 /nfs/dbraw/zinc/03/60/06/1076036006.db2.gz SHZUMWVTXYCZIQ-KOLCDFICSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1CN(C(=O)[C@@H]2CNC(=O)N2)CCO1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582782484 1076036002 /nfs/dbraw/zinc/03/60/02/1076036002.db2.gz SHZUMWVTXYCZIQ-KOLCDFICSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1CN(C(=O)[C@H]2CNC(=O)N2)CCO1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582782485 1076036109 /nfs/dbraw/zinc/03/61/09/1076036109.db2.gz SHZUMWVTXYCZIQ-MWLCHTKSSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1CN(C(=O)[C@H]2CNC(=O)N2)CCO1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582782485 1076036104 /nfs/dbraw/zinc/03/61/04/1076036104.db2.gz SHZUMWVTXYCZIQ-MWLCHTKSSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@H]1CN(C(=O)[C@@H]2CNC(=O)N2)CCO1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582782486 1076036037 /nfs/dbraw/zinc/03/60/37/1076036037.db2.gz SHZUMWVTXYCZIQ-ONGXEEELSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@H]1CN(C(=O)[C@@H]2CNC(=O)N2)CCO1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582782486 1076036034 /nfs/dbraw/zinc/03/60/34/1076036034.db2.gz SHZUMWVTXYCZIQ-ONGXEEELSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)[C@H]1CNC(=O)N1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582782509 1076036023 /nfs/dbraw/zinc/03/60/23/1076036023.db2.gz TUMCNJGAVGULKI-IQIPOGNMSA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)[C@H]1CNC(=O)N1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582782509 1076036017 /nfs/dbraw/zinc/03/60/17/1076036017.db2.gz TUMCNJGAVGULKI-IQIPOGNMSA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)[C@@H]1CNC(=O)N1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582782510 1076036071 /nfs/dbraw/zinc/03/60/71/1076036071.db2.gz TUMCNJGAVGULKI-LSKIRQOJSA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)[C@@H]1CNC(=O)N1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582782510 1076036068 /nfs/dbraw/zinc/03/60/68/1076036068.db2.gz TUMCNJGAVGULKI-LSKIRQOJSA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)[C@@H]1CNC(=O)N1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582782511 1076036324 /nfs/dbraw/zinc/03/63/24/1076036324.db2.gz TWCLABWTRJMTCW-HNXYORABSA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)[C@@H]1CNC(=O)N1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582782511 1076036315 /nfs/dbraw/zinc/03/63/15/1076036315.db2.gz TWCLABWTRJMTCW-HNXYORABSA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)[C@H]1CNC(=O)N1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582782512 1076036177 /nfs/dbraw/zinc/03/61/77/1076036177.db2.gz TWCLABWTRJMTCW-PUYANOKMSA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)[C@H]1CNC(=O)N1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582782512 1076036167 /nfs/dbraw/zinc/03/61/67/1076036167.db2.gz TWCLABWTRJMTCW-PUYANOKMSA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(c1cc(-c2nn[n-]n2)c[nH]1)N1CC[C@H]2CN(C(=O)[C@@H]3CNC(=O)N3)C[C@H]21 ZINC001582782527 1076036572 /nfs/dbraw/zinc/03/65/72/1076036572.db2.gz TZSOBMAIVYZJGR-KPXOXKRLSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1CC[C@H]2CN(C(=O)[C@@H]3CNC(=O)N3)C[C@H]21 ZINC001582782527 1076036566 /nfs/dbraw/zinc/03/65/66/1076036566.db2.gz TZSOBMAIVYZJGR-KPXOXKRLSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1cc(-c2nn[n-]n2)c[nH]1)N1CC[C@H]2CN(C(=O)[C@H]3CNC(=O)N3)C[C@H]21 ZINC001582782528 1076036708 /nfs/dbraw/zinc/03/67/08/1076036708.db2.gz TZSOBMAIVYZJGR-XXILOJSOSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1CC[C@H]2CN(C(=O)[C@H]3CNC(=O)N3)C[C@H]21 ZINC001582782528 1076036703 /nfs/dbraw/zinc/03/67/03/1076036703.db2.gz TZSOBMAIVYZJGR-XXILOJSOSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1C[C@@H]2CCN(C(=O)[C@@H]3CNC(=O)N3)[C@@H]2C1 ZINC001582782571 1076036725 /nfs/dbraw/zinc/03/67/25/1076036725.db2.gz UDANLMWEOBRKFV-KPXOXKRLSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1C[C@@H]2CCN(C(=O)[C@@H]3CNC(=O)N3)[C@@H]2C1 ZINC001582782571 1076036721 /nfs/dbraw/zinc/03/67/21/1076036721.db2.gz UDANLMWEOBRKFV-KPXOXKRLSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1C[C@@H]2CCN(C(=O)[C@H]3CNC(=O)N3)[C@@H]2C1 ZINC001582782573 1076036490 /nfs/dbraw/zinc/03/64/90/1076036490.db2.gz UDANLMWEOBRKFV-XXILOJSOSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1C[C@@H]2CCN(C(=O)[C@H]3CNC(=O)N3)[C@@H]2C1 ZINC001582782573 1076036486 /nfs/dbraw/zinc/03/64/86/1076036486.db2.gz UDANLMWEOBRKFV-XXILOJSOSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCCO[C@@H](CNc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582782574 1076036591 /nfs/dbraw/zinc/03/65/91/1076036591.db2.gz UEQYSSXQPIERDP-AAEUAGOBSA-N -1 3 387.404 -1.028 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCCO[C@@H](CNc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582782574 1076036585 /nfs/dbraw/zinc/03/65/85/1076036585.db2.gz UEQYSSXQPIERDP-AAEUAGOBSA-N -1 3 387.404 -1.028 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCCO[C@H](CNc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582782575 1076036521 /nfs/dbraw/zinc/03/65/21/1076036521.db2.gz UEQYSSXQPIERDP-DGCLKSJQSA-N -1 3 387.404 -1.028 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCCO[C@H](CNc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582782575 1076036515 /nfs/dbraw/zinc/03/65/15/1076036515.db2.gz UEQYSSXQPIERDP-DGCLKSJQSA-N -1 3 387.404 -1.028 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCCO[C@@H](CNc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582782577 1076036657 /nfs/dbraw/zinc/03/66/57/1076036657.db2.gz UEQYSSXQPIERDP-WCQYABFASA-N -1 3 387.404 -1.028 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCCO[C@@H](CNc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582782577 1076036652 /nfs/dbraw/zinc/03/66/52/1076036652.db2.gz UEQYSSXQPIERDP-WCQYABFASA-N -1 3 387.404 -1.028 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCCO[C@H](CNc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001582782578 1076036555 /nfs/dbraw/zinc/03/65/55/1076036555.db2.gz UEQYSSXQPIERDP-YPMHNXCESA-N -1 3 387.404 -1.028 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCCO[C@H](CNc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001582782578 1076036551 /nfs/dbraw/zinc/03/65/51/1076036551.db2.gz UEQYSSXQPIERDP-YPMHNXCESA-N -1 3 387.404 -1.028 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1CC2(C1)CCN(C(=O)[C@H]1CNC(=O)N1)C2 ZINC001582782658 1076036505 /nfs/dbraw/zinc/03/65/05/1076036505.db2.gz VGAFHUOYJCONKQ-LLVKDONJSA-N -1 3 385.388 -1.449 20 0 GAADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1CC2(C1)CCN(C(=O)[C@H]1CNC(=O)N1)C2 ZINC001582782658 1076036500 /nfs/dbraw/zinc/03/65/00/1076036500.db2.gz VGAFHUOYJCONKQ-LLVKDONJSA-N -1 3 385.388 -1.449 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1CC2(C1)CCN(C(=O)[C@@H]1CNC(=O)N1)C2 ZINC001582782660 1076036641 /nfs/dbraw/zinc/03/66/41/1076036641.db2.gz VGAFHUOYJCONKQ-NSHDSACASA-N -1 3 385.388 -1.449 20 0 GAADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1CC2(C1)CCN(C(=O)[C@@H]1CNC(=O)N1)C2 ZINC001582782660 1076036635 /nfs/dbraw/zinc/03/66/35/1076036635.db2.gz VGAFHUOYJCONKQ-NSHDSACASA-N -1 3 385.388 -1.449 20 0 GAADHM O=C(NC1(CCO)CN(Cc2ccc(-c3nn[n-]n3)cc2)C1)[C@H]1CNC(=O)N1 ZINC001582782667 1076036935 /nfs/dbraw/zinc/03/69/35/1076036935.db2.gz VIGIQCZCUJOALW-CYBMUJFWSA-N -1 3 386.416 -1.399 20 0 GAADHM O=C(NC1(CCO)CN(Cc2ccc(-c3nnn[n-]3)cc2)C1)[C@H]1CNC(=O)N1 ZINC001582782667 1076036932 /nfs/dbraw/zinc/03/69/32/1076036932.db2.gz VIGIQCZCUJOALW-CYBMUJFWSA-N -1 3 386.416 -1.399 20 0 GAADHM O=C(NC1(CCO)CN(Cc2ccc(-c3nn[n-]n3)cc2)C1)[C@@H]1CNC(=O)N1 ZINC001582782668 1076036968 /nfs/dbraw/zinc/03/69/68/1076036968.db2.gz VIGIQCZCUJOALW-ZDUSSCGKSA-N -1 3 386.416 -1.399 20 0 GAADHM O=C(NC1(CCO)CN(Cc2ccc(-c3nnn[n-]3)cc2)C1)[C@@H]1CNC(=O)N1 ZINC001582782668 1076036958 /nfs/dbraw/zinc/03/69/58/1076036958.db2.gz VIGIQCZCUJOALW-ZDUSSCGKSA-N -1 3 386.416 -1.399 20 0 GAADHM O=C(NC[C@H]1CCCN(C(=O)[C@H]2CNC(=O)N2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582782675 1076037152 /nfs/dbraw/zinc/03/71/52/1076037152.db2.gz VKKIVHMQTJDHFO-BXKDBHETSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NC[C@H]1CCCN(C(=O)[C@H]2CNC(=O)N2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582782675 1076037147 /nfs/dbraw/zinc/03/71/47/1076037147.db2.gz VKKIVHMQTJDHFO-BXKDBHETSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NC[C@@H]1CCCN(C(=O)[C@@H]2CNC(=O)N2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582782676 1076037196 /nfs/dbraw/zinc/03/71/96/1076037196.db2.gz VKKIVHMQTJDHFO-CABZTGNLSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NC[C@@H]1CCCN(C(=O)[C@@H]2CNC(=O)N2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582782676 1076037192 /nfs/dbraw/zinc/03/71/92/1076037192.db2.gz VKKIVHMQTJDHFO-CABZTGNLSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NC[C@@H]1CCCN(C(=O)[C@H]2CNC(=O)N2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582782677 1076037076 /nfs/dbraw/zinc/03/70/76/1076037076.db2.gz VKKIVHMQTJDHFO-JOYOIKCWSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NC[C@@H]1CCCN(C(=O)[C@H]2CNC(=O)N2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582782677 1076037068 /nfs/dbraw/zinc/03/70/68/1076037068.db2.gz VKKIVHMQTJDHFO-JOYOIKCWSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NC[C@H]1CCCN(C(=O)[C@@H]2CNC(=O)N2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582782679 1076036871 /nfs/dbraw/zinc/03/68/71/1076036871.db2.gz VKKIVHMQTJDHFO-SKDRFNHKSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NC[C@H]1CCCN(C(=O)[C@@H]2CNC(=O)N2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582782679 1076036866 /nfs/dbraw/zinc/03/68/66/1076036866.db2.gz VKKIVHMQTJDHFO-SKDRFNHKSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(c1cc(-c2nn[n-]n2)c[nH]1)N1C[C@@H]2CCN(C(=O)[C@@H]3CNC(=O)N3)[C@@H]2C1 ZINC001582782696 1076036854 /nfs/dbraw/zinc/03/68/54/1076036854.db2.gz VYLRSVFHPAQVBN-KPXOXKRLSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1C[C@@H]2CCN(C(=O)[C@@H]3CNC(=O)N3)[C@@H]2C1 ZINC001582782696 1076036849 /nfs/dbraw/zinc/03/68/49/1076036849.db2.gz VYLRSVFHPAQVBN-KPXOXKRLSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1cc(-c2nn[n-]n2)c[nH]1)N1C[C@@H]2CCN(C(=O)[C@H]3CNC(=O)N3)[C@@H]2C1 ZINC001582782698 1076037012 /nfs/dbraw/zinc/03/70/12/1076037012.db2.gz VYLRSVFHPAQVBN-XXILOJSOSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1C[C@@H]2CCN(C(=O)[C@H]3CNC(=O)N3)[C@@H]2C1 ZINC001582782698 1076037002 /nfs/dbraw/zinc/03/70/02/1076037002.db2.gz VYLRSVFHPAQVBN-XXILOJSOSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1CCC2(CN(C(=O)[C@H]3CNC(=O)N3)C2)C1 ZINC001582782751 1076037033 /nfs/dbraw/zinc/03/70/33/1076037033.db2.gz SFNFPTVQPPWFMJ-LLVKDONJSA-N -1 3 385.388 -1.449 20 0 GAADHM O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1CCC2(CN(C(=O)[C@H]3CNC(=O)N3)C2)C1 ZINC001582782751 1076037025 /nfs/dbraw/zinc/03/70/25/1076037025.db2.gz SFNFPTVQPPWFMJ-LLVKDONJSA-N -1 3 385.388 -1.449 20 0 GAADHM O=C(c1c[nH]c(-c2nn[n-]n2)c1)N1CCC2(CN(C(=O)[C@@H]3CNC(=O)N3)C2)C1 ZINC001582782752 1076037054 /nfs/dbraw/zinc/03/70/54/1076037054.db2.gz SFNFPTVQPPWFMJ-NSHDSACASA-N -1 3 385.388 -1.449 20 0 GAADHM O=C(c1c[nH]c(-c2nnn[n-]2)c1)N1CCC2(CN(C(=O)[C@@H]3CNC(=O)N3)C2)C1 ZINC001582782752 1076037046 /nfs/dbraw/zinc/03/70/46/1076037046.db2.gz SFNFPTVQPPWFMJ-NSHDSACASA-N -1 3 385.388 -1.449 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@@H]3CNC(=O)N3)C[C@H]21)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582782754 1076036889 /nfs/dbraw/zinc/03/68/89/1076036889.db2.gz SIWRZFIFCSOIFU-GUDRVLHUSA-N -1 3 385.388 -1.690 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@@H]3CNC(=O)N3)C[C@H]21)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582782754 1076036883 /nfs/dbraw/zinc/03/68/83/1076036883.db2.gz SIWRZFIFCSOIFU-GUDRVLHUSA-N -1 3 385.388 -1.690 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@H]3CNC(=O)N3)C[C@H]21)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582782756 1076037136 /nfs/dbraw/zinc/03/71/36/1076037136.db2.gz SIWRZFIFCSOIFU-MWGHHZFTSA-N -1 3 385.388 -1.690 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)[C@H]3CNC(=O)N3)C[C@H]21)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582782756 1076037131 /nfs/dbraw/zinc/03/71/31/1076037131.db2.gz SIWRZFIFCSOIFU-MWGHHZFTSA-N -1 3 385.388 -1.690 20 0 GAADHM O=C(c1cc(-c2nn[n-]n2)c[nH]1)N1CC2(C1)CCN(C(=O)[C@H]1CNC(=O)N1)C2 ZINC001582782758 1076037118 /nfs/dbraw/zinc/03/71/18/1076037118.db2.gz WIVAMFZGWZNMHF-LLVKDONJSA-N -1 3 385.388 -1.449 20 0 GAADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1CC2(C1)CCN(C(=O)[C@H]1CNC(=O)N1)C2 ZINC001582782758 1076037112 /nfs/dbraw/zinc/03/71/12/1076037112.db2.gz WIVAMFZGWZNMHF-LLVKDONJSA-N -1 3 385.388 -1.449 20 0 GAADHM O=C(c1cc(-c2nn[n-]n2)c[nH]1)N1CC2(C1)CCN(C(=O)[C@@H]1CNC(=O)N1)C2 ZINC001582782759 1076037169 /nfs/dbraw/zinc/03/71/69/1076037169.db2.gz WIVAMFZGWZNMHF-NSHDSACASA-N -1 3 385.388 -1.449 20 0 GAADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1CC2(C1)CCN(C(=O)[C@@H]1CNC(=O)N1)C2 ZINC001582782759 1076037164 /nfs/dbraw/zinc/03/71/64/1076037164.db2.gz WIVAMFZGWZNMHF-NSHDSACASA-N -1 3 385.388 -1.449 20 0 GAADHM O=C(NCC[C@@H]1CCN(C(=O)[C@H]2CNC(=O)N2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582782794 1076037382 /nfs/dbraw/zinc/03/73/82/1076037382.db2.gz SUSLFZPSGALQFT-BXKDBHETSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@@H]1CCN(C(=O)[C@H]2CNC(=O)N2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582782794 1076037372 /nfs/dbraw/zinc/03/73/72/1076037372.db2.gz SUSLFZPSGALQFT-BXKDBHETSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@H]1CCN(C(=O)[C@@H]2CNC(=O)N2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582782799 1076037452 /nfs/dbraw/zinc/03/74/52/1076037452.db2.gz SUSLFZPSGALQFT-CABZTGNLSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@H]1CCN(C(=O)[C@@H]2CNC(=O)N2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582782799 1076037445 /nfs/dbraw/zinc/03/74/45/1076037445.db2.gz SUSLFZPSGALQFT-CABZTGNLSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@H]1CCN(C(=O)[C@H]2CNC(=O)N2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582782802 1076037311 /nfs/dbraw/zinc/03/73/11/1076037311.db2.gz SUSLFZPSGALQFT-JOYOIKCWSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@H]1CCN(C(=O)[C@H]2CNC(=O)N2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582782802 1076037304 /nfs/dbraw/zinc/03/73/04/1076037304.db2.gz SUSLFZPSGALQFT-JOYOIKCWSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@@H]1CCN(C(=O)[C@@H]2CNC(=O)N2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582782806 1076037359 /nfs/dbraw/zinc/03/73/59/1076037359.db2.gz SUSLFZPSGALQFT-SKDRFNHKSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@@H]1CCN(C(=O)[C@@H]2CNC(=O)N2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582782806 1076037352 /nfs/dbraw/zinc/03/73/52/1076037352.db2.gz SUSLFZPSGALQFT-SKDRFNHKSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCO[C@@H](CNc2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001582782819 1076037536 /nfs/dbraw/zinc/03/75/36/1076037536.db2.gz XCNIYKYLYSNBOP-GXSJLCMTSA-N -1 3 391.367 -1.279 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCO[C@@H](CNc2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001582782819 1076037531 /nfs/dbraw/zinc/03/75/31/1076037531.db2.gz XCNIYKYLYSNBOP-GXSJLCMTSA-N -1 3 391.367 -1.279 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCO[C@H](CNc2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001582782821 1076037590 /nfs/dbraw/zinc/03/75/90/1076037590.db2.gz XCNIYKYLYSNBOP-KOLCDFICSA-N -1 3 391.367 -1.279 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCO[C@H](CNc2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001582782821 1076037584 /nfs/dbraw/zinc/03/75/84/1076037584.db2.gz XCNIYKYLYSNBOP-KOLCDFICSA-N -1 3 391.367 -1.279 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCO[C@H](CNc2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001582782822 1076037482 /nfs/dbraw/zinc/03/74/82/1076037482.db2.gz XCNIYKYLYSNBOP-MWLCHTKSSA-N -1 3 391.367 -1.279 20 0 GAADHM O=C([C@H]1CNC(=O)N1)N1CCO[C@H](CNc2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001582782822 1076037476 /nfs/dbraw/zinc/03/74/76/1076037476.db2.gz XCNIYKYLYSNBOP-MWLCHTKSSA-N -1 3 391.367 -1.279 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCO[C@@H](CNc2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001582782824 1076037514 /nfs/dbraw/zinc/03/75/14/1076037514.db2.gz XCNIYKYLYSNBOP-ONGXEEELSA-N -1 3 391.367 -1.279 20 0 GAADHM O=C([C@@H]1CNC(=O)N1)N1CCO[C@@H](CNc2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001582782824 1076037510 /nfs/dbraw/zinc/03/75/10/1076037510.db2.gz XCNIYKYLYSNBOP-ONGXEEELSA-N -1 3 391.367 -1.279 20 0 GAADHM O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)[C@H]1CNC(=O)N1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582782825 1076037465 /nfs/dbraw/zinc/03/74/65/1076037465.db2.gz XCVURWFYTLCEEO-DMWPJOQESA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)[C@H]1CNC(=O)N1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582782825 1076037461 /nfs/dbraw/zinc/03/74/61/1076037461.db2.gz XCVURWFYTLCEEO-DMWPJOQESA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)[C@H]1CNC(=O)N1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582782826 1076037526 /nfs/dbraw/zinc/03/75/26/1076037526.db2.gz XCVURWFYTLCEEO-IQIPOGNMSA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)[C@H]1CNC(=O)N1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582782826 1076037520 /nfs/dbraw/zinc/03/75/20/1076037520.db2.gz XCVURWFYTLCEEO-IQIPOGNMSA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)[C@@H]1CNC(=O)N1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582782827 1076037502 /nfs/dbraw/zinc/03/75/02/1076037502.db2.gz XCVURWFYTLCEEO-LSKIRQOJSA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)[C@@H]1CNC(=O)N1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582782827 1076037499 /nfs/dbraw/zinc/03/74/99/1076037499.db2.gz XCVURWFYTLCEEO-LSKIRQOJSA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)[C@@H]1CNC(=O)N1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582782828 1076037401 /nfs/dbraw/zinc/03/74/01/1076037401.db2.gz XCVURWFYTLCEEO-QCZKYFFMSA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)[C@@H]1CNC(=O)N1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582782828 1076037394 /nfs/dbraw/zinc/03/73/94/1076037394.db2.gz XCVURWFYTLCEEO-QCZKYFFMSA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(c1cc(-c2nn[n-]n2)c[nH]1)N1CC[C@@H]2CN(C(=O)[C@H]3CNC(=O)N3)[C@@H]2C1 ZINC001582782856 1076037492 /nfs/dbraw/zinc/03/74/92/1076037492.db2.gz XOHUIDVDERUEHK-GGZOMVNGSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1CC[C@@H]2CN(C(=O)[C@H]3CNC(=O)N3)[C@@H]2C1 ZINC001582782856 1076037489 /nfs/dbraw/zinc/03/74/89/1076037489.db2.gz XOHUIDVDERUEHK-GGZOMVNGSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1cc(-c2nn[n-]n2)c[nH]1)N1CC[C@@H]2CN(C(=O)[C@@H]3CNC(=O)N3)[C@@H]2C1 ZINC001582782858 1076037342 /nfs/dbraw/zinc/03/73/42/1076037342.db2.gz XOHUIDVDERUEHK-JFUSQASVSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(c1cc(-c2nnn[n-]2)c[nH]1)N1CC[C@@H]2CN(C(=O)[C@@H]3CNC(=O)N3)[C@@H]2C1 ZINC001582782858 1076037337 /nfs/dbraw/zinc/03/73/37/1076037337.db2.gz XOHUIDVDERUEHK-JFUSQASVSA-N -1 3 385.388 -1.451 20 0 GAADHM O=C(NC[C@H]1CCCN(C(=O)[C@H]2CNC(=O)N2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582782890 1076038059 /nfs/dbraw/zinc/03/80/59/1076038059.db2.gz YEMHJGVELVAUKW-BXKDBHETSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NC[C@H]1CCCN(C(=O)[C@H]2CNC(=O)N2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582782890 1076038053 /nfs/dbraw/zinc/03/80/53/1076038053.db2.gz YEMHJGVELVAUKW-BXKDBHETSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NC[C@@H]1CCCN(C(=O)[C@@H]2CNC(=O)N2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582782892 1076037812 /nfs/dbraw/zinc/03/78/12/1076037812.db2.gz YEMHJGVELVAUKW-CABZTGNLSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NC[C@@H]1CCCN(C(=O)[C@@H]2CNC(=O)N2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582782892 1076037808 /nfs/dbraw/zinc/03/78/08/1076037808.db2.gz YEMHJGVELVAUKW-CABZTGNLSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@@H]1CCN(C(=O)[C@H]2CNC(=O)N2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582782920 1076037761 /nfs/dbraw/zinc/03/77/61/1076037761.db2.gz VFZAADHMAWNZPW-BXKDBHETSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@@H]1CCN(C(=O)[C@H]2CNC(=O)N2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582782920 1076037755 /nfs/dbraw/zinc/03/77/55/1076037755.db2.gz 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O=C(NC[C@@H]1[C@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]21)[C@H]1CNC(=O)N1 ZINC001582784100 1076040266 /nfs/dbraw/zinc/04/02/66/1076040266.db2.gz JRDBJHYCBYBHLX-KZFFXBSXSA-N -1 3 385.388 -1.690 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]21)[C@H]1CNC(=O)N1 ZINC001582784100 1076040263 /nfs/dbraw/zinc/04/02/63/1076040263.db2.gz JRDBJHYCBYBHLX-KZFFXBSXSA-N -1 3 385.388 -1.690 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]21)[C@@H]1CNC(=O)N1 ZINC001582784101 1076040309 /nfs/dbraw/zinc/04/03/09/1076040309.db2.gz JRDBJHYCBYBHLX-UOKLYIGXSA-N -1 3 385.388 -1.690 20 0 GAADHM O=C(NC[C@@H]1[C@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]21)[C@@H]1CNC(=O)N1 ZINC001582784101 1076040304 /nfs/dbraw/zinc/04/03/04/1076040304.db2.gz JRDBJHYCBYBHLX-UOKLYIGXSA-N -1 3 385.388 -1.690 20 0 GAADHM O=C(NC[C@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)CCO1)[C@H]1CNC(=O)N1 ZINC001582784138 1076040524 /nfs/dbraw/zinc/04/05/24/1076040524.db2.gz KJERXDWOIQMKNT-GXSJLCMTSA-N -1 3 391.367 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O=C(NC[C@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)CCO1)[C@@H]1CNC(=O)N1 ZINC001582784141 1076040570 /nfs/dbraw/zinc/04/05/70/1076040570.db2.gz KJERXDWOIQMKNT-ONGXEEELSA-N -1 3 391.367 -1.596 20 0 GAADHM O=C(NC[C@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)CCO1)[C@@H]1CNC(=O)N1 ZINC001582784141 1076040566 /nfs/dbraw/zinc/04/05/66/1076040566.db2.gz KJERXDWOIQMKNT-ONGXEEELSA-N -1 3 391.367 -1.596 20 0 GAADHM O=C(NCCC1(CNC(=O)[C@H]2CNC(=O)N2)CC1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582784180 1076040812 /nfs/dbraw/zinc/04/08/12/1076040812.db2.gz LISFCKWSLJQKEJ-LLVKDONJSA-N -1 3 387.404 -1.108 20 0 GAADHM O=C(NCCC1(CNC(=O)[C@H]2CNC(=O)N2)CC1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582784180 1076040806 /nfs/dbraw/zinc/04/08/06/1076040806.db2.gz LISFCKWSLJQKEJ-LLVKDONJSA-N -1 3 387.404 -1.108 20 0 GAADHM O=C(NCCC1(CNC(=O)[C@@H]2CNC(=O)N2)CC1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001582784181 1076040860 /nfs/dbraw/zinc/04/08/60/1076040860.db2.gz LISFCKWSLJQKEJ-NSHDSACASA-N -1 3 387.404 -1.108 20 0 GAADHM O=C(NCCC1(CNC(=O)[C@@H]2CNC(=O)N2)CC1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001582784181 1076040855 /nfs/dbraw/zinc/04/08/55/1076040855.db2.gz LISFCKWSLJQKEJ-NSHDSACASA-N -1 3 387.404 -1.108 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1)[C@H]1CNC(=O)N1 ZINC001582784255 1076041178 /nfs/dbraw/zinc/04/11/78/1076041178.db2.gz MLKWFVBMDXUGDU-GXSJLCMTSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1)[C@H]1CNC(=O)N1 ZINC001582784255 1076041172 /nfs/dbraw/zinc/04/11/72/1076041172.db2.gz MLKWFVBMDXUGDU-GXSJLCMTSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1)[C@@H]1CNC(=O)N1 ZINC001582784256 1076041353 /nfs/dbraw/zinc/04/13/53/1076041353.db2.gz MLKWFVBMDXUGDU-KOLCDFICSA-N -1 3 389.376 -2.167 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1)[C@@H]1CNC(=O)N1 ZINC001582784256 1076041349 /nfs/dbraw/zinc/04/13/49/1076041349.db2.gz MLKWFVBMDXUGDU-KOLCDFICSA-N -1 3 389.376 -2.167 20 0 GAADHM 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O=C(NCCC1(CNC(=O)[C@H]2CNC(=O)N2)CC1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582784267 1076041256 /nfs/dbraw/zinc/04/12/56/1076041256.db2.gz MPWCDJNHCLVPEZ-LLVKDONJSA-N -1 3 387.404 -1.108 20 0 GAADHM O=C(NCCC1(CNC(=O)[C@@H]2CNC(=O)N2)CC1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001582784268 1076041062 /nfs/dbraw/zinc/04/10/62/1076041062.db2.gz MPWCDJNHCLVPEZ-NSHDSACASA-N -1 3 387.404 -1.108 20 0 GAADHM O=C(NCCC1(CNC(=O)[C@@H]2CNC(=O)N2)CC1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001582784268 1076041055 /nfs/dbraw/zinc/04/10/55/1076041055.db2.gz MPWCDJNHCLVPEZ-NSHDSACASA-N -1 3 387.404 -1.108 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ncc(-c2nn[n-]n2)cc1F)[C@H]1CNC(=O)N1 ZINC001582784281 1076041150 /nfs/dbraw/zinc/04/11/50/1076041150.db2.gz MYJNJMXVSRBSOA-GXSJLCMTSA-N -1 3 391.367 -1.596 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ncc(-c2nnn[n-]2)cc1F)[C@H]1CNC(=O)N1 ZINC001582784281 1076041146 /nfs/dbraw/zinc/04/11/46/1076041146.db2.gz MYJNJMXVSRBSOA-GXSJLCMTSA-N -1 3 391.367 -1.596 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ncc(-c2nn[n-]n2)cc1F)[C@@H]1CNC(=O)N1 ZINC001582784282 1076041019 /nfs/dbraw/zinc/04/10/19/1076041019.db2.gz MYJNJMXVSRBSOA-KOLCDFICSA-N -1 3 391.367 -1.596 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ncc(-c2nnn[n-]2)cc1F)[C@@H]1CNC(=O)N1 ZINC001582784282 1076041016 /nfs/dbraw/zinc/04/10/16/1076041016.db2.gz MYJNJMXVSRBSOA-KOLCDFICSA-N -1 3 391.367 -1.596 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ncc(-c2nn[n-]n2)cc1F)[C@H]1CNC(=O)N1 ZINC001582784283 1076041131 /nfs/dbraw/zinc/04/11/31/1076041131.db2.gz MYJNJMXVSRBSOA-MWLCHTKSSA-N -1 3 391.367 -1.596 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ncc(-c2nnn[n-]2)cc1F)[C@H]1CNC(=O)N1 ZINC001582784283 1076041123 /nfs/dbraw/zinc/04/11/23/1076041123.db2.gz MYJNJMXVSRBSOA-MWLCHTKSSA-N -1 3 391.367 -1.596 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ncc(-c2nn[n-]n2)cc1F)[C@@H]1CNC(=O)N1 ZINC001582784284 1076041093 /nfs/dbraw/zinc/04/10/93/1076041093.db2.gz MYJNJMXVSRBSOA-ONGXEEELSA-N -1 3 391.367 -1.596 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ncc(-c2nnn[n-]2)cc1F)[C@@H]1CNC(=O)N1 ZINC001582784284 1076041089 /nfs/dbraw/zinc/04/10/89/1076041089.db2.gz MYJNJMXVSRBSOA-ONGXEEELSA-N -1 3 391.367 -1.596 20 0 GAADHM O=C(NCC1(CCNC(=O)[C@H]2CNC(=O)N2)CC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582784285 1076041283 /nfs/dbraw/zinc/04/12/83/1076041283.db2.gz MZYOTMABEPLCHH-LLVKDONJSA-N -1 3 387.404 -1.108 20 0 GAADHM O=C(NCC1(CCNC(=O)[C@H]2CNC(=O)N2)CC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582784285 1076041273 /nfs/dbraw/zinc/04/12/73/1076041273.db2.gz MZYOTMABEPLCHH-LLVKDONJSA-N -1 3 387.404 -1.108 20 0 GAADHM O=C(NCC1(CCNC(=O)[C@@H]2CNC(=O)N2)CC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582784286 1076041078 /nfs/dbraw/zinc/04/10/78/1076041078.db2.gz MZYOTMABEPLCHH-NSHDSACASA-N -1 3 387.404 -1.108 20 0 GAADHM O=C(NCC1(CCNC(=O)[C@@H]2CNC(=O)N2)CC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582784286 1076041071 /nfs/dbraw/zinc/04/10/71/1076041071.db2.gz MZYOTMABEPLCHH-NSHDSACASA-N -1 3 387.404 -1.108 20 0 GAADHM O=C(NC[C@H]1CCCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)[C@H]1CNC(=O)N1 ZINC001582784317 1076041202 /nfs/dbraw/zinc/04/12/02/1076041202.db2.gz NJWINWMNFQSPCY-BXKDBHETSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NC[C@H]1CCCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)[C@H]1CNC(=O)N1 ZINC001582784317 1076041198 /nfs/dbraw/zinc/04/11/98/1076041198.db2.gz NJWINWMNFQSPCY-BXKDBHETSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NC[C@@H]1CCCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)[C@@H]1CNC(=O)N1 ZINC001582784318 1076041333 /nfs/dbraw/zinc/04/13/33/1076041333.db2.gz NJWINWMNFQSPCY-CABZTGNLSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NC[C@@H]1CCCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)[C@@H]1CNC(=O)N1 ZINC001582784318 1076041325 /nfs/dbraw/zinc/04/13/25/1076041325.db2.gz NJWINWMNFQSPCY-CABZTGNLSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NC[C@@H]1CCCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)[C@H]1CNC(=O)N1 ZINC001582784319 1076041110 /nfs/dbraw/zinc/04/11/10/1076041110.db2.gz NJWINWMNFQSPCY-JOYOIKCWSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NC[C@@H]1CCCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)[C@H]1CNC(=O)N1 ZINC001582784319 1076041106 /nfs/dbraw/zinc/04/11/06/1076041106.db2.gz NJWINWMNFQSPCY-JOYOIKCWSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NC[C@H]1CCCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)[C@@H]1CNC(=O)N1 ZINC001582784320 1076041215 /nfs/dbraw/zinc/04/12/15/1076041215.db2.gz NJWINWMNFQSPCY-SKDRFNHKSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NC[C@H]1CCCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)[C@@H]1CNC(=O)N1 ZINC001582784320 1076041210 /nfs/dbraw/zinc/04/12/10/1076041210.db2.gz NJWINWMNFQSPCY-SKDRFNHKSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC1(O)CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C1)[C@H]1CNC(=O)N1 ZINC001582784341 1076041552 /nfs/dbraw/zinc/04/15/52/1076041552.db2.gz NPQQQQJZRKUYIR-GFCCVEGCSA-N -1 3 390.379 -1.650 20 0 GAADHM O=C(NCC1(O)CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C1)[C@H]1CNC(=O)N1 ZINC001582784341 1076041547 /nfs/dbraw/zinc/04/15/47/1076041547.db2.gz NPQQQQJZRKUYIR-GFCCVEGCSA-N -1 3 390.379 -1.650 20 0 GAADHM O=C(NCC1(O)CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C1)[C@@H]1CNC(=O)N1 ZINC001582784342 1076041570 /nfs/dbraw/zinc/04/15/70/1076041570.db2.gz NPQQQQJZRKUYIR-LBPRGKRZSA-N -1 3 390.379 -1.650 20 0 GAADHM O=C(NCC1(O)CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C1)[C@@H]1CNC(=O)N1 ZINC001582784342 1076041564 /nfs/dbraw/zinc/04/15/64/1076041564.db2.gz NPQQQQJZRKUYIR-LBPRGKRZSA-N -1 3 390.379 -1.650 20 0 GAADHM O=C(NCC1(O)CN(Cc2cc(F)ccc2-c2nn[n-]n2)C1)[C@H]1CNC(=O)N1 ZINC001582784345 1076041606 /nfs/dbraw/zinc/04/16/06/1076041606.db2.gz NSDGHXOOPSUZPV-GFCCVEGCSA-N -1 3 390.379 -1.650 20 0 GAADHM O=C(NCC1(O)CN(Cc2cc(F)ccc2-c2nnn[n-]2)C1)[C@H]1CNC(=O)N1 ZINC001582784345 1076041600 /nfs/dbraw/zinc/04/16/00/1076041600.db2.gz NSDGHXOOPSUZPV-GFCCVEGCSA-N -1 3 390.379 -1.650 20 0 GAADHM O=C(NCC1(O)CN(Cc2cc(F)ccc2-c2nn[n-]n2)C1)[C@@H]1CNC(=O)N1 ZINC001582784346 1076041635 /nfs/dbraw/zinc/04/16/35/1076041635.db2.gz NSDGHXOOPSUZPV-LBPRGKRZSA-N -1 3 390.379 -1.650 20 0 GAADHM O=C(NCC1(O)CN(Cc2cc(F)ccc2-c2nnn[n-]2)C1)[C@@H]1CNC(=O)N1 ZINC001582784346 1076041628 /nfs/dbraw/zinc/04/16/28/1076041628.db2.gz NSDGHXOOPSUZPV-LBPRGKRZSA-N -1 3 390.379 -1.650 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1CCN(C2CN([C@H]3CCNC3=O)C2)CC1 ZINC001582784496 1076041678 /nfs/dbraw/zinc/04/16/78/1076041678.db2.gz AXYGUYPDEOWLCU-AWEZNQCLSA-N -1 3 385.432 -1.475 20 0 GAADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1CCN(C2CN([C@H]3CCNC3=O)C2)CC1 ZINC001582784496 1076041672 /nfs/dbraw/zinc/04/16/72/1076041672.db2.gz AXYGUYPDEOWLCU-AWEZNQCLSA-N -1 3 385.432 -1.475 20 0 GAADHM O=C(c1ccc(-c2nn[n-]n2)[nH]1)N1CCN(C2CN([C@@H]3CCNC3=O)C2)CC1 ZINC001582784497 1076041777 /nfs/dbraw/zinc/04/17/77/1076041777.db2.gz AXYGUYPDEOWLCU-CQSZACIVSA-N -1 3 385.432 -1.475 20 0 GAADHM O=C(c1ccc(-c2nnn[n-]2)[nH]1)N1CCN(C2CN([C@@H]3CCNC3=O)C2)CC1 ZINC001582784497 1076041771 /nfs/dbraw/zinc/04/17/71/1076041771.db2.gz AXYGUYPDEOWLCU-CQSZACIVSA-N -1 3 385.432 -1.475 20 0 GAADHM O=C(NCCN1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1)[C@H]1CNC(=O)N1 ZINC001582784597 1076041766 /nfs/dbraw/zinc/04/17/66/1076041766.db2.gz QJXISXOLLKUVLE-GFCCVEGCSA-N -1 3 386.420 -1.819 20 0 GAADHM O=C(NCCN1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1)[C@H]1CNC(=O)N1 ZINC001582784597 1076041762 /nfs/dbraw/zinc/04/17/62/1076041762.db2.gz QJXISXOLLKUVLE-GFCCVEGCSA-N -1 3 386.420 -1.819 20 0 GAADHM O=C(NCCN1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1)[C@@H]1CNC(=O)N1 ZINC001582784598 1076041590 /nfs/dbraw/zinc/04/15/90/1076041590.db2.gz QJXISXOLLKUVLE-LBPRGKRZSA-N -1 3 386.420 -1.819 20 0 GAADHM O=C(NCCN1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1)[C@@H]1CNC(=O)N1 ZINC001582784598 1076041585 /nfs/dbraw/zinc/04/15/85/1076041585.db2.gz QJXISXOLLKUVLE-LBPRGKRZSA-N -1 3 386.420 -1.819 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2cccc(F)c2-c2nn[n-]n2)C1)[C@H]1CNC(=O)N1 ZINC001582784599 1076041698 /nfs/dbraw/zinc/04/16/98/1076041698.db2.gz QLPGFTVDNXHCAG-HWPZZCPQSA-N -1 3 390.379 -1.255 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2cccc(F)c2-c2nnn[n-]2)C1)[C@H]1CNC(=O)N1 ZINC001582784599 1076041692 /nfs/dbraw/zinc/04/16/92/1076041692.db2.gz QLPGFTVDNXHCAG-HWPZZCPQSA-N -1 3 390.379 -1.255 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2cccc(F)c2-c2nn[n-]n2)C1)[C@@H]1CNC(=O)N1 ZINC001582784600 1076041743 /nfs/dbraw/zinc/04/17/43/1076041743.db2.gz QLPGFTVDNXHCAG-MGPLVRAMSA-N -1 3 390.379 -1.255 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2cccc(F)c2-c2nnn[n-]2)C1)[C@@H]1CNC(=O)N1 ZINC001582784600 1076041737 /nfs/dbraw/zinc/04/17/37/1076041737.db2.gz QLPGFTVDNXHCAG-MGPLVRAMSA-N -1 3 390.379 -1.255 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2cccc(F)c2-c2nn[n-]n2)C1)[C@@H]1CNC(=O)N1 ZINC001582784601 1076041964 /nfs/dbraw/zinc/04/19/64/1076041964.db2.gz QLPGFTVDNXHCAG-QFYYESIMSA-N -1 3 390.379 -1.255 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2cccc(F)c2-c2nnn[n-]2)C1)[C@@H]1CNC(=O)N1 ZINC001582784601 1076041961 /nfs/dbraw/zinc/04/19/61/1076041961.db2.gz QLPGFTVDNXHCAG-QFYYESIMSA-N -1 3 390.379 -1.255 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2cccc(F)c2-c2nn[n-]n2)C1)[C@H]1CNC(=O)N1 ZINC001582784602 1076042129 /nfs/dbraw/zinc/04/21/29/1076042129.db2.gz QLPGFTVDNXHCAG-QLJPJBMISA-N -1 3 390.379 -1.255 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2cccc(F)c2-c2nnn[n-]2)C1)[C@H]1CNC(=O)N1 ZINC001582784602 1076042120 /nfs/dbraw/zinc/04/21/20/1076042120.db2.gz QLPGFTVDNXHCAG-QLJPJBMISA-N -1 3 390.379 -1.255 20 0 GAADHM O=C(NCC1(O)CN(Cc2cc(-c3nn[n-]n3)ccc2F)C1)[C@H]1CNC(=O)N1 ZINC001582784607 1076042203 /nfs/dbraw/zinc/04/22/03/1076042203.db2.gz QVEPQYFNJHITDQ-GFCCVEGCSA-N -1 3 390.379 -1.650 20 0 GAADHM O=C(NCC1(O)CN(Cc2cc(-c3nnn[n-]3)ccc2F)C1)[C@H]1CNC(=O)N1 ZINC001582784607 1076042199 /nfs/dbraw/zinc/04/21/99/1076042199.db2.gz QVEPQYFNJHITDQ-GFCCVEGCSA-N -1 3 390.379 -1.650 20 0 GAADHM O=C(NCC1(O)CN(Cc2cc(-c3nn[n-]n3)ccc2F)C1)[C@@H]1CNC(=O)N1 ZINC001582784608 1076041992 /nfs/dbraw/zinc/04/19/92/1076041992.db2.gz QVEPQYFNJHITDQ-LBPRGKRZSA-N -1 3 390.379 -1.650 20 0 GAADHM O=C(NCC1(O)CN(Cc2cc(-c3nnn[n-]3)ccc2F)C1)[C@@H]1CNC(=O)N1 ZINC001582784608 1076041988 /nfs/dbraw/zinc/04/19/88/1076041988.db2.gz QVEPQYFNJHITDQ-LBPRGKRZSA-N -1 3 390.379 -1.650 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ncc(-c2nn[n-]n2)cc1F)[C@@H]1CCNC1=O ZINC001582784735 1076042009 /nfs/dbraw/zinc/04/20/09/1076042009.db2.gz FMGGLPBGLZTTNP-GHMZBOCLSA-N -1 3 390.379 -1.142 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ncc(-c2nnn[n-]2)cc1F)[C@@H]1CCNC1=O ZINC001582784735 1076042004 /nfs/dbraw/zinc/04/20/04/1076042004.db2.gz FMGGLPBGLZTTNP-GHMZBOCLSA-N -1 3 390.379 -1.142 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ncc(-c2nn[n-]n2)cc1F)[C@H]1CCNC1=O ZINC001582784736 1076042215 /nfs/dbraw/zinc/04/22/15/1076042215.db2.gz FMGGLPBGLZTTNP-MNOVXSKESA-N -1 3 390.379 -1.142 20 0 GAADHM O=C(NC[C@@H]1COCCN1c1ncc(-c2nnn[n-]2)cc1F)[C@H]1CCNC1=O ZINC001582784736 1076042212 /nfs/dbraw/zinc/04/22/12/1076042212.db2.gz FMGGLPBGLZTTNP-MNOVXSKESA-N -1 3 390.379 -1.142 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ncc(-c2nn[n-]n2)cc1F)[C@H]1CCNC1=O ZINC001582784737 1076041939 /nfs/dbraw/zinc/04/19/39/1076041939.db2.gz FMGGLPBGLZTTNP-QWRGUYRKSA-N -1 3 390.379 -1.142 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ncc(-c2nnn[n-]2)cc1F)[C@H]1CCNC1=O ZINC001582784737 1076041936 /nfs/dbraw/zinc/04/19/36/1076041936.db2.gz FMGGLPBGLZTTNP-QWRGUYRKSA-N -1 3 390.379 -1.142 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ncc(-c2nn[n-]n2)cc1F)[C@@H]1CCNC1=O ZINC001582784738 1076041927 /nfs/dbraw/zinc/04/19/27/1076041927.db2.gz FMGGLPBGLZTTNP-WDEREUQCSA-N -1 3 390.379 -1.142 20 0 GAADHM O=C(NC[C@H]1COCCN1c1ncc(-c2nnn[n-]2)cc1F)[C@@H]1CCNC1=O ZINC001582784738 1076041924 /nfs/dbraw/zinc/04/19/24/1076041924.db2.gz FMGGLPBGLZTTNP-WDEREUQCSA-N -1 3 390.379 -1.142 20 0 GAADHM O=C(NC[C@H]1COCCN1Cc1cccc(-c2nn[n-]n2)c1)[C@@H]1CNC(=O)N1 ZINC001582784759 1076042035 /nfs/dbraw/zinc/04/20/35/1076042035.db2.gz RGFIPTCHYHNUKM-KBPBESRZSA-N -1 3 386.416 -1.135 20 0 GAADHM O=C(NC[C@H]1COCCN1Cc1cccc(-c2nnn[n-]2)c1)[C@@H]1CNC(=O)N1 ZINC001582784759 1076042024 /nfs/dbraw/zinc/04/20/24/1076042024.db2.gz RGFIPTCHYHNUKM-KBPBESRZSA-N -1 3 386.416 -1.135 20 0 GAADHM O=C(NC[C@@H]1COCCN1Cc1cccc(-c2nn[n-]n2)c1)[C@@H]1CNC(=O)N1 ZINC001582784760 1076042106 /nfs/dbraw/zinc/04/21/06/1076042106.db2.gz RGFIPTCHYHNUKM-KGLIPLIRSA-N -1 3 386.416 -1.135 20 0 GAADHM O=C(NC[C@@H]1COCCN1Cc1cccc(-c2nnn[n-]2)c1)[C@@H]1CNC(=O)N1 ZINC001582784760 1076042098 /nfs/dbraw/zinc/04/20/98/1076042098.db2.gz RGFIPTCHYHNUKM-KGLIPLIRSA-N -1 3 386.416 -1.135 20 0 GAADHM O=C(NC[C@H]1COCCN1Cc1cccc(-c2nn[n-]n2)c1)[C@H]1CNC(=O)N1 ZINC001582784761 1076042152 /nfs/dbraw/zinc/04/21/52/1076042152.db2.gz RGFIPTCHYHNUKM-UONOGXRCSA-N -1 3 386.416 -1.135 20 0 GAADHM O=C(NC[C@H]1COCCN1Cc1cccc(-c2nnn[n-]2)c1)[C@H]1CNC(=O)N1 ZINC001582784761 1076042143 /nfs/dbraw/zinc/04/21/43/1076042143.db2.gz RGFIPTCHYHNUKM-UONOGXRCSA-N -1 3 386.416 -1.135 20 0 GAADHM O=C(NC[C@@H]1COCCN1Cc1cccc(-c2nn[n-]n2)c1)[C@H]1CNC(=O)N1 ZINC001582784762 1076042179 /nfs/dbraw/zinc/04/21/79/1076042179.db2.gz RGFIPTCHYHNUKM-ZIAGYGMSSA-N -1 3 386.416 -1.135 20 0 GAADHM O=C(NC[C@@H]1COCCN1Cc1cccc(-c2nnn[n-]2)c1)[C@H]1CNC(=O)N1 ZINC001582784762 1076042177 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O=C(NCCC1(CNC(=O)[C@H]2CNC(=O)N2)CC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582785191 1076043280 /nfs/dbraw/zinc/04/32/80/1076043280.db2.gz WOGLEDHLZXMJPB-LLVKDONJSA-N -1 3 387.404 -1.108 20 0 GAADHM O=C(NCCC1(CNC(=O)[C@@H]2CNC(=O)N2)CC1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582785192 1076043372 /nfs/dbraw/zinc/04/33/72/1076043372.db2.gz WOGLEDHLZXMJPB-NSHDSACASA-N -1 3 387.404 -1.108 20 0 GAADHM O=C(NCCC1(CNC(=O)[C@@H]2CNC(=O)N2)CC1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582785192 1076043363 /nfs/dbraw/zinc/04/33/63/1076043363.db2.gz WOGLEDHLZXMJPB-NSHDSACASA-N -1 3 387.404 -1.108 20 0 GAADHM O=C(NCC[C@@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)[C@H]1CNC(=O)N1 ZINC001582785205 1076043317 /nfs/dbraw/zinc/04/33/17/1076043317.db2.gz WWKDODJJFWYCOV-BXKDBHETSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)[C@H]1CNC(=O)N1 ZINC001582785205 1076043314 /nfs/dbraw/zinc/04/33/14/1076043314.db2.gz WWKDODJJFWYCOV-BXKDBHETSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)[C@@H]1CNC(=O)N1 ZINC001582785206 1076043332 /nfs/dbraw/zinc/04/33/32/1076043332.db2.gz WWKDODJJFWYCOV-CABZTGNLSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)[C@@H]1CNC(=O)N1 ZINC001582785206 1076043327 /nfs/dbraw/zinc/04/33/27/1076043327.db2.gz WWKDODJJFWYCOV-CABZTGNLSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)[C@H]1CNC(=O)N1 ZINC001582785207 1076043668 /nfs/dbraw/zinc/04/36/68/1076043668.db2.gz WWKDODJJFWYCOV-JOYOIKCWSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)[C@H]1CNC(=O)N1 ZINC001582785207 1076043666 /nfs/dbraw/zinc/04/36/66/1076043666.db2.gz WWKDODJJFWYCOV-JOYOIKCWSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)[C@@H]1CNC(=O)N1 ZINC001582785208 1076043739 /nfs/dbraw/zinc/04/37/39/1076043739.db2.gz WWKDODJJFWYCOV-SKDRFNHKSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)[C@@H]1CNC(=O)N1 ZINC001582785208 1076043732 /nfs/dbraw/zinc/04/37/32/1076043732.db2.gz WWKDODJJFWYCOV-SKDRFNHKSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1)[C@H]1CNC(=O)N1 ZINC001582785229 1076043717 /nfs/dbraw/zinc/04/37/17/1076043717.db2.gz XNKCXWLDHQTADX-BMIGLBTASA-N -1 3 391.367 -1.860 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1)[C@H]1CNC(=O)N1 ZINC001582785229 1076043710 /nfs/dbraw/zinc/04/37/10/1076043710.db2.gz XNKCXWLDHQTADX-BMIGLBTASA-N -1 3 391.367 -1.860 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1)[C@@H]1CNC(=O)N1 ZINC001582785230 1076043556 /nfs/dbraw/zinc/04/35/56/1076043556.db2.gz XNKCXWLDHQTADX-BONVTDFDSA-N -1 3 391.367 -1.860 20 0 GAADHM O=C(NC[C@@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1)[C@@H]1CNC(=O)N1 ZINC001582785230 1076043551 /nfs/dbraw/zinc/04/35/51/1076043551.db2.gz XNKCXWLDHQTADX-BONVTDFDSA-N -1 3 391.367 -1.860 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1)[C@H]1CNC(=O)N1 ZINC001582785231 1076043829 /nfs/dbraw/zinc/04/38/29/1076043829.db2.gz XNKCXWLDHQTADX-MEBBXXQBSA-N -1 3 391.367 -1.860 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1)[C@H]1CNC(=O)N1 ZINC001582785231 1076043826 /nfs/dbraw/zinc/04/38/26/1076043826.db2.gz XNKCXWLDHQTADX-MEBBXXQBSA-N -1 3 391.367 -1.860 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1)[C@@H]1CNC(=O)N1 ZINC001582785232 1076043540 /nfs/dbraw/zinc/04/35/40/1076043540.db2.gz XNKCXWLDHQTADX-ZUZCIYMTSA-N -1 3 391.367 -1.860 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1)[C@@H]1CNC(=O)N1 ZINC001582785232 1076043533 /nfs/dbraw/zinc/04/35/33/1076043533.db2.gz XNKCXWLDHQTADX-ZUZCIYMTSA-N -1 3 391.367 -1.860 20 0 GAADHM O=C(NC[C@H]1CN(Cc2ccccc2-c2nn[n-]n2)CCO1)[C@H]1CNC(=O)N1 ZINC001582785386 1076044090 /nfs/dbraw/zinc/04/40/90/1076044090.db2.gz YCVMVFRSYGMABM-GXTWGEPZSA-N -1 3 386.416 -1.135 20 0 GAADHM O=C(NC[C@H]1CN(Cc2ccccc2-c2nnn[n-]2)CCO1)[C@H]1CNC(=O)N1 ZINC001582785386 1076044088 /nfs/dbraw/zinc/04/40/88/1076044088.db2.gz YCVMVFRSYGMABM-GXTWGEPZSA-N -1 3 386.416 -1.135 20 0 GAADHM O=C(NC[C@H]1CN(Cc2ccccc2-c2nn[n-]n2)CCO1)[C@@H]1CNC(=O)N1 ZINC001582785388 1076044004 /nfs/dbraw/zinc/04/40/04/1076044004.db2.gz YCVMVFRSYGMABM-JSGCOSHPSA-N -1 3 386.416 -1.135 20 0 GAADHM O=C(NC[C@H]1CN(Cc2ccccc2-c2nnn[n-]2)CCO1)[C@@H]1CNC(=O)N1 ZINC001582785388 1076043999 /nfs/dbraw/zinc/04/39/99/1076043999.db2.gz YCVMVFRSYGMABM-JSGCOSHPSA-N -1 3 386.416 -1.135 20 0 GAADHM O=C(NC[C@@H]1CN(Cc2ccccc2-c2nn[n-]n2)CCO1)[C@@H]1CNC(=O)N1 ZINC001582785390 1076044100 /nfs/dbraw/zinc/04/41/00/1076044100.db2.gz YCVMVFRSYGMABM-OCCSQVGLSA-N -1 3 386.416 -1.135 20 0 GAADHM O=C(NC[C@@H]1CN(Cc2ccccc2-c2nnn[n-]2)CCO1)[C@@H]1CNC(=O)N1 ZINC001582785390 1076044098 /nfs/dbraw/zinc/04/40/98/1076044098.db2.gz YCVMVFRSYGMABM-OCCSQVGLSA-N -1 3 386.416 -1.135 20 0 GAADHM O=C(NC[C@@H]1CN(Cc2ccccc2-c2nn[n-]n2)CCO1)[C@H]1CNC(=O)N1 ZINC001582785392 1076044124 /nfs/dbraw/zinc/04/41/24/1076044124.db2.gz YCVMVFRSYGMABM-TZMCWYRMSA-N -1 3 386.416 -1.135 20 0 GAADHM O=C(NC[C@@H]1CN(Cc2ccccc2-c2nnn[n-]2)CCO1)[C@H]1CNC(=O)N1 ZINC001582785392 1076044122 /nfs/dbraw/zinc/04/41/22/1076044122.db2.gz YCVMVFRSYGMABM-TZMCWYRMSA-N -1 3 386.416 -1.135 20 0 GAADHM O=C(NCC[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@H]1CNC(=O)N1 ZINC001582785415 1076044057 /nfs/dbraw/zinc/04/40/57/1076044057.db2.gz YMEPCLOMJQTJQD-BXKDBHETSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@H]1CNC(=O)N1 ZINC001582785415 1076044050 /nfs/dbraw/zinc/04/40/50/1076044050.db2.gz YMEPCLOMJQTJQD-BXKDBHETSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@@H]1CNC(=O)N1 ZINC001582785416 1076044113 /nfs/dbraw/zinc/04/41/13/1076044113.db2.gz YMEPCLOMJQTJQD-CABZTGNLSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@@H]1CNC(=O)N1 ZINC001582785416 1076044111 /nfs/dbraw/zinc/04/41/11/1076044111.db2.gz YMEPCLOMJQTJQD-CABZTGNLSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@H]1CNC(=O)N1 ZINC001582785417 1076044075 /nfs/dbraw/zinc/04/40/75/1076044075.db2.gz YMEPCLOMJQTJQD-JOYOIKCWSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@H]1CNC(=O)N1 ZINC001582785417 1076044073 /nfs/dbraw/zinc/04/40/73/1076044073.db2.gz YMEPCLOMJQTJQD-JOYOIKCWSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)[C@@H]1CNC(=O)N1 ZINC001582785418 1076043949 /nfs/dbraw/zinc/04/39/49/1076043949.db2.gz YMEPCLOMJQTJQD-SKDRFNHKSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(NCC[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)[C@@H]1CNC(=O)N1 ZINC001582785418 1076043945 /nfs/dbraw/zinc/04/39/45/1076043945.db2.gz YMEPCLOMJQTJQD-SKDRFNHKSA-N -1 3 387.404 -1.155 20 0 GAADHM O=C(N[C@@H]1CCCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1)[C@H]1CNC(=O)N1 ZINC001582785427 1076044151 /nfs/dbraw/zinc/04/41/51/1076044151.db2.gz YXUGPBLDHVGATF-BXKDBHETSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@@H]1CCCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1)[C@H]1CNC(=O)N1 ZINC001582785427 1076044149 /nfs/dbraw/zinc/04/41/49/1076044149.db2.gz YXUGPBLDHVGATF-BXKDBHETSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@H]1CCCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1)[C@@H]1CNC(=O)N1 ZINC001582785428 1076044029 /nfs/dbraw/zinc/04/40/29/1076044029.db2.gz YXUGPBLDHVGATF-CABZTGNLSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@H]1CCCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1)[C@@H]1CNC(=O)N1 ZINC001582785428 1076044026 /nfs/dbraw/zinc/04/40/26/1076044026.db2.gz YXUGPBLDHVGATF-CABZTGNLSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@H]1CCCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1)[C@H]1CNC(=O)N1 ZINC001582785429 1076044426 /nfs/dbraw/zinc/04/44/26/1076044426.db2.gz YXUGPBLDHVGATF-JOYOIKCWSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@H]1CCCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1)[C@H]1CNC(=O)N1 ZINC001582785429 1076044424 /nfs/dbraw/zinc/04/44/24/1076044424.db2.gz YXUGPBLDHVGATF-JOYOIKCWSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@@H]1CCCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1)[C@@H]1CNC(=O)N1 ZINC001582785430 1076044351 /nfs/dbraw/zinc/04/43/51/1076044351.db2.gz YXUGPBLDHVGATF-SKDRFNHKSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@@H]1CCCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1)[C@@H]1CNC(=O)N1 ZINC001582785430 1076044348 /nfs/dbraw/zinc/04/43/48/1076044348.db2.gz YXUGPBLDHVGATF-SKDRFNHKSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@H]1CN(c2ncccc2-c2nn[n-]n2)CCCO1)[C@H]1CNC(=O)N1 ZINC001582785453 1076044298 /nfs/dbraw/zinc/04/42/98/1076044298.db2.gz ZNYOPPZBTLNXCN-CMPLNLGQSA-N -1 3 387.404 -1.345 20 0 GAADHM O=C(NC[C@H]1CN(c2ncccc2-c2nnn[n-]2)CCCO1)[C@H]1CNC(=O)N1 ZINC001582785453 1076044294 /nfs/dbraw/zinc/04/42/94/1076044294.db2.gz ZNYOPPZBTLNXCN-CMPLNLGQSA-N -1 3 387.404 -1.345 20 0 GAADHM O=C(NC[C@H]1CN(c2ncccc2-c2nn[n-]n2)CCCO1)[C@@H]1CNC(=O)N1 ZINC001582785454 1076044360 /nfs/dbraw/zinc/04/43/60/1076044360.db2.gz ZNYOPPZBTLNXCN-JQWIXIFHSA-N -1 3 387.404 -1.345 20 0 GAADHM O=C(NC[C@H]1CN(c2ncccc2-c2nnn[n-]2)CCCO1)[C@@H]1CNC(=O)N1 ZINC001582785454 1076044357 /nfs/dbraw/zinc/04/43/57/1076044357.db2.gz ZNYOPPZBTLNXCN-JQWIXIFHSA-N -1 3 387.404 -1.345 20 0 GAADHM O=C(NC[C@@H]1CN(c2ncccc2-c2nn[n-]n2)CCCO1)[C@@H]1CNC(=O)N1 ZINC001582785455 1076044438 /nfs/dbraw/zinc/04/44/38/1076044438.db2.gz ZNYOPPZBTLNXCN-PWSUYJOCSA-N -1 3 387.404 -1.345 20 0 GAADHM O=C(NC[C@@H]1CN(c2ncccc2-c2nnn[n-]2)CCCO1)[C@@H]1CNC(=O)N1 ZINC001582785455 1076044433 /nfs/dbraw/zinc/04/44/33/1076044433.db2.gz ZNYOPPZBTLNXCN-PWSUYJOCSA-N -1 3 387.404 -1.345 20 0 GAADHM O=C(NC[C@@H]1CN(c2ncccc2-c2nn[n-]n2)CCCO1)[C@H]1CNC(=O)N1 ZINC001582785456 1076044370 /nfs/dbraw/zinc/04/43/70/1076044370.db2.gz ZNYOPPZBTLNXCN-ZYHUDNBSSA-N -1 3 387.404 -1.345 20 0 GAADHM O=C(NC[C@@H]1CN(c2ncccc2-c2nnn[n-]2)CCCO1)[C@H]1CNC(=O)N1 ZINC001582785456 1076044367 /nfs/dbraw/zinc/04/43/67/1076044367.db2.gz ZNYOPPZBTLNXCN-ZYHUDNBSSA-N -1 3 387.404 -1.345 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)s2)C[C@H]1O)[C@@H]1CCNC1=O ZINC001582785633 1076044603 /nfs/dbraw/zinc/04/46/03/1076044603.db2.gz OOILCYMLQPHMRT-GMTAPVOTSA-N -1 3 377.430 -1.274 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)s2)C[C@H]1O)[C@@H]1CCNC1=O ZINC001582785633 1076044598 /nfs/dbraw/zinc/04/45/98/1076044598.db2.gz OOILCYMLQPHMRT-GMTAPVOTSA-N -1 3 377.430 -1.274 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)s2)C[C@H]1O)[C@H]1CCNC1=O ZINC001582785634 1076044647 /nfs/dbraw/zinc/04/46/47/1076044647.db2.gz OOILCYMLQPHMRT-HBNTYKKESA-N -1 3 377.430 -1.274 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)s2)C[C@H]1O)[C@H]1CCNC1=O ZINC001582785634 1076044642 /nfs/dbraw/zinc/04/46/42/1076044642.db2.gz OOILCYMLQPHMRT-HBNTYKKESA-N -1 3 377.430 -1.274 20 0 GAADHM O=C(NCCN1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1)[C@H]1CNC(=O)N1 ZINC001582785684 1076044691 /nfs/dbraw/zinc/04/46/91/1076044691.db2.gz FDIOBUOKWZPLRO-CYBMUJFWSA-N -1 3 386.420 -1.819 20 0 GAADHM O=C(NCCN1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1)[C@H]1CNC(=O)N1 ZINC001582785684 1076044685 /nfs/dbraw/zinc/04/46/85/1076044685.db2.gz FDIOBUOKWZPLRO-CYBMUJFWSA-N -1 3 386.420 -1.819 20 0 GAADHM O=C(NCCN1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1)[C@@H]1CNC(=O)N1 ZINC001582785685 1076044708 /nfs/dbraw/zinc/04/47/08/1076044708.db2.gz FDIOBUOKWZPLRO-ZDUSSCGKSA-N -1 3 386.420 -1.819 20 0 GAADHM O=C(NCCN1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1)[C@@H]1CNC(=O)N1 ZINC001582785685 1076044704 /nfs/dbraw/zinc/04/47/04/1076044704.db2.gz FDIOBUOKWZPLRO-ZDUSSCGKSA-N -1 3 386.420 -1.819 20 0 GAADHM O=C(N[C@]12CCC[C@H]1CN(C(=O)c1c[nH]c(-c3nn[n-]n3)c1)C2)[C@H]1CNC(=O)N1 ZINC001582785847 1076044618 /nfs/dbraw/zinc/04/46/18/1076044618.db2.gz HAGMHIWJKZIAAP-BFCNOCSMSA-N -1 3 399.415 -1.013 20 0 GAADHM O=C(N[C@]12CCC[C@H]1CN(C(=O)c1c[nH]c(-c3nnn[n-]3)c1)C2)[C@H]1CNC(=O)N1 ZINC001582785847 1076044612 /nfs/dbraw/zinc/04/46/12/1076044612.db2.gz HAGMHIWJKZIAAP-BFCNOCSMSA-N -1 3 399.415 -1.013 20 0 GAADHM O=C(N[C@]12CCC[C@H]1CN(C(=O)c1c[nH]c(-c3nn[n-]n3)c1)C2)[C@@H]1CNC(=O)N1 ZINC001582785848 1076044855 /nfs/dbraw/zinc/04/48/55/1076044855.db2.gz HAGMHIWJKZIAAP-ZMNCSTGQSA-N -1 3 399.415 -1.013 20 0 GAADHM O=C(N[C@]12CCC[C@H]1CN(C(=O)c1c[nH]c(-c3nnn[n-]3)c1)C2)[C@@H]1CNC(=O)N1 ZINC001582785848 1076044849 /nfs/dbraw/zinc/04/48/49/1076044849.db2.gz HAGMHIWJKZIAAP-ZMNCSTGQSA-N -1 3 399.415 -1.013 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C[C@H]1O)[C@H]1CCNC1=O ZINC001582785855 1076044836 /nfs/dbraw/zinc/04/48/36/1076044836.db2.gz RSZXNQQWYFHILV-IACUBPJLSA-N -1 3 389.391 -1.197 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C[C@H]1O)[C@H]1CCNC1=O ZINC001582785855 1076044831 /nfs/dbraw/zinc/04/48/31/1076044831.db2.gz RSZXNQQWYFHILV-IACUBPJLSA-N -1 3 389.391 -1.197 20 0 GAADHM 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OEBVNXTZNOGWGE-YGOYTEALSA-N -1 3 387.404 -1.109 20 0 GAADHM O=C1NCC2(CCOCC2)[C@@H]1NS(=O)(=O)c1cncc(-c2nn[n-]n2)c1 ZINC001582786464 1076045750 /nfs/dbraw/zinc/04/57/50/1076045750.db2.gz OQHVUHTVWBRWLC-LLVKDONJSA-N -1 3 379.402 -1.165 20 0 GAADHM O=C1NCC2(CCOCC2)[C@@H]1NS(=O)(=O)c1cncc(-c2nnn[n-]2)c1 ZINC001582786464 1076045744 /nfs/dbraw/zinc/04/57/44/1076045744.db2.gz OQHVUHTVWBRWLC-LLVKDONJSA-N -1 3 379.402 -1.165 20 0 GAADHM O=C1NCC2(CCOCC2)[C@H]1NS(=O)(=O)c1cncc(-c2nn[n-]n2)c1 ZINC001582786465 1076045581 /nfs/dbraw/zinc/04/55/81/1076045581.db2.gz OQHVUHTVWBRWLC-NSHDSACASA-N -1 3 379.402 -1.165 20 0 GAADHM O=C1NCC2(CCOCC2)[C@H]1NS(=O)(=O)c1cncc(-c2nnn[n-]2)c1 ZINC001582786465 1076045574 /nfs/dbraw/zinc/04/55/74/1076045574.db2.gz OQHVUHTVWBRWLC-NSHDSACASA-N -1 3 379.402 -1.165 20 0 GAADHM O=C1NC[C@@H](O)CC12CN(S(=O)(=O)c1cc(F)cc(-c3nn[n-]n3)c1)C2 ZINC001582786598 1076045795 /nfs/dbraw/zinc/04/57/95/1076045795.db2.gz OYQHUMURIYUHHJ-JTQLQIEISA-N -1 3 382.377 -1.123 20 0 GAADHM O=C1NC[C@@H](O)CC12CN(S(=O)(=O)c1cc(F)cc(-c3nnn[n-]3)c1)C2 ZINC001582786598 1076045793 /nfs/dbraw/zinc/04/57/93/1076045793.db2.gz OYQHUMURIYUHHJ-JTQLQIEISA-N -1 3 382.377 -1.123 20 0 GAADHM O=C1NC[C@H](O)CC12CN(S(=O)(=O)c1cc(F)cc(-c3nn[n-]n3)c1)C2 ZINC001582786599 1076045764 /nfs/dbraw/zinc/04/57/64/1076045764.db2.gz OYQHUMURIYUHHJ-SNVBAGLBSA-N -1 3 382.377 -1.123 20 0 GAADHM O=C1NC[C@H](O)CC12CN(S(=O)(=O)c1cc(F)cc(-c3nnn[n-]3)c1)C2 ZINC001582786599 1076045763 /nfs/dbraw/zinc/04/57/63/1076045763.db2.gz OYQHUMURIYUHHJ-SNVBAGLBSA-N -1 3 382.377 -1.123 20 0 GAADHM O=C(N[C@@H]1CC[C@H](CNC(=O)[C@H]2CNC(=O)N2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582786701 1076045778 /nfs/dbraw/zinc/04/57/78/1076045778.db2.gz QALJSCIUALCJLC-MKPLZMMCSA-N -1 3 387.404 -1.109 20 0 GAADHM O=C(N[C@@H]1CC[C@H](CNC(=O)[C@H]2CNC(=O)N2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582786701 1076045775 /nfs/dbraw/zinc/04/57/75/1076045775.db2.gz QALJSCIUALCJLC-MKPLZMMCSA-N -1 3 387.404 -1.109 20 0 GAADHM O=C(N[C@@H]1CC[C@H](CNC(=O)[C@@H]2CNC(=O)N2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582786703 1076045624 /nfs/dbraw/zinc/04/56/24/1076045624.db2.gz QALJSCIUALCJLC-XRNSZHNASA-N -1 3 387.404 -1.109 20 0 GAADHM O=C(N[C@@H]1CC[C@H](CNC(=O)[C@@H]2CNC(=O)N2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582786703 1076045617 /nfs/dbraw/zinc/04/56/17/1076045617.db2.gz QALJSCIUALCJLC-XRNSZHNASA-N -1 3 387.404 -1.109 20 0 GAADHM O=C1NCC2(CCOCC2)[C@@H]1NS(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001582786741 1076045945 /nfs/dbraw/zinc/04/59/45/1076045945.db2.gz QNBCNATUSKTTTD-LLVKDONJSA-N -1 3 379.402 -1.165 20 0 GAADHM O=C1NCC2(CCOCC2)[C@@H]1NS(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001582786741 1076045938 /nfs/dbraw/zinc/04/59/38/1076045938.db2.gz QNBCNATUSKTTTD-LLVKDONJSA-N -1 3 379.402 -1.165 20 0 GAADHM O=C1NCC2(CCOCC2)[C@H]1NS(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001582786745 1076045924 /nfs/dbraw/zinc/04/59/24/1076045924.db2.gz QNBCNATUSKTTTD-NSHDSACASA-N -1 3 379.402 -1.165 20 0 GAADHM O=C1NCC2(CCOCC2)[C@H]1NS(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001582786745 1076045914 /nfs/dbraw/zinc/04/59/14/1076045914.db2.gz QNBCNATUSKTTTD-NSHDSACASA-N -1 3 379.402 -1.165 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C[C@H]1O)[C@H]1CNC(=O)N1 ZINC001582786763 1076046081 /nfs/dbraw/zinc/04/60/81/1076046081.db2.gz RBHJZKCJKRGRCI-JHJVBQTASA-N -1 3 390.379 -1.652 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C[C@H]1O)[C@H]1CNC(=O)N1 ZINC001582786763 1076046076 /nfs/dbraw/zinc/04/60/76/1076046076.db2.gz RBHJZKCJKRGRCI-JHJVBQTASA-N -1 3 390.379 -1.652 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C[C@@H]1O)[C@H]1CNC(=O)N1 ZINC001582786764 1076046057 /nfs/dbraw/zinc/04/60/57/1076046057.db2.gz RBHJZKCJKRGRCI-UPJWGTAASA-N -1 3 390.379 -1.652 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C[C@@H]1O)[C@H]1CNC(=O)N1 ZINC001582786764 1076046052 /nfs/dbraw/zinc/04/60/52/1076046052.db2.gz RBHJZKCJKRGRCI-UPJWGTAASA-N -1 3 390.379 -1.652 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C[C@@H]1O)[C@@H]1CNC(=O)N1 ZINC001582786765 1076046114 /nfs/dbraw/zinc/04/61/14/1076046114.db2.gz RBHJZKCJKRGRCI-XQQFMLRXSA-N -1 3 390.379 -1.652 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C[C@@H]1O)[C@@H]1CNC(=O)N1 ZINC001582786765 1076046108 /nfs/dbraw/zinc/04/61/08/1076046108.db2.gz RBHJZKCJKRGRCI-XQQFMLRXSA-N -1 3 390.379 -1.652 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C[C@H]1O)[C@@H]1CNC(=O)N1 ZINC001582786766 1076046155 /nfs/dbraw/zinc/04/61/55/1076046155.db2.gz RBHJZKCJKRGRCI-YNEHKIRRSA-N -1 3 390.379 -1.652 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C[C@H]1O)[C@@H]1CNC(=O)N1 ZINC001582786766 1076046147 /nfs/dbraw/zinc/04/61/47/1076046147.db2.gz RBHJZKCJKRGRCI-YNEHKIRRSA-N -1 3 390.379 -1.652 20 0 GAADHM O=C(NC[C@H]1CCCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@H]1CNC(=O)N1 ZINC001582786771 1076046364 /nfs/dbraw/zinc/04/63/64/1076046364.db2.gz RGNCFGVNPVTPAR-BXKDBHETSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@H]1CCCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@H]1CNC(=O)N1 ZINC001582786771 1076046361 /nfs/dbraw/zinc/04/63/61/1076046361.db2.gz RGNCFGVNPVTPAR-BXKDBHETSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@@H]1CCCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@@H]1CNC(=O)N1 ZINC001582786772 1076045997 /nfs/dbraw/zinc/04/59/97/1076045997.db2.gz RGNCFGVNPVTPAR-CABZTGNLSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@@H]1CCCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@@H]1CNC(=O)N1 ZINC001582786772 1076045992 /nfs/dbraw/zinc/04/59/92/1076045992.db2.gz RGNCFGVNPVTPAR-CABZTGNLSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@@H]1CCCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@H]1CNC(=O)N1 ZINC001582786773 1076046294 /nfs/dbraw/zinc/04/62/94/1076046294.db2.gz RGNCFGVNPVTPAR-JOYOIKCWSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@@H]1CCCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@H]1CNC(=O)N1 ZINC001582786773 1076046292 /nfs/dbraw/zinc/04/62/92/1076046292.db2.gz RGNCFGVNPVTPAR-JOYOIKCWSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@H]1CCCCN1C(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@@H]1CNC(=O)N1 ZINC001582786774 1076046307 /nfs/dbraw/zinc/04/63/07/1076046307.db2.gz RGNCFGVNPVTPAR-SKDRFNHKSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(NC[C@H]1CCCCN1C(=O)c1ccc(-c2nnn[n-]2)[nH]1)[C@@H]1CNC(=O)N1 ZINC001582786774 1076046303 /nfs/dbraw/zinc/04/63/03/1076046303.db2.gz RGNCFGVNPVTPAR-SKDRFNHKSA-N -1 3 387.404 -1.013 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)s2)C[C@@H]1O)[C@@H]1CNC(=O)N1 ZINC001582786788 1076046031 /nfs/dbraw/zinc/04/60/31/1076046031.db2.gz RTNCTYNATHHHSU-AEJSXWLSSA-N -1 3 378.418 -1.729 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)s2)C[C@@H]1O)[C@@H]1CNC(=O)N1 ZINC001582786788 1076046025 /nfs/dbraw/zinc/04/60/25/1076046025.db2.gz RTNCTYNATHHHSU-AEJSXWLSSA-N -1 3 378.418 -1.729 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)s2)C[C@@H]1O)[C@H]1CNC(=O)N1 ZINC001582786789 1076046208 /nfs/dbraw/zinc/04/62/08/1076046208.db2.gz RTNCTYNATHHHSU-BBBLOLIVSA-N -1 3 378.418 -1.729 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)s2)C[C@@H]1O)[C@H]1CNC(=O)N1 ZINC001582786789 1076046203 /nfs/dbraw/zinc/04/62/03/1076046203.db2.gz RTNCTYNATHHHSU-BBBLOLIVSA-N -1 3 378.418 -1.729 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)s2)C[C@H]1O)[C@@H]1CNC(=O)N1 ZINC001582786790 1076045980 /nfs/dbraw/zinc/04/59/80/1076045980.db2.gz RTNCTYNATHHHSU-IVZWLZJFSA-N -1 3 378.418 -1.729 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)s2)C[C@H]1O)[C@@H]1CNC(=O)N1 ZINC001582786790 1076045975 /nfs/dbraw/zinc/04/59/75/1076045975.db2.gz RTNCTYNATHHHSU-IVZWLZJFSA-N -1 3 378.418 -1.729 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)s2)C[C@H]1O)[C@H]1CNC(=O)N1 ZINC001582786791 1076046326 /nfs/dbraw/zinc/04/63/26/1076046326.db2.gz RTNCTYNATHHHSU-OPRDCNLKSA-N -1 3 378.418 -1.729 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)s2)C[C@H]1O)[C@H]1CNC(=O)N1 ZINC001582786791 1076046322 /nfs/dbraw/zinc/04/63/22/1076046322.db2.gz RTNCTYNATHHHSU-OPRDCNLKSA-N -1 3 378.418 -1.729 20 0 GAADHM O=C(NC[C@H]1CC[C@@H](NC(=O)[C@H]2CNC(=O)N2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582786977 1076046178 /nfs/dbraw/zinc/04/61/78/1076046178.db2.gz SZNZWLCTVFQQCT-MKPLZMMCSA-N -1 3 387.404 -1.109 20 0 GAADHM O=C(NC[C@H]1CC[C@@H](NC(=O)[C@H]2CNC(=O)N2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582786977 1076046171 /nfs/dbraw/zinc/04/61/71/1076046171.db2.gz SZNZWLCTVFQQCT-MKPLZMMCSA-N -1 3 387.404 -1.109 20 0 GAADHM O=C(NC[C@H]1CC[C@@H](NC(=O)[C@@H]2CNC(=O)N2)C1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001582786978 1076046352 /nfs/dbraw/zinc/04/63/52/1076046352.db2.gz SZNZWLCTVFQQCT-XRNSZHNASA-N -1 3 387.404 -1.109 20 0 GAADHM O=C(NC[C@H]1CC[C@@H](NC(=O)[C@@H]2CNC(=O)N2)C1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001582786978 1076046349 /nfs/dbraw/zinc/04/63/49/1076046349.db2.gz SZNZWLCTVFQQCT-XRNSZHNASA-N -1 3 387.404 -1.109 20 0 GAADHM O=C(NCCOCCCNc1ncccc1-c1nn[n-]n1)[C@H]1CNC(=O)N1 ZINC001582787019 1076046278 /nfs/dbraw/zinc/04/62/78/1076046278.db2.gz TYYJKXBKJYYIIN-LLVKDONJSA-N -1 3 375.393 -1.122 20 0 GAADHM O=C(NCCOCCCNc1ncccc1-c1nnn[n-]1)[C@H]1CNC(=O)N1 ZINC001582787019 1076046271 /nfs/dbraw/zinc/04/62/71/1076046271.db2.gz TYYJKXBKJYYIIN-LLVKDONJSA-N -1 3 375.393 -1.122 20 0 GAADHM O=C(NCCOCCCNc1ncccc1-c1nn[n-]n1)[C@@H]1CNC(=O)N1 ZINC001582787023 1076046781 /nfs/dbraw/zinc/04/67/81/1076046781.db2.gz TYYJKXBKJYYIIN-NSHDSACASA-N -1 3 375.393 -1.122 20 0 GAADHM O=C(NCCOCCCNc1ncccc1-c1nnn[n-]1)[C@@H]1CNC(=O)N1 ZINC001582787023 1076046779 /nfs/dbraw/zinc/04/67/79/1076046779.db2.gz TYYJKXBKJYYIIN-NSHDSACASA-N -1 3 375.393 -1.122 20 0 GAADHM O=C1NC[C@H](O)CC12CN(S(=O)(=O)Cc1cccc(-c3nn[n-]n3)c1)C2 ZINC001582787123 1076046540 /nfs/dbraw/zinc/04/65/40/1076046540.db2.gz VHZCXPIFEZJQGM-GFCCVEGCSA-N -1 3 378.414 -1.121 20 0 GAADHM O=C1NC[C@H](O)CC12CN(S(=O)(=O)Cc1cccc(-c3nnn[n-]3)c1)C2 ZINC001582787123 1076046535 /nfs/dbraw/zinc/04/65/35/1076046535.db2.gz VHZCXPIFEZJQGM-GFCCVEGCSA-N -1 3 378.414 -1.121 20 0 GAADHM O=C1NC[C@@H](O)CC12CN(S(=O)(=O)Cc1cccc(-c3nn[n-]n3)c1)C2 ZINC001582787126 1076046756 /nfs/dbraw/zinc/04/67/56/1076046756.db2.gz VHZCXPIFEZJQGM-LBPRGKRZSA-N -1 3 378.414 -1.121 20 0 GAADHM O=C1NC[C@@H](O)CC12CN(S(=O)(=O)Cc1cccc(-c3nnn[n-]3)c1)C2 ZINC001582787126 1076046753 /nfs/dbraw/zinc/04/67/53/1076046753.db2.gz VHZCXPIFEZJQGM-LBPRGKRZSA-N -1 3 378.414 -1.121 20 0 GAADHM O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1c[nH]c(-c2nn[n-]n2)c1)[C@H]1CNC(=O)N1 ZINC001582787173 1076046691 /nfs/dbraw/zinc/04/66/91/1076046691.db2.gz WNBUWMDEVIBEOH-DMWPJOQESA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1c[nH]c(-c2nnn[n-]2)c1)[C@H]1CNC(=O)N1 ZINC001582787173 1076046686 /nfs/dbraw/zinc/04/66/86/1076046686.db2.gz WNBUWMDEVIBEOH-DMWPJOQESA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1c[nH]c(-c2nn[n-]n2)c1)[C@@H]1CNC(=O)N1 ZINC001582787174 1076046706 /nfs/dbraw/zinc/04/67/06/1076046706.db2.gz WNBUWMDEVIBEOH-QCZKYFFMSA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)c1c[nH]c(-c2nnn[n-]2)c1)[C@@H]1CNC(=O)N1 ZINC001582787174 1076046701 /nfs/dbraw/zinc/04/67/01/1076046701.db2.gz WNBUWMDEVIBEOH-QCZKYFFMSA-N -1 3 385.388 -1.262 20 0 GAADHM O=C(N[C@@H]1CN(Cc2cc(F)ccc2-c2nn[n-]n2)C[C@H]1O)[C@H]1CNC(=O)N1 ZINC001582787175 1076046509 /nfs/dbraw/zinc/04/65/09/1076046509.db2.gz WRDUMWVSJAPSMC-JHJVBQTASA-N -1 3 390.379 -1.652 20 0 GAADHM O=C(N[C@@H]1CN(Cc2cc(F)ccc2-c2nn[n-]n2)C[C@H]1O)[C@@H]1CNC(=O)N1 ZINC001582787176 1076046644 /nfs/dbraw/zinc/04/66/44/1076046644.db2.gz WRDUMWVSJAPSMC-YNEHKIRRSA-N -1 3 390.379 -1.652 20 0 GAADHM O=C(N[C@@H]1CN(Cc2cc(-c3nn[n-]n3)ccc2F)C[C@H]1O)[C@H]1CNC(=O)N1 ZINC001582787179 1076046728 /nfs/dbraw/zinc/04/67/28/1076046728.db2.gz WXPJOJHVJUPMCA-JHJVBQTASA-N -1 3 390.379 -1.652 20 0 GAADHM O=C(N[C@@H]1CN(Cc2cc(-c3nn[n-]n3)ccc2F)C[C@H]1O)[C@@H]1CNC(=O)N1 ZINC001582787180 1076046626 /nfs/dbraw/zinc/04/66/26/1076046626.db2.gz WXPJOJHVJUPMCA-YNEHKIRRSA-N -1 3 390.379 -1.652 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C[C@H]1O)[C@H]1CNC(=O)N1 ZINC001582787183 1076046569 /nfs/dbraw/zinc/04/65/69/1076046569.db2.gz XDLFGBJENOLZKT-JHJVBQTASA-N -1 3 390.379 -1.652 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C[C@H]1O)[C@H]1CNC(=O)N1 ZINC001582787183 1076046565 /nfs/dbraw/zinc/04/65/65/1076046565.db2.gz XDLFGBJENOLZKT-JHJVBQTASA-N -1 3 390.379 -1.652 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C[C@@H]1O)[C@H]1CNC(=O)N1 ZINC001582787184 1076046612 /nfs/dbraw/zinc/04/66/12/1076046612.db2.gz XDLFGBJENOLZKT-UPJWGTAASA-N -1 3 390.379 -1.652 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C[C@@H]1O)[C@H]1CNC(=O)N1 ZINC001582787184 1076046606 /nfs/dbraw/zinc/04/66/06/1076046606.db2.gz XDLFGBJENOLZKT-UPJWGTAASA-N -1 3 390.379 -1.652 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C[C@@H]1O)[C@@H]1CNC(=O)N1 ZINC001582787185 1076046670 /nfs/dbraw/zinc/04/66/70/1076046670.db2.gz XDLFGBJENOLZKT-XQQFMLRXSA-N -1 3 390.379 -1.652 20 0 GAADHM O=C(N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C[C@@H]1O)[C@@H]1CNC(=O)N1 ZINC001582787185 1076046667 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O=S(=O)(CCN1C[C@@H](CO)[C@H](CCO)C1)c1ccc(-c2nn[n-]n2)cn1 ZINC001582791100 1076048473 /nfs/dbraw/zinc/04/84/73/1076048473.db2.gz UJEIQIOJQADXTP-OLZOCXBDSA-N -1 3 382.446 -1.042 20 0 GAADHM O=S(=O)(CCN1C[C@@H](CO)[C@H](CCO)C1)c1ccc(-c2nnn[n-]2)cn1 ZINC001582791100 1076048465 /nfs/dbraw/zinc/04/84/65/1076048465.db2.gz UJEIQIOJQADXTP-OLZOCXBDSA-N -1 3 382.446 -1.042 20 0 GAADHM O=S(=O)(CCN1C[C@H](CO)[C@@H](CCO)C1)c1ccc(-c2nn[n-]n2)cn1 ZINC001582791101 1076048436 /nfs/dbraw/zinc/04/84/36/1076048436.db2.gz UJEIQIOJQADXTP-QWHCGFSZSA-N -1 3 382.446 -1.042 20 0 GAADHM O=S(=O)(CCN1C[C@H](CO)[C@@H](CCO)C1)c1ccc(-c2nnn[n-]2)cn1 ZINC001582791101 1076048428 /nfs/dbraw/zinc/04/84/28/1076048428.db2.gz UJEIQIOJQADXTP-QWHCGFSZSA-N -1 3 382.446 -1.042 20 0 GAADHM O=S(=O)(CCN1C[C@H](CCO)[C@H](CO)C1)c1ccc(-c2nn[n-]n2)cn1 ZINC001582791102 1076048572 /nfs/dbraw/zinc/04/85/72/1076048572.db2.gz UJEIQIOJQADXTP-STQMWFEESA-N -1 3 382.446 -1.042 20 0 GAADHM O=S(=O)(CCN1C[C@H](CCO)[C@H](CO)C1)c1ccc(-c2nnn[n-]2)cn1 ZINC001582791102 1076048569 /nfs/dbraw/zinc/04/85/69/1076048569.db2.gz UJEIQIOJQADXTP-STQMWFEESA-N -1 3 382.446 -1.042 20 0 GAADHM O=S(=O)(Cc1ccc(-c2nn[n-]n2)cc1)N[C@H](CO)CN1CCOCC1 ZINC001582791682 1076048601 /nfs/dbraw/zinc/04/86/01/1076048601.db2.gz OWBKUPUWJFSOEL-AWEZNQCLSA-N -1 3 382.446 -1.021 20 0 GAADHM O=S(=O)(Cc1ccc(-c2nnn[n-]2)cc1)N[C@H](CO)CN1CCOCC1 ZINC001582791682 1076048598 /nfs/dbraw/zinc/04/85/98/1076048598.db2.gz OWBKUPUWJFSOEL-AWEZNQCLSA-N -1 3 382.446 -1.021 20 0 GAADHM O=S(=O)(Cc1ccc(-c2nn[n-]n2)cc1)N[C@@H](CO)CN1CCOCC1 ZINC001582791683 1076048592 /nfs/dbraw/zinc/04/85/92/1076048592.db2.gz OWBKUPUWJFSOEL-CQSZACIVSA-N -1 3 382.446 -1.021 20 0 GAADHM O=S(=O)(Cc1ccc(-c2nnn[n-]2)cc1)N[C@@H](CO)CN1CCOCC1 ZINC001582791683 1076048589 /nfs/dbraw/zinc/04/85/89/1076048589.db2.gz OWBKUPUWJFSOEL-CQSZACIVSA-N -1 3 382.446 -1.021 20 0 GAADHM O=S(=O)(N[C@@H](CO)CN1CCOCC1)c1cc(F)cc(-c2nn[n-]n2)c1 ZINC001582792490 1076048622 /nfs/dbraw/zinc/04/86/22/1076048622.db2.gz GCZXBJKTEHKUSH-GFCCVEGCSA-N -1 3 386.409 -1.023 20 0 GAADHM O=S(=O)(N[C@@H](CO)CN1CCOCC1)c1cc(F)cc(-c2nnn[n-]2)c1 ZINC001582792490 1076048616 /nfs/dbraw/zinc/04/86/16/1076048616.db2.gz GCZXBJKTEHKUSH-GFCCVEGCSA-N -1 3 386.409 -1.023 20 0 GAADHM O=S(=O)(N[C@H](CO)CN1CCOCC1)c1cc(F)cc(-c2nn[n-]n2)c1 ZINC001582792491 1076048312 /nfs/dbraw/zinc/04/83/12/1076048312.db2.gz GCZXBJKTEHKUSH-LBPRGKRZSA-N -1 3 386.409 -1.023 20 0 GAADHM O=S(=O)(N[C@H](CO)CN1CCOCC1)c1cc(F)cc(-c2nnn[n-]2)c1 ZINC001582792491 1076048307 /nfs/dbraw/zinc/04/83/07/1076048307.db2.gz GCZXBJKTEHKUSH-LBPRGKRZSA-N -1 3 386.409 -1.023 20 0 GAADHM O=S(=O)(N[C@H](CO)CN1CCOCC1)c1ccc(F)c(-c2nn[n-]n2)c1 ZINC001582792658 1076048356 /nfs/dbraw/zinc/04/83/56/1076048356.db2.gz IOGGKIWEIVJKPJ-JTQLQIEISA-N -1 3 386.409 -1.023 20 0 GAADHM O=S(=O)(N[C@H](CO)CN1CCOCC1)c1ccc(F)c(-c2nnn[n-]2)c1 ZINC001582792658 1076048349 /nfs/dbraw/zinc/04/83/49/1076048349.db2.gz IOGGKIWEIVJKPJ-JTQLQIEISA-N -1 3 386.409 -1.023 20 0 GAADHM O=S(=O)(N[C@@H](CO)CN1CCOCC1)c1ccc(F)c(-c2nn[n-]n2)c1 ZINC001582792659 1076048336 /nfs/dbraw/zinc/04/83/36/1076048336.db2.gz IOGGKIWEIVJKPJ-SNVBAGLBSA-N -1 3 386.409 -1.023 20 0 GAADHM O=S(=O)(N[C@@H](CO)CN1CCOCC1)c1ccc(F)c(-c2nnn[n-]2)c1 ZINC001582792659 1076048328 /nfs/dbraw/zinc/04/83/28/1076048328.db2.gz IOGGKIWEIVJKPJ-SNVBAGLBSA-N -1 3 386.409 -1.023 20 0 GAADHM O=S(=O)(Cc1cccc(-c2nn[n-]n2)c1)N[C@H](CO)CN1CCOCC1 ZINC001582792742 1076048299 /nfs/dbraw/zinc/04/82/99/1076048299.db2.gz HLVQNQNDGYQVAX-AWEZNQCLSA-N -1 3 382.446 -1.021 20 0 GAADHM O=S(=O)(Cc1cccc(-c2nnn[n-]2)c1)N[C@H](CO)CN1CCOCC1 ZINC001582792742 1076048296 /nfs/dbraw/zinc/04/82/96/1076048296.db2.gz HLVQNQNDGYQVAX-AWEZNQCLSA-N -1 3 382.446 -1.021 20 0 GAADHM O=S(=O)(Cc1cccc(-c2nn[n-]n2)c1)N[C@@H](CO)CN1CCOCC1 ZINC001582792743 1076048398 /nfs/dbraw/zinc/04/83/98/1076048398.db2.gz HLVQNQNDGYQVAX-CQSZACIVSA-N -1 3 382.446 -1.021 20 0 GAADHM O=S(=O)(Cc1cccc(-c2nnn[n-]2)c1)N[C@@H](CO)CN1CCOCC1 ZINC001582792743 1076048391 /nfs/dbraw/zinc/04/83/91/1076048391.db2.gz HLVQNQNDGYQVAX-CQSZACIVSA-N -1 3 382.446 -1.021 20 0 GAADHM O=S(=O)(NCCCN1CCCS1(=O)=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001582795100 1076048609 /nfs/dbraw/zinc/04/86/09/1076048609.db2.gz QDOLTBUGFQOFRG-UHFFFAOYSA-N -1 3 387.447 -1.034 20 0 GAADHM O=S(=O)(NCCCN1CCCS1(=O)=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001582795100 1076048606 /nfs/dbraw/zinc/04/86/06/1076048606.db2.gz QDOLTBUGFQOFRG-UHFFFAOYSA-N -1 3 387.447 -1.034 20 0 GAADHM O=S(=O)(NCCN1CCC2(C1)OCCO2)c1cncc(-c2nn[n-]n2)c1 ZINC001582795247 1076048492 /nfs/dbraw/zinc/04/84/92/1076048492.db2.gz YQRRLDNEXVDXRU-UHFFFAOYSA-N -1 3 381.418 -1.011 20 0 GAADHM O=S(=O)(NCCN1CCC2(C1)OCCO2)c1cncc(-c2nnn[n-]2)c1 ZINC001582795247 1076048486 /nfs/dbraw/zinc/04/84/86/1076048486.db2.gz YQRRLDNEXVDXRU-UHFFFAOYSA-N -1 3 381.418 -1.011 20 0 GAADHM O=S(=O)(NCCN1CCC2(C1)OCCO2)c1ccc(-c2nn[n-]n2)cn1 ZINC001582795267 1076048582 /nfs/dbraw/zinc/04/85/82/1076048582.db2.gz ZTZZVTSYDWQVBP-UHFFFAOYSA-N -1 3 381.418 -1.011 20 0 GAADHM O=S(=O)(NCCN1CCC2(C1)OCCO2)c1ccc(-c2nnn[n-]2)cn1 ZINC001582795267 1076048579 /nfs/dbraw/zinc/04/85/79/1076048579.db2.gz ZTZZVTSYDWQVBP-UHFFFAOYSA-N -1 3 381.418 -1.011 20 0 GAADHM O=S(=O)(NCC12COCCN1CCOC2)c1cncc(-c2nn[n-]n2)c1 ZINC001582795443 1076048377 /nfs/dbraw/zinc/04/83/77/1076048377.db2.gz GONOEFGPQYGFOI-UHFFFAOYSA-N -1 3 381.418 -1.359 20 0 GAADHM O=S(=O)(NCC12COCCN1CCOC2)c1cncc(-c2nnn[n-]2)c1 ZINC001582795443 1076048370 /nfs/dbraw/zinc/04/83/70/1076048370.db2.gz GONOEFGPQYGFOI-UHFFFAOYSA-N -1 3 381.418 -1.359 20 0 GAADHM O=S(=O)(NCC12COCCN1CCOC2)c1ccc(-c2nn[n-]n2)cn1 ZINC001582795911 1076049003 /nfs/dbraw/zinc/04/90/03/1076049003.db2.gz VLMCSAGKMYVAGN-UHFFFAOYSA-N -1 3 381.418 -1.359 20 0 GAADHM O=S(=O)(NCC12COCCN1CCOC2)c1ccc(-c2nnn[n-]2)cn1 ZINC001582795911 1076048997 /nfs/dbraw/zinc/04/89/97/1076048997.db2.gz VLMCSAGKMYVAGN-UHFFFAOYSA-N -1 3 381.418 -1.359 20 0 GAADHM O=S(=O)([C@@H]1COC[C@H]1O)N1CC[C@@H](Oc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001582798806 1076048827 /nfs/dbraw/zinc/04/88/27/1076048827.db2.gz FDPXVPQWHJIFTA-IJLUTSLNSA-N -1 3 382.402 -1.196 20 0 GAADHM O=S(=O)([C@@H]1COC[C@H]1O)N1CC[C@@H](Oc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001582798806 1076048824 /nfs/dbraw/zinc/04/88/24/1076048824.db2.gz FDPXVPQWHJIFTA-IJLUTSLNSA-N -1 3 382.402 -1.196 20 0 GAADHM O=S(=O)([C@@H]1COC[C@H]1O)N1CC[C@H](Oc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001582798807 1076048984 /nfs/dbraw/zinc/04/89/84/1076048984.db2.gz FDPXVPQWHJIFTA-QJPTWQEYSA-N -1 3 382.402 -1.196 20 0 GAADHM O=S(=O)([C@@H]1COC[C@H]1O)N1CC[C@H](Oc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001582798807 1076048978 /nfs/dbraw/zinc/04/89/78/1076048978.db2.gz FDPXVPQWHJIFTA-QJPTWQEYSA-N -1 3 382.402 -1.196 20 0 GAADHM O=S(=O)([C@@H]1COC[C@H]1O)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001582798835 1076049047 /nfs/dbraw/zinc/04/90/47/1076049047.db2.gz GTOHMEFLSGLPNV-VXGBXAGGSA-N -1 3 381.418 -1.527 20 0 GAADHM O=S(=O)([C@@H]1COC[C@H]1O)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001582798835 1076049039 /nfs/dbraw/zinc/04/90/39/1076049039.db2.gz GTOHMEFLSGLPNV-VXGBXAGGSA-N -1 3 381.418 -1.527 20 0 GAADHM O=S(=O)([C@@H]1COC[C@H]1O)N1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001582798922 1076048888 /nfs/dbraw/zinc/04/88/88/1076048888.db2.gz LAEASERBWPPYGG-VXGBXAGGSA-N -1 3 381.418 -1.527 20 0 GAADHM O=S(=O)([C@@H]1COC[C@H]1O)N1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001582798922 1076048883 /nfs/dbraw/zinc/04/88/83/1076048883.db2.gz LAEASERBWPPYGG-VXGBXAGGSA-N -1 3 381.418 -1.527 20 0 GAADHM O=S(=O)([C@@H]1COC[C@H]1O)N1CCN(c2cnccc2-c2nn[n-]n2)CC1 ZINC001582799061 1076049024 /nfs/dbraw/zinc/04/90/24/1076049024.db2.gz SOBPPAFFWZFCGM-CHWSQXEVSA-N -1 3 381.418 -1.527 20 0 GAADHM O=S(=O)([C@@H]1COC[C@H]1O)N1CCN(c2cnccc2-c2nnn[n-]2)CC1 ZINC001582799061 1076049020 /nfs/dbraw/zinc/04/90/20/1076049020.db2.gz SOBPPAFFWZFCGM-CHWSQXEVSA-N -1 3 381.418 -1.527 20 0 GAADHM O=S(=O)([C@@H]1COC[C@H]1O)N1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001582799076 1076049070 /nfs/dbraw/zinc/04/90/70/1076049070.db2.gz UEDMRSOFFCYHRT-CHWSQXEVSA-N -1 3 381.418 -1.527 20 0 GAADHM O=S(=O)([C@@H]1COC[C@H]1O)N1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001582799076 1076049061 /nfs/dbraw/zinc/04/90/61/1076049061.db2.gz UEDMRSOFFCYHRT-CHWSQXEVSA-N -1 3 381.418 -1.527 20 0 GAADHM O=S(=O)([C@@H]1COC[C@H]1O)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1 ZINC001582799103 1076049120 /nfs/dbraw/zinc/04/91/20/1076049120.db2.gz VQHUCBFDCXMKLO-VXGBXAGGSA-N -1 3 381.418 -1.527 20 0 GAADHM O=S(=O)([C@@H]1COC[C@H]1O)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1 ZINC001582799103 1076049116 /nfs/dbraw/zinc/04/91/16/1076049116.db2.gz VQHUCBFDCXMKLO-VXGBXAGGSA-N -1 3 381.418 -1.527 20 0 GAADHM O=S(=O)(c1ccc(-c2nn[n-]n2)cn1)N1CCO[C@H](Cn2ccnn2)C1 ZINC001582799199 1076048963 /nfs/dbraw/zinc/04/89/63/1076048963.db2.gz BOKDGVIKGDBLAE-LLVKDONJSA-N -1 3 377.390 -1.057 20 0 GAADHM O=S(=O)(c1ccc(-c2nnn[n-]2)cn1)N1CCO[C@H](Cn2ccnn2)C1 ZINC001582799199 1076048956 /nfs/dbraw/zinc/04/89/56/1076048956.db2.gz BOKDGVIKGDBLAE-LLVKDONJSA-N -1 3 377.390 -1.057 20 0 GAADHM O=S(=O)(c1ccc(-c2nn[n-]n2)cn1)N1CCO[C@@H](Cn2ccnn2)C1 ZINC001582799200 1076048859 /nfs/dbraw/zinc/04/88/59/1076048859.db2.gz BOKDGVIKGDBLAE-NSHDSACASA-N -1 3 377.390 -1.057 20 0 GAADHM O=S(=O)(c1ccc(-c2nnn[n-]2)cn1)N1CCO[C@@H](Cn2ccnn2)C1 ZINC001582799200 1076048855 /nfs/dbraw/zinc/04/88/55/1076048855.db2.gz BOKDGVIKGDBLAE-NSHDSACASA-N -1 3 377.390 -1.057 20 0 GAADHM O=S(=O)(c1cccc(-c2nn[n-]n2)c1)N1CCN2CCOC[C@@]2(CO)C1 ZINC001582800726 1076049104 /nfs/dbraw/zinc/04/91/04/1076049104.db2.gz CNSNNMCQIIWEKA-HNNXBMFYSA-N -1 3 380.430 -1.066 20 0 GAADHM O=S(=O)(c1cccc(-c2nnn[n-]2)c1)N1CCN2CCOC[C@@]2(CO)C1 ZINC001582800726 1076049099 /nfs/dbraw/zinc/04/90/99/1076049099.db2.gz CNSNNMCQIIWEKA-HNNXBMFYSA-N -1 3 380.430 -1.066 20 0 GAADHM O=S(=O)(c1cccc(-c2nn[n-]n2)c1)N1CCN2CCOC[C@]2(CO)C1 ZINC001582800727 1076049136 /nfs/dbraw/zinc/04/91/36/1076049136.db2.gz CNSNNMCQIIWEKA-OAHLLOKOSA-N -1 3 380.430 -1.066 20 0 GAADHM O=S(=O)(c1cccc(-c2nnn[n-]2)c1)N1CCN2CCOC[C@]2(CO)C1 ZINC001582800727 1076049131 /nfs/dbraw/zinc/04/91/31/1076049131.db2.gz CNSNNMCQIIWEKA-OAHLLOKOSA-N -1 3 380.430 -1.066 20 0 GAADHM O=S(=O)(c1ccccc1-c1nn[n-]n1)N1CCN2CCOC[C@@]2(CO)C1 ZINC001582800850 1076048903 /nfs/dbraw/zinc/04/89/03/1076048903.db2.gz ICUFRBUJYIMUGY-HNNXBMFYSA-N -1 3 380.430 -1.066 20 0 GAADHM O=S(=O)(c1ccccc1-c1nnn[n-]1)N1CCN2CCOC[C@@]2(CO)C1 ZINC001582800850 1076048897 /nfs/dbraw/zinc/04/88/97/1076048897.db2.gz ICUFRBUJYIMUGY-HNNXBMFYSA-N -1 3 380.430 -1.066 20 0 GAADHM O=S(=O)(c1ccccc1-c1nn[n-]n1)N1CCN2CCOC[C@]2(CO)C1 ZINC001582800851 1076049526 /nfs/dbraw/zinc/04/95/26/1076049526.db2.gz ICUFRBUJYIMUGY-OAHLLOKOSA-N -1 3 380.430 -1.066 20 0 GAADHM O=S(=O)(c1ccccc1-c1nnn[n-]1)N1CCN2CCOC[C@]2(CO)C1 ZINC001582800851 1076049523 /nfs/dbraw/zinc/04/95/23/1076049523.db2.gz ICUFRBUJYIMUGY-OAHLLOKOSA-N -1 3 380.430 -1.066 20 0 GAADHM O=S(=O)(NCC1(O)CCS(=O)(=O)CC1)c1cncc(-c2nn[n-]n2)c1 ZINC001582801165 1076049473 /nfs/dbraw/zinc/04/94/73/1076049473.db2.gz DMIYTOJYMIDYIK-UHFFFAOYSA-N -1 3 388.431 -1.520 20 0 GAADHM O=S(=O)(NCC1(O)CCS(=O)(=O)CC1)c1cncc(-c2nnn[n-]2)c1 ZINC001582801165 1076049468 /nfs/dbraw/zinc/04/94/68/1076049468.db2.gz DMIYTOJYMIDYIK-UHFFFAOYSA-N -1 3 388.431 -1.520 20 0 GAADHM O=S(=O)(c1ccccc1-c1nn[n-]n1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001582801603 1076049372 /nfs/dbraw/zinc/04/93/72/1076049372.db2.gz BDFDBXDOJAJYMQ-SECBINFHSA-N -1 3 385.431 -1.610 20 0 GAADHM O=S(=O)(c1ccccc1-c1nnn[n-]1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001582801603 1076049369 /nfs/dbraw/zinc/04/93/69/1076049369.db2.gz BDFDBXDOJAJYMQ-SECBINFHSA-N -1 3 385.431 -1.610 20 0 GAADHM O=S(=O)(c1ccccc1-c1nn[n-]n1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001582801604 1076049328 /nfs/dbraw/zinc/04/93/28/1076049328.db2.gz BDFDBXDOJAJYMQ-VIFPVBQESA-N -1 3 385.431 -1.610 20 0 GAADHM O=S(=O)(c1ccccc1-c1nnn[n-]1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001582801604 1076049321 /nfs/dbraw/zinc/04/93/21/1076049321.db2.gz BDFDBXDOJAJYMQ-VIFPVBQESA-N -1 3 385.431 -1.610 20 0 GAADHM O=S(=O)(N[C@@H]1CS(=O)(=O)C[C@H]1O)c1cc(-c2nn[n-]n2)ccc1Cl ZINC001582801687 1076049517 /nfs/dbraw/zinc/04/95/17/1076049517.db2.gz CULVNBHJGJMJQS-RKDXNWHRSA-N -1 3 393.834 -1.044 20 0 GAADHM O=S(=O)(N[C@@H]1CS(=O)(=O)C[C@H]1O)c1cc(-c2nnn[n-]2)ccc1Cl ZINC001582801687 1076049514 /nfs/dbraw/zinc/04/95/14/1076049514.db2.gz CULVNBHJGJMJQS-RKDXNWHRSA-N -1 3 393.834 -1.044 20 0 GAADHM O=S(=O)(NCC1(O)CCS(=O)(=O)CC1)c1ccc(-c2nn[n-]n2)cn1 ZINC001582801868 1076049488 /nfs/dbraw/zinc/04/94/88/1076049488.db2.gz SNKFRLSSUDRKFW-UHFFFAOYSA-N -1 3 388.431 -1.520 20 0 GAADHM O=S(=O)(NCC1(O)CCS(=O)(=O)CC1)c1ccc(-c2nnn[n-]2)cn1 ZINC001582801868 1076049485 /nfs/dbraw/zinc/04/94/85/1076049485.db2.gz SNKFRLSSUDRKFW-UHFFFAOYSA-N -1 3 388.431 -1.520 20 0 GAADHM O=S(=O)(N[C@@H]1CS(=O)(=O)C[C@H]1O)c1ccc(F)c(-c2nn[n-]n2)c1 ZINC001582801953 1076049505 /nfs/dbraw/zinc/04/95/05/1076049505.db2.gz HMPGALPZVYMXBC-NXEZZACHSA-N -1 3 377.379 -1.558 20 0 GAADHM O=S(=O)(N[C@@H]1CS(=O)(=O)C[C@H]1O)c1ccc(F)c(-c2nnn[n-]2)c1 ZINC001582801953 1076049504 /nfs/dbraw/zinc/04/95/04/1076049504.db2.gz HMPGALPZVYMXBC-NXEZZACHSA-N -1 3 377.379 -1.558 20 0 GAADHM O=S(=O)(c1cncc(-c2nn[n-]n2)c1)N1CCN2CCOC[C@@]2(CO)C1 ZINC001582802013 1076049434 /nfs/dbraw/zinc/04/94/34/1076049434.db2.gz VZUSGIRQPHFYAH-AWEZNQCLSA-N -1 3 381.418 -1.671 20 0 GAADHM O=S(=O)(c1cncc(-c2nnn[n-]2)c1)N1CCN2CCOC[C@@]2(CO)C1 ZINC001582802013 1076049431 /nfs/dbraw/zinc/04/94/31/1076049431.db2.gz VZUSGIRQPHFYAH-AWEZNQCLSA-N -1 3 381.418 -1.671 20 0 GAADHM O=S(=O)(c1cncc(-c2nn[n-]n2)c1)N1CCN2CCOC[C@]2(CO)C1 ZINC001582802014 1076049509 /nfs/dbraw/zinc/04/95/09/1076049509.db2.gz VZUSGIRQPHFYAH-CQSZACIVSA-N -1 3 381.418 -1.671 20 0 GAADHM O=S(=O)(c1cncc(-c2nnn[n-]2)c1)N1CCN2CCOC[C@]2(CO)C1 ZINC001582802014 1076049508 /nfs/dbraw/zinc/04/95/08/1076049508.db2.gz VZUSGIRQPHFYAH-CQSZACIVSA-N -1 3 381.418 -1.671 20 0 GAADHM O=S(=O)(c1ccc(-c2nn[n-]n2)cn1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001582802234 1076049764 /nfs/dbraw/zinc/04/97/64/1076049764.db2.gz MMYRAXPMXBOGAQ-SECBINFHSA-N -1 3 386.419 -2.215 20 0 GAADHM O=S(=O)(c1ccc(-c2nnn[n-]2)cn1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001582802234 1076049758 /nfs/dbraw/zinc/04/97/58/1076049758.db2.gz MMYRAXPMXBOGAQ-SECBINFHSA-N -1 3 386.419 -2.215 20 0 GAADHM O=S(=O)(c1ccc(-c2nn[n-]n2)cn1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001582802235 1076049663 /nfs/dbraw/zinc/04/96/63/1076049663.db2.gz MMYRAXPMXBOGAQ-VIFPVBQESA-N -1 3 386.419 -2.215 20 0 GAADHM O=S(=O)(c1ccc(-c2nnn[n-]2)cn1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001582802235 1076049661 /nfs/dbraw/zinc/04/96/61/1076049661.db2.gz MMYRAXPMXBOGAQ-VIFPVBQESA-N -1 3 386.419 -2.215 20 0 GAADHM O=S(=O)(N[C@@H]1CS(=O)(=O)C[C@H]1O)c1ccc(Cl)cc1-c1nn[n-]n1 ZINC001582802281 1076049851 /nfs/dbraw/zinc/04/98/51/1076049851.db2.gz NUZQOTDJWLQSQE-RKDXNWHRSA-N -1 3 393.834 -1.044 20 0 GAADHM O=S(=O)(N[C@@H]1CS(=O)(=O)C[C@H]1O)c1ccc(Cl)cc1-c1nnn[n-]1 ZINC001582802281 1076049844 /nfs/dbraw/zinc/04/98/44/1076049844.db2.gz NUZQOTDJWLQSQE-RKDXNWHRSA-N -1 3 393.834 -1.044 20 0 GAADHM O=S(=O)(c1cccc(-c2nn[n-]n2)c1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001582802425 1076049632 /nfs/dbraw/zinc/04/96/32/1076049632.db2.gz TZGPTSGLWHYHLT-JTQLQIEISA-N -1 3 385.431 -1.610 20 0 GAADHM O=S(=O)(c1cccc(-c2nnn[n-]2)c1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001582802425 1076049627 /nfs/dbraw/zinc/04/96/27/1076049627.db2.gz TZGPTSGLWHYHLT-JTQLQIEISA-N -1 3 385.431 -1.610 20 0 GAADHM O=S(=O)(c1cccc(-c2nn[n-]n2)c1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001582802426 1076049724 /nfs/dbraw/zinc/04/97/24/1076049724.db2.gz TZGPTSGLWHYHLT-SNVBAGLBSA-N -1 3 385.431 -1.610 20 0 GAADHM O=S(=O)(c1cccc(-c2nnn[n-]2)c1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001582802426 1076049717 /nfs/dbraw/zinc/04/97/17/1076049717.db2.gz TZGPTSGLWHYHLT-SNVBAGLBSA-N -1 3 385.431 -1.610 20 0 GAADHM O=S(=O)(N[C@@H]1CS(=O)(=O)C[C@H]1O)c1cc(F)cc(-c2nn[n-]n2)c1 ZINC001582802564 1076049885 /nfs/dbraw/zinc/04/98/85/1076049885.db2.gz ZFWTXRMHZLTXMI-NXEZZACHSA-N -1 3 377.379 -1.558 20 0 GAADHM O=S(=O)(N[C@@H]1CS(=O)(=O)C[C@H]1O)c1cc(F)cc(-c2nnn[n-]2)c1 ZINC001582802564 1076049880 /nfs/dbraw/zinc/04/98/80/1076049880.db2.gz ZFWTXRMHZLTXMI-NXEZZACHSA-N -1 3 377.379 -1.558 20 0 GAADHM O=c1ccn(CCCNS(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)c(=O)[nH]1 ZINC001582808789 1076050206 /nfs/dbraw/zinc/05/02/06/1076050206.db2.gz LSZJLVXJSGDBNI-UHFFFAOYSA-N -1 3 378.374 -1.107 20 0 GAADHM O=c1ccn(CCCNS(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)c(=O)[nH]1 ZINC001582808789 1076050202 /nfs/dbraw/zinc/05/02/02/1076050202.db2.gz LSZJLVXJSGDBNI-UHFFFAOYSA-N -1 3 378.374 -1.107 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)CCOCCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001588796504 1076065161 /nfs/dbraw/zinc/06/51/61/1076065161.db2.gz OSROZBNHPUIXRE-UHFFFAOYSA-N -1 3 392.420 -1.122 20 0 GAADHM CC(=O)N(C)CC(=O)N(C)CCOCCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001588796504 1076065158 /nfs/dbraw/zinc/06/51/58/1076065158.db2.gz OSROZBNHPUIXRE-UHFFFAOYSA-N -1 3 392.420 -1.122 20 0 GAADHM CC(=O)N(C)CC(=O)NCCOCCN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001588801015 1076065150 /nfs/dbraw/zinc/06/51/50/1076065150.db2.gz IXXUDUFAZFTURM-UHFFFAOYSA-N -1 3 392.420 -1.122 20 0 GAADHM CC(=O)N(C)CC(=O)NCCOCCN(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001588801015 1076065147 /nfs/dbraw/zinc/06/51/47/1076065147.db2.gz IXXUDUFAZFTURM-UHFFFAOYSA-N -1 3 392.420 -1.122 20 0 GAADHM CC(=O)N1CC(C(=O)N[C@@H]2CN(c3snc(C)c3-c3nnn[n-]3)C[C@@H]2O)C1 ZINC001588806887 1076065043 /nfs/dbraw/zinc/06/50/43/1076065043.db2.gz MBAPSYFQZRLGMG-MNOVXSKESA-N -1 3 392.445 -1.224 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N(C)CCOCCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001588831414 1076065427 /nfs/dbraw/zinc/06/54/27/1076065427.db2.gz HVVKTYKZBRUZKK-JTQLQIEISA-N -1 3 392.420 -1.076 20 0 GAADHM CC(=O)N[C@@H](C)C(=O)N(C)CCOCCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001588831414 1076065421 /nfs/dbraw/zinc/06/54/21/1076065421.db2.gz HVVKTYKZBRUZKK-JTQLQIEISA-N -1 3 392.420 -1.076 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N(C)CCOCCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001588831415 1076065387 /nfs/dbraw/zinc/06/53/87/1076065387.db2.gz HVVKTYKZBRUZKK-SNVBAGLBSA-N -1 3 392.420 -1.076 20 0 GAADHM CC(=O)N[C@H](C)C(=O)N(C)CCOCCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001588831415 1076065381 /nfs/dbraw/zinc/06/53/81/1076065381.db2.gz HVVKTYKZBRUZKK-SNVBAGLBSA-N -1 3 392.420 -1.076 20 0 GAADHM CC(=O)N[C@@H]1CCN(C(=O)CNS(=O)(=O)c2cccc(-c3nn[n-]n3)c2)C1 ZINC001588841754 1076065838 /nfs/dbraw/zinc/06/58/38/1076065838.db2.gz PXXLKDFWXOZTHJ-GFCCVEGCSA-N -1 3 393.429 -1.118 20 0 GAADHM CC(=O)N[C@@H]1CCN(C(=O)CNS(=O)(=O)c2cccc(-c3nnn[n-]3)c2)C1 ZINC001588841754 1076065834 /nfs/dbraw/zinc/06/58/34/1076065834.db2.gz PXXLKDFWXOZTHJ-GFCCVEGCSA-N -1 3 393.429 -1.118 20 0 GAADHM CC(=O)N[C@H]1CCN(C(=O)CNS(=O)(=O)c2cccc(-c3nn[n-]n3)c2)C1 ZINC001588841755 1076066104 /nfs/dbraw/zinc/06/61/04/1076066104.db2.gz PXXLKDFWXOZTHJ-LBPRGKRZSA-N -1 3 393.429 -1.118 20 0 GAADHM CC(=O)N[C@H]1CCN(C(=O)CNS(=O)(=O)c2cccc(-c3nnn[n-]3)c2)C1 ZINC001588841755 1076066096 /nfs/dbraw/zinc/06/60/96/1076066096.db2.gz PXXLKDFWXOZTHJ-LBPRGKRZSA-N -1 3 393.429 -1.118 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)OCC(=O)NCc1ccc(-c2nn[n-]n2)cc1 ZINC001588846126 1076065868 /nfs/dbraw/zinc/06/58/68/1076065868.db2.gz FAWNQGJGGNTMGG-UHFFFAOYSA-N -1 3 389.372 -1.722 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)OCC(=O)NCc1ccc(-c2nnn[n-]2)cc1 ZINC001588846126 1076065866 /nfs/dbraw/zinc/06/58/66/1076065866.db2.gz FAWNQGJGGNTMGG-UHFFFAOYSA-N -1 3 389.372 -1.722 20 0 GAADHM CC(=O)NCC(=O)NCCOCCN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001588846152 1076066047 /nfs/dbraw/zinc/06/60/47/1076066047.db2.gz IJNXFLNGADPSEZ-UHFFFAOYSA-N -1 3 378.393 -1.464 20 0 GAADHM CC(=O)NCC(=O)NCCOCCN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001588846152 1076066040 /nfs/dbraw/zinc/06/60/40/1076066040.db2.gz IJNXFLNGADPSEZ-UHFFFAOYSA-N -1 3 378.393 -1.464 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)OCC(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC001588846176 1076065927 /nfs/dbraw/zinc/06/59/27/1076065927.db2.gz LZGPMZIXGISTKQ-UHFFFAOYSA-N -1 3 375.345 -1.399 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)OCC(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC001588846176 1076065917 /nfs/dbraw/zinc/06/59/17/1076065917.db2.gz LZGPMZIXGISTKQ-UHFFFAOYSA-N -1 3 375.345 -1.399 20 0 GAADHM CC(=O)NCC(=O)NCCCN1CCN(c2cncc(-c3nn[n-]n3)n2)CC1 ZINC001588846188 1076065795 /nfs/dbraw/zinc/06/57/95/1076065795.db2.gz OATSALZTQADHMI-UHFFFAOYSA-N -1 3 388.436 -1.579 20 0 GAADHM CC(=O)NCC(=O)NCCCN1CCN(c2cncc(-c3nnn[n-]3)n2)CC1 ZINC001588846188 1076065789 /nfs/dbraw/zinc/06/57/89/1076065789.db2.gz OATSALZTQADHMI-UHFFFAOYSA-N -1 3 388.436 -1.579 20 0 GAADHM CC(=O)NCC(=O)NCCOCCN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001588846206 1076065951 /nfs/dbraw/zinc/06/59/51/1076065951.db2.gz QQIRFWGDKGOMTA-UHFFFAOYSA-N -1 3 378.393 -1.464 20 0 GAADHM CC(=O)NCC(=O)NCCOCCN(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001588846206 1076065944 /nfs/dbraw/zinc/06/59/44/1076065944.db2.gz QQIRFWGDKGOMTA-UHFFFAOYSA-N -1 3 378.393 -1.464 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)OCC(=O)NCc1cccc(-c2nn[n-]n2)c1 ZINC001588846216 1076065806 /nfs/dbraw/zinc/06/58/06/1076065806.db2.gz UMRZKGOSRVPCEW-UHFFFAOYSA-N -1 3 389.372 -1.722 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)OCC(=O)NCc1cccc(-c2nnn[n-]2)c1 ZINC001588846216 1076065803 /nfs/dbraw/zinc/06/58/03/1076065803.db2.gz UMRZKGOSRVPCEW-UHFFFAOYSA-N -1 3 389.372 -1.722 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)C[C@@H](O)c1cccc(-c2nn[n-]n2)c1 ZINC001588846913 1076065816 /nfs/dbraw/zinc/06/58/16/1076065816.db2.gz COQPJZSVFNLRSS-CYBMUJFWSA-N -1 3 375.389 -1.389 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)C[C@@H](O)c1cccc(-c2nnn[n-]2)c1 ZINC001588846913 1076065813 /nfs/dbraw/zinc/06/58/13/1076065813.db2.gz COQPJZSVFNLRSS-CYBMUJFWSA-N -1 3 375.389 -1.389 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)C[C@H](O)c1cccc(-c2nn[n-]n2)c1 ZINC001588846914 1076066482 /nfs/dbraw/zinc/06/64/82/1076066482.db2.gz COQPJZSVFNLRSS-ZDUSSCGKSA-N -1 3 375.389 -1.389 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)C[C@H](O)c1cccc(-c2nnn[n-]2)c1 ZINC001588846914 1076066481 /nfs/dbraw/zinc/06/64/81/1076066481.db2.gz COQPJZSVFNLRSS-ZDUSSCGKSA-N -1 3 375.389 -1.389 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCNc1cccc(F)c1-c1nn[n-]n1 ZINC001588846919 1076066365 /nfs/dbraw/zinc/06/63/65/1076066365.db2.gz FMRHRPAGIXGOMC-UHFFFAOYSA-N -1 3 378.368 -1.214 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCNc1cccc(F)c1-c1nnn[n-]1 ZINC001588846919 1076066361 /nfs/dbraw/zinc/06/63/61/1076066361.db2.gz FMRHRPAGIXGOMC-UHFFFAOYSA-N -1 3 378.368 -1.214 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CCN(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001588846943 1076066275 /nfs/dbraw/zinc/06/62/75/1076066275.db2.gz QESRKOFUMPPQSR-UHFFFAOYSA-N -1 3 386.416 -1.232 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCCNc1ncccc1-c1nn[n-]n1 ZINC001588846955 1076066349 /nfs/dbraw/zinc/06/63/49/1076066349.db2.gz SNPMIPRFCUCDDG-UHFFFAOYSA-N -1 3 375.393 -1.568 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCCNc1ncccc1-c1nnn[n-]1 ZINC001588846955 1076066344 /nfs/dbraw/zinc/06/63/44/1076066344.db2.gz SNPMIPRFCUCDDG-UHFFFAOYSA-N -1 3 375.393 -1.568 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCNc1nc(C)ccc1-c1nn[n-]n1 ZINC001588846975 1076066386 /nfs/dbraw/zinc/06/63/86/1076066386.db2.gz YVBOIEZPLPLNKU-UHFFFAOYSA-N -1 3 375.393 -1.649 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCNc1nc(C)ccc1-c1nnn[n-]1 ZINC001588846975 1076066381 /nfs/dbraw/zinc/06/63/81/1076066381.db2.gz YVBOIEZPLPLNKU-UHFFFAOYSA-N -1 3 375.393 -1.649 20 0 GAADHM CC(=O)NC[C@H]1CN(C(=O)C(=O)NCc2cccc(-c3nn[n-]n3)c2)CCO1 ZINC001588854926 1076066493 /nfs/dbraw/zinc/06/64/93/1076066493.db2.gz NCCGHLYCHYNLPD-AWEZNQCLSA-N -1 3 387.400 -1.154 20 0 GAADHM CC(=O)NC[C@H]1CN(C(=O)C(=O)NCc2cccc(-c3nnn[n-]3)c2)CCO1 ZINC001588854926 1076066492 /nfs/dbraw/zinc/06/64/92/1076066492.db2.gz NCCGHLYCHYNLPD-AWEZNQCLSA-N -1 3 387.400 -1.154 20 0 GAADHM CC(=O)NC[C@@H]1CN(C(=O)C(=O)NCc2cccc(-c3nn[n-]n3)c2)CCO1 ZINC001588854927 1076066500 /nfs/dbraw/zinc/06/65/00/1076066500.db2.gz NCCGHLYCHYNLPD-CQSZACIVSA-N -1 3 387.400 -1.154 20 0 GAADHM CC(=O)NC[C@@H]1CN(C(=O)C(=O)NCc2cccc(-c3nnn[n-]3)c2)CCO1 ZINC001588854927 1076066498 /nfs/dbraw/zinc/06/64/98/1076066498.db2.gz NCCGHLYCHYNLPD-CQSZACIVSA-N -1 3 387.400 -1.154 20 0 GAADHM CC(=O)NCCCNC(=O)C(=O)NCCNc1ncccc1-c1nn[n-]n1 ZINC001588862682 1076066507 /nfs/dbraw/zinc/06/65/07/1076066507.db2.gz WONFJOFTVZVPFL-UHFFFAOYSA-N -1 3 375.393 -1.568 20 0 GAADHM CC(=O)NCCCNC(=O)C(=O)NCCNc1ncccc1-c1nnn[n-]1 ZINC001588862682 1076066505 /nfs/dbraw/zinc/06/65/05/1076066505.db2.gz WONFJOFTVZVPFL-UHFFFAOYSA-N -1 3 375.393 -1.568 20 0 GAADHM CC(=O)NCCNC(=O)N1CCN(c2c(-c3nn[n-]n3)c(C)nn2C)CC1 ZINC001588865154 1076066262 /nfs/dbraw/zinc/06/62/62/1076066262.db2.gz SLZQLURHHOQQAN-UHFFFAOYSA-N -1 3 376.425 -1.124 20 0 GAADHM CC(=O)NCCNC(=O)N1CCN(c2c(-c3nnn[n-]3)c(C)nn2C)CC1 ZINC001588865154 1076066259 /nfs/dbraw/zinc/06/62/59/1076066259.db2.gz SLZQLURHHOQQAN-UHFFFAOYSA-N -1 3 376.425 -1.124 20 0 GAADHM CC(=O)N[C@@H](CC(=O)N(C)C[C@@H](O)c1cccc(-c2nn[n-]n2)c1)C(N)=O ZINC001588868282 1076066806 /nfs/dbraw/zinc/06/68/06/1076066806.db2.gz QKCCEIXLLDFUPH-QWHCGFSZSA-N -1 3 375.389 -1.261 20 0 GAADHM CC(=O)N[C@@H](CC(=O)N(C)C[C@@H](O)c1cccc(-c2nnn[n-]2)c1)C(N)=O ZINC001588868282 1076066802 /nfs/dbraw/zinc/06/68/02/1076066802.db2.gz QKCCEIXLLDFUPH-QWHCGFSZSA-N -1 3 375.389 -1.261 20 0 GAADHM CC(=O)N[C@@H](CC(=O)N(C)C[C@H](O)c1cccc(-c2nn[n-]n2)c1)C(N)=O ZINC001588868283 1076066905 /nfs/dbraw/zinc/06/69/05/1076066905.db2.gz QKCCEIXLLDFUPH-STQMWFEESA-N -1 3 375.389 -1.261 20 0 GAADHM CC(=O)N[C@@H](CC(=O)N(C)C[C@H](O)c1cccc(-c2nnn[n-]2)c1)C(N)=O ZINC001588868283 1076066899 /nfs/dbraw/zinc/06/68/99/1076066899.db2.gz QKCCEIXLLDFUPH-STQMWFEESA-N -1 3 375.389 -1.261 20 0 GAADHM C[C@H](C(=O)N1CC(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)N1C(=O)CCC1=O ZINC001588944949 1076066839 /nfs/dbraw/zinc/06/68/39/1076066839.db2.gz GWUAVHYVHHWWRP-MRVPVSSYSA-N -1 3 386.372 -1.327 20 0 GAADHM C[C@H](C(=O)N1CC(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)N1C(=O)CCC1=O ZINC001588944949 1076066835 /nfs/dbraw/zinc/06/68/35/1076066835.db2.gz GWUAVHYVHHWWRP-MRVPVSSYSA-N -1 3 386.372 -1.327 20 0 GAADHM C[C@@H](C(=O)N1CC(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)N1C(=O)CCC1=O ZINC001588944950 1076066718 /nfs/dbraw/zinc/06/67/18/1076066718.db2.gz GWUAVHYVHHWWRP-QMMMGPOBSA-N -1 3 386.372 -1.327 20 0 GAADHM C[C@@H](C(=O)N1CC(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)N1C(=O)CCC1=O ZINC001588944950 1076066716 /nfs/dbraw/zinc/06/67/16/1076066716.db2.gz GWUAVHYVHHWWRP-QMMMGPOBSA-N -1 3 386.372 -1.327 20 0 GAADHM C[C@H](C(=O)N1CC(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)N1C(=O)CCC1=O ZINC001588946777 1076066777 /nfs/dbraw/zinc/06/67/77/1076066777.db2.gz XCJOQKSYBJGVOZ-MRVPVSSYSA-N -1 3 386.372 -1.327 20 0 GAADHM C[C@H](C(=O)N1CC(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)N1C(=O)CCC1=O ZINC001588946777 1076066773 /nfs/dbraw/zinc/06/67/73/1076066773.db2.gz XCJOQKSYBJGVOZ-MRVPVSSYSA-N -1 3 386.372 -1.327 20 0 GAADHM C[C@@H](C(=O)N1CC(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1)N1C(=O)CCC1=O ZINC001588947201 1076066757 /nfs/dbraw/zinc/06/67/57/1076066757.db2.gz XCJOQKSYBJGVOZ-QMMMGPOBSA-N -1 3 386.372 -1.327 20 0 GAADHM C[C@@H](C(=O)N1CC(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1)N1C(=O)CCC1=O ZINC001588947201 1076066752 /nfs/dbraw/zinc/06/67/52/1076066752.db2.gz XCJOQKSYBJGVOZ-QMMMGPOBSA-N -1 3 386.372 -1.327 20 0 GAADHM C[C@H](C(=O)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1)N1CCNCC1=O ZINC001588957590 1076067346 /nfs/dbraw/zinc/06/73/46/1076067346.db2.gz JZBIDRBNLMRARD-GFCCVEGCSA-N -1 3 385.432 -1.269 20 0 GAADHM C[C@H](C(=O)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1)N1CCNCC1=O ZINC001588957590 1076067340 /nfs/dbraw/zinc/06/73/40/1076067340.db2.gz JZBIDRBNLMRARD-GFCCVEGCSA-N -1 3 385.432 -1.269 20 0 GAADHM C[C@@H](C(=O)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1)N1CCNCC1=O ZINC001588957591 1076067090 /nfs/dbraw/zinc/06/70/90/1076067090.db2.gz JZBIDRBNLMRARD-LBPRGKRZSA-N -1 3 385.432 -1.269 20 0 GAADHM C[C@@H](C(=O)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1)N1CCNCC1=O ZINC001588957591 1076067087 /nfs/dbraw/zinc/06/70/87/1076067087.db2.gz JZBIDRBNLMRARD-LBPRGKRZSA-N -1 3 385.432 -1.269 20 0 GAADHM C[C@H](C(=O)N1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1)N1CCNCC1=O ZINC001588957666 1076067790 /nfs/dbraw/zinc/06/77/90/1076067790.db2.gz MULCYGVRRCLBOL-GFCCVEGCSA-N -1 3 385.432 -1.269 20 0 GAADHM C[C@H](C(=O)N1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1)N1CCNCC1=O ZINC001588957666 1076067787 /nfs/dbraw/zinc/06/77/87/1076067787.db2.gz MULCYGVRRCLBOL-GFCCVEGCSA-N -1 3 385.432 -1.269 20 0 GAADHM C[C@@H](C(=O)N1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1)N1CCNCC1=O ZINC001588957667 1076067804 /nfs/dbraw/zinc/06/78/04/1076067804.db2.gz MULCYGVRRCLBOL-LBPRGKRZSA-N -1 3 385.432 -1.269 20 0 GAADHM C[C@@H](C(=O)N1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1)N1CCNCC1=O ZINC001588957667 1076067800 /nfs/dbraw/zinc/06/78/00/1076067800.db2.gz MULCYGVRRCLBOL-LBPRGKRZSA-N -1 3 385.432 -1.269 20 0 GAADHM C[C@H](C(=O)N1CCN(C(=O)CN2CCCC2)CC1)n1cnc(-c2nnn[n-]2)n1 ZINC001588958244 1076067672 /nfs/dbraw/zinc/06/76/72/1076067672.db2.gz YNLSPHGCNMTSMS-GFCCVEGCSA-N -1 3 388.436 -1.214 20 0 GAADHM C[C@@H](C(=O)N1CCN(C(=O)CN2CCCC2)CC1)n1cnc(-c2nnn[n-]2)n1 ZINC001588958247 1076067693 /nfs/dbraw/zinc/06/76/93/1076067693.db2.gz YNLSPHGCNMTSMS-LBPRGKRZSA-N -1 3 388.436 -1.214 20 0 GAADHM C[C@H](C(=O)N[C@@H]1CCN(CCN2CCOCC2)C1)n1cnc(-c2nn[n-]n2)n1 ZINC001588977138 1076067777 /nfs/dbraw/zinc/06/77/77/1076067777.db2.gz FDNUUNZUZDZYAV-CHWSQXEVSA-N -1 3 390.452 -1.458 20 0 GAADHM C[C@H](C(=O)N[C@@H]1CCN(CCN2CCOCC2)C1)n1cnc(-c2nnn[n-]2)n1 ZINC001588977138 1076067773 /nfs/dbraw/zinc/06/77/73/1076067773.db2.gz FDNUUNZUZDZYAV-CHWSQXEVSA-N -1 3 390.452 -1.458 20 0 GAADHM C[C@H](C(=O)N[C@H]1CCN(CCN2CCOCC2)C1)n1cnc(-c2nn[n-]n2)n1 ZINC001588977141 1076067873 /nfs/dbraw/zinc/06/78/73/1076067873.db2.gz FDNUUNZUZDZYAV-OLZOCXBDSA-N -1 3 390.452 -1.458 20 0 GAADHM C[C@H](C(=O)N[C@H]1CCN(CCN2CCOCC2)C1)n1cnc(-c2nnn[n-]2)n1 ZINC001588977141 1076067869 /nfs/dbraw/zinc/06/78/69/1076067869.db2.gz FDNUUNZUZDZYAV-OLZOCXBDSA-N -1 3 390.452 -1.458 20 0 GAADHM C[C@@H](C(=O)N[C@@H]1CCN(CCN2CCOCC2)C1)n1cnc(-c2nn[n-]n2)n1 ZINC001588977143 1076067565 /nfs/dbraw/zinc/06/75/65/1076067565.db2.gz FDNUUNZUZDZYAV-QWHCGFSZSA-N -1 3 390.452 -1.458 20 0 GAADHM C[C@@H](C(=O)N[C@@H]1CCN(CCN2CCOCC2)C1)n1cnc(-c2nnn[n-]2)n1 ZINC001588977143 1076067562 /nfs/dbraw/zinc/06/75/62/1076067562.db2.gz FDNUUNZUZDZYAV-QWHCGFSZSA-N -1 3 390.452 -1.458 20 0 GAADHM C[C@@H](C(=O)N[C@H]1CCN(CCN2CCOCC2)C1)n1cnc(-c2nn[n-]n2)n1 ZINC001588977145 1076067831 /nfs/dbraw/zinc/06/78/31/1076067831.db2.gz FDNUUNZUZDZYAV-STQMWFEESA-N -1 3 390.452 -1.458 20 0 GAADHM C[C@@H](C(=O)N[C@H]1CCN(CCN2CCOCC2)C1)n1cnc(-c2nnn[n-]2)n1 ZINC001588977145 1076067829 /nfs/dbraw/zinc/06/78/29/1076067829.db2.gz FDNUUNZUZDZYAV-STQMWFEESA-N -1 3 390.452 -1.458 20 0 GAADHM C[C@@H](C(=O)NC1CCN(CC(=O)N(C)C)CC1)n1cnc(-c2nn[n-]n2)n1 ZINC001588978221 1076068320 /nfs/dbraw/zinc/06/83/20/1076068320.db2.gz ONORCAJAHCQUPD-JTQLQIEISA-N -1 3 376.425 -1.312 20 0 GAADHM C[C@@H](C(=O)NC1CCN(CC(=O)N(C)C)CC1)n1cnc(-c2nnn[n-]2)n1 ZINC001588978221 1076068315 /nfs/dbraw/zinc/06/83/15/1076068315.db2.gz ONORCAJAHCQUPD-JTQLQIEISA-N -1 3 376.425 -1.312 20 0 GAADHM C[C@H](C(=O)NC1CCN(CC(=O)N(C)C)CC1)n1cnc(-c2nn[n-]n2)n1 ZINC001588978223 1076068246 /nfs/dbraw/zinc/06/82/46/1076068246.db2.gz ONORCAJAHCQUPD-SNVBAGLBSA-N -1 3 376.425 -1.312 20 0 GAADHM C[C@H](C(=O)NC1CCN(CC(=O)N(C)C)CC1)n1cnc(-c2nnn[n-]2)n1 ZINC001588978223 1076068243 /nfs/dbraw/zinc/06/82/43/1076068243.db2.gz ONORCAJAHCQUPD-SNVBAGLBSA-N -1 3 376.425 -1.312 20 0 GAADHM C[C@@H](C(=O)NC[C@H](CO)Nc1ccc(-c2nn[n-]n2)cn1)N1C(=O)CCC1=O ZINC001588978542 1076068127 /nfs/dbraw/zinc/06/81/27/1076068127.db2.gz FORLQZVBADWTLB-GXSJLCMTSA-N -1 3 388.388 -1.312 20 0 GAADHM C[C@@H](C(=O)NC[C@H](CO)Nc1ccc(-c2nnn[n-]2)cn1)N1C(=O)CCC1=O ZINC001588978542 1076068121 /nfs/dbraw/zinc/06/81/21/1076068121.db2.gz FORLQZVBADWTLB-GXSJLCMTSA-N -1 3 388.388 -1.312 20 0 GAADHM C[C@H](C(=O)NC[C@@H](CO)Nc1ccc(-c2nn[n-]n2)cn1)N1C(=O)CCC1=O ZINC001588978543 1076068284 /nfs/dbraw/zinc/06/82/84/1076068284.db2.gz FORLQZVBADWTLB-KOLCDFICSA-N -1 3 388.388 -1.312 20 0 GAADHM C[C@H](C(=O)NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)cn1)N1C(=O)CCC1=O ZINC001588978543 1076068278 /nfs/dbraw/zinc/06/82/78/1076068278.db2.gz FORLQZVBADWTLB-KOLCDFICSA-N -1 3 388.388 -1.312 20 0 GAADHM C[C@H](C(=O)NC[C@H](CO)Nc1ccc(-c2nn[n-]n2)cn1)N1C(=O)CCC1=O ZINC001588978544 1076068270 /nfs/dbraw/zinc/06/82/70/1076068270.db2.gz FORLQZVBADWTLB-MWLCHTKSSA-N -1 3 388.388 -1.312 20 0 GAADHM C[C@H](C(=O)NC[C@H](CO)Nc1ccc(-c2nnn[n-]2)cn1)N1C(=O)CCC1=O ZINC001588978544 1076068264 /nfs/dbraw/zinc/06/82/64/1076068264.db2.gz FORLQZVBADWTLB-MWLCHTKSSA-N -1 3 388.388 -1.312 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](CO)Nc1ccc(-c2nn[n-]n2)cn1)N1C(=O)CCC1=O ZINC001588978546 1076068172 /nfs/dbraw/zinc/06/81/72/1076068172.db2.gz FORLQZVBADWTLB-ONGXEEELSA-N -1 3 388.388 -1.312 20 0 GAADHM C[C@@H](C(=O)NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)cn1)N1C(=O)CCC1=O ZINC001588978546 1076068168 /nfs/dbraw/zinc/06/81/68/1076068168.db2.gz FORLQZVBADWTLB-ONGXEEELSA-N -1 3 388.388 -1.312 20 0 GAADHM C[C@H](C(=O)NC1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)N1C(=O)CCC1=O ZINC001588979670 1076068538 /nfs/dbraw/zinc/06/85/38/1076068538.db2.gz XNTBXGSUGGWJKU-MRVPVSSYSA-N -1 3 386.372 -1.327 20 0 GAADHM C[C@H](C(=O)NC1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)N1C(=O)CCC1=O ZINC001588979670 1076068533 /nfs/dbraw/zinc/06/85/33/1076068533.db2.gz XNTBXGSUGGWJKU-MRVPVSSYSA-N -1 3 386.372 -1.327 20 0 GAADHM C[C@@H](C(=O)NC1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)N1C(=O)CCC1=O ZINC001588979671 1076068567 /nfs/dbraw/zinc/06/85/67/1076068567.db2.gz XNTBXGSUGGWJKU-QMMMGPOBSA-N -1 3 386.372 -1.327 20 0 GAADHM C[C@@H](C(=O)NC1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)N1C(=O)CCC1=O ZINC001588979671 1076068565 /nfs/dbraw/zinc/06/85/65/1076068565.db2.gz XNTBXGSUGGWJKU-QMMMGPOBSA-N -1 3 386.372 -1.327 20 0 GAADHM C[C@@H](C(=O)NC[C@H](O)CNc1ccc(-c2nn[n-]n2)cn1)N1C(=O)CCC1=O ZINC001588979867 1076068710 /nfs/dbraw/zinc/06/87/10/1076068710.db2.gz YZSXBNRWQDQSQY-GXSJLCMTSA-N -1 3 388.388 -1.312 20 0 GAADHM C[C@@H](C(=O)NC[C@H](O)CNc1ccc(-c2nnn[n-]2)cn1)N1C(=O)CCC1=O ZINC001588979867 1076068704 /nfs/dbraw/zinc/06/87/04/1076068704.db2.gz YZSXBNRWQDQSQY-GXSJLCMTSA-N -1 3 388.388 -1.312 20 0 GAADHM 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C[C@@H](C(=O)NC[C@@H](O)CNc1ccc(-c2nnn[n-]2)cn1)N1C(=O)CCC1=O ZINC001588979872 1076068513 /nfs/dbraw/zinc/06/85/13/1076068513.db2.gz YZSXBNRWQDQSQY-ONGXEEELSA-N -1 3 388.388 -1.312 20 0 GAADHM C[C@H](C(=O)NCCCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)N1C(=O)CCC1=O ZINC001588990938 1076069114 /nfs/dbraw/zinc/06/91/14/1076069114.db2.gz YVTJZRHWTWRHKT-SECBINFHSA-N -1 3 388.388 -1.032 20 0 GAADHM C[C@H](C(=O)NCCCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)N1C(=O)CCC1=O ZINC001588990938 1076069108 /nfs/dbraw/zinc/06/91/08/1076069108.db2.gz YVTJZRHWTWRHKT-SECBINFHSA-N -1 3 388.388 -1.032 20 0 GAADHM C[C@@H](C(=O)NCCCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)N1C(=O)CCC1=O ZINC001588990939 1076068998 /nfs/dbraw/zinc/06/89/98/1076068998.db2.gz YVTJZRHWTWRHKT-VIFPVBQESA-N -1 3 388.388 -1.032 20 0 GAADHM C[C@@H](C(=O)NCCCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)N1C(=O)CCC1=O ZINC001588990939 1076068996 /nfs/dbraw/zinc/06/89/96/1076068996.db2.gz YVTJZRHWTWRHKT-VIFPVBQESA-N -1 3 388.388 -1.032 20 0 GAADHM 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C[C@H](CNC(=O)[C@H](C)N1C(=O)CCC1=O)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001588996171 1076069127 /nfs/dbraw/zinc/06/91/27/1076069127.db2.gz JCZXKIRRBFKZHF-BDAKNGLRSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@H](CNC(=O)[C@@H](C)N1C(=O)CCC1=O)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001588996172 1076069096 /nfs/dbraw/zinc/06/90/96/1076069096.db2.gz JCZXKIRRBFKZHF-RKDXNWHRSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@H](CNC(=O)[C@@H](C)N1C(=O)CCC1=O)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001588996172 1076069093 /nfs/dbraw/zinc/06/90/93/1076069093.db2.gz JCZXKIRRBFKZHF-RKDXNWHRSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@@H](C(=O)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)cc2)C[C@@H]1O)S(C)(=O)=O ZINC001589005609 1076069425 /nfs/dbraw/zinc/06/94/25/1076069425.db2.gz VEXPFAWCTYDICV-GDLCADMTSA-N -1 3 394.457 -1.039 20 0 GAADHM C[C@H](C(=O)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)cc2)C[C@@H]1O)S(C)(=O)=O ZINC001589005610 1076069389 /nfs/dbraw/zinc/06/93/89/1076069389.db2.gz VEXPFAWCTYDICV-HONMWMINSA-N -1 3 394.457 -1.039 20 0 GAADHM 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CC(C)(C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@H]1O)S(C)(=O)=O ZINC001589054867 1076070407 /nfs/dbraw/zinc/07/04/07/1076070407.db2.gz SVDGPGQCNJTIMW-GHMZBOCLSA-N -1 3 395.445 -1.249 20 0 GAADHM CC(C)(C(N)=O)C(=O)NCCN1CCN(c2cnc(-c3nnn[n-]3)cn2)CC1 ZINC001589065336 1076070465 /nfs/dbraw/zinc/07/04/65/1076070465.db2.gz BXFICRWHDHBGJI-UHFFFAOYSA-N -1 3 388.436 -1.594 20 0 GAADHM CC(C)(C(N)=O)N1CCN(c2cccc(S(N)(=O)=O)c2-c2nn[n-]n2)CC1 ZINC001589065525 1076070332 /nfs/dbraw/zinc/07/03/32/1076070332.db2.gz HEKKMFPDJKVIMA-UHFFFAOYSA-N -1 3 394.461 -1.100 20 0 GAADHM CC(C)(C(N)=O)N1CCN(c2cccc(S(N)(=O)=O)c2-c2nnn[n-]2)CC1 ZINC001589065525 1076070327 /nfs/dbraw/zinc/07/03/27/1076070327.db2.gz HEKKMFPDJKVIMA-UHFFFAOYSA-N -1 3 394.461 -1.100 20 0 GAADHM CC(C)(C(N)=O)C(=O)NC[C@@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001589065818 1076070378 /nfs/dbraw/zinc/07/03/78/1076070378.db2.gz RHFSIOMALMYOFS-INIZCTEOSA-N -1 3 392.395 -1.030 20 0 GAADHM CC(C)(C(N)=O)C(=O)NC[C@@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001589065818 1076070375 /nfs/dbraw/zinc/07/03/75/1076070375.db2.gz RHFSIOMALMYOFS-INIZCTEOSA-N -1 3 392.395 -1.030 20 0 GAADHM CC(C)(C(N)=O)C(=O)NC[C@]1(O)CCN(c2ncc(-c3nn[n-]n3)cc2F)C1 ZINC001589065819 1076070441 /nfs/dbraw/zinc/07/04/41/1076070441.db2.gz RHFSIOMALMYOFS-MRXNPFEDSA-N -1 3 392.395 -1.030 20 0 GAADHM CC(C)(C(N)=O)C(=O)NC[C@]1(O)CCN(c2ncc(-c3nnn[n-]3)cc2F)C1 ZINC001589065819 1076070434 /nfs/dbraw/zinc/07/04/34/1076070434.db2.gz RHFSIOMALMYOFS-MRXNPFEDSA-N -1 3 392.395 -1.030 20 0 GAADHM C[C@@H]1C(=O)N(CCN(C)C)CN1C(=O)C1(C(=O)[O-])CCS(=O)(=O)CC1 ZINC001589258685 957021029 /nfs/dbraw/zinc/02/10/29/957021029.db2.gz LCDPXVCILJCVQV-LLVKDONJSA-N -1 3 375.447 -1.156 20 0 GAADHM C[C@H]1C(=O)N(CCN(C)C)CN1C(=O)C1(C(=O)[O-])CCS(=O)(=O)CC1 ZINC001589258690 957020423 /nfs/dbraw/zinc/02/04/23/957020423.db2.gz LCDPXVCILJCVQV-NSHDSACASA-N -1 3 375.447 -1.156 20 0 GAADHM CC(C)(C)n1nnc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@@H]2O)n1 ZINC001589265883 1076071191 /nfs/dbraw/zinc/07/11/91/1076071191.db2.gz UYJOMFMUBOSYPK-MNOVXSKESA-N -1 3 399.419 -1.017 20 0 GAADHM CC(C)(C)n1nnc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@@H]2O)n1 ZINC001589265883 1076071187 /nfs/dbraw/zinc/07/11/87/1076071187.db2.gz UYJOMFMUBOSYPK-MNOVXSKESA-N -1 3 399.419 -1.017 20 0 GAADHM CC(C)(C)n1nnc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]2O)n1 ZINC001589266005 1076071208 /nfs/dbraw/zinc/07/12/08/1076071208.db2.gz XUYNZLJBLLGHHT-VXGBXAGGSA-N -1 3 399.419 -1.017 20 0 GAADHM CC(C)(C)n1nnc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]2O)n1 ZINC001589266005 1076071203 /nfs/dbraw/zinc/07/12/03/1076071203.db2.gz XUYNZLJBLLGHHT-VXGBXAGGSA-N -1 3 399.419 -1.017 20 0 GAADHM CC(C)(CCN1CCOCC1)NC(=O)Cn1cc(-c2nn[n-]n2)c(=O)[nH]c1=O ZINC001589276644 1076071084 /nfs/dbraw/zinc/07/10/84/1076071084.db2.gz XXWPPOYQHDPGEI-UHFFFAOYSA-N -1 3 392.420 -1.254 20 0 GAADHM CC(C)(CNC(=O)C(=O)NCc1ccc(-c2nn[n-]n2)cc1)NS(C)(=O)=O ZINC001589278201 1076071339 /nfs/dbraw/zinc/07/13/39/1076071339.db2.gz 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CC(C)(C(=O)[O-])N1CCN(C(=O)NCCS(=O)(=O)N2CCOCC2)CC1 ZINC001589623949 987519798 /nfs/dbraw/zinc/51/97/98/987519798.db2.gz VALDOPHGFAICJU-UHFFFAOYSA-N -1 3 392.478 -1.161 20 0 GAADHM CC(C)N(CC(N)=O)C(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001589679424 1076071814 /nfs/dbraw/zinc/07/18/14/1076071814.db2.gz SHOVJKIREXXIEQ-UHFFFAOYSA-N -1 3 381.418 -1.133 20 0 GAADHM CC(C)N(CC(N)=O)C(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001589679424 1076071809 /nfs/dbraw/zinc/07/18/09/1076071809.db2.gz SHOVJKIREXXIEQ-UHFFFAOYSA-N -1 3 381.418 -1.133 20 0 GAADHM CC(C)N1CC[C@@H](N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)C1=O ZINC001589711610 1076071607 /nfs/dbraw/zinc/07/16/07/1076071607.db2.gz AXSJZRSQHHZLNK-MCIONIFRSA-N -1 3 388.432 -1.021 20 0 GAADHM CC(C)N1CC[C@@H](N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)C1=O ZINC001589711610 1076071600 /nfs/dbraw/zinc/07/16/00/1076071600.db2.gz AXSJZRSQHHZLNK-MCIONIFRSA-N -1 3 388.432 -1.021 20 0 GAADHM CC(C)N1CC[C@H](N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)C1=O ZINC001589711611 1076071866 /nfs/dbraw/zinc/07/18/66/1076071866.db2.gz AXSJZRSQHHZLNK-RDBSUJKOSA-N -1 3 388.432 -1.021 20 0 GAADHM CC(C)N1CC[C@H](N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)C1=O ZINC001589711611 1076071862 /nfs/dbraw/zinc/07/18/62/1076071862.db2.gz AXSJZRSQHHZLNK-RDBSUJKOSA-N -1 3 388.432 -1.021 20 0 GAADHM CC(C)NC(=O)CCNC(=O)C(=O)NCCNc1ncccc1-c1nn[n-]n1 ZINC001589719718 1076072011 /nfs/dbraw/zinc/07/20/11/1076072011.db2.gz DZIMWKDBOXAVPP-UHFFFAOYSA-N -1 3 389.420 -1.179 20 0 GAADHM CC(C)NC(=O)CCNC(=O)C(=O)NCCNc1ncccc1-c1nnn[n-]1 ZINC001589719718 1076072008 /nfs/dbraw/zinc/07/20/08/1076072008.db2.gz DZIMWKDBOXAVPP-UHFFFAOYSA-N -1 3 389.420 -1.179 20 0 GAADHM CC(C)NS(=O)(=O)CCNC(=O)C(=O)NCc1ccc(-c2nn[n-]n2)cc1 ZINC001589727686 1076072249 /nfs/dbraw/zinc/07/22/49/1076072249.db2.gz LVPHERFGGVFDGP-UHFFFAOYSA-N -1 3 395.445 -1.073 20 0 GAADHM CC(C)NS(=O)(=O)CCNC(=O)C(=O)NCc1ccc(-c2nnn[n-]2)cc1 ZINC001589727686 1076072244 /nfs/dbraw/zinc/07/22/44/1076072244.db2.gz LVPHERFGGVFDGP-UHFFFAOYSA-N -1 3 395.445 -1.073 20 0 GAADHM CC(C)NS(=O)(=O)CCNC(=O)C(=O)NCc1cccc(-c2nn[n-]n2)c1 ZINC001589727849 1076072140 /nfs/dbraw/zinc/07/21/40/1076072140.db2.gz PNSNEVGYLYHABH-UHFFFAOYSA-N -1 3 395.445 -1.073 20 0 GAADHM CC(C)NS(=O)(=O)CCNC(=O)C(=O)NCc1cccc(-c2nnn[n-]2)c1 ZINC001589727849 1076072135 /nfs/dbraw/zinc/07/21/35/1076072135.db2.gz PNSNEVGYLYHABH-UHFFFAOYSA-N -1 3 395.445 -1.073 20 0 GAADHM CC(C)NS(=O)(=O)NCCNCc1cnc2c(-c3nnn[n-]3)cnn2c1 ZINC001589729651 1076072263 /nfs/dbraw/zinc/07/22/63/1076072263.db2.gz PQFQYDNJKCVTPT-UHFFFAOYSA-N -1 3 380.438 -1.169 20 0 GAADHM CC(C)NS(=O)(=O)NCCNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001589729777 1076072126 /nfs/dbraw/zinc/07/21/26/1076072126.db2.gz XRBVXHXUFOAQIC-UHFFFAOYSA-N -1 3 389.463 -1.023 20 0 GAADHM CC(C)NS(=O)(=O)NCCNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001589729777 1076072123 /nfs/dbraw/zinc/07/21/23/1076072123.db2.gz XRBVXHXUFOAQIC-UHFFFAOYSA-N -1 3 389.463 -1.023 20 0 GAADHM CC(C)S(=O)(=O)CC(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001589759061 1076072210 /nfs/dbraw/zinc/07/22/10/1076072210.db2.gz BDPGSPMYSDGZQM-NEPJUHHUSA-N -1 3 395.445 -1.249 20 0 GAADHM CC(C)S(=O)(=O)CC(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001589759061 1076072205 /nfs/dbraw/zinc/07/22/05/1076072205.db2.gz BDPGSPMYSDGZQM-NEPJUHHUSA-N -1 3 395.445 -1.249 20 0 GAADHM CC(C)S(=O)(=O)CC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001589759334 1076072111 /nfs/dbraw/zinc/07/21/11/1076072111.db2.gz PKLLONMVKGSIAC-NEPJUHHUSA-N -1 3 395.445 -1.249 20 0 GAADHM CC(C)S(=O)(=O)CC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1O ZINC001589759335 1076072044 /nfs/dbraw/zinc/07/20/44/1076072044.db2.gz PKLLONMVKGSIAC-VXGBXAGGSA-N -1 3 395.445 -1.249 20 0 GAADHM CC(C)c1nnnn1CC(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001589778448 1076072653 /nfs/dbraw/zinc/07/26/53/1076072653.db2.gz KZCIFKZSMKLIOM-NEPJUHHUSA-N -1 3 399.419 -1.263 20 0 GAADHM CC(C)c1nnnn1CC(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001589778448 1076072649 /nfs/dbraw/zinc/07/26/49/1076072649.db2.gz KZCIFKZSMKLIOM-NEPJUHHUSA-N -1 3 399.419 -1.263 20 0 GAADHM CC(C)c1nnnn1CC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O ZINC001589778718 1076072580 /nfs/dbraw/zinc/07/25/80/1076072580.db2.gz SGQGGTMOYVHJHR-CHWSQXEVSA-N -1 3 399.419 -1.263 20 0 GAADHM CC(C)c1nnnn1CC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O ZINC001589778718 1076072576 /nfs/dbraw/zinc/07/25/76/1076072576.db2.gz SGQGGTMOYVHJHR-CHWSQXEVSA-N -1 3 399.419 -1.263 20 0 GAADHM C[C@@H](CCCNC(=O)[C@H]1CNC(=O)N1)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589810508 1076073072 /nfs/dbraw/zinc/07/30/72/1076073072.db2.gz AVJSCDJTSGTFHB-GZMMTYOYSA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@@H](CCCNC(=O)[C@H]1CNC(=O)N1)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589810508 1076073066 /nfs/dbraw/zinc/07/30/66/1076073066.db2.gz AVJSCDJTSGTFHB-GZMMTYOYSA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@H](CCCNC(=O)[C@@H]1CNC(=O)N1)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589810510 1076073034 /nfs/dbraw/zinc/07/30/34/1076073034.db2.gz AVJSCDJTSGTFHB-KCJUWKMLSA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@H](CCCNC(=O)[C@@H]1CNC(=O)N1)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589810510 1076073033 /nfs/dbraw/zinc/07/30/33/1076073033.db2.gz AVJSCDJTSGTFHB-KCJUWKMLSA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@@H](CCCNC(=O)[C@@H]1CNC(=O)N1)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589810512 1076073003 /nfs/dbraw/zinc/07/30/03/1076073003.db2.gz AVJSCDJTSGTFHB-KWQFWETISA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@@H](CCCNC(=O)[C@@H]1CNC(=O)N1)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589810512 1076072998 /nfs/dbraw/zinc/07/29/98/1076072998.db2.gz AVJSCDJTSGTFHB-KWQFWETISA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@H](CCCNC(=O)[C@H]1CNC(=O)N1)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589810514 1076072976 /nfs/dbraw/zinc/07/29/76/1076072976.db2.gz AVJSCDJTSGTFHB-LDYMZIIASA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@H](CCCNC(=O)[C@H]1CNC(=O)N1)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589810514 1076072972 /nfs/dbraw/zinc/07/29/72/1076072972.db2.gz AVJSCDJTSGTFHB-LDYMZIIASA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@@H](CCCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)[C@H]1CNC(=O)N1 ZINC001589811040 1076072915 /nfs/dbraw/zinc/07/29/15/1076072915.db2.gz FRCPTJPNZCRRES-GZMMTYOYSA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@@H](CCCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)[C@H]1CNC(=O)N1 ZINC001589811040 1076072908 /nfs/dbraw/zinc/07/29/08/1076072908.db2.gz FRCPTJPNZCRRES-GZMMTYOYSA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@H](CCCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)[C@@H]1CNC(=O)N1 ZINC001589811041 1076072846 /nfs/dbraw/zinc/07/28/46/1076072846.db2.gz FRCPTJPNZCRRES-KCJUWKMLSA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@H](CCCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)[C@@H]1CNC(=O)N1 ZINC001589811041 1076072840 /nfs/dbraw/zinc/07/28/40/1076072840.db2.gz FRCPTJPNZCRRES-KCJUWKMLSA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@@H](CCCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)[C@@H]1CNC(=O)N1 ZINC001589811042 1076072965 /nfs/dbraw/zinc/07/29/65/1076072965.db2.gz FRCPTJPNZCRRES-KWQFWETISA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@@H](CCCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)[C@@H]1CNC(=O)N1 ZINC001589811042 1076072960 /nfs/dbraw/zinc/07/29/60/1076072960.db2.gz FRCPTJPNZCRRES-KWQFWETISA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@H](CCCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)[C@H]1CNC(=O)N1 ZINC001589811043 1076072929 /nfs/dbraw/zinc/07/29/29/1076072929.db2.gz FRCPTJPNZCRRES-LDYMZIIASA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@H](CCCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)[C@H]1CNC(=O)N1 ZINC001589811043 1076072926 /nfs/dbraw/zinc/07/29/26/1076072926.db2.gz FRCPTJPNZCRRES-LDYMZIIASA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@@H](CCCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)NC(=O)[C@H]1CNC(=O)N1 ZINC001589813196 1076072881 /nfs/dbraw/zinc/07/28/81/1076072881.db2.gz VMDDGLIIAZMKML-GZMMTYOYSA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@@H](CCCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)NC(=O)[C@H]1CNC(=O)N1 ZINC001589813196 1076072875 /nfs/dbraw/zinc/07/28/75/1076072875.db2.gz VMDDGLIIAZMKML-GZMMTYOYSA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@H](CCCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)NC(=O)[C@@H]1CNC(=O)N1 ZINC001589813199 1076073025 /nfs/dbraw/zinc/07/30/25/1076073025.db2.gz VMDDGLIIAZMKML-KCJUWKMLSA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@H](CCCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)NC(=O)[C@@H]1CNC(=O)N1 ZINC001589813199 1076073022 /nfs/dbraw/zinc/07/30/22/1076073022.db2.gz VMDDGLIIAZMKML-KCJUWKMLSA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@@H](CCCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)NC(=O)[C@@H]1CNC(=O)N1 ZINC001589813202 1076072990 /nfs/dbraw/zinc/07/29/90/1076072990.db2.gz VMDDGLIIAZMKML-KWQFWETISA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@@H](CCCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)NC(=O)[C@@H]1CNC(=O)N1 ZINC001589813202 1076072987 /nfs/dbraw/zinc/07/29/87/1076072987.db2.gz VMDDGLIIAZMKML-KWQFWETISA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@H](CCCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)NC(=O)[C@H]1CNC(=O)N1 ZINC001589813206 1076072898 /nfs/dbraw/zinc/07/28/98/1076072898.db2.gz VMDDGLIIAZMKML-LDYMZIIASA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@H](CCCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)NC(=O)[C@H]1CNC(=O)N1 ZINC001589813206 1076072893 /nfs/dbraw/zinc/07/28/93/1076072893.db2.gz VMDDGLIIAZMKML-LDYMZIIASA-N -1 3 375.393 -1.109 20 0 GAADHM C[C@H](CCNC(=O)CN1C(=O)CCC1=O)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589823135 1076073505 /nfs/dbraw/zinc/07/35/05/1076073505.db2.gz SUEWJZXWNJDTIJ-SECBINFHSA-N -1 3 388.388 -1.032 20 0 GAADHM C[C@H](CCNC(=O)CN1C(=O)CCC1=O)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589823135 1076073502 /nfs/dbraw/zinc/07/35/02/1076073502.db2.gz SUEWJZXWNJDTIJ-SECBINFHSA-N -1 3 388.388 -1.032 20 0 GAADHM C[C@@H](CCNC(=O)CN1C(=O)CCC1=O)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589823136 1076073399 /nfs/dbraw/zinc/07/33/99/1076073399.db2.gz SUEWJZXWNJDTIJ-VIFPVBQESA-N -1 3 388.388 -1.032 20 0 GAADHM C[C@@H](CCNC(=O)CN1C(=O)CCC1=O)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589823136 1076073396 /nfs/dbraw/zinc/07/33/96/1076073396.db2.gz SUEWJZXWNJDTIJ-VIFPVBQESA-N -1 3 388.388 -1.032 20 0 GAADHM C[C@H](CN(C)C(=O)C1CC(=O)NC(=O)C1)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001589837182 1076074167 /nfs/dbraw/zinc/07/41/67/1076074167.db2.gz VMVUIGFTAOHAFK-MRVPVSSYSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN(C)C(=O)C1CC(=O)NC(=O)C1)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001589837182 1076074163 /nfs/dbraw/zinc/07/41/63/1076074163.db2.gz VMVUIGFTAOHAFK-MRVPVSSYSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)C1CC(=O)NC(=O)C1)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001589837184 1076074246 /nfs/dbraw/zinc/07/42/46/1076074246.db2.gz VMVUIGFTAOHAFK-QMMMGPOBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)C1CC(=O)NC(=O)C1)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001589837184 1076074241 /nfs/dbraw/zinc/07/42/41/1076074241.db2.gz VMVUIGFTAOHAFK-QMMMGPOBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN(C)C(=O)C[C@@H]1CC(=O)NC1=O)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001589838452 1076074368 /nfs/dbraw/zinc/07/43/68/1076074368.db2.gz BZVGNZAXXOCQNH-BDAKNGLRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN(C)C(=O)C[C@@H]1CC(=O)NC1=O)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001589838452 1076074362 /nfs/dbraw/zinc/07/43/62/1076074362.db2.gz BZVGNZAXXOCQNH-BDAKNGLRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)C[C@H]1CC(=O)NC1=O)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001589838453 1076074355 /nfs/dbraw/zinc/07/43/55/1076074355.db2.gz BZVGNZAXXOCQNH-DTWKUNHWSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)C[C@H]1CC(=O)NC1=O)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001589838453 1076074350 /nfs/dbraw/zinc/07/43/50/1076074350.db2.gz BZVGNZAXXOCQNH-DTWKUNHWSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)C[C@@H]1CC(=O)NC1=O)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001589838454 1076074274 /nfs/dbraw/zinc/07/42/74/1076074274.db2.gz BZVGNZAXXOCQNH-IUCAKERBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)C[C@@H]1CC(=O)NC1=O)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001589838454 1076074269 /nfs/dbraw/zinc/07/42/69/1076074269.db2.gz BZVGNZAXXOCQNH-IUCAKERBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN(C)C(=O)C[C@H]1CC(=O)NC1=O)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001589838455 1076074383 /nfs/dbraw/zinc/07/43/83/1076074383.db2.gz BZVGNZAXXOCQNH-RKDXNWHRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN(C)C(=O)C[C@H]1CC(=O)NC1=O)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001589838455 1076074378 /nfs/dbraw/zinc/07/43/78/1076074378.db2.gz BZVGNZAXXOCQNH-RKDXNWHRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN(C)C(=O)C[C@@H]1CC(=O)NC1=O)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589838808 1076074260 /nfs/dbraw/zinc/07/42/60/1076074260.db2.gz ZSOLMTFBCBQLLE-BDAKNGLRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN(C)C(=O)C[C@@H]1CC(=O)NC1=O)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589838808 1076074256 /nfs/dbraw/zinc/07/42/56/1076074256.db2.gz ZSOLMTFBCBQLLE-BDAKNGLRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)C[C@H]1CC(=O)NC1=O)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589838809 1076074150 /nfs/dbraw/zinc/07/41/50/1076074150.db2.gz ZSOLMTFBCBQLLE-DTWKUNHWSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)C[C@H]1CC(=O)NC1=O)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589838809 1076074146 /nfs/dbraw/zinc/07/41/46/1076074146.db2.gz ZSOLMTFBCBQLLE-DTWKUNHWSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)C[C@@H]1CC(=O)NC1=O)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589838810 1076074397 /nfs/dbraw/zinc/07/43/97/1076074397.db2.gz ZSOLMTFBCBQLLE-IUCAKERBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)C[C@@H]1CC(=O)NC1=O)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589838810 1076074393 /nfs/dbraw/zinc/07/43/93/1076074393.db2.gz ZSOLMTFBCBQLLE-IUCAKERBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN(C)C(=O)C[C@H]1CC(=O)NC1=O)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589838811 1076074214 /nfs/dbraw/zinc/07/42/14/1076074214.db2.gz ZSOLMTFBCBQLLE-RKDXNWHRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN(C)C(=O)C[C@H]1CC(=O)NC1=O)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589838811 1076074208 /nfs/dbraw/zinc/07/42/08/1076074208.db2.gz ZSOLMTFBCBQLLE-RKDXNWHRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1)NC(=O)CN1C(=O)CCC1=O ZINC001589840385 1076074803 /nfs/dbraw/zinc/07/48/03/1076074803.db2.gz JYAXZKKUQJPJMP-SECBINFHSA-N -1 3 388.388 -1.080 20 0 GAADHM C[C@H](CN(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1)NC(=O)CN1C(=O)CCC1=O ZINC001589840385 1076074799 /nfs/dbraw/zinc/07/47/99/1076074799.db2.gz JYAXZKKUQJPJMP-SECBINFHSA-N -1 3 388.388 -1.080 20 0 GAADHM C[C@@H](CN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1)NC(=O)CN1C(=O)CCC1=O ZINC001589840386 1076074737 /nfs/dbraw/zinc/07/47/37/1076074737.db2.gz JYAXZKKUQJPJMP-VIFPVBQESA-N -1 3 388.388 -1.080 20 0 GAADHM C[C@@H](CN(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1)NC(=O)CN1C(=O)CCC1=O ZINC001589840386 1076074733 /nfs/dbraw/zinc/07/47/33/1076074733.db2.gz JYAXZKKUQJPJMP-VIFPVBQESA-N -1 3 388.388 -1.080 20 0 GAADHM C[C@H](CN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1)NC(=O)CN1CC(=O)NC1=O ZINC001589840475 1076074778 /nfs/dbraw/zinc/07/47/78/1076074778.db2.gz VDSHXCBDYHXKAD-MRVPVSSYSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@@H](CN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1)NC(=O)CN1CC(=O)NC1=O ZINC001589840476 1076074771 /nfs/dbraw/zinc/07/47/71/1076074771.db2.gz VDSHXCBDYHXKAD-QMMMGPOBSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@H](CN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1)NC(=O)C1CC(=O)NC(=O)C1 ZINC001589840513 1076074746 /nfs/dbraw/zinc/07/47/46/1076074746.db2.gz ZUQBKYNMCRBJEU-MRVPVSSYSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1)NC(=O)C1CC(=O)NC(=O)C1 ZINC001589840513 1076074744 /nfs/dbraw/zinc/07/47/44/1076074744.db2.gz ZUQBKYNMCRBJEU-MRVPVSSYSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1)NC(=O)C1CC(=O)NC(=O)C1 ZINC001589840514 1076074543 /nfs/dbraw/zinc/07/45/43/1076074543.db2.gz ZUQBKYNMCRBJEU-QMMMGPOBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1)NC(=O)C1CC(=O)NC(=O)C1 ZINC001589840514 1076074533 /nfs/dbraw/zinc/07/45/33/1076074533.db2.gz ZUQBKYNMCRBJEU-QMMMGPOBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)C[C@H]1CC(=O)NC1=O ZINC001589840575 1076074662 /nfs/dbraw/zinc/07/46/62/1076074662.db2.gz FYKRRNGVGGWQEJ-BDAKNGLRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)C[C@H]1CC(=O)NC1=O ZINC001589840575 1076074655 /nfs/dbraw/zinc/07/46/55/1076074655.db2.gz FYKRRNGVGGWQEJ-BDAKNGLRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)C[C@@H]1CC(=O)NC1=O ZINC001589840577 1076074714 /nfs/dbraw/zinc/07/47/14/1076074714.db2.gz FYKRRNGVGGWQEJ-DTWKUNHWSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)C[C@@H]1CC(=O)NC1=O ZINC001589840577 1076074709 /nfs/dbraw/zinc/07/47/09/1076074709.db2.gz FYKRRNGVGGWQEJ-DTWKUNHWSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)C[C@H]1CC(=O)NC1=O ZINC001589840579 1076074692 /nfs/dbraw/zinc/07/46/92/1076074692.db2.gz FYKRRNGVGGWQEJ-IUCAKERBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)C[C@H]1CC(=O)NC1=O ZINC001589840579 1076074687 /nfs/dbraw/zinc/07/46/87/1076074687.db2.gz FYKRRNGVGGWQEJ-IUCAKERBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)C[C@@H]1CC(=O)NC1=O ZINC001589840581 1076074816 /nfs/dbraw/zinc/07/48/16/1076074816.db2.gz FYKRRNGVGGWQEJ-RKDXNWHRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)C[C@@H]1CC(=O)NC1=O ZINC001589840581 1076074811 /nfs/dbraw/zinc/07/48/11/1076074811.db2.gz FYKRRNGVGGWQEJ-RKDXNWHRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1)NC(=O)CN1C(=O)CNC1=O ZINC001589841649 1076074623 /nfs/dbraw/zinc/07/46/23/1076074623.db2.gz CPUAOFQEZICSKB-MRVPVSSYSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@H](CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1)NC(=O)CN1C(=O)CNC1=O ZINC001589841649 1076074621 /nfs/dbraw/zinc/07/46/21/1076074621.db2.gz CPUAOFQEZICSKB-MRVPVSSYSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@@H](CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1)NC(=O)CN1C(=O)CNC1=O ZINC001589841650 1076074794 /nfs/dbraw/zinc/07/47/94/1076074794.db2.gz CPUAOFQEZICSKB-QMMMGPOBSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@@H](CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1)NC(=O)CN1C(=O)CNC1=O ZINC001589841650 1076074790 /nfs/dbraw/zinc/07/47/90/1076074790.db2.gz CPUAOFQEZICSKB-QMMMGPOBSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@H](CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1)NC(=O)C[C@H]1CC(=O)NC1=O ZINC001589841887 1076074701 /nfs/dbraw/zinc/07/47/01/1076074701.db2.gz SJFJKAQSVFCFCC-BDAKNGLRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1)NC(=O)C[C@H]1CC(=O)NC1=O ZINC001589841887 1076074698 /nfs/dbraw/zinc/07/46/98/1076074698.db2.gz SJFJKAQSVFCFCC-BDAKNGLRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1)NC(=O)C[C@@H]1CC(=O)NC1=O ZINC001589841888 1076074568 /nfs/dbraw/zinc/07/45/68/1076074568.db2.gz SJFJKAQSVFCFCC-DTWKUNHWSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1)NC(=O)C[C@@H]1CC(=O)NC1=O ZINC001589841888 1076074561 /nfs/dbraw/zinc/07/45/61/1076074561.db2.gz SJFJKAQSVFCFCC-DTWKUNHWSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1)NC(=O)C[C@H]1CC(=O)NC1=O ZINC001589841889 1076074676 /nfs/dbraw/zinc/07/46/76/1076074676.db2.gz SJFJKAQSVFCFCC-IUCAKERBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1)NC(=O)C[C@H]1CC(=O)NC1=O ZINC001589841889 1076074672 /nfs/dbraw/zinc/07/46/72/1076074672.db2.gz SJFJKAQSVFCFCC-IUCAKERBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1)NC(=O)C[C@@H]1CC(=O)NC1=O ZINC001589841890 1076074608 /nfs/dbraw/zinc/07/46/08/1076074608.db2.gz SJFJKAQSVFCFCC-RKDXNWHRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1)NC(=O)C[C@@H]1CC(=O)NC1=O ZINC001589841890 1076074600 /nfs/dbraw/zinc/07/46/00/1076074600.db2.gz SJFJKAQSVFCFCC-RKDXNWHRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CN1CCOCC1)C(=O)NCCCNc1ccnc(-c2nn[n-]n2)n1 ZINC001589847881 1076075172 /nfs/dbraw/zinc/07/51/72/1076075172.db2.gz LUGXMVYPBRDSOG-GFCCVEGCSA-N -1 3 375.437 -1.035 20 0 GAADHM C[C@H](CN1CCOCC1)C(=O)NCCCNc1ccnc(-c2nnn[n-]2)n1 ZINC001589847881 1076075169 /nfs/dbraw/zinc/07/51/69/1076075169.db2.gz LUGXMVYPBRDSOG-GFCCVEGCSA-N -1 3 375.437 -1.035 20 0 GAADHM C[C@@H](CN1CCOCC1)C(=O)NCCCNc1ccnc(-c2nn[n-]n2)n1 ZINC001589847886 1076075146 /nfs/dbraw/zinc/07/51/46/1076075146.db2.gz LUGXMVYPBRDSOG-LBPRGKRZSA-N -1 3 375.437 -1.035 20 0 GAADHM C[C@@H](CN1CCOCC1)C(=O)NCCCNc1ccnc(-c2nnn[n-]2)n1 ZINC001589847886 1076075142 /nfs/dbraw/zinc/07/51/42/1076075142.db2.gz LUGXMVYPBRDSOG-LBPRGKRZSA-N -1 3 375.437 -1.035 20 0 GAADHM C[C@H](CN1CCN(C)CC1)NC(=O)CCn1cc(-c2nn[n-]n2)c(=O)[nH]c1=O ZINC001589850035 1076075159 /nfs/dbraw/zinc/07/51/59/1076075159.db2.gz YEJWYZKNYBFSIU-LLVKDONJSA-N -1 3 391.436 -1.729 20 0 GAADHM C[C@H](CN1CCN(C)CC1)NC(=O)CCn1cc(-c2nnn[n-]2)c(=O)[nH]c1=O ZINC001589850035 1076075158 /nfs/dbraw/zinc/07/51/58/1076075158.db2.gz YEJWYZKNYBFSIU-LLVKDONJSA-N -1 3 391.436 -1.729 20 0 GAADHM C[C@@H](CN1CCN(C)CC1)NC(=O)CCn1cc(-c2nn[n-]n2)c(=O)[nH]c1=O ZINC001589850036 1076075119 /nfs/dbraw/zinc/07/51/19/1076075119.db2.gz YEJWYZKNYBFSIU-NSHDSACASA-N -1 3 391.436 -1.729 20 0 GAADHM C[C@@H](CN1CCN(C)CC1)NC(=O)CCn1cc(-c2nnn[n-]2)c(=O)[nH]c1=O ZINC001589850036 1076075118 /nfs/dbraw/zinc/07/51/18/1076075118.db2.gz YEJWYZKNYBFSIU-NSHDSACASA-N -1 3 391.436 -1.729 20 0 GAADHM C[C@H](CNC(=O)C(=O)N1Cc2ccc(-c3nn[n-]n3)cc2C1)S(N)(=O)=O ZINC001589850227 1076075048 /nfs/dbraw/zinc/07/50/48/1076075048.db2.gz FBPMCIJDFGMSTE-MRVPVSSYSA-N -1 3 379.402 -1.498 20 0 GAADHM C[C@H](CNC(=O)C(=O)N1Cc2ccc(-c3nnn[n-]3)cc2C1)S(N)(=O)=O ZINC001589850227 1076075045 /nfs/dbraw/zinc/07/50/45/1076075045.db2.gz FBPMCIJDFGMSTE-MRVPVSSYSA-N -1 3 379.402 -1.498 20 0 GAADHM C[C@@H](CNC(=O)C(=O)N1Cc2ccc(-c3nn[n-]n3)cc2C1)S(N)(=O)=O ZINC001589850228 1076075357 /nfs/dbraw/zinc/07/53/57/1076075357.db2.gz FBPMCIJDFGMSTE-QMMMGPOBSA-N -1 3 379.402 -1.498 20 0 GAADHM C[C@@H](CNC(=O)C(=O)N1Cc2ccc(-c3nnn[n-]3)cc2C1)S(N)(=O)=O ZINC001589850228 1076075353 /nfs/dbraw/zinc/07/53/53/1076075353.db2.gz FBPMCIJDFGMSTE-QMMMGPOBSA-N -1 3 379.402 -1.498 20 0 GAADHM C[C@H](CNC(=O)C(=O)N1Cc2cccc(-c3nn[n-]n3)c2C1)S(N)(=O)=O ZINC001589850793 1076075368 /nfs/dbraw/zinc/07/53/68/1076075368.db2.gz SQLVNEMRAAGTGS-MRVPVSSYSA-N -1 3 379.402 -1.498 20 0 GAADHM C[C@H](CNC(=O)C(=O)N1Cc2cccc(-c3nnn[n-]3)c2C1)S(N)(=O)=O ZINC001589850793 1076075364 /nfs/dbraw/zinc/07/53/64/1076075364.db2.gz SQLVNEMRAAGTGS-MRVPVSSYSA-N -1 3 379.402 -1.498 20 0 GAADHM C[C@@H](CNC(=O)C(=O)N1Cc2cccc(-c3nn[n-]n3)c2C1)S(N)(=O)=O ZINC001589850796 1076075630 /nfs/dbraw/zinc/07/56/30/1076075630.db2.gz SQLVNEMRAAGTGS-QMMMGPOBSA-N -1 3 379.402 -1.498 20 0 GAADHM C[C@@H](CNC(=O)C(=O)N1Cc2cccc(-c3nnn[n-]3)c2C1)S(N)(=O)=O ZINC001589850796 1076075626 /nfs/dbraw/zinc/07/56/26/1076075626.db2.gz SQLVNEMRAAGTGS-QMMMGPOBSA-N -1 3 379.402 -1.498 20 0 GAADHM C[C@H](CNC(=O)[C@H](C)N1C(=O)CCC1=O)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001589851191 1076075438 /nfs/dbraw/zinc/07/54/38/1076075438.db2.gz VDJXXLQSVHEWGJ-BDAKNGLRSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@H](CNC(=O)[C@H](C)N1C(=O)CCC1=O)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001589851191 1076075430 /nfs/dbraw/zinc/07/54/30/1076075430.db2.gz VDJXXLQSVHEWGJ-BDAKNGLRSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@H](C(=O)NC[C@H](C)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)N1C(=O)CCC1=O ZINC001589851192 1076075572 /nfs/dbraw/zinc/07/55/72/1076075572.db2.gz VDJXXLQSVHEWGJ-DTWKUNHWSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@H](C(=O)NC[C@H](C)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1)N1C(=O)CCC1=O ZINC001589851192 1076075566 /nfs/dbraw/zinc/07/55/66/1076075566.db2.gz VDJXXLQSVHEWGJ-DTWKUNHWSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@@H](CNC(=O)[C@H](C)N1C(=O)CCC1=O)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001589851193 1076075533 /nfs/dbraw/zinc/07/55/33/1076075533.db2.gz VDJXXLQSVHEWGJ-IUCAKERBSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@@H](CNC(=O)[C@H](C)N1C(=O)CCC1=O)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001589851193 1076075528 /nfs/dbraw/zinc/07/55/28/1076075528.db2.gz VDJXXLQSVHEWGJ-IUCAKERBSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@H](CNC(=O)[C@@H](C)N1C(=O)CCC1=O)NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001589851194 1076075645 /nfs/dbraw/zinc/07/56/45/1076075645.db2.gz VDJXXLQSVHEWGJ-RKDXNWHRSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@H](CNC(=O)[C@@H](C)N1C(=O)CCC1=O)NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001589851194 1076075639 /nfs/dbraw/zinc/07/56/39/1076075639.db2.gz VDJXXLQSVHEWGJ-RKDXNWHRSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@H](CNC(=O)C1CC(=O)NC(=O)C1)N(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001589852840 1076075400 /nfs/dbraw/zinc/07/54/00/1076075400.db2.gz QQHHURFOYALOQZ-MRVPVSSYSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CNC(=O)C1CC(=O)NC(=O)C1)N(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001589852840 1076075397 /nfs/dbraw/zinc/07/53/97/1076075397.db2.gz QQHHURFOYALOQZ-MRVPVSSYSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CNC(=O)C1CC(=O)NC(=O)C1)N(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001589852841 1076075496 /nfs/dbraw/zinc/07/54/96/1076075496.db2.gz QQHHURFOYALOQZ-QMMMGPOBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CNC(=O)C1CC(=O)NC(=O)C1)N(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001589852841 1076075492 /nfs/dbraw/zinc/07/54/92/1076075492.db2.gz QQHHURFOYALOQZ-QMMMGPOBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CNC(=O)C[C@H]1CC(=O)NC1=O)N(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001589855243 1076075600 /nfs/dbraw/zinc/07/56/00/1076075600.db2.gz SPCFAKAJLKAMIQ-BDAKNGLRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CNC(=O)C[C@H]1CC(=O)NC1=O)N(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001589855243 1076075595 /nfs/dbraw/zinc/07/55/95/1076075595.db2.gz SPCFAKAJLKAMIQ-BDAKNGLRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CNC(=O)C[C@@H]1CC(=O)NC1=O)N(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001589855244 1076075342 /nfs/dbraw/zinc/07/53/42/1076075342.db2.gz SPCFAKAJLKAMIQ-DTWKUNHWSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CNC(=O)C[C@@H]1CC(=O)NC1=O)N(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001589855244 1076075337 /nfs/dbraw/zinc/07/53/37/1076075337.db2.gz SPCFAKAJLKAMIQ-DTWKUNHWSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CNC(=O)C[C@H]1CC(=O)NC1=O)N(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001589855245 1076075515 /nfs/dbraw/zinc/07/55/15/1076075515.db2.gz SPCFAKAJLKAMIQ-IUCAKERBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CNC(=O)C[C@H]1CC(=O)NC1=O)N(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001589855245 1076075508 /nfs/dbraw/zinc/07/55/08/1076075508.db2.gz SPCFAKAJLKAMIQ-IUCAKERBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CNC(=O)C[C@@H]1CC(=O)NC1=O)N(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001589855246 1076075586 /nfs/dbraw/zinc/07/55/86/1076075586.db2.gz SPCFAKAJLKAMIQ-RKDXNWHRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CNC(=O)C[C@@H]1CC(=O)NC1=O)N(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001589855246 1076075583 /nfs/dbraw/zinc/07/55/83/1076075583.db2.gz SPCFAKAJLKAMIQ-RKDXNWHRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CNC(=O)C[C@H]1CC(=O)NC1=O)N(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589855489 1076075476 /nfs/dbraw/zinc/07/54/76/1076075476.db2.gz ZJQKVEGBFFEYMJ-BDAKNGLRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CNC(=O)C[C@H]1CC(=O)NC1=O)N(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589855489 1076075470 /nfs/dbraw/zinc/07/54/70/1076075470.db2.gz ZJQKVEGBFFEYMJ-BDAKNGLRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CNC(=O)C[C@@H]1CC(=O)NC1=O)N(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589855490 1076075326 /nfs/dbraw/zinc/07/53/26/1076075326.db2.gz ZJQKVEGBFFEYMJ-DTWKUNHWSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CNC(=O)C[C@@H]1CC(=O)NC1=O)N(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589855490 1076075324 /nfs/dbraw/zinc/07/53/24/1076075324.db2.gz ZJQKVEGBFFEYMJ-DTWKUNHWSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CNC(=O)C[C@H]1CC(=O)NC1=O)N(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589855491 1076075417 /nfs/dbraw/zinc/07/54/17/1076075417.db2.gz ZJQKVEGBFFEYMJ-IUCAKERBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CNC(=O)C[C@H]1CC(=O)NC1=O)N(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589855491 1076075411 /nfs/dbraw/zinc/07/54/11/1076075411.db2.gz ZJQKVEGBFFEYMJ-IUCAKERBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CNC(=O)C[C@@H]1CC(=O)NC1=O)N(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589855492 1076075776 /nfs/dbraw/zinc/07/57/76/1076075776.db2.gz ZJQKVEGBFFEYMJ-RKDXNWHRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CNC(=O)C[C@@H]1CC(=O)NC1=O)N(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589855492 1076075771 /nfs/dbraw/zinc/07/57/71/1076075771.db2.gz ZJQKVEGBFFEYMJ-RKDXNWHRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CNC(=O)CCN1C(=O)CCC1=O)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001589855780 1076075997 /nfs/dbraw/zinc/07/59/97/1076075997.db2.gz HSQDBWMBPUCHFO-SECBINFHSA-N -1 3 388.388 -1.032 20 0 GAADHM C[C@H](CNC(=O)CCN1C(=O)CCC1=O)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001589855780 1076075993 /nfs/dbraw/zinc/07/59/93/1076075993.db2.gz HSQDBWMBPUCHFO-SECBINFHSA-N -1 3 388.388 -1.032 20 0 GAADHM C[C@@H](CNC(=O)CCN1C(=O)CCC1=O)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001589855781 1076075840 /nfs/dbraw/zinc/07/58/40/1076075840.db2.gz HSQDBWMBPUCHFO-VIFPVBQESA-N -1 3 388.388 -1.032 20 0 GAADHM C[C@@H](CNC(=O)CCN1C(=O)CCC1=O)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001589855781 1076075836 /nfs/dbraw/zinc/07/58/36/1076075836.db2.gz HSQDBWMBPUCHFO-VIFPVBQESA-N -1 3 388.388 -1.032 20 0 GAADHM C[C@H](CNC(=O)CN1CC(=O)N(C)C1=O)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589856373 1076075823 /nfs/dbraw/zinc/07/58/23/1076075823.db2.gz AZWOAWMCAAGATA-MRVPVSSYSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@H](CNC(=O)CN1CC(=O)N(C)C1=O)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589856373 1076075822 /nfs/dbraw/zinc/07/58/22/1076075822.db2.gz AZWOAWMCAAGATA-MRVPVSSYSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@@H](CNC(=O)CN1CC(=O)N(C)C1=O)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589856375 1076075791 /nfs/dbraw/zinc/07/57/91/1076075791.db2.gz AZWOAWMCAAGATA-QMMMGPOBSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@@H](CNC(=O)CN1CC(=O)N(C)C1=O)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589856375 1076075787 /nfs/dbraw/zinc/07/57/87/1076075787.db2.gz AZWOAWMCAAGATA-QMMMGPOBSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@H](CNC(=O)CN1C(=O)CCC1=O)N(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001589856376 1076075985 /nfs/dbraw/zinc/07/59/85/1076075985.db2.gz BHNUEKKCRFFHCE-SECBINFHSA-N -1 3 388.388 -1.080 20 0 GAADHM C[C@H](CNC(=O)CN1C(=O)CCC1=O)N(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001589856376 1076075982 /nfs/dbraw/zinc/07/59/82/1076075982.db2.gz BHNUEKKCRFFHCE-SECBINFHSA-N -1 3 388.388 -1.080 20 0 GAADHM C[C@@H](CNC(=O)CN1C(=O)CCC1=O)N(C)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001589856378 1076075951 /nfs/dbraw/zinc/07/59/51/1076075951.db2.gz BHNUEKKCRFFHCE-VIFPVBQESA-N -1 3 388.388 -1.080 20 0 GAADHM C[C@@H](CNC(=O)CN1C(=O)CCC1=O)N(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001589856378 1076075949 /nfs/dbraw/zinc/07/59/49/1076075949.db2.gz BHNUEKKCRFFHCE-VIFPVBQESA-N -1 3 388.388 -1.080 20 0 GAADHM C[C@H](CNC(=O)CN1C(=O)CCC1=O)N(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589856509 1076076008 /nfs/dbraw/zinc/07/60/08/1076076008.db2.gz PGONXXOYUIGADL-SECBINFHSA-N -1 3 388.388 -1.080 20 0 GAADHM C[C@H](CNC(=O)CN1C(=O)CCC1=O)N(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589856509 1076076004 /nfs/dbraw/zinc/07/60/04/1076076004.db2.gz PGONXXOYUIGADL-SECBINFHSA-N -1 3 388.388 -1.080 20 0 GAADHM C[C@@H](CNC(=O)CN1C(=O)CCC1=O)N(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589856510 1076075941 /nfs/dbraw/zinc/07/59/41/1076075941.db2.gz PGONXXOYUIGADL-VIFPVBQESA-N -1 3 388.388 -1.080 20 0 GAADHM C[C@@H](CNC(=O)CN1C(=O)CCC1=O)N(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589856510 1076075940 /nfs/dbraw/zinc/07/59/40/1076075940.db2.gz PGONXXOYUIGADL-VIFPVBQESA-N -1 3 388.388 -1.080 20 0 GAADHM C[C@H](CNC(=O)CN1C(=O)CNC1=O)N(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001589856743 1076076211 /nfs/dbraw/zinc/07/62/11/1076076211.db2.gz YMYQJJJGBCTHJV-MRVPVSSYSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@H](CNC(=O)CN1C(=O)CNC1=O)N(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001589856743 1076076204 /nfs/dbraw/zinc/07/62/04/1076076204.db2.gz YMYQJJJGBCTHJV-MRVPVSSYSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@@H](CNC(=O)CN1C(=O)CNC1=O)N(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001589856744 1076076277 /nfs/dbraw/zinc/07/62/77/1076076277.db2.gz YMYQJJJGBCTHJV-QMMMGPOBSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@@H](CNC(=O)CN1C(=O)CNC1=O)N(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001589856744 1076076270 /nfs/dbraw/zinc/07/62/70/1076076270.db2.gz YMYQJJJGBCTHJV-QMMMGPOBSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@H](CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)NC(=O)CCN1C(=O)CCC1=O ZINC001589860425 1076076164 /nfs/dbraw/zinc/07/61/64/1076076164.db2.gz GOEBWSSTNGGNFC-SECBINFHSA-N -1 3 388.388 -1.032 20 0 GAADHM C[C@H](CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)NC(=O)CCN1C(=O)CCC1=O ZINC001589860425 1076076157 /nfs/dbraw/zinc/07/61/57/1076076157.db2.gz GOEBWSSTNGGNFC-SECBINFHSA-N -1 3 388.388 -1.032 20 0 GAADHM C[C@H](C(=O)N[C@@H](C)CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)N1C(=O)CCC1=O ZINC001589860477 1076076299 /nfs/dbraw/zinc/07/62/99/1076076299.db2.gz INEJDTVVBRXBEW-DTWKUNHWSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@H](C(=O)N[C@@H](C)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)N1C(=O)CCC1=O ZINC001589860477 1076076293 /nfs/dbraw/zinc/07/62/93/1076076293.db2.gz INEJDTVVBRXBEW-DTWKUNHWSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@@H](CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)NC(=O)[C@H](C)N1C(=O)CCC1=O ZINC001589860480 1076076353 /nfs/dbraw/zinc/07/63/53/1076076353.db2.gz INEJDTVVBRXBEW-IUCAKERBSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@@H](CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)NC(=O)[C@H](C)N1C(=O)CCC1=O ZINC001589860480 1076076351 /nfs/dbraw/zinc/07/63/51/1076076351.db2.gz INEJDTVVBRXBEW-IUCAKERBSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@H](CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)N(C)C(=O)CN1C(=O)CNC1=O ZINC001589860490 1076076345 /nfs/dbraw/zinc/07/63/45/1076076345.db2.gz KZNSQKDADVVHRZ-MRVPVSSYSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@H](CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)N(C)C(=O)CN1C(=O)CNC1=O ZINC001589860490 1076076342 /nfs/dbraw/zinc/07/63/42/1076076342.db2.gz KZNSQKDADVVHRZ-MRVPVSSYSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@@H](CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)N(C)C(=O)CN1C(=O)CNC1=O ZINC001589860491 1076076393 /nfs/dbraw/zinc/07/63/93/1076076393.db2.gz KZNSQKDADVVHRZ-QMMMGPOBSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@@H](CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)N(C)C(=O)CN1C(=O)CNC1=O ZINC001589860491 1076076391 /nfs/dbraw/zinc/07/63/91/1076076391.db2.gz KZNSQKDADVVHRZ-QMMMGPOBSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@H](CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)N(C)C(=O)C1CC(=O)NC(=O)C1 ZINC001589862369 1076076326 /nfs/dbraw/zinc/07/63/26/1076076326.db2.gz GRUNCYMQHSOIEK-MRVPVSSYSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)N(C)C(=O)C1CC(=O)NC(=O)C1 ZINC001589862369 1076076323 /nfs/dbraw/zinc/07/63/23/1076076323.db2.gz GRUNCYMQHSOIEK-MRVPVSSYSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)N(C)C(=O)C1CC(=O)NC(=O)C1 ZINC001589862370 1076076383 /nfs/dbraw/zinc/07/63/83/1076076383.db2.gz GRUNCYMQHSOIEK-QMMMGPOBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)N(C)C(=O)C1CC(=O)NC(=O)C1 ZINC001589862370 1076076381 /nfs/dbraw/zinc/07/63/81/1076076381.db2.gz GRUNCYMQHSOIEK-QMMMGPOBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)N(C)C(=O)C[C@@H]1CC(=O)NC1=O ZINC001589862379 1076076548 /nfs/dbraw/zinc/07/65/48/1076076548.db2.gz HILPFPYYOIGUAR-BDAKNGLRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)N(C)C(=O)C[C@@H]1CC(=O)NC1=O ZINC001589862379 1076076542 /nfs/dbraw/zinc/07/65/42/1076076542.db2.gz HILPFPYYOIGUAR-BDAKNGLRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)N(C)C(=O)C[C@H]1CC(=O)NC1=O ZINC001589862380 1076076563 /nfs/dbraw/zinc/07/65/63/1076076563.db2.gz HILPFPYYOIGUAR-DTWKUNHWSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)N(C)C(=O)C[C@H]1CC(=O)NC1=O ZINC001589862380 1076076562 /nfs/dbraw/zinc/07/65/62/1076076562.db2.gz HILPFPYYOIGUAR-DTWKUNHWSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)N(C)C(=O)C[C@@H]1CC(=O)NC1=O ZINC001589862381 1076076832 /nfs/dbraw/zinc/07/68/32/1076076832.db2.gz HILPFPYYOIGUAR-IUCAKERBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@@H](CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)N(C)C(=O)C[C@@H]1CC(=O)NC1=O ZINC001589862381 1076076829 /nfs/dbraw/zinc/07/68/29/1076076829.db2.gz HILPFPYYOIGUAR-IUCAKERBSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)N(C)C(=O)C[C@H]1CC(=O)NC1=O ZINC001589862382 1076076681 /nfs/dbraw/zinc/07/66/81/1076076681.db2.gz HILPFPYYOIGUAR-RKDXNWHRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)N(C)C(=O)C[C@H]1CC(=O)NC1=O ZINC001589862382 1076076675 /nfs/dbraw/zinc/07/66/75/1076076675.db2.gz HILPFPYYOIGUAR-RKDXNWHRSA-N -1 3 388.388 -1.176 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)N(C)C(=O)CN1C(=O)CCC1=O ZINC001589863454 1076076783 /nfs/dbraw/zinc/07/67/83/1076076783.db2.gz JDRIXJIWWSUTJZ-SECBINFHSA-N -1 3 388.388 -1.080 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)N(C)C(=O)CN1C(=O)CCC1=O ZINC001589863454 1076076778 /nfs/dbraw/zinc/07/67/78/1076076778.db2.gz JDRIXJIWWSUTJZ-SECBINFHSA-N -1 3 388.388 -1.080 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)N(C)C(=O)CN1C(=O)CCC1=O ZINC001589863455 1076076616 /nfs/dbraw/zinc/07/66/16/1076076616.db2.gz JDRIXJIWWSUTJZ-VIFPVBQESA-N -1 3 388.388 -1.080 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)N(C)C(=O)CN1C(=O)CCC1=O ZINC001589863455 1076076612 /nfs/dbraw/zinc/07/66/12/1076076612.db2.gz JDRIXJIWWSUTJZ-VIFPVBQESA-N -1 3 388.388 -1.080 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)N(C)C(=O)CN1CC(=O)NC1=O ZINC001589863470 1076076518 /nfs/dbraw/zinc/07/65/18/1076076518.db2.gz LFHYNNRFDQZFDU-MRVPVSSYSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)N(C)C(=O)CN1CC(=O)NC1=O ZINC001589863471 1076076531 /nfs/dbraw/zinc/07/65/31/1076076531.db2.gz LFHYNNRFDQZFDU-QMMMGPOBSA-N -1 3 389.376 -1.677 20 0 GAADHM CC(CO)(CO)CNC(=O)CS(=O)(=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC001589881104 1076077181 /nfs/dbraw/zinc/07/71/81/1076077181.db2.gz AJQUXFWNQRTYNZ-UHFFFAOYSA-N -1 3 383.430 -1.111 20 0 GAADHM CC(CO)(CO)CNC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001589881441 1076077029 /nfs/dbraw/zinc/07/70/29/1076077029.db2.gz QGDAGLIKKQFMPP-UHFFFAOYSA-N -1 3 384.418 -1.748 20 0 GAADHM CC(CO)(CO)CNC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001589881441 1076077022 /nfs/dbraw/zinc/07/70/22/1076077022.db2.gz QGDAGLIKKQFMPP-UHFFFAOYSA-N -1 3 384.418 -1.748 20 0 GAADHM C[C@H](CS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001589887174 1076077457 /nfs/dbraw/zinc/07/74/57/1076077457.db2.gz RJJPDFSPWNQKSM-JLLWLGSASA-N -1 3 395.445 -1.392 20 0 GAADHM C[C@H](CS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001589887174 1076077449 /nfs/dbraw/zinc/07/74/49/1076077449.db2.gz RJJPDFSPWNQKSM-JLLWLGSASA-N -1 3 395.445 -1.392 20 0 GAADHM C[C@@H](CS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001589887185 1076077519 /nfs/dbraw/zinc/07/75/19/1076077519.db2.gz RJJPDFSPWNQKSM-WCQGTBRESA-N -1 3 395.445 -1.392 20 0 GAADHM C[C@@H](CS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001589887185 1076077514 /nfs/dbraw/zinc/07/75/14/1076077514.db2.gz RJJPDFSPWNQKSM-WCQGTBRESA-N -1 3 395.445 -1.392 20 0 GAADHM C[C@H](CS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O ZINC001589887231 1076077669 /nfs/dbraw/zinc/07/76/69/1076077669.db2.gz SECXCXFUHWJELE-OASPWFOLSA-N -1 3 395.445 -1.392 20 0 GAADHM C[C@H](CS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O ZINC001589887231 1076077665 /nfs/dbraw/zinc/07/76/65/1076077665.db2.gz SECXCXFUHWJELE-OASPWFOLSA-N -1 3 395.445 -1.392 20 0 GAADHM C[C@@H](CS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O ZINC001589887232 1076077630 /nfs/dbraw/zinc/07/76/30/1076077630.db2.gz SECXCXFUHWJELE-ZWKOPEQDSA-N -1 3 395.445 -1.392 20 0 GAADHM C[C@@H](CS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O ZINC001589887232 1076077628 /nfs/dbraw/zinc/07/76/28/1076077628.db2.gz SECXCXFUHWJELE-ZWKOPEQDSA-N -1 3 395.445 -1.392 20 0 GAADHM C[C@H](C[S@](C)=O)NC(=O)C(=O)NCCNc1ccc(-c2nn[n-]n2)cn1 ZINC001589889315 1076077563 /nfs/dbraw/zinc/07/75/63/1076077563.db2.gz QICLGINKKMXNLQ-BGGANLFTSA-N -1 3 380.434 -1.327 20 0 GAADHM C[C@H](C[S@](C)=O)NC(=O)C(=O)NCCNc1ccc(-c2nnn[n-]2)cn1 ZINC001589889315 1076077558 /nfs/dbraw/zinc/07/75/58/1076077558.db2.gz QICLGINKKMXNLQ-BGGANLFTSA-N -1 3 380.434 -1.327 20 0 GAADHM C[C@@H](C[S@](C)=O)NC(=O)C(=O)NCCNc1ccc(-c2nn[n-]n2)cn1 ZINC001589889317 1076077547 /nfs/dbraw/zinc/07/75/47/1076077547.db2.gz QICLGINKKMXNLQ-MGGBDBEPSA-N -1 3 380.434 -1.327 20 0 GAADHM C[C@@H](C[S@](C)=O)NC(=O)C(=O)NCCNc1ccc(-c2nnn[n-]2)cn1 ZINC001589889317 1076077542 /nfs/dbraw/zinc/07/75/42/1076077542.db2.gz QICLGINKKMXNLQ-MGGBDBEPSA-N -1 3 380.434 -1.327 20 0 GAADHM C[C@@H](C[S@@](C)=O)NC(=O)C(=O)NCCNc1ccc(-c2nn[n-]n2)cn1 ZINC001589889319 1076077624 /nfs/dbraw/zinc/07/76/24/1076077624.db2.gz QICLGINKKMXNLQ-UAXLGHPASA-N -1 3 380.434 -1.327 20 0 GAADHM C[C@@H](C[S@@](C)=O)NC(=O)C(=O)NCCNc1ccc(-c2nnn[n-]2)cn1 ZINC001589889319 1076077621 /nfs/dbraw/zinc/07/76/21/1076077621.db2.gz QICLGINKKMXNLQ-UAXLGHPASA-N -1 3 380.434 -1.327 20 0 GAADHM C[C@H](C[S@@](C)=O)NC(=O)C(=O)NCCNc1ccc(-c2nn[n-]n2)cn1 ZINC001589889321 1076077477 /nfs/dbraw/zinc/07/74/77/1076077477.db2.gz QICLGINKKMXNLQ-ZJJDNZPOSA-N -1 3 380.434 -1.327 20 0 GAADHM C[C@H](C[S@@](C)=O)NC(=O)C(=O)NCCNc1ccc(-c2nnn[n-]2)cn1 ZINC001589889321 1076077474 /nfs/dbraw/zinc/07/74/74/1076077474.db2.gz QICLGINKKMXNLQ-ZJJDNZPOSA-N -1 3 380.434 -1.327 20 0 GAADHM C[C@H](C[S@](C)=O)NC(=O)C(=O)NCCNc1ncccc1-c1nn[n-]n1 ZINC001589890177 1076078110 /nfs/dbraw/zinc/07/81/10/1076078110.db2.gz VXTGZJAWIRRYML-BGGANLFTSA-N -1 3 380.434 -1.327 20 0 GAADHM C[C@H](C[S@](C)=O)NC(=O)C(=O)NCCNc1ncccc1-c1nnn[n-]1 ZINC001589890177 1076078105 /nfs/dbraw/zinc/07/81/05/1076078105.db2.gz VXTGZJAWIRRYML-BGGANLFTSA-N -1 3 380.434 -1.327 20 0 GAADHM C[C@@H](C[S@](C)=O)NC(=O)C(=O)NCCNc1ncccc1-c1nn[n-]n1 ZINC001589890178 1076078037 /nfs/dbraw/zinc/07/80/37/1076078037.db2.gz VXTGZJAWIRRYML-MGGBDBEPSA-N -1 3 380.434 -1.327 20 0 GAADHM C[C@@H](C[S@](C)=O)NC(=O)C(=O)NCCNc1ncccc1-c1nnn[n-]1 ZINC001589890178 1076078035 /nfs/dbraw/zinc/07/80/35/1076078035.db2.gz VXTGZJAWIRRYML-MGGBDBEPSA-N -1 3 380.434 -1.327 20 0 GAADHM C[C@@H](C[S@@](C)=O)NC(=O)C(=O)NCCNc1ncccc1-c1nn[n-]n1 ZINC001589890179 1076077998 /nfs/dbraw/zinc/07/79/98/1076077998.db2.gz VXTGZJAWIRRYML-UAXLGHPASA-N -1 3 380.434 -1.327 20 0 GAADHM C[C@@H](C[S@@](C)=O)NC(=O)C(=O)NCCNc1ncccc1-c1nnn[n-]1 ZINC001589890179 1076077993 /nfs/dbraw/zinc/07/79/93/1076077993.db2.gz VXTGZJAWIRRYML-UAXLGHPASA-N -1 3 380.434 -1.327 20 0 GAADHM C[C@H](C[S@@](C)=O)NC(=O)C(=O)NCCNc1ncccc1-c1nn[n-]n1 ZINC001589890180 1076077939 /nfs/dbraw/zinc/07/79/39/1076077939.db2.gz VXTGZJAWIRRYML-ZJJDNZPOSA-N -1 3 380.434 -1.327 20 0 GAADHM C[C@H](C[S@@](C)=O)NC(=O)C(=O)NCCNc1ncccc1-c1nnn[n-]1 ZINC001589890180 1076077935 /nfs/dbraw/zinc/07/79/35/1076077935.db2.gz VXTGZJAWIRRYML-ZJJDNZPOSA-N -1 3 380.434 -1.327 20 0 GAADHM C[C@@H](Cn1cncn1)NC(=O)C(=O)NCCNc1ncccc1-c1nn[n-]n1 ZINC001589904786 1076078011 /nfs/dbraw/zinc/07/80/11/1076078011.db2.gz YRADRSHXHHYEFH-JTQLQIEISA-N -1 3 385.392 -1.414 20 0 GAADHM C[C@@H](Cn1cncn1)NC(=O)C(=O)NCCNc1ncccc1-c1nnn[n-]1 ZINC001589904786 1076078007 /nfs/dbraw/zinc/07/80/07/1076078007.db2.gz YRADRSHXHHYEFH-JTQLQIEISA-N -1 3 385.392 -1.414 20 0 GAADHM C[C@H](Cn1cncn1)NC(=O)C(=O)NCCNc1ncccc1-c1nn[n-]n1 ZINC001589904810 1076078051 /nfs/dbraw/zinc/07/80/51/1076078051.db2.gz YRADRSHXHHYEFH-SNVBAGLBSA-N -1 3 385.392 -1.414 20 0 GAADHM C[C@H](Cn1cncn1)NC(=O)C(=O)NCCNc1ncccc1-c1nnn[n-]1 ZINC001589904810 1076078048 /nfs/dbraw/zinc/07/80/48/1076078048.db2.gz YRADRSHXHHYEFH-SNVBAGLBSA-N -1 3 385.392 -1.414 20 0 GAADHM C[C@@H](NC(=O)C(=O)NCCNS(C)(=O)=O)c1cccc(-c2nn[n-]n2)c1 ZINC001589916296 1076077984 /nfs/dbraw/zinc/07/79/84/1076077984.db2.gz BBAFOSCICLEHKX-SECBINFHSA-N -1 3 381.418 -1.291 20 0 GAADHM C[C@@H](NC(=O)C(=O)NCCNS(C)(=O)=O)c1cccc(-c2nnn[n-]2)c1 ZINC001589916296 1076077978 /nfs/dbraw/zinc/07/79/78/1076077978.db2.gz BBAFOSCICLEHKX-SECBINFHSA-N -1 3 381.418 -1.291 20 0 GAADHM C[C@H](NC(=O)C(=O)NCCNS(C)(=O)=O)c1cccc(-c2nn[n-]n2)c1 ZINC001589916299 1076077922 /nfs/dbraw/zinc/07/79/22/1076077922.db2.gz BBAFOSCICLEHKX-VIFPVBQESA-N -1 3 381.418 -1.291 20 0 GAADHM C[C@H](NC(=O)C(=O)NCCNS(C)(=O)=O)c1cccc(-c2nnn[n-]2)c1 ZINC001589916299 1076077918 /nfs/dbraw/zinc/07/79/18/1076077918.db2.gz BBAFOSCICLEHKX-VIFPVBQESA-N -1 3 381.418 -1.291 20 0 GAADHM C[C@@H](NC(=O)C(=O)NCCNS(C)(=O)=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001589916952 1076078133 /nfs/dbraw/zinc/07/81/33/1076078133.db2.gz FHYLOWSAOFBUBT-SECBINFHSA-N -1 3 381.418 -1.291 20 0 GAADHM C[C@@H](NC(=O)C(=O)NCCNS(C)(=O)=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001589916952 1076078125 /nfs/dbraw/zinc/07/81/25/1076078125.db2.gz FHYLOWSAOFBUBT-SECBINFHSA-N -1 3 381.418 -1.291 20 0 GAADHM C[C@H](NC(=O)C(=O)NCCNS(C)(=O)=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001589916957 1076077969 /nfs/dbraw/zinc/07/79/69/1076077969.db2.gz FHYLOWSAOFBUBT-VIFPVBQESA-N -1 3 381.418 -1.291 20 0 GAADHM C[C@H](NC(=O)C(=O)NCCNS(C)(=O)=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001589916957 1076077963 /nfs/dbraw/zinc/07/79/63/1076077963.db2.gz FHYLOWSAOFBUBT-VIFPVBQESA-N -1 3 381.418 -1.291 20 0 GAADHM C[C@@H](NC(=O)C(=O)NCCNc1ncccc1-c1nn[n-]n1)c1ncn(C)n1 ZINC001589919919 1076078549 /nfs/dbraw/zinc/07/85/49/1076078549.db2.gz VZCGLICSHUVCKG-SECBINFHSA-N -1 3 385.392 -1.204 20 0 GAADHM C[C@@H](NC(=O)C(=O)NCCNc1ncccc1-c1nnn[n-]1)c1ncn(C)n1 ZINC001589919919 1076078541 /nfs/dbraw/zinc/07/85/41/1076078541.db2.gz VZCGLICSHUVCKG-SECBINFHSA-N -1 3 385.392 -1.204 20 0 GAADHM C[C@H](NC(=O)C(=O)NCCNc1ncccc1-c1nn[n-]n1)c1ncn(C)n1 ZINC001589919923 1076078380 /nfs/dbraw/zinc/07/83/80/1076078380.db2.gz VZCGLICSHUVCKG-VIFPVBQESA-N -1 3 385.392 -1.204 20 0 GAADHM C[C@H](NC(=O)C(=O)NCCNc1ncccc1-c1nnn[n-]1)c1ncn(C)n1 ZINC001589919923 1076078376 /nfs/dbraw/zinc/07/83/76/1076078376.db2.gz VZCGLICSHUVCKG-VIFPVBQESA-N -1 3 385.392 -1.204 20 0 GAADHM C[C@@H](NC(=O)CN1C(=O)CCC1=O)[C@H](C)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001589922741 1076078321 /nfs/dbraw/zinc/07/83/21/1076078321.db2.gz BGLQYINMICHARO-BDAKNGLRSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@@H](NC(=O)CN1C(=O)CCC1=O)[C@H](C)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001589922741 1076078315 /nfs/dbraw/zinc/07/83/15/1076078315.db2.gz BGLQYINMICHARO-BDAKNGLRSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@@H](NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)[C@H](C)NC(=O)CN1C(=O)CCC1=O ZINC001589922743 1076078344 /nfs/dbraw/zinc/07/83/44/1076078344.db2.gz BGLQYINMICHARO-DTWKUNHWSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@@H](NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)[C@H](C)NC(=O)CN1C(=O)CCC1=O ZINC001589922743 1076078341 /nfs/dbraw/zinc/07/83/41/1076078341.db2.gz BGLQYINMICHARO-DTWKUNHWSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@H](NC(=O)CN1C(=O)CCC1=O)[C@H](C)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001589922745 1076078388 /nfs/dbraw/zinc/07/83/88/1076078388.db2.gz BGLQYINMICHARO-IUCAKERBSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@H](NC(=O)CN1C(=O)CCC1=O)[C@H](C)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001589922745 1076078385 /nfs/dbraw/zinc/07/83/85/1076078385.db2.gz BGLQYINMICHARO-IUCAKERBSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@@H](NC(=O)CN1C(=O)CCC1=O)[C@@H](C)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001589922747 1076078334 /nfs/dbraw/zinc/07/83/34/1076078334.db2.gz BGLQYINMICHARO-RKDXNWHRSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@@H](NC(=O)CN1C(=O)CCC1=O)[C@@H](C)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001589922747 1076078329 /nfs/dbraw/zinc/07/83/29/1076078329.db2.gz BGLQYINMICHARO-RKDXNWHRSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@@H](NC(=O)CN1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1)C(=O)N(C)C ZINC001589922773 1076078402 /nfs/dbraw/zinc/07/84/02/1076078402.db2.gz CCRHJCXGULZUNF-GFCCVEGCSA-N -1 3 387.448 -1.023 20 0 GAADHM C[C@@H](NC(=O)CN1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1)C(=O)N(C)C ZINC001589922773 1076078399 /nfs/dbraw/zinc/07/83/99/1076078399.db2.gz CCRHJCXGULZUNF-GFCCVEGCSA-N -1 3 387.448 -1.023 20 0 GAADHM C[C@H](NC(=O)CN1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1)C(=O)N(C)C ZINC001589922778 1076078366 /nfs/dbraw/zinc/07/83/66/1076078366.db2.gz CCRHJCXGULZUNF-LBPRGKRZSA-N -1 3 387.448 -1.023 20 0 GAADHM C[C@H](NC(=O)CN1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1)C(=O)N(C)C ZINC001589922778 1076078364 /nfs/dbraw/zinc/07/83/64/1076078364.db2.gz CCRHJCXGULZUNF-LBPRGKRZSA-N -1 3 387.448 -1.023 20 0 GAADHM C[C@@H](NC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N(C)C ZINC001589922808 1076078484 /nfs/dbraw/zinc/07/84/84/1076078484.db2.gz DLZOXYLCJQNYTM-SECBINFHSA-N -1 3 381.418 -1.262 20 0 GAADHM C[C@@H](NC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N(C)C ZINC001589922808 1076078480 /nfs/dbraw/zinc/07/84/80/1076078480.db2.gz DLZOXYLCJQNYTM-SECBINFHSA-N -1 3 381.418 -1.262 20 0 GAADHM C[C@H](NC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N(C)C ZINC001589922810 1076078441 /nfs/dbraw/zinc/07/84/41/1076078441.db2.gz DLZOXYLCJQNYTM-VIFPVBQESA-N -1 3 381.418 -1.262 20 0 GAADHM C[C@H](NC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N(C)C ZINC001589922810 1076078438 /nfs/dbraw/zinc/07/84/38/1076078438.db2.gz DLZOXYLCJQNYTM-VIFPVBQESA-N -1 3 381.418 -1.262 20 0 GAADHM C[C@@H](NC(=O)CN1CCN(c2cnccc2-c2nn[n-]n2)CC1)C(=O)N(C)C ZINC001589922812 1076078978 /nfs/dbraw/zinc/07/89/78/1076078978.db2.gz FIZKRBHYVXYXAG-GFCCVEGCSA-N -1 3 387.448 -1.023 20 0 GAADHM C[C@@H](NC(=O)CN1CCN(c2cnccc2-c2nnn[n-]2)CC1)C(=O)N(C)C ZINC001589922812 1076078974 /nfs/dbraw/zinc/07/89/74/1076078974.db2.gz FIZKRBHYVXYXAG-GFCCVEGCSA-N -1 3 387.448 -1.023 20 0 GAADHM C[C@H](NC(=O)CN1CCN(c2cnccc2-c2nn[n-]n2)CC1)C(=O)N(C)C ZINC001589922814 1076078843 /nfs/dbraw/zinc/07/88/43/1076078843.db2.gz FIZKRBHYVXYXAG-LBPRGKRZSA-N -1 3 387.448 -1.023 20 0 GAADHM C[C@H](NC(=O)CN1CCN(c2cnccc2-c2nnn[n-]2)CC1)C(=O)N(C)C ZINC001589922814 1076078838 /nfs/dbraw/zinc/07/88/38/1076078838.db2.gz FIZKRBHYVXYXAG-LBPRGKRZSA-N -1 3 387.448 -1.023 20 0 GAADHM C[C@@H](NC(=O)CN1CCN(c2ncccc2-c2nn[n-]n2)CC1)C(=O)N(C)C ZINC001589923028 1076078993 /nfs/dbraw/zinc/07/89/93/1076078993.db2.gz KGUZQFHGNHOOSW-GFCCVEGCSA-N -1 3 387.448 -1.023 20 0 GAADHM C[C@@H](NC(=O)CN1CCN(c2ncccc2-c2nnn[n-]2)CC1)C(=O)N(C)C ZINC001589923028 1076078990 /nfs/dbraw/zinc/07/89/90/1076078990.db2.gz KGUZQFHGNHOOSW-GFCCVEGCSA-N -1 3 387.448 -1.023 20 0 GAADHM C[C@H](NC(=O)CN1CCN(c2ncccc2-c2nn[n-]n2)CC1)C(=O)N(C)C ZINC001589923031 1076078707 /nfs/dbraw/zinc/07/87/07/1076078707.db2.gz KGUZQFHGNHOOSW-LBPRGKRZSA-N -1 3 387.448 -1.023 20 0 GAADHM C[C@H](NC(=O)CN1CCN(c2ncccc2-c2nnn[n-]2)CC1)C(=O)N(C)C ZINC001589923031 1076078704 /nfs/dbraw/zinc/07/87/04/1076078704.db2.gz KGUZQFHGNHOOSW-LBPRGKRZSA-N -1 3 387.448 -1.023 20 0 GAADHM C[C@@H](NC(=O)CN1C(=O)CCC1=O)[C@H](C)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589923204 1076078749 /nfs/dbraw/zinc/07/87/49/1076078749.db2.gz PMUDVFYRZOWQHY-BDAKNGLRSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@@H](NC(=O)CN1C(=O)CCC1=O)[C@H](C)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589923204 1076078746 /nfs/dbraw/zinc/07/87/46/1076078746.db2.gz PMUDVFYRZOWQHY-BDAKNGLRSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@@H](NC(=O)[C@@H]1CN(C)C(=O)N1)C1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001589923296 1076078720 /nfs/dbraw/zinc/07/87/20/1076078720.db2.gz CBZMZGJEQYLQJR-PELKAZGASA-N -1 3 387.404 -1.205 20 0 GAADHM C[C@@H](NC(=O)[C@@H]1CN(C)C(=O)N1)C1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001589923296 1076078717 /nfs/dbraw/zinc/07/87/17/1076078717.db2.gz CBZMZGJEQYLQJR-PELKAZGASA-N -1 3 387.404 -1.205 20 0 GAADHM C[C@@H](NC(=O)[C@H]1CN(C)C(=O)N1)C1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001589923297 1076079265 /nfs/dbraw/zinc/07/92/65/1076079265.db2.gz CBZMZGJEQYLQJR-PRHODGIISA-N -1 3 387.404 -1.205 20 0 GAADHM C[C@@H](NC(=O)[C@H]1CN(C)C(=O)N1)C1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001589923297 1076079260 /nfs/dbraw/zinc/07/92/60/1076079260.db2.gz CBZMZGJEQYLQJR-PRHODGIISA-N -1 3 387.404 -1.205 20 0 GAADHM C[C@H](NC(=O)[C@H]1CN(C)C(=O)N1)C1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001589923298 1076079390 /nfs/dbraw/zinc/07/93/90/1076079390.db2.gz CBZMZGJEQYLQJR-QPUJVOFHSA-N -1 3 387.404 -1.205 20 0 GAADHM C[C@H](NC(=O)[C@H]1CN(C)C(=O)N1)C1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001589923298 1076079383 /nfs/dbraw/zinc/07/93/83/1076079383.db2.gz CBZMZGJEQYLQJR-QPUJVOFHSA-N -1 3 387.404 -1.205 20 0 GAADHM C[C@H](NC(=O)[C@@H]1CN(C)C(=O)N1)C1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001589923299 1076079225 /nfs/dbraw/zinc/07/92/25/1076079225.db2.gz CBZMZGJEQYLQJR-UFBFGSQYSA-N -1 3 387.404 -1.205 20 0 GAADHM C[C@H](NC(=O)[C@@H]1CN(C)C(=O)N1)C1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001589923299 1076079222 /nfs/dbraw/zinc/07/92/22/1076079222.db2.gz CBZMZGJEQYLQJR-UFBFGSQYSA-N -1 3 387.404 -1.205 20 0 GAADHM C[C@@H](NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)[C@H](C)NC(=O)CN1C(=O)CCC1=O ZINC001589923306 1076079169 /nfs/dbraw/zinc/07/91/69/1076079169.db2.gz PMUDVFYRZOWQHY-DTWKUNHWSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@@H](NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)[C@H](C)NC(=O)CN1C(=O)CCC1=O ZINC001589923306 1076079166 /nfs/dbraw/zinc/07/91/66/1076079166.db2.gz PMUDVFYRZOWQHY-DTWKUNHWSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@H](NC(=O)CN1C(=O)CCC1=O)[C@H](C)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589923309 1076079372 /nfs/dbraw/zinc/07/93/72/1076079372.db2.gz PMUDVFYRZOWQHY-IUCAKERBSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@H](NC(=O)CN1C(=O)CCC1=O)[C@H](C)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589923309 1076079363 /nfs/dbraw/zinc/07/93/63/1076079363.db2.gz PMUDVFYRZOWQHY-IUCAKERBSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@@H](NC(=O)CN1C(=O)CCC1=O)[C@@H](C)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001589923311 1076079300 /nfs/dbraw/zinc/07/93/00/1076079300.db2.gz PMUDVFYRZOWQHY-RKDXNWHRSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@@H](NC(=O)CN1C(=O)CCC1=O)[C@@H](C)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001589923311 1076079292 /nfs/dbraw/zinc/07/92/92/1076079292.db2.gz PMUDVFYRZOWQHY-RKDXNWHRSA-N -1 3 388.388 -1.033 20 0 GAADHM C[C@@H](NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCCF ZINC001589923563 1076079247 /nfs/dbraw/zinc/07/92/47/1076079247.db2.gz VPUQKDGTBROTMP-SECBINFHSA-N -1 3 399.408 -1.265 20 0 GAADHM C[C@@H](NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCCF ZINC001589923563 1076079239 /nfs/dbraw/zinc/07/92/39/1076079239.db2.gz VPUQKDGTBROTMP-SECBINFHSA-N -1 3 399.408 -1.265 20 0 GAADHM C[C@H](NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NCCF ZINC001589923566 1076079407 /nfs/dbraw/zinc/07/94/07/1076079407.db2.gz VPUQKDGTBROTMP-VIFPVBQESA-N -1 3 399.408 -1.265 20 0 GAADHM C[C@H](NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NCCF ZINC001589923566 1076079400 /nfs/dbraw/zinc/07/94/00/1076079400.db2.gz VPUQKDGTBROTMP-VIFPVBQESA-N -1 3 399.408 -1.265 20 0 GAADHM C[C@@H](NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)C1CN(C(=O)CS(C)(=O)=O)C1 ZINC001589940667 1076079680 /nfs/dbraw/zinc/07/96/80/1076079680.db2.gz GFZRNRGQXLXOMF-MRVPVSSYSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@@H](NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)C1CN(C(=O)CS(C)(=O)=O)C1 ZINC001589940667 1076079674 /nfs/dbraw/zinc/07/96/74/1076079674.db2.gz GFZRNRGQXLXOMF-MRVPVSSYSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@H](NC(=O)c1cc(-c2nn[n-]n2)c[nH]1)C1CN(C(=O)CS(C)(=O)=O)C1 ZINC001589940670 1076079717 /nfs/dbraw/zinc/07/97/17/1076079717.db2.gz GFZRNRGQXLXOMF-QMMMGPOBSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@H](NC(=O)c1cc(-c2nnn[n-]2)c[nH]1)C1CN(C(=O)CS(C)(=O)=O)C1 ZINC001589940670 1076079715 /nfs/dbraw/zinc/07/97/15/1076079715.db2.gz GFZRNRGQXLXOMF-QMMMGPOBSA-N -1 3 381.418 -1.184 20 0 GAADHM C[C@@H](NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)C1CN(C(=O)CCn2cnnn2)C1 ZINC001589940694 1076079810 /nfs/dbraw/zinc/07/98/10/1076079810.db2.gz DCHATIJDULUHLX-SECBINFHSA-N -1 3 385.392 -1.152 20 0 GAADHM C[C@@H](NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)C1CN(C(=O)CCn2cnnn2)C1 ZINC001589940694 1076079808 /nfs/dbraw/zinc/07/98/08/1076079808.db2.gz DCHATIJDULUHLX-SECBINFHSA-N -1 3 385.392 -1.152 20 0 GAADHM C[C@H](NC(=O)c1c[nH]c(-c2nn[n-]n2)c1)C1CN(C(=O)CCn2cnnn2)C1 ZINC001589940711 1076079778 /nfs/dbraw/zinc/07/97/78/1076079778.db2.gz DCHATIJDULUHLX-VIFPVBQESA-N -1 3 385.392 -1.152 20 0 GAADHM C[C@H](NC(=O)c1c[nH]c(-c2nnn[n-]2)c1)C1CN(C(=O)CCn2cnnn2)C1 ZINC001589940711 1076079771 /nfs/dbraw/zinc/07/97/71/1076079771.db2.gz DCHATIJDULUHLX-VIFPVBQESA-N -1 3 385.392 -1.152 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CC(CO)(CO)C1 ZINC001589972988 1076080001 /nfs/dbraw/zinc/08/00/01/1076080001.db2.gz CXZOIGZFXHKUCH-JTQLQIEISA-N -1 3 396.429 -1.653 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CC(CO)(CO)C1 ZINC001589972988 1076079993 /nfs/dbraw/zinc/07/99/93/1076079993.db2.gz CXZOIGZFXHKUCH-JTQLQIEISA-N -1 3 396.429 -1.653 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CC(CO)(CO)C1 ZINC001589972990 1076080235 /nfs/dbraw/zinc/08/02/35/1076080235.db2.gz CXZOIGZFXHKUCH-SNVBAGLBSA-N -1 3 396.429 -1.653 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CC(CO)(CO)C1 ZINC001589972990 1076080227 /nfs/dbraw/zinc/08/02/27/1076080227.db2.gz CXZOIGZFXHKUCH-SNVBAGLBSA-N -1 3 396.429 -1.653 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CC(C(N)=O)C1 ZINC001589973293 1076080128 /nfs/dbraw/zinc/08/01/28/1076080128.db2.gz DQAROKLGTRBQRU-MRVPVSSYSA-N -1 3 379.402 -1.523 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CC(C(N)=O)C1 ZINC001589973293 1076080122 /nfs/dbraw/zinc/08/01/22/1076080122.db2.gz DQAROKLGTRBQRU-MRVPVSSYSA-N -1 3 379.402 -1.523 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CC(C(N)=O)C1 ZINC001589973295 1076080022 /nfs/dbraw/zinc/08/00/22/1076080022.db2.gz DQAROKLGTRBQRU-QMMMGPOBSA-N -1 3 379.402 -1.523 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CC(C(N)=O)C1 ZINC001589973295 1076080015 /nfs/dbraw/zinc/08/00/15/1076080015.db2.gz DQAROKLGTRBQRU-QMMMGPOBSA-N -1 3 379.402 -1.523 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@]1(CO)CCOC1 ZINC001589973727 1076080098 /nfs/dbraw/zinc/08/00/98/1076080098.db2.gz JQYZLIHJCYBYSF-BMIGLBTASA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@]1(CO)CCOC1 ZINC001589973727 1076080091 /nfs/dbraw/zinc/08/00/91/1076080091.db2.gz JQYZLIHJCYBYSF-BMIGLBTASA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@]1(CO)CCOC1 ZINC001589973728 1076080172 /nfs/dbraw/zinc/08/01/72/1076080172.db2.gz JQYZLIHJCYBYSF-BONVTDFDSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@]1(CO)CCOC1 ZINC001589973728 1076080167 /nfs/dbraw/zinc/08/01/67/1076080167.db2.gz JQYZLIHJCYBYSF-BONVTDFDSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@]1(CO)CCOC1 ZINC001589973729 1076080259 /nfs/dbraw/zinc/08/02/59/1076080259.db2.gz JQYZLIHJCYBYSF-MEBBXXQBSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@]1(CO)CCOC1 ZINC001589973729 1076080250 /nfs/dbraw/zinc/08/02/50/1076080250.db2.gz JQYZLIHJCYBYSF-MEBBXXQBSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@]1(CO)CCOC1 ZINC001589973730 1076080079 /nfs/dbraw/zinc/08/00/79/1076080079.db2.gz JQYZLIHJCYBYSF-ZUZCIYMTSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@]1(CO)CCOC1 ZINC001589973730 1076080071 /nfs/dbraw/zinc/08/00/71/1076080071.db2.gz JQYZLIHJCYBYSF-ZUZCIYMTSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N(C)C[C@H](O)CO ZINC001589974817 1076080048 /nfs/dbraw/zinc/08/00/48/1076080048.db2.gz RVCQKHAOVDUCTI-KOLCDFICSA-N -1 3 384.418 -1.655 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N(C)C[C@H](O)CO ZINC001589974817 1076080044 /nfs/dbraw/zinc/08/00/44/1076080044.db2.gz RVCQKHAOVDUCTI-KOLCDFICSA-N -1 3 384.418 -1.655 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N(C)C[C@H](O)CO ZINC001589974819 1076080060 /nfs/dbraw/zinc/08/00/60/1076080060.db2.gz RVCQKHAOVDUCTI-ONGXEEELSA-N -1 3 384.418 -1.655 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N(C)C[C@H](O)CO ZINC001589974819 1076080055 /nfs/dbraw/zinc/08/00/55/1076080055.db2.gz RVCQKHAOVDUCTI-ONGXEEELSA-N -1 3 384.418 -1.655 20 0 GAADHM C[C@H](NS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001589975017 1076080215 /nfs/dbraw/zinc/08/02/15/1076080215.db2.gz AUOJYLPPSJEKDD-AXTRIDKLSA-N -1 3 396.433 -2.135 20 0 GAADHM C[C@H](NS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001589975017 1076080210 /nfs/dbraw/zinc/08/02/10/1076080210.db2.gz AUOJYLPPSJEKDD-AXTRIDKLSA-N -1 3 396.433 -2.135 20 0 GAADHM C[C@@H](NS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001589975018 1076080184 /nfs/dbraw/zinc/08/01/84/1076080184.db2.gz AUOJYLPPSJEKDD-FXAINCCUSA-N -1 3 396.433 -2.135 20 0 GAADHM C[C@@H](NS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001589975018 1076080182 /nfs/dbraw/zinc/08/01/82/1076080182.db2.gz AUOJYLPPSJEKDD-FXAINCCUSA-N -1 3 396.433 -2.135 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CCOCCN1 ZINC001589975310 1076080448 /nfs/dbraw/zinc/08/04/48/1076080448.db2.gz AQNLDVVQPNYNAW-JTQLQIEISA-N -1 3 381.418 -1.103 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CCOCCN1 ZINC001589975310 1076080444 /nfs/dbraw/zinc/08/04/44/1076080444.db2.gz AQNLDVVQPNYNAW-JTQLQIEISA-N -1 3 381.418 -1.103 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CCOCCN1 ZINC001589975327 1076080586 /nfs/dbraw/zinc/08/05/86/1076080586.db2.gz AQNLDVVQPNYNAW-SNVBAGLBSA-N -1 3 381.418 -1.103 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CCOCCN1 ZINC001589975327 1076080580 /nfs/dbraw/zinc/08/05/80/1076080580.db2.gz AQNLDVVQPNYNAW-SNVBAGLBSA-N -1 3 381.418 -1.103 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CC(C)(C(N)=O)C1 ZINC001589975486 1076080463 /nfs/dbraw/zinc/08/04/63/1076080463.db2.gz BUOKKKKPAWZZCA-SECBINFHSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CC(C)(C(N)=O)C1 ZINC001589975486 1076080458 /nfs/dbraw/zinc/08/04/58/1076080458.db2.gz BUOKKKKPAWZZCA-SECBINFHSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CC(C)(C(N)=O)C1 ZINC001589975488 1076080691 /nfs/dbraw/zinc/08/06/91/1076080691.db2.gz BUOKKKKPAWZZCA-VIFPVBQESA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CC(C)(C(N)=O)C1 ZINC001589975488 1076080688 /nfs/dbraw/zinc/08/06/88/1076080688.db2.gz BUOKKKKPAWZZCA-VIFPVBQESA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1C[C@@H](O)[C@@H](O)C1 ZINC001589975719 1076080739 /nfs/dbraw/zinc/08/07/39/1076080739.db2.gz KDFOBGIOSDXVKI-DXLKZPDWSA-N -1 3 396.429 -1.466 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1C[C@@H](O)[C@@H](O)C1 ZINC001589975719 1076080735 /nfs/dbraw/zinc/08/07/35/1076080735.db2.gz KDFOBGIOSDXVKI-DXLKZPDWSA-N -1 3 396.429 -1.466 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1C[C@@H](O)[C@@H](O)C1 ZINC001589975722 1076080429 /nfs/dbraw/zinc/08/04/29/1076080429.db2.gz KDFOBGIOSDXVKI-HMHPOGMRSA-N -1 3 396.429 -1.466 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1C[C@@H](O)[C@@H](O)C1 ZINC001589975722 1076080423 /nfs/dbraw/zinc/08/04/23/1076080423.db2.gz KDFOBGIOSDXVKI-HMHPOGMRSA-N -1 3 396.429 -1.466 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1C[C@@H](O)[C@@H](O)C1 ZINC001589975725 1076080511 /nfs/dbraw/zinc/08/05/11/1076080511.db2.gz KDFOBGIOSDXVKI-SKZLGDCLSA-N -1 3 396.429 -1.466 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1C[C@@H](O)[C@@H](O)C1 ZINC001589975725 1076080506 /nfs/dbraw/zinc/08/05/06/1076080506.db2.gz KDFOBGIOSDXVKI-SKZLGDCLSA-N -1 3 396.429 -1.466 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1C[C@@H](O)[C@@H](O)C1 ZINC001589975727 1076080621 /nfs/dbraw/zinc/08/06/21/1076080621.db2.gz KDFOBGIOSDXVKI-ZDAZMGEQSA-N -1 3 396.429 -1.466 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1C[C@@H](O)[C@@H](O)C1 ZINC001589975727 1076080617 /nfs/dbraw/zinc/08/06/17/1076080617.db2.gz KDFOBGIOSDXVKI-ZDAZMGEQSA-N -1 3 396.429 -1.466 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCOCCN1 ZINC001589975829 1076080569 /nfs/dbraw/zinc/08/05/69/1076080569.db2.gz ZADBRQKJFLWCNT-JTQLQIEISA-N -1 3 381.418 -1.103 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CCOCCN1 ZINC001589975829 1076080563 /nfs/dbraw/zinc/08/05/63/1076080563.db2.gz ZADBRQKJFLWCNT-JTQLQIEISA-N -1 3 381.418 -1.103 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCOCCN1 ZINC001589975832 1076080492 /nfs/dbraw/zinc/08/04/92/1076080492.db2.gz ZADBRQKJFLWCNT-SNVBAGLBSA-N -1 3 381.418 -1.103 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CCOCCN1 ZINC001589975832 1076080486 /nfs/dbraw/zinc/08/04/86/1076080486.db2.gz ZADBRQKJFLWCNT-SNVBAGLBSA-N -1 3 381.418 -1.103 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@H]1CCNC1=O ZINC001589976029 1076080602 /nfs/dbraw/zinc/08/06/02/1076080602.db2.gz FKSYDMCAVNUTPY-KCJUWKMLSA-N -1 3 379.402 -1.462 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@H]1CCNC1=O ZINC001589976029 1076080597 /nfs/dbraw/zinc/08/05/97/1076080597.db2.gz FKSYDMCAVNUTPY-KCJUWKMLSA-N -1 3 379.402 -1.462 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@H]1CCNC1=O ZINC001589976030 1076080710 /nfs/dbraw/zinc/08/07/10/1076080710.db2.gz FKSYDMCAVNUTPY-KWQFWETISA-N -1 3 379.402 -1.462 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@H]1CCNC1=O ZINC001589976030 1076080708 /nfs/dbraw/zinc/08/07/08/1076080708.db2.gz FKSYDMCAVNUTPY-KWQFWETISA-N -1 3 379.402 -1.462 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)OCc1nnn(C)n1 ZINC001589976037 1076080410 /nfs/dbraw/zinc/08/04/10/1076080410.db2.gz FQNASVZANGFTIF-MRVPVSSYSA-N -1 3 393.389 -1.200 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)OCc1nnn(C)n1 ZINC001589976037 1076080405 /nfs/dbraw/zinc/08/04/05/1076080405.db2.gz FQNASVZANGFTIF-MRVPVSSYSA-N -1 3 393.389 -1.200 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)OCc1nnn(C)n1 ZINC001589976038 1076080553 /nfs/dbraw/zinc/08/05/53/1076080553.db2.gz FQNASVZANGFTIF-QMMMGPOBSA-N -1 3 393.389 -1.200 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)OCc1nnn(C)n1 ZINC001589976038 1076080546 /nfs/dbraw/zinc/08/05/46/1076080546.db2.gz FQNASVZANGFTIF-QMMMGPOBSA-N -1 3 393.389 -1.200 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N(C)[C@@H]1COC[C@H]1O ZINC001589976084 1076080531 /nfs/dbraw/zinc/08/05/31/1076080531.db2.gz HKKYFKDLGXIOCN-OASPWFOLSA-N -1 3 396.429 -1.248 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N(C)[C@@H]1COC[C@H]1O ZINC001589976084 1076080526 /nfs/dbraw/zinc/08/05/26/1076080526.db2.gz HKKYFKDLGXIOCN-OASPWFOLSA-N -1 3 396.429 -1.248 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N(C)[C@@H]1COC[C@H]1O ZINC001589976085 1076080678 /nfs/dbraw/zinc/08/06/78/1076080678.db2.gz HKKYFKDLGXIOCN-ZWKOPEQDSA-N -1 3 396.429 -1.248 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N(C)[C@@H]1COC[C@H]1O ZINC001589976085 1076080672 /nfs/dbraw/zinc/08/06/72/1076080672.db2.gz HKKYFKDLGXIOCN-ZWKOPEQDSA-N -1 3 396.429 -1.248 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1C[C@H](O)[C@H](CO)C1 ZINC001589976092 1076081144 /nfs/dbraw/zinc/08/11/44/1076081144.db2.gz HXFCYKQGEDAOKG-GAFUQQFSSA-N -1 3 396.429 -1.655 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1C[C@H](O)[C@H](CO)C1 ZINC001589976092 1076081139 /nfs/dbraw/zinc/08/11/39/1076081139.db2.gz HXFCYKQGEDAOKG-GAFUQQFSSA-N -1 3 396.429 -1.655 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1C[C@H](O)[C@@H](CO)C1 ZINC001589976093 1076080843 /nfs/dbraw/zinc/08/08/43/1076080843.db2.gz HXFCYKQGEDAOKG-NDMJEZRESA-N -1 3 396.429 -1.655 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1C[C@H](O)[C@@H](CO)C1 ZINC001589976093 1076080837 /nfs/dbraw/zinc/08/08/37/1076080837.db2.gz HXFCYKQGEDAOKG-NDMJEZRESA-N -1 3 396.429 -1.655 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1C[C@H](CO)[C@H](O)C1 ZINC001589976094 1076081074 /nfs/dbraw/zinc/08/10/74/1076081074.db2.gz HXFCYKQGEDAOKG-UFGOTCBOSA-N -1 3 396.429 -1.655 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1C[C@H](CO)[C@H](O)C1 ZINC001589976094 1076081070 /nfs/dbraw/zinc/08/10/70/1076081070.db2.gz HXFCYKQGEDAOKG-UFGOTCBOSA-N -1 3 396.429 -1.655 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1C[C@@H](O)[C@H](CO)C1 ZINC001589976095 1076081181 /nfs/dbraw/zinc/08/11/81/1076081181.db2.gz HXFCYKQGEDAOKG-XHVZSJERSA-N -1 3 396.429 -1.655 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1C[C@@H](O)[C@H](CO)C1 ZINC001589976095 1076081177 /nfs/dbraw/zinc/08/11/77/1076081177.db2.gz HXFCYKQGEDAOKG-XHVZSJERSA-N -1 3 396.429 -1.655 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@@H]1C[C@@H](O)[C@@H](O)C1 ZINC001589976104 1076081112 /nfs/dbraw/zinc/08/11/12/1076081112.db2.gz IRIYWKQVHKBHSQ-DXLKZPDWSA-N -1 3 396.429 -1.466 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@@H]1C[C@@H](O)[C@@H](O)C1 ZINC001589976104 1076081104 /nfs/dbraw/zinc/08/11/04/1076081104.db2.gz IRIYWKQVHKBHSQ-DXLKZPDWSA-N -1 3 396.429 -1.466 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@H]1C[C@@H](O)[C@@H](O)C1 ZINC001589976105 1076081125 /nfs/dbraw/zinc/08/11/25/1076081125.db2.gz IRIYWKQVHKBHSQ-HMHPOGMRSA-N -1 3 396.429 -1.466 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@H]1C[C@@H](O)[C@@H](O)C1 ZINC001589976105 1076081120 /nfs/dbraw/zinc/08/11/20/1076081120.db2.gz IRIYWKQVHKBHSQ-HMHPOGMRSA-N -1 3 396.429 -1.466 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@@H]1C[C@@H](O)[C@@H](O)C1 ZINC001589976106 1076081169 /nfs/dbraw/zinc/08/11/69/1076081169.db2.gz IRIYWKQVHKBHSQ-SKZLGDCLSA-N -1 3 396.429 -1.466 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@@H]1C[C@@H](O)[C@@H](O)C1 ZINC001589976106 1076081165 /nfs/dbraw/zinc/08/11/65/1076081165.db2.gz IRIYWKQVHKBHSQ-SKZLGDCLSA-N -1 3 396.429 -1.466 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@H]1C[C@@H](O)[C@@H](O)C1 ZINC001589976107 1076081092 /nfs/dbraw/zinc/08/10/92/1076081092.db2.gz IRIYWKQVHKBHSQ-ZDAZMGEQSA-N -1 3 396.429 -1.466 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@H]1C[C@@H](O)[C@@H](O)C1 ZINC001589976107 1076081085 /nfs/dbraw/zinc/08/10/85/1076081085.db2.gz IRIYWKQVHKBHSQ-ZDAZMGEQSA-N -1 3 396.429 -1.466 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1CNC(=O)C1 ZINC001589976227 1076080863 /nfs/dbraw/zinc/08/08/63/1076080863.db2.gz OCSZWWMIDWEVRU-PSASIEDQSA-N -1 3 379.402 -1.462 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1CNC(=O)C1 ZINC001589976227 1076080856 /nfs/dbraw/zinc/08/08/56/1076080856.db2.gz OCSZWWMIDWEVRU-PSASIEDQSA-N -1 3 379.402 -1.462 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CNC(=O)C1 ZINC001589976228 1076081057 /nfs/dbraw/zinc/08/10/57/1076081057.db2.gz OCSZWWMIDWEVRU-SCZZXKLOSA-N -1 3 379.402 -1.462 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CNC(=O)C1 ZINC001589976228 1076081050 /nfs/dbraw/zinc/08/10/50/1076081050.db2.gz OCSZWWMIDWEVRU-SCZZXKLOSA-N -1 3 379.402 -1.462 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@H]1CNC(=O)C1 ZINC001589976229 1076081036 /nfs/dbraw/zinc/08/10/36/1076081036.db2.gz OCSZWWMIDWEVRU-WCBMZHEXSA-N -1 3 379.402 -1.462 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@H]1CNC(=O)C1 ZINC001589976229 1076081027 /nfs/dbraw/zinc/08/10/27/1076081027.db2.gz OCSZWWMIDWEVRU-WCBMZHEXSA-N -1 3 379.402 -1.462 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H]1CNC(=O)C1 ZINC001589976230 1076080925 /nfs/dbraw/zinc/08/09/25/1076080925.db2.gz OCSZWWMIDWEVRU-WPRPVWTQSA-N -1 3 379.402 -1.462 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H]1CNC(=O)C1 ZINC001589976230 1076080919 /nfs/dbraw/zinc/08/09/19/1076080919.db2.gz OCSZWWMIDWEVRU-WPRPVWTQSA-N -1 3 379.402 -1.462 20 0 GAADHM C[C@@H](NS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1O ZINC001589976365 1076080903 /nfs/dbraw/zinc/08/09/03/1076080903.db2.gz JQDYKAIADKBIDS-FBIMIBRVSA-N -1 3 396.433 -2.135 20 0 GAADHM C[C@@H](NS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@H]1O ZINC001589976365 1076080896 /nfs/dbraw/zinc/08/08/96/1076080896.db2.gz JQDYKAIADKBIDS-FBIMIBRVSA-N -1 3 396.433 -2.135 20 0 GAADHM C[C@H](NS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1O ZINC001589976368 1076080971 /nfs/dbraw/zinc/08/09/71/1076080971.db2.gz JQDYKAIADKBIDS-JMJZKYOTSA-N -1 3 396.433 -2.135 20 0 GAADHM C[C@H](NS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@H]1O ZINC001589976368 1076080965 /nfs/dbraw/zinc/08/09/65/1076080965.db2.gz JQDYKAIADKBIDS-JMJZKYOTSA-N -1 3 396.433 -2.135 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)OCc1nnn(C)n1 ZINC001589976631 1076080954 /nfs/dbraw/zinc/08/09/54/1076080954.db2.gz UBIHFZXGHRETSU-MRVPVSSYSA-N -1 3 393.389 -1.200 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)OCc1nnn(C)n1 ZINC001589976631 1076080948 /nfs/dbraw/zinc/08/09/48/1076080948.db2.gz UBIHFZXGHRETSU-MRVPVSSYSA-N -1 3 393.389 -1.200 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)OCc1nnn(C)n1 ZINC001589976633 1076080884 /nfs/dbraw/zinc/08/08/84/1076080884.db2.gz UBIHFZXGHRETSU-QMMMGPOBSA-N -1 3 393.389 -1.200 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)OCc1nnn(C)n1 ZINC001589976633 1076080876 /nfs/dbraw/zinc/08/08/76/1076080876.db2.gz UBIHFZXGHRETSU-QMMMGPOBSA-N -1 3 393.389 -1.200 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCCn1cnnc1 ZINC001589976645 1076081362 /nfs/dbraw/zinc/08/13/62/1076081362.db2.gz UCLHDHNJTRKMRJ-JTQLQIEISA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCCn1cnnc1 ZINC001589976645 1076081358 /nfs/dbraw/zinc/08/13/58/1076081358.db2.gz UCLHDHNJTRKMRJ-JTQLQIEISA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NCCn1cnnc1 ZINC001589976650 1076081349 /nfs/dbraw/zinc/08/13/49/1076081349.db2.gz UCLHDHNJTRKMRJ-SNVBAGLBSA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NCCn1cnnc1 ZINC001589976650 1076081345 /nfs/dbraw/zinc/08/13/45/1076081345.db2.gz UCLHDHNJTRKMRJ-SNVBAGLBSA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@@H]1CN(C)NC1=O ZINC001589976872 1076081601 /nfs/dbraw/zinc/08/16/01/1076081601.db2.gz MLDQVJOVURPPTO-GZMMTYOYSA-N -1 3 394.417 -2.005 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@@H]1CN(C)NC1=O ZINC001589976872 1076081595 /nfs/dbraw/zinc/08/15/95/1076081595.db2.gz MLDQVJOVURPPTO-GZMMTYOYSA-N -1 3 394.417 -2.005 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@H]1CN(C)NC1=O ZINC001589976885 1076081461 /nfs/dbraw/zinc/08/14/61/1076081461.db2.gz MLDQVJOVURPPTO-KCJUWKMLSA-N -1 3 394.417 -2.005 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@H]1CN(C)NC1=O ZINC001589976885 1076081452 /nfs/dbraw/zinc/08/14/52/1076081452.db2.gz MLDQVJOVURPPTO-KCJUWKMLSA-N -1 3 394.417 -2.005 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@H]1CN(C)NC1=O ZINC001589976887 1076081483 /nfs/dbraw/zinc/08/14/83/1076081483.db2.gz MLDQVJOVURPPTO-KWQFWETISA-N -1 3 394.417 -2.005 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@H]1CN(C)NC1=O ZINC001589976887 1076081477 /nfs/dbraw/zinc/08/14/77/1076081477.db2.gz MLDQVJOVURPPTO-KWQFWETISA-N -1 3 394.417 -2.005 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@@H]1CN(C)NC1=O ZINC001589976889 1076081324 /nfs/dbraw/zinc/08/13/24/1076081324.db2.gz MLDQVJOVURPPTO-LDYMZIIASA-N -1 3 394.417 -2.005 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@@H]1CN(C)NC1=O ZINC001589976889 1076081322 /nfs/dbraw/zinc/08/13/22/1076081322.db2.gz MLDQVJOVURPPTO-LDYMZIIASA-N -1 3 394.417 -2.005 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NC[C@@H]1CCC(=O)N1 ZINC001589977016 1076081336 /nfs/dbraw/zinc/08/13/36/1076081336.db2.gz XQVNRDCTLUXRTC-KOLCDFICSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NC[C@@H]1CCC(=O)N1 ZINC001589977016 1076081332 /nfs/dbraw/zinc/08/13/32/1076081332.db2.gz XQVNRDCTLUXRTC-KOLCDFICSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NC[C@@H]1CCC(=O)N1 ZINC001589977020 1076081567 /nfs/dbraw/zinc/08/15/67/1076081567.db2.gz XQVNRDCTLUXRTC-ONGXEEELSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NC[C@@H]1CCC(=O)N1 ZINC001589977020 1076081562 /nfs/dbraw/zinc/08/15/62/1076081562.db2.gz XQVNRDCTLUXRTC-ONGXEEELSA-N -1 3 393.429 -1.072 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CC(O)(CO)C1 ZINC001589977643 1076081375 /nfs/dbraw/zinc/08/13/75/1076081375.db2.gz VNAFOLMFGBTVSE-SECBINFHSA-N -1 3 382.402 -1.901 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CC(O)(CO)C1 ZINC001589977643 1076081371 /nfs/dbraw/zinc/08/13/71/1076081371.db2.gz VNAFOLMFGBTVSE-SECBINFHSA-N -1 3 382.402 -1.901 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CC(O)(CO)C1 ZINC001589977644 1076081396 /nfs/dbraw/zinc/08/13/96/1076081396.db2.gz VNAFOLMFGBTVSE-VIFPVBQESA-N -1 3 382.402 -1.901 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CC(O)(CO)C1 ZINC001589977644 1076081383 /nfs/dbraw/zinc/08/13/83/1076081383.db2.gz VNAFOLMFGBTVSE-VIFPVBQESA-N -1 3 382.402 -1.901 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC[C@@](C)(O)CO ZINC001589977657 1076081583 /nfs/dbraw/zinc/08/15/83/1076081583.db2.gz VTFCCSWUEQLYHJ-LKFCYVNXSA-N -1 3 384.418 -1.607 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NC[C@@](C)(O)CO ZINC001589977657 1076081580 /nfs/dbraw/zinc/08/15/80/1076081580.db2.gz VTFCCSWUEQLYHJ-LKFCYVNXSA-N -1 3 384.418 -1.607 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC[C@](C)(O)CO ZINC001589977658 1076081527 /nfs/dbraw/zinc/08/15/27/1076081527.db2.gz VTFCCSWUEQLYHJ-OTYXRUKQSA-N -1 3 384.418 -1.607 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NC[C@](C)(O)CO ZINC001589977658 1076081520 /nfs/dbraw/zinc/08/15/20/1076081520.db2.gz VTFCCSWUEQLYHJ-OTYXRUKQSA-N -1 3 384.418 -1.607 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC[C@](C)(O)CO ZINC001589977659 1076081506 /nfs/dbraw/zinc/08/15/06/1076081506.db2.gz VTFCCSWUEQLYHJ-XPTSAGLGSA-N -1 3 384.418 -1.607 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NC[C@](C)(O)CO ZINC001589977659 1076081499 /nfs/dbraw/zinc/08/14/99/1076081499.db2.gz VTFCCSWUEQLYHJ-XPTSAGLGSA-N -1 3 384.418 -1.607 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC[C@@](C)(O)CO ZINC001589977660 1076081438 /nfs/dbraw/zinc/08/14/38/1076081438.db2.gz VTFCCSWUEQLYHJ-YMTOWFKASA-N -1 3 384.418 -1.607 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NC[C@@](C)(O)CO ZINC001589977660 1076081430 /nfs/dbraw/zinc/08/14/30/1076081430.db2.gz VTFCCSWUEQLYHJ-YMTOWFKASA-N -1 3 384.418 -1.607 20 0 GAADHM C[C@@H](O)C(=O)N1CCN(c2cccc(S(N)(=O)=O)c2-c2nnn[n-]2)CC1 ZINC001589992977 1076082117 /nfs/dbraw/zinc/08/21/17/1076082117.db2.gz HJJRBDLAMVSMNL-SECBINFHSA-N -1 3 381.418 -1.457 20 0 GAADHM C[C@H](O)C(=O)N1CCN(c2cccc(S(N)(=O)=O)c2-c2nnn[n-]2)CC1 ZINC001589992978 1076082447 /nfs/dbraw/zinc/08/24/47/1076082447.db2.gz HJJRBDLAMVSMNL-VIFPVBQESA-N -1 3 381.418 -1.457 20 0 GAADHM C[C@@H](O)C(=O)N1CCN(CCS(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001589993095 1076082393 /nfs/dbraw/zinc/08/23/93/1076082393.db2.gz KXVZYERIOSKGGD-LLVKDONJSA-N -1 3 395.445 -1.440 20 0 GAADHM C[C@@H](O)C(=O)N1CCN(CCS(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001589993095 1076082389 /nfs/dbraw/zinc/08/23/89/1076082389.db2.gz KXVZYERIOSKGGD-LLVKDONJSA-N -1 3 395.445 -1.440 20 0 GAADHM C[C@H](O)C(=O)N1CCN(CCS(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001589993096 1076082259 /nfs/dbraw/zinc/08/22/59/1076082259.db2.gz KXVZYERIOSKGGD-NSHDSACASA-N -1 3 395.445 -1.440 20 0 GAADHM C[C@H](O)C(=O)N1CCN(CCS(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001589993096 1076082254 /nfs/dbraw/zinc/08/22/54/1076082254.db2.gz KXVZYERIOSKGGD-NSHDSACASA-N -1 3 395.445 -1.440 20 0 GAADHM C[C@@H](O)C(=O)N1CCN(C(=O)C(=O)Nc2ccc(-c3nn[n-]n3)c(F)c2)CC1 ZINC001589993477 1076082218 /nfs/dbraw/zinc/08/22/18/1076082218.db2.gz XOPIVNAQJNYTFZ-SECBINFHSA-N -1 3 391.363 -1.004 20 0 GAADHM C[C@@H](O)C(=O)N1CCN(C(=O)C(=O)Nc2ccc(-c3nnn[n-]3)c(F)c2)CC1 ZINC001589993477 1076082212 /nfs/dbraw/zinc/08/22/12/1076082212.db2.gz XOPIVNAQJNYTFZ-SECBINFHSA-N -1 3 391.363 -1.004 20 0 GAADHM C[C@H](O)C(=O)N1CCN(C(=O)C(=O)Nc2ccc(-c3nn[n-]n3)c(F)c2)CC1 ZINC001589993478 1076082319 /nfs/dbraw/zinc/08/23/19/1076082319.db2.gz XOPIVNAQJNYTFZ-VIFPVBQESA-N -1 3 391.363 -1.004 20 0 GAADHM C[C@H](O)C(=O)N1CCN(C(=O)C(=O)Nc2ccc(-c3nnn[n-]3)c(F)c2)CC1 ZINC001589993478 1076082313 /nfs/dbraw/zinc/08/23/13/1076082313.db2.gz XOPIVNAQJNYTFZ-VIFPVBQESA-N -1 3 391.363 -1.004 20 0 GAADHM C[C@@H](O)CN(C(=O)C(=O)NCCNc1ncccc1-c1nn[n-]n1)[C@H](C)CO ZINC001589997485 1076082301 /nfs/dbraw/zinc/08/23/01/1076082301.db2.gz BVTCCCAQIBQFCU-GHMZBOCLSA-N -1 3 392.420 -1.620 20 0 GAADHM C[C@@H](O)CN(C(=O)C(=O)NCCNc1ncccc1-c1nnn[n-]1)[C@H](C)CO ZINC001589997485 1076082296 /nfs/dbraw/zinc/08/22/96/1076082296.db2.gz BVTCCCAQIBQFCU-GHMZBOCLSA-N -1 3 392.420 -1.620 20 0 GAADHM C[C@H](CO)N(C[C@H](C)O)C(=O)C(=O)NCCNc1ncccc1-c1nn[n-]n1 ZINC001589997486 1076082411 /nfs/dbraw/zinc/08/24/11/1076082411.db2.gz BVTCCCAQIBQFCU-MNOVXSKESA-N -1 3 392.420 -1.620 20 0 GAADHM C[C@H](CO)N(C[C@H](C)O)C(=O)C(=O)NCCNc1ncccc1-c1nnn[n-]1 ZINC001589997486 1076082403 /nfs/dbraw/zinc/08/24/03/1076082403.db2.gz BVTCCCAQIBQFCU-MNOVXSKESA-N -1 3 392.420 -1.620 20 0 GAADHM C[C@H](O)CN(C(=O)C(=O)NCCNc1ncccc1-c1nn[n-]n1)[C@@H](C)CO ZINC001589997488 1076082237 /nfs/dbraw/zinc/08/22/37/1076082237.db2.gz BVTCCCAQIBQFCU-QWRGUYRKSA-N -1 3 392.420 -1.620 20 0 GAADHM C[C@H](O)CN(C(=O)C(=O)NCCNc1ncccc1-c1nnn[n-]1)[C@@H](C)CO ZINC001589997488 1076082235 /nfs/dbraw/zinc/08/22/35/1076082235.db2.gz BVTCCCAQIBQFCU-QWRGUYRKSA-N -1 3 392.420 -1.620 20 0 GAADHM C[C@@H](O)CN(C(=O)C(=O)NCCNc1ncccc1-c1nn[n-]n1)[C@@H](C)CO ZINC001589997489 1076082467 /nfs/dbraw/zinc/08/24/67/1076082467.db2.gz BVTCCCAQIBQFCU-WDEREUQCSA-N -1 3 392.420 -1.620 20 0 GAADHM C[C@@H](O)CN(C(=O)C(=O)NCCNc1ncccc1-c1nnn[n-]1)[C@@H](C)CO ZINC001589997489 1076082460 /nfs/dbraw/zinc/08/24/60/1076082460.db2.gz BVTCCCAQIBQFCU-WDEREUQCSA-N -1 3 392.420 -1.620 20 0 GAADHM C[C@@H](O)CN(C(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)[C@H](C)CO ZINC001589999657 1076082339 /nfs/dbraw/zinc/08/23/39/1076082339.db2.gz AEHMHHWPUQWGHR-GHMZBOCLSA-N -1 3 398.445 -1.265 20 0 GAADHM C[C@@H](O)CN(C(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)[C@H](C)CO ZINC001589999657 1076082333 /nfs/dbraw/zinc/08/23/33/1076082333.db2.gz AEHMHHWPUQWGHR-GHMZBOCLSA-N -1 3 398.445 -1.265 20 0 GAADHM C[C@H](CO)N(C[C@H](C)O)C(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001589999659 1076082091 /nfs/dbraw/zinc/08/20/91/1076082091.db2.gz AEHMHHWPUQWGHR-MNOVXSKESA-N -1 3 398.445 -1.265 20 0 GAADHM C[C@H](CO)N(C[C@H](C)O)C(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001589999659 1076082085 /nfs/dbraw/zinc/08/20/85/1076082085.db2.gz AEHMHHWPUQWGHR-MNOVXSKESA-N -1 3 398.445 -1.265 20 0 GAADHM C[C@H](O)CN(C(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)[C@@H](C)CO ZINC001589999661 1076082158 /nfs/dbraw/zinc/08/21/58/1076082158.db2.gz AEHMHHWPUQWGHR-QWRGUYRKSA-N -1 3 398.445 -1.265 20 0 GAADHM C[C@H](O)CN(C(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)[C@@H](C)CO ZINC001589999661 1076082152 /nfs/dbraw/zinc/08/21/52/1076082152.db2.gz AEHMHHWPUQWGHR-QWRGUYRKSA-N -1 3 398.445 -1.265 20 0 GAADHM C[C@@H](O)CN(C(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)[C@@H](C)CO ZINC001589999663 1076082284 /nfs/dbraw/zinc/08/22/84/1076082284.db2.gz AEHMHHWPUQWGHR-WDEREUQCSA-N -1 3 398.445 -1.265 20 0 GAADHM C[C@@H](O)CN(C(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)[C@@H](C)CO ZINC001589999663 1076082278 /nfs/dbraw/zinc/08/22/78/1076082278.db2.gz AEHMHHWPUQWGHR-WDEREUQCSA-N -1 3 398.445 -1.265 20 0 GAADHM C[C@@H](O)CN1CCN(C(=O)CCn2cc(-c3nn[n-]n3)c(=O)[nH]c2=O)[C@H](C)C1 ZINC001590001196 1076082588 /nfs/dbraw/zinc/08/25/88/1076082588.db2.gz HRVZQAYYONZOOL-GHMZBOCLSA-N -1 3 392.420 -1.567 20 0 GAADHM C[C@H](O)CN1CCN(C(=O)CCn2cc(-c3nn[n-]n3)c(=O)[nH]c2=O)[C@H](C)C1 ZINC001590001197 1076082732 /nfs/dbraw/zinc/08/27/32/1076082732.db2.gz HRVZQAYYONZOOL-MNOVXSKESA-N -1 3 392.420 -1.567 20 0 GAADHM C[C@H](O)CN1CCN(C(=O)CCn2cc(-c3nn[n-]n3)c(=O)[nH]c2=O)[C@@H](C)C1 ZINC001590001198 1076082705 /nfs/dbraw/zinc/08/27/05/1076082705.db2.gz HRVZQAYYONZOOL-QWRGUYRKSA-N -1 3 392.420 -1.567 20 0 GAADHM C[C@@H](O)CN1CCN(C(=O)CCn2cc(-c3nn[n-]n3)c(=O)[nH]c2=O)[C@@H](C)C1 ZINC001590001199 1076082679 /nfs/dbraw/zinc/08/26/79/1076082679.db2.gz HRVZQAYYONZOOL-WDEREUQCSA-N -1 3 392.420 -1.567 20 0 GAADHM C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1-c1nn[n-]n1)c1nnnn1C ZINC001590009567 1076082807 /nfs/dbraw/zinc/08/28/07/1076082807.db2.gz NLNWNUUZTKARMI-MRVPVSSYSA-N -1 3 393.389 -1.027 20 0 GAADHM C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1-c1nnn[n-]1)c1nnnn1C ZINC001590009567 1076082802 /nfs/dbraw/zinc/08/28/02/1076082802.db2.gz NLNWNUUZTKARMI-MRVPVSSYSA-N -1 3 393.389 -1.027 20 0 GAADHM C[C@H](OC(=O)CNS(=O)(=O)c1ccccc1-c1nn[n-]n1)c1nnnn1C ZINC001590009568 1076082606 /nfs/dbraw/zinc/08/26/06/1076082606.db2.gz NLNWNUUZTKARMI-QMMMGPOBSA-N -1 3 393.389 -1.027 20 0 GAADHM C[C@H](OC(=O)CNS(=O)(=O)c1ccccc1-c1nnn[n-]1)c1nnnn1C ZINC001590009568 1076082601 /nfs/dbraw/zinc/08/26/01/1076082601.db2.gz NLNWNUUZTKARMI-QMMMGPOBSA-N -1 3 393.389 -1.027 20 0 GAADHM C[C@H](Oc1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001590020327 1076082901 /nfs/dbraw/zinc/08/29/01/1076082901.db2.gz KRCXCIIXFRUOLO-CMPLNLGQSA-N -1 3 393.429 -1.005 20 0 GAADHM C[C@H](Oc1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001590020330 1076082856 /nfs/dbraw/zinc/08/28/56/1076082856.db2.gz KRCXCIIXFRUOLO-JQWIXIFHSA-N -1 3 393.429 -1.005 20 0 GAADHM C[C@@H](Oc1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001590020333 1076082793 /nfs/dbraw/zinc/08/27/93/1076082793.db2.gz KRCXCIIXFRUOLO-PWSUYJOCSA-N -1 3 393.429 -1.005 20 0 GAADHM C[C@@H](Oc1ccc(-c2nn[n-]n2)cc1)C(=O)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001590020336 1076082651 /nfs/dbraw/zinc/08/26/51/1076082651.db2.gz KRCXCIIXFRUOLO-ZYHUDNBSSA-N -1 3 393.429 -1.005 20 0 GAADHM C[C@]1(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)CCNC1=O ZINC001590057595 1076082761 /nfs/dbraw/zinc/08/27/61/1076082761.db2.gz FWPMHQHFHWBDME-HNNXBMFYSA-N -1 3 388.388 -1.976 20 0 GAADHM C[C@]1(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)CCNC1=O ZINC001590057595 1076082758 /nfs/dbraw/zinc/08/27/58/1076082758.db2.gz FWPMHQHFHWBDME-HNNXBMFYSA-N -1 3 388.388 -1.976 20 0 GAADHM C[C@@]1(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)CCNC1=O ZINC001590057603 1076082874 /nfs/dbraw/zinc/08/28/74/1076082874.db2.gz FWPMHQHFHWBDME-OAHLLOKOSA-N -1 3 388.388 -1.976 20 0 GAADHM C[C@@]1(C(=O)N2CC(O)(CNC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)CCNC1=O ZINC001590057603 1076082867 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ZINC001590060342 1076083262 /nfs/dbraw/zinc/08/32/62/1076083262.db2.gz JRTAPPDUTNAYNS-GDLVEWKHSA-N -1 3 388.388 -1.978 20 0 GAADHM C[C@]1(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)CCNC1=O ZINC001590060342 1076083256 /nfs/dbraw/zinc/08/32/56/1076083256.db2.gz JRTAPPDUTNAYNS-GDLVEWKHSA-N -1 3 388.388 -1.978 20 0 GAADHM C[C@@]1(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)CCNC1=O ZINC001590060343 1076083277 /nfs/dbraw/zinc/08/32/77/1076083277.db2.gz JRTAPPDUTNAYNS-OHUAYANFSA-N -1 3 388.388 -1.978 20 0 GAADHM C[C@@]1(C(=O)N2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)CCNC1=O ZINC001590060343 1076083272 /nfs/dbraw/zinc/08/32/72/1076083272.db2.gz JRTAPPDUTNAYNS-OHUAYANFSA-N -1 3 388.388 -1.978 20 0 GAADHM C[C@]1(C(=O)N2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCNC1=O ZINC001590060390 1076083011 /nfs/dbraw/zinc/08/30/11/1076083011.db2.gz LQACAFLQFAQUQQ-XLKPWHTISA-N -1 3 384.400 -1.092 20 0 GAADHM 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CC1(C)CN(C(=O)[C@H]2CNC(=O)N2)C[C@@H]1NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001590102145 1076084570 /nfs/dbraw/zinc/08/45/70/1076084570.db2.gz OKBFXNRLKIEDFP-MNOVXSKESA-N -1 3 387.404 -1.157 20 0 GAADHM CC1(C)CN(C(=O)[C@H]2CNC(=O)N2)C[C@@H]1NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001590102145 1076084561 /nfs/dbraw/zinc/08/45/61/1076084561.db2.gz OKBFXNRLKIEDFP-MNOVXSKESA-N -1 3 387.404 -1.157 20 0 GAADHM CC1(C)CN(C(=O)[C@@H]2CNC(=O)N2)C[C@@H]1NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001590102146 1076084547 /nfs/dbraw/zinc/08/45/47/1076084547.db2.gz OKBFXNRLKIEDFP-QWRGUYRKSA-N -1 3 387.404 -1.157 20 0 GAADHM CC1(C)CN(C(=O)[C@@H]2CNC(=O)N2)C[C@@H]1NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001590102146 1076084543 /nfs/dbraw/zinc/08/45/43/1076084543.db2.gz OKBFXNRLKIEDFP-QWRGUYRKSA-N -1 3 387.404 -1.157 20 0 GAADHM CC1(C)CN(C(=O)[C@@H]2CNC(=O)N2)C[C@H]1NC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001590102147 1076084365 /nfs/dbraw/zinc/08/43/65/1076084365.db2.gz OKBFXNRLKIEDFP-WDEREUQCSA-N -1 3 387.404 -1.157 20 0 GAADHM CC1(C)CN(C(=O)[C@@H]2CNC(=O)N2)C[C@H]1NC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001590102147 1076084358 /nfs/dbraw/zinc/08/43/58/1076084358.db2.gz OKBFXNRLKIEDFP-WDEREUQCSA-N -1 3 387.404 -1.157 20 0 GAADHM CC1(C)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1NC(=O)Cn1cnnn1 ZINC001590103252 1076084384 /nfs/dbraw/zinc/08/43/84/1076084384.db2.gz KATGZNCAHHHUPL-LLVKDONJSA-N -1 3 385.392 -1.152 20 0 GAADHM CC1(C)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1NC(=O)Cn1cnnn1 ZINC001590103252 1076084378 /nfs/dbraw/zinc/08/43/78/1076084378.db2.gz KATGZNCAHHHUPL-LLVKDONJSA-N -1 3 385.392 -1.152 20 0 GAADHM CC1(C)CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1NC(=O)Cn1cnnn1 ZINC001590103253 1076084322 /nfs/dbraw/zinc/08/43/22/1076084322.db2.gz KATGZNCAHHHUPL-NSHDSACASA-N -1 3 385.392 -1.152 20 0 GAADHM CC1(C)CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1NC(=O)Cn1cnnn1 ZINC001590103253 1076084314 /nfs/dbraw/zinc/08/43/14/1076084314.db2.gz KATGZNCAHHHUPL-NSHDSACASA-N -1 3 385.392 -1.152 20 0 GAADHM CC1(C)NC(=O)N(CCN2CC(NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)C1=O ZINC001590114169 1076084443 /nfs/dbraw/zinc/08/44/43/1076084443.db2.gz IDGPFAJTOZJWGL-UHFFFAOYSA-N -1 3 387.404 -1.061 20 0 GAADHM CC1(C)NC(=O)N(CCN2CC(NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)C1=O ZINC001590114169 1076084439 /nfs/dbraw/zinc/08/44/39/1076084439.db2.gz IDGPFAJTOZJWGL-UHFFFAOYSA-N -1 3 387.404 -1.061 20 0 GAADHM C[C@@]1(CNC(=O)CNS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)CCC(=O)N1 ZINC001590126582 1076084481 /nfs/dbraw/zinc/08/44/81/1076084481.db2.gz BMKOWFAGHYMELK-HNNXBMFYSA-N -1 3 393.429 -1.070 20 0 GAADHM C[C@@]1(CNC(=O)CNS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)CCC(=O)N1 ZINC001590126582 1076084475 /nfs/dbraw/zinc/08/44/75/1076084475.db2.gz BMKOWFAGHYMELK-HNNXBMFYSA-N -1 3 393.429 -1.070 20 0 GAADHM C[C@]1(CNC(=O)CNS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)CCC(=O)N1 ZINC001590126583 1076084606 /nfs/dbraw/zinc/08/46/06/1076084606.db2.gz BMKOWFAGHYMELK-OAHLLOKOSA-N -1 3 393.429 -1.070 20 0 GAADHM C[C@]1(CNC(=O)CNS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)CCC(=O)N1 ZINC001590126583 1076084598 /nfs/dbraw/zinc/08/45/98/1076084598.db2.gz BMKOWFAGHYMELK-OAHLLOKOSA-N -1 3 393.429 -1.070 20 0 GAADHM C[C@]1(NC(=O)CN2C(=O)CNC2=O)CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001590142912 1076085038 /nfs/dbraw/zinc/08/50/38/1076085038.db2.gz CUXQNBORWNVNLA-INIZCTEOSA-N -1 3 385.388 -1.102 20 0 GAADHM C[C@]1(NC(=O)CN2C(=O)CNC2=O)CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001590142912 1076085035 /nfs/dbraw/zinc/08/50/35/1076085035.db2.gz CUXQNBORWNVNLA-INIZCTEOSA-N -1 3 385.388 -1.102 20 0 GAADHM C[C@@]1(NC(=O)CN2C(=O)CNC2=O)CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001590142915 1076085029 /nfs/dbraw/zinc/08/50/29/1076085029.db2.gz CUXQNBORWNVNLA-MRXNPFEDSA-N -1 3 385.388 -1.102 20 0 GAADHM C[C@@]1(NC(=O)CN2C(=O)CNC2=O)CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001590142915 1076085025 /nfs/dbraw/zinc/08/50/25/1076085025.db2.gz CUXQNBORWNVNLA-MRXNPFEDSA-N -1 3 385.388 -1.102 20 0 GAADHM C[C@@]1(NC(=O)[C@@H]2CC(=O)NC(=O)N2)CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001590144592 1076085197 /nfs/dbraw/zinc/08/51/97/1076085197.db2.gz DQJANIOGEZVGQH-MEDUHNTESA-N -1 3 385.388 -1.055 20 0 GAADHM C[C@@]1(NC(=O)[C@@H]2CC(=O)NC(=O)N2)CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001590144592 1076085191 /nfs/dbraw/zinc/08/51/91/1076085191.db2.gz DQJANIOGEZVGQH-MEDUHNTESA-N -1 3 385.388 -1.055 20 0 GAADHM C[C@]1(NC(=O)[C@@H]2CC(=O)NC(=O)N2)CCN(c2ccc(-c3nn[n-]n3)nc2)C1 ZINC001590144596 1076085343 /nfs/dbraw/zinc/08/53/43/1076085343.db2.gz DQJANIOGEZVGQH-ZBEGNZNMSA-N -1 3 385.388 -1.055 20 0 GAADHM C[C@]1(NC(=O)[C@@H]2CC(=O)NC(=O)N2)CCN(c2ccc(-c3nnn[n-]3)nc2)C1 ZINC001590144596 1076085339 /nfs/dbraw/zinc/08/53/39/1076085339.db2.gz DQJANIOGEZVGQH-ZBEGNZNMSA-N -1 3 385.388 -1.055 20 0 GAADHM C[C@]1(O)CCN(C(=O)C(=O)N2CCN(c3ncccc3-c3nn[n-]n3)CC2)C1 ZINC001590149822 1076085481 /nfs/dbraw/zinc/08/54/81/1076085481.db2.gz CWHUWFRSZHPCAZ-KRWDZBQOSA-N -1 3 386.416 -1.106 20 0 GAADHM C[C@]1(O)CCN(C(=O)C(=O)N2CCN(c3ncccc3-c3nnn[n-]3)CC2)C1 ZINC001590149822 1076085474 /nfs/dbraw/zinc/08/54/74/1076085474.db2.gz CWHUWFRSZHPCAZ-KRWDZBQOSA-N -1 3 386.416 -1.106 20 0 GAADHM C[C@@]1(O)CCN(C(=O)C(=O)N2CCN(c3ncccc3-c3nn[n-]n3)CC2)C1 ZINC001590149823 1076085383 /nfs/dbraw/zinc/08/53/83/1076085383.db2.gz CWHUWFRSZHPCAZ-QGZVFWFLSA-N -1 3 386.416 -1.106 20 0 GAADHM C[C@@]1(O)CCN(C(=O)C(=O)N2CCN(c3ncccc3-c3nnn[n-]3)CC2)C1 ZINC001590149823 1076085379 /nfs/dbraw/zinc/08/53/79/1076085379.db2.gz CWHUWFRSZHPCAZ-QGZVFWFLSA-N -1 3 386.416 -1.106 20 0 GAADHM C[C@]1(O)CCN(C(=O)C(=O)N2CCN(c3ccc(-c4nn[n-]n4)cn3)CC2)C1 ZINC001590150553 1076085398 /nfs/dbraw/zinc/08/53/98/1076085398.db2.gz SCVRMWFHIUXPDR-KRWDZBQOSA-N -1 3 386.416 -1.106 20 0 GAADHM C[C@]1(O)CCN(C(=O)C(=O)N2CCN(c3ccc(-c4nnn[n-]4)cn3)CC2)C1 ZINC001590150553 1076085392 /nfs/dbraw/zinc/08/53/92/1076085392.db2.gz SCVRMWFHIUXPDR-KRWDZBQOSA-N -1 3 386.416 -1.106 20 0 GAADHM C[C@@]1(O)CCN(C(=O)C(=O)N2CCN(c3ccc(-c4nn[n-]n4)cn3)CC2)C1 ZINC001590150555 1076085320 /nfs/dbraw/zinc/08/53/20/1076085320.db2.gz SCVRMWFHIUXPDR-QGZVFWFLSA-N -1 3 386.416 -1.106 20 0 GAADHM C[C@@]1(O)CCN(C(=O)C(=O)N2CCN(c3ccc(-c4nnn[n-]4)cn3)CC2)C1 ZINC001590150555 1076085315 /nfs/dbraw/zinc/08/53/15/1076085315.db2.gz SCVRMWFHIUXPDR-QGZVFWFLSA-N -1 3 386.416 -1.106 20 0 GAADHM C[C@H]1C(=O)N(C)CCN1C(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001590163124 1076085884 /nfs/dbraw/zinc/08/58/84/1076085884.db2.gz GWXKIRFNQLCYAB-JTQLQIEISA-N -1 3 393.429 -1.166 20 0 GAADHM C[C@H]1C(=O)N(C)CCN1C(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001590163124 1076085877 /nfs/dbraw/zinc/08/58/77/1076085877.db2.gz GWXKIRFNQLCYAB-JTQLQIEISA-N -1 3 393.429 -1.166 20 0 GAADHM C[C@@H]1C(=O)N(C)CCN1C(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001590163125 1076085646 /nfs/dbraw/zinc/08/56/46/1076085646.db2.gz GWXKIRFNQLCYAB-SNVBAGLBSA-N -1 3 393.429 -1.166 20 0 GAADHM C[C@@H]1C(=O)N(C)CCN1C(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001590163125 1076085639 /nfs/dbraw/zinc/08/56/39/1076085639.db2.gz GWXKIRFNQLCYAB-SNVBAGLBSA-N -1 3 393.429 -1.166 20 0 GAADHM C[C@@H]1C(=O)NCCN1C(=O)C(=O)N1CCN(c2ccccc2-c2nn[n-]n2)CC1 ZINC001590164332 1076085839 /nfs/dbraw/zinc/08/58/39/1076085839.db2.gz DPITUETZAOMLAU-GFCCVEGCSA-N -1 3 398.427 -1.138 20 0 GAADHM C[C@@H]1C(=O)NCCN1C(=O)C(=O)N1CCN(c2ccccc2-c2nnn[n-]2)CC1 ZINC001590164332 1076085835 /nfs/dbraw/zinc/08/58/35/1076085835.db2.gz DPITUETZAOMLAU-GFCCVEGCSA-N -1 3 398.427 -1.138 20 0 GAADHM C[C@H]1C(=O)NCCN1C(=O)C(=O)N1CCN(c2ccccc2-c2nn[n-]n2)CC1 ZINC001590164333 1076085664 /nfs/dbraw/zinc/08/56/64/1076085664.db2.gz DPITUETZAOMLAU-LBPRGKRZSA-N -1 3 398.427 -1.138 20 0 GAADHM C[C@H]1C(=O)NCCN1C(=O)C(=O)N1CCN(c2ccccc2-c2nnn[n-]2)CC1 ZINC001590164333 1076085658 /nfs/dbraw/zinc/08/56/58/1076085658.db2.gz DPITUETZAOMLAU-LBPRGKRZSA-N -1 3 398.427 -1.138 20 0 GAADHM C[C@H]1C(=O)NCCN1C(=O)C(=O)N(C)C[C@H](O)c1cccc(-c2nn[n-]n2)c1 ZINC001590164856 1076085595 /nfs/dbraw/zinc/08/55/95/1076085595.db2.gz IEWAAKFTDOLQHZ-GWCFXTLKSA-N -1 3 387.400 -1.295 20 0 GAADHM C[C@H]1C(=O)NCCN1C(=O)C(=O)N(C)C[C@H](O)c1cccc(-c2nnn[n-]2)c1 ZINC001590164856 1076085589 /nfs/dbraw/zinc/08/55/89/1076085589.db2.gz IEWAAKFTDOLQHZ-GWCFXTLKSA-N -1 3 387.400 -1.295 20 0 GAADHM C[C@H]1C(=O)NCCN1C(=O)C(=O)N(C)C[C@@H](O)c1cccc(-c2nn[n-]n2)c1 ZINC001590164858 1076085609 /nfs/dbraw/zinc/08/56/09/1076085609.db2.gz IEWAAKFTDOLQHZ-GXFFZTMASA-N -1 3 387.400 -1.295 20 0 GAADHM C[C@H]1C(=O)NCCN1C(=O)C(=O)N(C)C[C@@H](O)c1cccc(-c2nnn[n-]2)c1 ZINC001590164858 1076085604 /nfs/dbraw/zinc/08/56/04/1076085604.db2.gz IEWAAKFTDOLQHZ-GXFFZTMASA-N -1 3 387.400 -1.295 20 0 GAADHM C[C@@H]1C(=O)NCCN1C(=O)C(=O)N(C)C[C@H](O)c1cccc(-c2nn[n-]n2)c1 ZINC001590164860 1076085803 /nfs/dbraw/zinc/08/58/03/1076085803.db2.gz IEWAAKFTDOLQHZ-MFKMUULPSA-N -1 3 387.400 -1.295 20 0 GAADHM C[C@@H]1C(=O)NCCN1C(=O)C(=O)N(C)C[C@H](O)c1cccc(-c2nnn[n-]2)c1 ZINC001590164860 1076085802 /nfs/dbraw/zinc/08/58/02/1076085802.db2.gz IEWAAKFTDOLQHZ-MFKMUULPSA-N -1 3 387.400 -1.295 20 0 GAADHM C[C@@H]1C(=O)NCCN1C(=O)C(=O)N(C)C[C@@H](O)c1cccc(-c2nn[n-]n2)c1 ZINC001590164861 1076085708 /nfs/dbraw/zinc/08/57/08/1076085708.db2.gz IEWAAKFTDOLQHZ-ZWNOBZJWSA-N -1 3 387.400 -1.295 20 0 GAADHM C[C@@H]1C(=O)NCCN1C(=O)C(=O)N(C)C[C@@H](O)c1cccc(-c2nnn[n-]2)c1 ZINC001590164861 1076085702 /nfs/dbraw/zinc/08/57/02/1076085702.db2.gz IEWAAKFTDOLQHZ-ZWNOBZJWSA-N -1 3 387.400 -1.295 20 0 GAADHM C[C@@H]1C(=O)N(C)CN1C(=O)C(=O)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1 ZINC001590164995 1076085626 /nfs/dbraw/zinc/08/56/26/1076085626.db2.gz WIPHWVLRPLJCAQ-LLVKDONJSA-N -1 3 399.415 -1.443 20 0 GAADHM C[C@@H]1C(=O)N(C)CN1C(=O)C(=O)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1 ZINC001590164995 1076085621 /nfs/dbraw/zinc/08/56/21/1076085621.db2.gz WIPHWVLRPLJCAQ-LLVKDONJSA-N -1 3 399.415 -1.443 20 0 GAADHM C[C@H]1C(=O)N(C)CN1C(=O)C(=O)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1 ZINC001590164996 1076085814 /nfs/dbraw/zinc/08/58/14/1076085814.db2.gz WIPHWVLRPLJCAQ-NSHDSACASA-N -1 3 399.415 -1.443 20 0 GAADHM C[C@H]1C(=O)N(C)CN1C(=O)C(=O)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1 ZINC001590164996 1076085810 /nfs/dbraw/zinc/08/58/10/1076085810.db2.gz WIPHWVLRPLJCAQ-NSHDSACASA-N -1 3 399.415 -1.443 20 0 GAADHM C[C@@H]1C(=O)NCCN1C(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001590166239 1076085767 /nfs/dbraw/zinc/08/57/67/1076085767.db2.gz XEJQBZXDFZSZKW-SECBINFHSA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@@H]1C(=O)NCCN1C(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001590166239 1076085762 /nfs/dbraw/zinc/08/57/62/1076085762.db2.gz XEJQBZXDFZSZKW-SECBINFHSA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@H]1C(=O)NCCN1C(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001590166240 1076085829 /nfs/dbraw/zinc/08/58/29/1076085829.db2.gz XEJQBZXDFZSZKW-VIFPVBQESA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@H]1C(=O)NCCN1C(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001590166240 1076085827 /nfs/dbraw/zinc/08/58/27/1076085827.db2.gz XEJQBZXDFZSZKW-VIFPVBQESA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@H]1[C@H](NC(=O)Cn2cnnn2)CCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001590169942 1076085794 /nfs/dbraw/zinc/08/57/94/1076085794.db2.gz HQQHPJHKBGFYMT-GXSJLCMTSA-N -1 3 385.392 -1.009 20 0 GAADHM C[C@H]1[C@H](NC(=O)Cn2cnnn2)CCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001590169942 1076085789 /nfs/dbraw/zinc/08/57/89/1076085789.db2.gz HQQHPJHKBGFYMT-GXSJLCMTSA-N -1 3 385.392 -1.009 20 0 GAADHM C[C@@H]1[C@@H](NC(=O)Cn2cnnn2)CCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001590169947 1076085687 /nfs/dbraw/zinc/08/56/87/1076085687.db2.gz HQQHPJHKBGFYMT-KOLCDFICSA-N -1 3 385.392 -1.009 20 0 GAADHM C[C@@H]1[C@@H](NC(=O)Cn2cnnn2)CCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001590169947 1076085681 /nfs/dbraw/zinc/08/56/81/1076085681.db2.gz HQQHPJHKBGFYMT-KOLCDFICSA-N -1 3 385.392 -1.009 20 0 GAADHM C[C@@H]1[C@H](NC(=O)Cn2cnnn2)CCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001590169948 1076086227 /nfs/dbraw/zinc/08/62/27/1076086227.db2.gz HQQHPJHKBGFYMT-MWLCHTKSSA-N -1 3 385.392 -1.009 20 0 GAADHM C[C@@H]1[C@H](NC(=O)Cn2cnnn2)CCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001590169948 1076086219 /nfs/dbraw/zinc/08/62/19/1076086219.db2.gz HQQHPJHKBGFYMT-MWLCHTKSSA-N -1 3 385.392 -1.009 20 0 GAADHM C[C@H]1[C@@H](NC(=O)Cn2cnnn2)CCCN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001590169950 1076086087 /nfs/dbraw/zinc/08/60/87/1076086087.db2.gz HQQHPJHKBGFYMT-ONGXEEELSA-N -1 3 385.392 -1.009 20 0 GAADHM C[C@H]1[C@@H](NC(=O)Cn2cnnn2)CCCN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001590169950 1076086082 /nfs/dbraw/zinc/08/60/82/1076086082.db2.gz HQQHPJHKBGFYMT-ONGXEEELSA-N -1 3 385.392 -1.009 20 0 GAADHM C[C@H]1CC(=O)NCCN1C(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001590180139 1076086585 /nfs/dbraw/zinc/08/65/85/1076086585.db2.gz DGSXMACLCCIWBZ-JTQLQIEISA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@H]1CC(=O)NCCN1C(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001590180139 1076086580 /nfs/dbraw/zinc/08/65/80/1076086580.db2.gz DGSXMACLCCIWBZ-JTQLQIEISA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@@H]1CC(=O)NCCN1C(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001590180140 1076086567 /nfs/dbraw/zinc/08/65/67/1076086567.db2.gz DGSXMACLCCIWBZ-SNVBAGLBSA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@@H]1CC(=O)NCCN1C(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001590180140 1076086562 /nfs/dbraw/zinc/08/65/62/1076086562.db2.gz DGSXMACLCCIWBZ-SNVBAGLBSA-N -1 3 393.429 -1.118 20 0 GAADHM C[C@@H]1C[C@@H](NC(=O)CN2CN=NC2=O)CN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001590202557 1076086955 /nfs/dbraw/zinc/08/69/55/1076086955.db2.gz XKHVZDCQJWGJSS-PSASIEDQSA-N -1 3 386.376 -1.089 20 0 GAADHM C[C@@H]1C[C@@H](NC(=O)CN2CN=NC2=O)CN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001590202557 1076086948 /nfs/dbraw/zinc/08/69/48/1076086948.db2.gz XKHVZDCQJWGJSS-PSASIEDQSA-N -1 3 386.376 -1.089 20 0 GAADHM C[C@@H]1C[C@H](NC(=O)CN2CN=NC2=O)CN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001590202558 1076086973 /nfs/dbraw/zinc/08/69/73/1076086973.db2.gz XKHVZDCQJWGJSS-SCZZXKLOSA-N -1 3 386.376 -1.089 20 0 GAADHM C[C@@H]1C[C@H](NC(=O)CN2CN=NC2=O)CN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001590202558 1076086967 /nfs/dbraw/zinc/08/69/67/1076086967.db2.gz XKHVZDCQJWGJSS-SCZZXKLOSA-N -1 3 386.376 -1.089 20 0 GAADHM C[C@H]1C[C@@H](NC(=O)CN2CN=NC2=O)CN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001590202559 1076086888 /nfs/dbraw/zinc/08/68/88/1076086888.db2.gz XKHVZDCQJWGJSS-WCBMZHEXSA-N -1 3 386.376 -1.089 20 0 GAADHM C[C@H]1C[C@@H](NC(=O)CN2CN=NC2=O)CN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001590202559 1076086882 /nfs/dbraw/zinc/08/68/82/1076086882.db2.gz XKHVZDCQJWGJSS-WCBMZHEXSA-N -1 3 386.376 -1.089 20 0 GAADHM C[C@H]1C[C@H](NC(=O)CN2CN=NC2=O)CN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001590202560 1076087104 /nfs/dbraw/zinc/08/71/04/1076087104.db2.gz XKHVZDCQJWGJSS-WPRPVWTQSA-N -1 3 386.376 -1.089 20 0 GAADHM C[C@H]1C[C@H](NC(=O)CN2CN=NC2=O)CN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001590202560 1076087098 /nfs/dbraw/zinc/08/70/98/1076087098.db2.gz XKHVZDCQJWGJSS-WPRPVWTQSA-N -1 3 386.376 -1.089 20 0 GAADHM C[C@H]1CCN(C(=O)C(=O)N[C@@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001590266064 1076087709 /nfs/dbraw/zinc/08/77/09/1076087709.db2.gz JXRARALRDHYFKK-GXSJLCMTSA-N -1 3 390.404 -1.730 20 0 GAADHM C[C@H]1CCN(C(=O)C(=O)N[C@@H](CO)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001590266064 1076087703 /nfs/dbraw/zinc/08/77/03/1076087703.db2.gz JXRARALRDHYFKK-GXSJLCMTSA-N -1 3 390.404 -1.730 20 0 GAADHM C[C@@H]1CCN(C(=O)C(=O)N[C@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001590266065 1076087905 /nfs/dbraw/zinc/08/79/05/1076087905.db2.gz JXRARALRDHYFKK-KOLCDFICSA-N -1 3 390.404 -1.730 20 0 GAADHM C[C@@H]1CCN(C(=O)C(=O)N[C@H](CO)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001590266065 1076087899 /nfs/dbraw/zinc/08/78/99/1076087899.db2.gz JXRARALRDHYFKK-KOLCDFICSA-N -1 3 390.404 -1.730 20 0 GAADHM C[C@@H]1CCN(C(=O)C(=O)N[C@@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001590266066 1076087981 /nfs/dbraw/zinc/08/79/81/1076087981.db2.gz JXRARALRDHYFKK-MWLCHTKSSA-N -1 3 390.404 -1.730 20 0 GAADHM C[C@@H]1CCN(C(=O)C(=O)N[C@@H](CO)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001590266066 1076087977 /nfs/dbraw/zinc/08/79/77/1076087977.db2.gz JXRARALRDHYFKK-MWLCHTKSSA-N -1 3 390.404 -1.730 20 0 GAADHM C[C@H]1CCN(C(=O)C(=O)N[C@H](CO)CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001590266067 1076087804 /nfs/dbraw/zinc/08/78/04/1076087804.db2.gz JXRARALRDHYFKK-ONGXEEELSA-N -1 3 390.404 -1.730 20 0 GAADHM C[C@H]1CCN(C(=O)C(=O)N[C@H](CO)CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001590266067 1076087797 /nfs/dbraw/zinc/08/77/97/1076087797.db2.gz JXRARALRDHYFKK-ONGXEEELSA-N -1 3 390.404 -1.730 20 0 GAADHM C[C@@H]1CCNC(=O)[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001590275876 1076088238 /nfs/dbraw/zinc/08/82/38/1076088238.db2.gz FZXULYOWJUVQNQ-NOZJJQNGSA-N -1 3 393.429 -1.214 20 0 GAADHM C[C@@H]1CCNC(=O)[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001590275876 1076088230 /nfs/dbraw/zinc/08/82/30/1076088230.db2.gz FZXULYOWJUVQNQ-NOZJJQNGSA-N -1 3 393.429 -1.214 20 0 GAADHM C[C@@H]1CCNC(=O)[C@H]1NC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001590275877 1076088159 /nfs/dbraw/zinc/08/81/59/1076088159.db2.gz FZXULYOWJUVQNQ-RNCFNFMXSA-N -1 3 393.429 -1.214 20 0 GAADHM C[C@@H]1CCNC(=O)[C@H]1NC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001590275877 1076088152 /nfs/dbraw/zinc/08/81/52/1076088152.db2.gz FZXULYOWJUVQNQ-RNCFNFMXSA-N -1 3 393.429 -1.214 20 0 GAADHM C[C@H]1CCNC(=O)[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001590275878 1076088103 /nfs/dbraw/zinc/08/81/03/1076088103.db2.gz FZXULYOWJUVQNQ-TVQRCGJNSA-N -1 3 393.429 -1.214 20 0 GAADHM C[C@H]1CCNC(=O)[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001590275878 1076088100 /nfs/dbraw/zinc/08/81/00/1076088100.db2.gz FZXULYOWJUVQNQ-TVQRCGJNSA-N -1 3 393.429 -1.214 20 0 GAADHM C[C@H]1CCNC(=O)[C@H]1NC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001590275879 1076088179 /nfs/dbraw/zinc/08/81/79/1076088179.db2.gz FZXULYOWJUVQNQ-ZANVPECISA-N -1 3 393.429 -1.214 20 0 GAADHM C[C@H]1CCNC(=O)[C@H]1NC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001590275879 1076088172 /nfs/dbraw/zinc/08/81/72/1076088172.db2.gz FZXULYOWJUVQNQ-ZANVPECISA-N -1 3 393.429 -1.214 20 0 GAADHM C[C@H]1CN(C(=O)C(=O)NCCNc2ncccc2-c2nn[n-]n2)CC(=O)N1C ZINC001590281930 1076088274 /nfs/dbraw/zinc/08/82/74/1076088274.db2.gz HMNCODHXKWZHLG-JTQLQIEISA-N -1 3 387.404 -1.521 20 0 GAADHM C[C@H]1CN(C(=O)C(=O)NCCNc2ncccc2-c2nnn[n-]2)CC(=O)N1C ZINC001590281930 1076088268 /nfs/dbraw/zinc/08/82/68/1076088268.db2.gz HMNCODHXKWZHLG-JTQLQIEISA-N -1 3 387.404 -1.521 20 0 GAADHM C[C@@H]1CN(C(=O)C(=O)NCCNc2ncccc2-c2nn[n-]n2)CC(=O)N1C ZINC001590281934 1076088216 /nfs/dbraw/zinc/08/82/16/1076088216.db2.gz HMNCODHXKWZHLG-SNVBAGLBSA-N -1 3 387.404 -1.521 20 0 GAADHM C[C@@H]1CN(C(=O)C(=O)NCCNc2ncccc2-c2nnn[n-]2)CC(=O)N1C ZINC001590281934 1076088211 /nfs/dbraw/zinc/08/82/11/1076088211.db2.gz HMNCODHXKWZHLG-SNVBAGLBSA-N -1 3 387.404 -1.521 20 0 GAADHM C[C@@H]1CN(C(=O)C(=O)N2CCN(c3ccc(-c4nnn[n-]4)nc3)CC2)CCN1 ZINC001590282481 1076088257 /nfs/dbraw/zinc/08/82/57/1076088257.db2.gz KEPODXSFDHRCOL-GFCCVEGCSA-N -1 3 385.432 -1.269 20 0 GAADHM C[C@H]1CN(C(=O)C(=O)N2CCN(c3ccc(-c4nnn[n-]4)nc3)CC2)CCN1 ZINC001590282483 1076088402 /nfs/dbraw/zinc/08/84/02/1076088402.db2.gz KEPODXSFDHRCOL-LBPRGKRZSA-N -1 3 385.432 -1.269 20 0 GAADHM C[C@@H]1CN(C(=O)C(=O)NCCNc2ncccc2-c2nn[n-]n2)C[C@H](CO)O1 ZINC001590284145 1076088291 /nfs/dbraw/zinc/08/82/91/1076088291.db2.gz QAUAIVYREKTVFW-GHMZBOCLSA-N -1 3 390.404 -1.602 20 0 GAADHM C[C@@H]1CN(C(=O)C(=O)NCCNc2ncccc2-c2nnn[n-]2)C[C@H](CO)O1 ZINC001590284145 1076088286 /nfs/dbraw/zinc/08/82/86/1076088286.db2.gz QAUAIVYREKTVFW-GHMZBOCLSA-N -1 3 390.404 -1.602 20 0 GAADHM C[C@@H]1CN(C(=O)C(=O)NCCNc2ncccc2-c2nn[n-]n2)C[C@@H](CO)O1 ZINC001590284150 1076088326 /nfs/dbraw/zinc/08/83/26/1076088326.db2.gz QAUAIVYREKTVFW-MNOVXSKESA-N -1 3 390.404 -1.602 20 0 GAADHM C[C@@H]1CN(C(=O)C(=O)NCCNc2ncccc2-c2nnn[n-]2)C[C@@H](CO)O1 ZINC001590284150 1076088320 /nfs/dbraw/zinc/08/83/20/1076088320.db2.gz QAUAIVYREKTVFW-MNOVXSKESA-N -1 3 390.404 -1.602 20 0 GAADHM C[C@H]1CN(C(=O)C(=O)NCCNc2ncccc2-c2nn[n-]n2)C[C@@H](CO)O1 ZINC001590284152 1076088308 /nfs/dbraw/zinc/08/83/08/1076088308.db2.gz QAUAIVYREKTVFW-QWRGUYRKSA-N -1 3 390.404 -1.602 20 0 GAADHM C[C@H]1CN(C(=O)C(=O)NCCNc2ncccc2-c2nnn[n-]2)C[C@@H](CO)O1 ZINC001590284152 1076088302 /nfs/dbraw/zinc/08/83/02/1076088302.db2.gz QAUAIVYREKTVFW-QWRGUYRKSA-N -1 3 390.404 -1.602 20 0 GAADHM C[C@H]1CN(C(=O)C(=O)NCCNc2ncccc2-c2nn[n-]n2)C[C@H](CO)O1 ZINC001590284154 1076088092 /nfs/dbraw/zinc/08/80/92/1076088092.db2.gz QAUAIVYREKTVFW-WDEREUQCSA-N -1 3 390.404 -1.602 20 0 GAADHM C[C@H]1CN(C(=O)C(=O)NCCNc2ncccc2-c2nnn[n-]2)C[C@H](CO)O1 ZINC001590284154 1076088087 /nfs/dbraw/zinc/08/80/87/1076088087.db2.gz QAUAIVYREKTVFW-WDEREUQCSA-N -1 3 390.404 -1.602 20 0 GAADHM C[C@@H]1CN(C(=O)CNS(=O)(=O)c2cccc(-c3nn[n-]n3)c2)CC(=O)N1 ZINC001590288154 1076088826 /nfs/dbraw/zinc/08/88/26/1076088826.db2.gz KMCOVYWDACKARO-SECBINFHSA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@@H]1CN(C(=O)CNS(=O)(=O)c2cccc(-c3nnn[n-]3)c2)CC(=O)N1 ZINC001590288154 1076088821 /nfs/dbraw/zinc/08/88/21/1076088821.db2.gz KMCOVYWDACKARO-SECBINFHSA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@H]1CN(C(=O)CNS(=O)(=O)c2cccc(-c3nn[n-]n3)c2)CC(=O)N1 ZINC001590288155 1076088810 /nfs/dbraw/zinc/08/88/10/1076088810.db2.gz KMCOVYWDACKARO-VIFPVBQESA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@H]1CN(C(=O)CNS(=O)(=O)c2cccc(-c3nnn[n-]3)c2)CC(=O)N1 ZINC001590288155 1076088805 /nfs/dbraw/zinc/08/88/05/1076088805.db2.gz KMCOVYWDACKARO-VIFPVBQESA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@H]1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)C[C@H](CO)O1 ZINC001590288169 1076088571 /nfs/dbraw/zinc/08/85/71/1076088571.db2.gz KZZQENWIIWZSPT-CMPLNLGQSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@H]1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)C[C@H](CO)O1 ZINC001590288169 1076088566 /nfs/dbraw/zinc/08/85/66/1076088566.db2.gz KZZQENWIIWZSPT-CMPLNLGQSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@H]1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)C[C@@H](CO)O1 ZINC001590288170 1076088629 /nfs/dbraw/zinc/08/86/29/1076088629.db2.gz KZZQENWIIWZSPT-JQWIXIFHSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@H]1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)C[C@@H](CO)O1 ZINC001590288170 1076088623 /nfs/dbraw/zinc/08/86/23/1076088623.db2.gz KZZQENWIIWZSPT-JQWIXIFHSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H]1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)C[C@@H](CO)O1 ZINC001590288171 1076088703 /nfs/dbraw/zinc/08/87/03/1076088703.db2.gz KZZQENWIIWZSPT-PWSUYJOCSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H]1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)C[C@@H](CO)O1 ZINC001590288171 1076088696 /nfs/dbraw/zinc/08/86/96/1076088696.db2.gz KZZQENWIIWZSPT-PWSUYJOCSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H]1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)C[C@H](CO)O1 ZINC001590288172 1076088724 /nfs/dbraw/zinc/08/87/24/1076088724.db2.gz KZZQENWIIWZSPT-ZYHUDNBSSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H]1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)C[C@H](CO)O1 ZINC001590288172 1076088717 /nfs/dbraw/zinc/08/87/17/1076088717.db2.gz KZZQENWIIWZSPT-ZYHUDNBSSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H]1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)CC(=O)N1 ZINC001590288444 1076089129 /nfs/dbraw/zinc/08/91/29/1076089129.db2.gz NYDUWSCAUGRMTP-SECBINFHSA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@@H]1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)CC(=O)N1 ZINC001590288444 1076089123 /nfs/dbraw/zinc/08/91/23/1076089123.db2.gz NYDUWSCAUGRMTP-SECBINFHSA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@H]1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)CC(=O)N1 ZINC001590288445 1076089154 /nfs/dbraw/zinc/08/91/54/1076089154.db2.gz NYDUWSCAUGRMTP-VIFPVBQESA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@H]1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)CC(=O)N1 ZINC001590288445 1076089150 /nfs/dbraw/zinc/08/91/50/1076089150.db2.gz NYDUWSCAUGRMTP-VIFPVBQESA-N -1 3 379.402 -1.508 20 0 GAADHM C[C@H]1CN(C(=O)CNS(=O)(=O)c2cccc(-c3nn[n-]n3)c2)C[C@H](CO)O1 ZINC001590289201 1076089467 /nfs/dbraw/zinc/08/94/67/1076089467.db2.gz YWZZMDZQBFMHPA-CMPLNLGQSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@H]1CN(C(=O)CNS(=O)(=O)c2cccc(-c3nnn[n-]3)c2)C[C@H](CO)O1 ZINC001590289201 1076089462 /nfs/dbraw/zinc/08/94/62/1076089462.db2.gz YWZZMDZQBFMHPA-CMPLNLGQSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@H]1CN(C(=O)CNS(=O)(=O)c2cccc(-c3nn[n-]n3)c2)C[C@@H](CO)O1 ZINC001590289202 1076089782 /nfs/dbraw/zinc/08/97/82/1076089782.db2.gz YWZZMDZQBFMHPA-JQWIXIFHSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@H]1CN(C(=O)CNS(=O)(=O)c2cccc(-c3nnn[n-]3)c2)C[C@@H](CO)O1 ZINC001590289202 1076089776 /nfs/dbraw/zinc/08/97/76/1076089776.db2.gz YWZZMDZQBFMHPA-JQWIXIFHSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H]1CN(C(=O)CNS(=O)(=O)c2cccc(-c3nn[n-]n3)c2)C[C@@H](CO)O1 ZINC001590289203 1076089485 /nfs/dbraw/zinc/08/94/85/1076089485.db2.gz YWZZMDZQBFMHPA-PWSUYJOCSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H]1CN(C(=O)CNS(=O)(=O)c2cccc(-c3nnn[n-]3)c2)C[C@@H](CO)O1 ZINC001590289203 1076089479 /nfs/dbraw/zinc/08/94/79/1076089479.db2.gz YWZZMDZQBFMHPA-PWSUYJOCSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H]1CN(C(=O)CNS(=O)(=O)c2cccc(-c3nn[n-]n3)c2)C[C@H](CO)O1 ZINC001590289204 1076089646 /nfs/dbraw/zinc/08/96/46/1076089646.db2.gz YWZZMDZQBFMHPA-ZYHUDNBSSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H]1CN(C(=O)CNS(=O)(=O)c2cccc(-c3nnn[n-]3)c2)C[C@H](CO)O1 ZINC001590289204 1076089639 /nfs/dbraw/zinc/08/96/39/1076089639.db2.gz YWZZMDZQBFMHPA-ZYHUDNBSSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@H]1CN(C(=O)Cn2cc(-c3nn[n-]n3)c(=O)[nH]c2=O)CCN1CC(C)(C)O ZINC001590290659 1076089608 /nfs/dbraw/zinc/08/96/08/1076089608.db2.gz BMBNMYWPTFLBDY-JTQLQIEISA-N -1 3 392.420 -1.567 20 0 GAADHM C[C@H]1CN(C(=O)Cn2cc(-c3nnn[n-]3)c(=O)[nH]c2=O)CCN1CC(C)(C)O ZINC001590290659 1076089601 /nfs/dbraw/zinc/08/96/01/1076089601.db2.gz BMBNMYWPTFLBDY-JTQLQIEISA-N -1 3 392.420 -1.567 20 0 GAADHM C[C@@H]1CN(C(=O)Cn2cc(-c3nn[n-]n3)c(=O)[nH]c2=O)CCN1CC(C)(C)O ZINC001590290660 1076089557 /nfs/dbraw/zinc/08/95/57/1076089557.db2.gz BMBNMYWPTFLBDY-SNVBAGLBSA-N -1 3 392.420 -1.567 20 0 GAADHM C[C@@H]1CN(C(=O)Cn2cc(-c3nnn[n-]3)c(=O)[nH]c2=O)CCN1CC(C)(C)O ZINC001590290660 1076089550 /nfs/dbraw/zinc/08/95/50/1076089550.db2.gz BMBNMYWPTFLBDY-SNVBAGLBSA-N -1 3 392.420 -1.567 20 0 GAADHM C[C@@H]1CN(C(=O)NCCn2cnc(-c3nn[n-]n3)n2)CCN1CC(C)(C)O ZINC001590291800 1076090289 /nfs/dbraw/zinc/09/02/89/1076090289.db2.gz PYJMFQDZPINXSW-LLVKDONJSA-N -1 3 378.441 -1.055 20 0 GAADHM C[C@@H]1CN(C(=O)NCCn2cnc(-c3nnn[n-]3)n2)CCN1CC(C)(C)O ZINC001590291800 1076090283 /nfs/dbraw/zinc/09/02/83/1076090283.db2.gz PYJMFQDZPINXSW-LLVKDONJSA-N -1 3 378.441 -1.055 20 0 GAADHM C[C@H]1CN(C(=O)NCCn2cnc(-c3nn[n-]n3)n2)CCN1CC(C)(C)O ZINC001590291801 1076090048 /nfs/dbraw/zinc/09/00/48/1076090048.db2.gz PYJMFQDZPINXSW-NSHDSACASA-N -1 3 378.441 -1.055 20 0 GAADHM C[C@H]1CN(C(=O)NCCn2cnc(-c3nnn[n-]3)n2)CCN1CC(C)(C)O ZINC001590291801 1076090043 /nfs/dbraw/zinc/09/00/43/1076090043.db2.gz PYJMFQDZPINXSW-NSHDSACASA-N -1 3 378.441 -1.055 20 0 GAADHM C[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@]2(CCN(C(=O)C(N)=O)C2)O1 ZINC001590294265 1076090132 /nfs/dbraw/zinc/09/01/32/1076090132.db2.gz YZXRUWYSLHFMNI-ABKXIKBNSA-N -1 3 388.388 -1.488 20 0 GAADHM C[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@]2(CCN(C(=O)C(N)=O)C2)O1 ZINC001590294265 1076090125 /nfs/dbraw/zinc/09/01/25/1076090125.db2.gz YZXRUWYSLHFMNI-ABKXIKBNSA-N -1 3 388.388 -1.488 20 0 GAADHM C[C@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@]2(CCN(C(=O)C(N)=O)C2)O1 ZINC001590294266 1076089918 /nfs/dbraw/zinc/08/99/18/1076089918.db2.gz YZXRUWYSLHFMNI-FVMDXXJSSA-N -1 3 388.388 -1.488 20 0 GAADHM C[C@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@]2(CCN(C(=O)C(N)=O)C2)O1 ZINC001590294266 1076089911 /nfs/dbraw/zinc/08/99/11/1076089911.db2.gz YZXRUWYSLHFMNI-FVMDXXJSSA-N -1 3 388.388 -1.488 20 0 GAADHM C[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@]2(CCN(C(=O)C(N)=O)C2)O1 ZINC001590294267 1076089952 /nfs/dbraw/zinc/08/99/52/1076089952.db2.gz YZXRUWYSLHFMNI-JDNHERCYSA-N -1 3 388.388 -1.488 20 0 GAADHM C[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@]2(CCN(C(=O)C(N)=O)C2)O1 ZINC001590294267 1076089947 /nfs/dbraw/zinc/08/99/47/1076089947.db2.gz YZXRUWYSLHFMNI-JDNHERCYSA-N -1 3 388.388 -1.488 20 0 GAADHM C[C@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@]2(CCN(C(=O)C(N)=O)C2)O1 ZINC001590294268 1076090066 /nfs/dbraw/zinc/09/00/66/1076090066.db2.gz YZXRUWYSLHFMNI-XXFAHNHDSA-N -1 3 388.388 -1.488 20 0 GAADHM C[C@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@]2(CCN(C(=O)C(N)=O)C2)O1 ZINC001590294268 1076090060 /nfs/dbraw/zinc/09/00/60/1076090060.db2.gz YZXRUWYSLHFMNI-XXFAHNHDSA-N -1 3 388.388 -1.488 20 0 GAADHM C[C@H]1CN(C)C(=O)CN1C(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001590302388 1076090791 /nfs/dbraw/zinc/09/07/91/1076090791.db2.gz KAMDOAZOZUHKFR-JTQLQIEISA-N -1 3 393.429 -1.166 20 0 GAADHM C[C@H]1CN(C)C(=O)CN1C(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001590302388 1076090784 /nfs/dbraw/zinc/09/07/84/1076090784.db2.gz KAMDOAZOZUHKFR-JTQLQIEISA-N -1 3 393.429 -1.166 20 0 GAADHM C[C@@H]1CN(C)C(=O)CN1C(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001590302390 1076090601 /nfs/dbraw/zinc/09/06/01/1076090601.db2.gz KAMDOAZOZUHKFR-SNVBAGLBSA-N -1 3 393.429 -1.166 20 0 GAADHM C[C@@H]1CN(C)C(=O)CN1C(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001590302390 1076090595 /nfs/dbraw/zinc/09/05/95/1076090595.db2.gz KAMDOAZOZUHKFR-SNVBAGLBSA-N -1 3 393.429 -1.166 20 0 GAADHM C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)NCCn1cnc(-c2nn[n-]n2)n1 ZINC001590303006 1076090582 /nfs/dbraw/zinc/09/05/82/1076090582.db2.gz DKBFUTZGIXSKLV-LLVKDONJSA-N -1 3 378.441 -1.055 20 0 GAADHM C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)NCCn1cnc(-c2nnn[n-]2)n1 ZINC001590303006 1076090576 /nfs/dbraw/zinc/09/05/76/1076090576.db2.gz DKBFUTZGIXSKLV-LLVKDONJSA-N -1 3 378.441 -1.055 20 0 GAADHM C[C@H]1CN(CC(C)(C)O)CCN1C(=O)NCCn1cnc(-c2nn[n-]n2)n1 ZINC001590303009 1076090521 /nfs/dbraw/zinc/09/05/21/1076090521.db2.gz DKBFUTZGIXSKLV-NSHDSACASA-N -1 3 378.441 -1.055 20 0 GAADHM C[C@H]1CN(CC(C)(C)O)CCN1C(=O)NCCn1cnc(-c2nnn[n-]2)n1 ZINC001590303009 1076090516 /nfs/dbraw/zinc/09/05/16/1076090516.db2.gz DKBFUTZGIXSKLV-NSHDSACASA-N -1 3 378.441 -1.055 20 0 GAADHM C[C@@H]1CN(CCCNC(=O)Cn2cc(-c3nn[n-]n3)c(=O)[nH]c2=O)C[C@@H](C)O1 ZINC001590303459 1076090725 /nfs/dbraw/zinc/09/07/25/1076090725.db2.gz HGDXQFCNMBBMNP-GHMZBOCLSA-N -1 3 392.420 -1.256 20 0 GAADHM C[C@@H]1CN(CCCNC(=O)Cn2cc(-c3nn[n-]n3)c(=O)[nH]c2=O)C[C@H](C)O1 ZINC001590303464 1076090436 /nfs/dbraw/zinc/09/04/36/1076090436.db2.gz HGDXQFCNMBBMNP-PHIMTYICSA-N -1 3 392.420 -1.256 20 0 GAADHM C[C@H]1CN(CCCNC(=O)Cn2cc(-c3nn[n-]n3)c(=O)[nH]c2=O)C[C@H](C)O1 ZINC001590303467 1076090473 /nfs/dbraw/zinc/09/04/73/1076090473.db2.gz HGDXQFCNMBBMNP-QWRGUYRKSA-N -1 3 392.420 -1.256 20 0 GAADHM C[C@@H]1CN(c2nccnc2-c2nn[n-]n2)CCN1C(=O)C(=O)N1CCNCC1 ZINC001590318139 1076090914 /nfs/dbraw/zinc/09/09/14/1076090914.db2.gz PWLKWZKXYYTBBR-LLVKDONJSA-N -1 3 386.420 -1.874 20 0 GAADHM C[C@@H]1CN(c2nccnc2-c2nnn[n-]2)CCN1C(=O)C(=O)N1CCNCC1 ZINC001590318139 1076090910 /nfs/dbraw/zinc/09/09/10/1076090910.db2.gz PWLKWZKXYYTBBR-LLVKDONJSA-N -1 3 386.420 -1.874 20 0 GAADHM C[C@H]1CN(c2nccnc2-c2nn[n-]n2)CCN1C(=O)C(=O)N1CCNCC1 ZINC001590318140 1076091111 /nfs/dbraw/zinc/09/11/11/1076091111.db2.gz PWLKWZKXYYTBBR-NSHDSACASA-N -1 3 386.420 -1.874 20 0 GAADHM C[C@H]1CN(c2nccnc2-c2nnn[n-]2)CCN1C(=O)C(=O)N1CCNCC1 ZINC001590318140 1076091104 /nfs/dbraw/zinc/09/11/04/1076091104.db2.gz PWLKWZKXYYTBBR-NSHDSACASA-N -1 3 386.420 -1.874 20 0 GAADHM C[C@H]1CO[C@@H](CO)CN1C(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001590323583 1076091008 /nfs/dbraw/zinc/09/10/08/1076091008.db2.gz MWAHAVZQQHSEPU-CMPLNLGQSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@H]1CO[C@@H](CO)CN1C(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001590323583 1076091003 /nfs/dbraw/zinc/09/10/03/1076091003.db2.gz MWAHAVZQQHSEPU-CMPLNLGQSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@H]1CO[C@H](CO)CN1C(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001590323584 1076091088 /nfs/dbraw/zinc/09/10/88/1076091088.db2.gz MWAHAVZQQHSEPU-JQWIXIFHSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@H]1CO[C@H](CO)CN1C(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001590323584 1076091081 /nfs/dbraw/zinc/09/10/81/1076091081.db2.gz MWAHAVZQQHSEPU-JQWIXIFHSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H]1CO[C@H](CO)CN1C(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001590323586 1076091255 /nfs/dbraw/zinc/09/12/55/1076091255.db2.gz MWAHAVZQQHSEPU-PWSUYJOCSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H]1CO[C@H](CO)CN1C(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001590323586 1076091248 /nfs/dbraw/zinc/09/12/48/1076091248.db2.gz MWAHAVZQQHSEPU-PWSUYJOCSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H]1CO[C@@H](CO)CN1C(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001590323587 1076091026 /nfs/dbraw/zinc/09/10/26/1076091026.db2.gz MWAHAVZQQHSEPU-ZYHUDNBSSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@@H]1CO[C@@H](CO)CN1C(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001590323587 1076091022 /nfs/dbraw/zinc/09/10/22/1076091022.db2.gz MWAHAVZQQHSEPU-ZYHUDNBSSA-N -1 3 396.429 -1.247 20 0 GAADHM C[C@H]1OCC[C@]1(O)CNC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001590333513 1076091236 /nfs/dbraw/zinc/09/12/36/1076091236.db2.gz HEJUBWHKXNHKFA-BMIGLBTASA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@H]1OCC[C@]1(O)CNC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001590333513 1076091229 /nfs/dbraw/zinc/09/12/29/1076091229.db2.gz HEJUBWHKXNHKFA-BMIGLBTASA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@@H]1OCC[C@]1(O)CNC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001590333514 1076091217 /nfs/dbraw/zinc/09/12/17/1076091217.db2.gz HEJUBWHKXNHKFA-BONVTDFDSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@@H]1OCC[C@]1(O)CNC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001590333514 1076091211 /nfs/dbraw/zinc/09/12/11/1076091211.db2.gz HEJUBWHKXNHKFA-BONVTDFDSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@H]1OCC[C@@]1(O)CNC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001590333515 1076091517 /nfs/dbraw/zinc/09/15/17/1076091517.db2.gz HEJUBWHKXNHKFA-MEBBXXQBSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@H]1OCC[C@@]1(O)CNC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001590333515 1076091510 /nfs/dbraw/zinc/09/15/10/1076091510.db2.gz HEJUBWHKXNHKFA-MEBBXXQBSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@@H]1OCC[C@@]1(O)CNC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001590333516 1076091374 /nfs/dbraw/zinc/09/13/74/1076091374.db2.gz HEJUBWHKXNHKFA-ZUZCIYMTSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@@H]1OCC[C@@]1(O)CNC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001590333516 1076091370 /nfs/dbraw/zinc/09/13/70/1076091370.db2.gz HEJUBWHKXNHKFA-ZUZCIYMTSA-N -1 3 396.429 -1.199 20 0 GAADHM CC[C@@]1(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@@H]2O)CCNC1=O ZINC001590488635 1076092099 /nfs/dbraw/zinc/09/20/99/1076092099.db2.gz ALAZSITXFSZFQK-BWACUDIHSA-N -1 3 386.416 -1.156 20 0 GAADHM CC[C@@]1(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@@H]2O)CCNC1=O ZINC001590488635 1076092093 /nfs/dbraw/zinc/09/20/93/1076092093.db2.gz ALAZSITXFSZFQK-BWACUDIHSA-N -1 3 386.416 -1.156 20 0 GAADHM CC[C@]1(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@@H]2O)CCNC1=O ZINC001590488636 1076091943 /nfs/dbraw/zinc/09/19/43/1076091943.db2.gz ALAZSITXFSZFQK-PEBVRCNWSA-N -1 3 386.416 -1.156 20 0 GAADHM CC[C@]1(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@@H]2O)CCNC1=O ZINC001590488636 1076091937 /nfs/dbraw/zinc/09/19/37/1076091937.db2.gz ALAZSITXFSZFQK-PEBVRCNWSA-N -1 3 386.416 -1.156 20 0 GAADHM CC[C@]1(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@@H]2O)CCNC1=O ZINC001590488667 1076092469 /nfs/dbraw/zinc/09/24/69/1076092469.db2.gz FFMRBNWIZNDYBM-IGCXYCKISA-N -1 3 386.416 -1.156 20 0 GAADHM CC[C@]1(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@@H]2O)CCNC1=O ZINC001590488667 1076092465 /nfs/dbraw/zinc/09/24/65/1076092465.db2.gz FFMRBNWIZNDYBM-IGCXYCKISA-N -1 3 386.416 -1.156 20 0 GAADHM CC[C@@]1(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@@H]2O)CCNC1=O ZINC001590488668 1076092455 /nfs/dbraw/zinc/09/24/55/1076092455.db2.gz FFMRBNWIZNDYBM-IIYDPXPESA-N -1 3 386.416 -1.156 20 0 GAADHM CC[C@@]1(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@@H]2O)CCNC1=O ZINC001590488668 1076092452 /nfs/dbraw/zinc/09/24/52/1076092452.db2.gz FFMRBNWIZNDYBM-IIYDPXPESA-N -1 3 386.416 -1.156 20 0 GAADHM CC[C@@]1(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]2O)CCNC1=O ZINC001590488669 1076092429 /nfs/dbraw/zinc/09/24/29/1076092429.db2.gz FFMRBNWIZNDYBM-PBFPGSCMSA-N -1 3 386.416 -1.156 20 0 GAADHM CC[C@@]1(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]2O)CCNC1=O ZINC001590488669 1076092425 /nfs/dbraw/zinc/09/24/25/1076092425.db2.gz FFMRBNWIZNDYBM-PBFPGSCMSA-N -1 3 386.416 -1.156 20 0 GAADHM CC[C@]1(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]2O)CCNC1=O ZINC001590488670 1076092491 /nfs/dbraw/zinc/09/24/91/1076092491.db2.gz FFMRBNWIZNDYBM-XNJGSVPQSA-N -1 3 386.416 -1.156 20 0 GAADHM CC[C@]1(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]2O)CCNC1=O ZINC001590488670 1076092484 /nfs/dbraw/zinc/09/24/84/1076092484.db2.gz FFMRBNWIZNDYBM-XNJGSVPQSA-N -1 3 386.416 -1.156 20 0 GAADHM CC[C@@]1(C(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]2O)CCNC1=O ZINC001590488961 1076092368 /nfs/dbraw/zinc/09/23/68/1076092368.db2.gz YBMCMHLLRUEVSP-PSTGCABASA-N -1 3 386.416 -1.156 20 0 GAADHM CC[C@@]1(C(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]2O)CCNC1=O ZINC001590488961 1076092362 /nfs/dbraw/zinc/09/23/62/1076092362.db2.gz YBMCMHLLRUEVSP-PSTGCABASA-N -1 3 386.416 -1.156 20 0 GAADHM CC[C@]1(C(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]2O)CCNC1=O ZINC001590488962 1076092324 /nfs/dbraw/zinc/09/23/24/1076092324.db2.gz YBMCMHLLRUEVSP-QFSBIZTOSA-N -1 3 386.416 -1.156 20 0 GAADHM CC[C@]1(C(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]2O)CCNC1=O ZINC001590488962 1076092318 /nfs/dbraw/zinc/09/23/18/1076092318.db2.gz YBMCMHLLRUEVSP-QFSBIZTOSA-N -1 3 386.416 -1.156 20 0 GAADHM CC[C@@H]1C(=O)NCCN1C(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001590498773 1076092525 /nfs/dbraw/zinc/09/25/25/1076092525.db2.gz DJYOEEUWDOBVKR-GFCCVEGCSA-N -1 3 393.429 -1.118 20 0 GAADHM CC[C@@H]1C(=O)NCCN1C(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001590498773 1076092517 /nfs/dbraw/zinc/09/25/17/1076092517.db2.gz DJYOEEUWDOBVKR-GFCCVEGCSA-N -1 3 393.429 -1.118 20 0 GAADHM CC[C@H]1C(=O)NCCN1C(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001590498776 1076092213 /nfs/dbraw/zinc/09/22/13/1076092213.db2.gz DJYOEEUWDOBVKR-LBPRGKRZSA-N -1 3 393.429 -1.118 20 0 GAADHM CC[C@H]1C(=O)NCCN1C(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001590498776 1076092207 /nfs/dbraw/zinc/09/22/07/1076092207.db2.gz DJYOEEUWDOBVKR-LBPRGKRZSA-N -1 3 393.429 -1.118 20 0 GAADHM CCC[C@@H](O)[C@@H](CO)NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001590560229 1076092990 /nfs/dbraw/zinc/09/29/90/1076092990.db2.gz VJSZRJYVAPTOLY-CHWSQXEVSA-N -1 3 398.445 -1.217 20 0 GAADHM CCC[C@@H](O)[C@@H](CO)NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001590560229 1076092986 /nfs/dbraw/zinc/09/29/86/1076092986.db2.gz VJSZRJYVAPTOLY-CHWSQXEVSA-N -1 3 398.445 -1.217 20 0 GAADHM CCC[C@H](O)[C@@H](CO)NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001590560232 1076092815 /nfs/dbraw/zinc/09/28/15/1076092815.db2.gz VJSZRJYVAPTOLY-OLZOCXBDSA-N -1 3 398.445 -1.217 20 0 GAADHM CCC[C@H](O)[C@@H](CO)NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001590560232 1076092809 /nfs/dbraw/zinc/09/28/09/1076092809.db2.gz VJSZRJYVAPTOLY-OLZOCXBDSA-N -1 3 398.445 -1.217 20 0 GAADHM CCC[C@@H](O)[C@H](CO)NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001590560233 1076092847 /nfs/dbraw/zinc/09/28/47/1076092847.db2.gz VJSZRJYVAPTOLY-QWHCGFSZSA-N -1 3 398.445 -1.217 20 0 GAADHM CCC[C@@H](O)[C@H](CO)NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001590560233 1076092843 /nfs/dbraw/zinc/09/28/43/1076092843.db2.gz VJSZRJYVAPTOLY-QWHCGFSZSA-N -1 3 398.445 -1.217 20 0 GAADHM CCC[C@H](O)[C@H](CO)NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001590560236 1076092705 /nfs/dbraw/zinc/09/27/05/1076092705.db2.gz VJSZRJYVAPTOLY-STQMWFEESA-N -1 3 398.445 -1.217 20 0 GAADHM CCC[C@H](O)[C@H](CO)NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001590560236 1076092700 /nfs/dbraw/zinc/09/27/00/1076092700.db2.gz VJSZRJYVAPTOLY-STQMWFEESA-N -1 3 398.445 -1.217 20 0 GAADHM CCCCNC(=O)CN1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001590603314 1076092920 /nfs/dbraw/zinc/09/29/20/1076092920.db2.gz CFOSIORILJEFCY-CHWSQXEVSA-N -1 3 376.421 -1.114 20 0 GAADHM CCCCNC(=O)CN1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001590603314 1076092917 /nfs/dbraw/zinc/09/29/17/1076092917.db2.gz CFOSIORILJEFCY-CHWSQXEVSA-N -1 3 376.421 -1.114 20 0 GAADHM CCCn1nnnc1CN1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001590666024 1076093354 /nfs/dbraw/zinc/09/33/54/1076093354.db2.gz JCOCUYADHUYDLW-NEPJUHHUSA-N -1 3 387.408 -1.434 20 0 GAADHM CCCn1nnnc1CN1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001590666024 1076093346 /nfs/dbraw/zinc/09/33/46/1076093346.db2.gz JCOCUYADHUYDLW-NEPJUHHUSA-N -1 3 387.408 -1.434 20 0 GAADHM CCN(C)C(=O)CNC(=O)C(=O)N(C)C[C@@H](O)c1cccc(-c2nn[n-]n2)c1 ZINC001590677342 1076093279 /nfs/dbraw/zinc/09/32/79/1076093279.db2.gz CGACHDQDFNHUAQ-CYBMUJFWSA-N -1 3 389.416 -1.047 20 0 GAADHM CCN(C)C(=O)CNC(=O)C(=O)N(C)C[C@@H](O)c1cccc(-c2nnn[n-]2)c1 ZINC001590677342 1076093276 /nfs/dbraw/zinc/09/32/76/1076093276.db2.gz CGACHDQDFNHUAQ-CYBMUJFWSA-N -1 3 389.416 -1.047 20 0 GAADHM CCN(C)C(=O)CNC(=O)C(=O)N(C)C[C@H](O)c1cccc(-c2nn[n-]n2)c1 ZINC001590677343 1076093245 /nfs/dbraw/zinc/09/32/45/1076093245.db2.gz CGACHDQDFNHUAQ-ZDUSSCGKSA-N -1 3 389.416 -1.047 20 0 GAADHM CCN(C)C(=O)CNC(=O)C(=O)N(C)C[C@H](O)c1cccc(-c2nnn[n-]2)c1 ZINC001590677343 1076093240 /nfs/dbraw/zinc/09/32/40/1076093240.db2.gz CGACHDQDFNHUAQ-ZDUSSCGKSA-N -1 3 389.416 -1.047 20 0 GAADHM CCN(C)C(=O)CNC(=O)C(=O)NCCNc1ccc(-c2nn[n-]n2)cn1 ZINC001590677504 1076093173 /nfs/dbraw/zinc/09/31/73/1076093173.db2.gz JCSOCVPBOXIIQE-UHFFFAOYSA-N -1 3 375.393 -1.616 20 0 GAADHM CCN(C)C(=O)CNC(=O)C(=O)NCCNc1ccc(-c2nnn[n-]2)cn1 ZINC001590677504 1076093169 /nfs/dbraw/zinc/09/31/69/1076093169.db2.gz JCSOCVPBOXIIQE-UHFFFAOYSA-N -1 3 375.393 -1.616 20 0 GAADHM CCN(C)C(=O)CNC(=O)C(=O)Nc1cnn(-c2ncccc2-c2nn[n-]n2)c1 ZINC001590677755 1076093294 /nfs/dbraw/zinc/09/32/94/1076093294.db2.gz ZDKODRMHPFLXHA-UHFFFAOYSA-N -1 3 398.387 -1.020 20 0 GAADHM CCN(C)C(=O)CNC(=O)C(=O)Nc1cnn(-c2ncccc2-c2nnn[n-]2)c1 ZINC001590677755 1076093291 /nfs/dbraw/zinc/09/32/91/1076093291.db2.gz ZDKODRMHPFLXHA-UHFFFAOYSA-N -1 3 398.387 -1.020 20 0 GAADHM CCN(CC(=O)NC)C(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001590681780 1076093526 /nfs/dbraw/zinc/09/35/26/1076093526.db2.gz MYMHODSTXCHXNF-UHFFFAOYSA-N -1 3 381.418 -1.261 20 0 GAADHM CCN(CC(=O)NC)C(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001590681780 1076093519 /nfs/dbraw/zinc/09/35/19/1076093519.db2.gz MYMHODSTXCHXNF-UHFFFAOYSA-N -1 3 381.418 -1.261 20 0 GAADHM CCN(CC(N)=O)C(=O)[C@@H](C)NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001590683323 1076093812 /nfs/dbraw/zinc/09/38/12/1076093812.db2.gz QEZLMLUTIKYIOM-SECBINFHSA-N -1 3 381.418 -1.133 20 0 GAADHM CCN(CC(N)=O)C(=O)[C@@H](C)NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001590683323 1076093806 /nfs/dbraw/zinc/09/38/06/1076093806.db2.gz QEZLMLUTIKYIOM-SECBINFHSA-N -1 3 381.418 -1.133 20 0 GAADHM CCN(CC(N)=O)C(=O)[C@H](C)NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001590683325 1076093675 /nfs/dbraw/zinc/09/36/75/1076093675.db2.gz QEZLMLUTIKYIOM-VIFPVBQESA-N -1 3 381.418 -1.133 20 0 GAADHM CCN(CC(N)=O)C(=O)[C@H](C)NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001590683325 1076093669 /nfs/dbraw/zinc/09/36/69/1076093669.db2.gz QEZLMLUTIKYIOM-VIFPVBQESA-N -1 3 381.418 -1.133 20 0 GAADHM CCN(CC)C(=O)CN1CCC(NC(=O)Cn2cnc(-c3nn[n-]n3)n2)CC1 ZINC001590684239 1076093576 /nfs/dbraw/zinc/09/35/76/1076093576.db2.gz UHIICPCMUGWOSN-UHFFFAOYSA-N -1 3 390.452 -1.093 20 0 GAADHM CCN(CC)C(=O)CN1CCC(NC(=O)Cn2cnc(-c3nnn[n-]3)n2)CC1 ZINC001590684239 1076093571 /nfs/dbraw/zinc/09/35/71/1076093571.db2.gz UHIICPCMUGWOSN-UHFFFAOYSA-N -1 3 390.452 -1.093 20 0 GAADHM CCN(CCCNC(=O)[C@H]1CNC(=O)N1)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001590697362 1076094098 /nfs/dbraw/zinc/09/40/98/1076094098.db2.gz VVJQALQLXOXPQN-LLVKDONJSA-N -1 3 375.393 -1.155 20 0 GAADHM CCN(CCCNC(=O)[C@H]1CNC(=O)N1)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001590697362 1076094095 /nfs/dbraw/zinc/09/40/95/1076094095.db2.gz VVJQALQLXOXPQN-LLVKDONJSA-N -1 3 375.393 -1.155 20 0 GAADHM CCN(CCCNC(=O)[C@@H]1CNC(=O)N1)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001590697363 1076094290 /nfs/dbraw/zinc/09/42/90/1076094290.db2.gz VVJQALQLXOXPQN-NSHDSACASA-N -1 3 375.393 -1.155 20 0 GAADHM CCN(CCCNC(=O)[C@@H]1CNC(=O)N1)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001590697363 1076094284 /nfs/dbraw/zinc/09/42/84/1076094284.db2.gz VVJQALQLXOXPQN-NSHDSACASA-N -1 3 375.393 -1.155 20 0 GAADHM CCN(CCCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)C(=O)[C@H]1CNC(=O)N1 ZINC001590699203 1076094186 /nfs/dbraw/zinc/09/41/86/1076094186.db2.gz YAQBCRQGSZBLSX-LLVKDONJSA-N -1 3 375.393 -1.155 20 0 GAADHM CCN(CCCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)C(=O)[C@H]1CNC(=O)N1 ZINC001590699203 1076094180 /nfs/dbraw/zinc/09/41/80/1076094180.db2.gz YAQBCRQGSZBLSX-LLVKDONJSA-N -1 3 375.393 -1.155 20 0 GAADHM CCN(CCCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1)C(=O)[C@@H]1CNC(=O)N1 ZINC001590699204 1076094115 /nfs/dbraw/zinc/09/41/15/1076094115.db2.gz YAQBCRQGSZBLSX-NSHDSACASA-N -1 3 375.393 -1.155 20 0 GAADHM CCN(CCCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1)C(=O)[C@@H]1CNC(=O)N1 ZINC001590699204 1076094111 /nfs/dbraw/zinc/09/41/11/1076094111.db2.gz YAQBCRQGSZBLSX-NSHDSACASA-N -1 3 375.393 -1.155 20 0 GAADHM CCN(CCNC(=O)C1CC(=O)NC(=O)C1)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001590703384 1076094221 /nfs/dbraw/zinc/09/42/21/1076094221.db2.gz JLBNBBUPYJKNDJ-UHFFFAOYSA-N -1 3 388.388 -1.174 20 0 GAADHM CCN(CCNC(=O)C1CC(=O)NC(=O)C1)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001590703384 1076094214 /nfs/dbraw/zinc/09/42/14/1076094214.db2.gz JLBNBBUPYJKNDJ-UHFFFAOYSA-N -1 3 388.388 -1.174 20 0 GAADHM CCN(CCNC(=O)CN1C(=O)CCC1=O)C(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001590704599 1076094257 /nfs/dbraw/zinc/09/42/57/1076094257.db2.gz IQCONZKPHFSXSA-UHFFFAOYSA-N -1 3 388.388 -1.078 20 0 GAADHM CCN(CCNC(=O)CN1C(=O)CCC1=O)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001590704599 1076094250 /nfs/dbraw/zinc/09/42/50/1076094250.db2.gz IQCONZKPHFSXSA-UHFFFAOYSA-N -1 3 388.388 -1.078 20 0 GAADHM CCN(CCNC(=O)CN1C(=O)CCC1=O)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001590704600 1076094238 /nfs/dbraw/zinc/09/42/38/1076094238.db2.gz ISORGXWACRKGGD-UHFFFAOYSA-N -1 3 388.388 -1.078 20 0 GAADHM CCN(CCNC(=O)CN1C(=O)CCC1=O)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001590704600 1076094233 /nfs/dbraw/zinc/09/42/33/1076094233.db2.gz ISORGXWACRKGGD-UHFFFAOYSA-N -1 3 388.388 -1.078 20 0 GAADHM CCN(CCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)C(=O)C[C@H]1CC(=O)NC1=O ZINC001590707381 1076094059 /nfs/dbraw/zinc/09/40/59/1076094059.db2.gz YMPMXHKSXASBMT-SECBINFHSA-N -1 3 388.388 -1.174 20 0 GAADHM CCN(CCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)C(=O)C[C@H]1CC(=O)NC1=O ZINC001590707381 1076094056 /nfs/dbraw/zinc/09/40/56/1076094056.db2.gz YMPMXHKSXASBMT-SECBINFHSA-N -1 3 388.388 -1.174 20 0 GAADHM CCN(CCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)C(=O)C[C@@H]1CC(=O)NC1=O ZINC001590707382 1076094071 /nfs/dbraw/zinc/09/40/71/1076094071.db2.gz YMPMXHKSXASBMT-VIFPVBQESA-N -1 3 388.388 -1.174 20 0 GAADHM CCN(CCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)C(=O)C[C@@H]1CC(=O)NC1=O ZINC001590707382 1076094067 /nfs/dbraw/zinc/09/40/67/1076094067.db2.gz YMPMXHKSXASBMT-VIFPVBQESA-N -1 3 388.388 -1.174 20 0 GAADHM CCN1C(=O)[C@@H]2CN(S(=O)(=O)c3ccc(-c4nn[n-]n4)cn3)CCN2C1=O ZINC001590727735 1076094592 /nfs/dbraw/zinc/09/45/92/1076094592.db2.gz SMPZMSUDIPIKAK-JTQLQIEISA-N -1 3 392.401 -1.081 20 0 GAADHM CCN1C(=O)[C@@H]2CN(S(=O)(=O)c3ccc(-c4nnn[n-]4)cn3)CCN2C1=O ZINC001590727735 1076094590 /nfs/dbraw/zinc/09/45/90/1076094590.db2.gz SMPZMSUDIPIKAK-JTQLQIEISA-N -1 3 392.401 -1.081 20 0 GAADHM CCN1C(=O)[C@H]2CN(S(=O)(=O)c3ccc(-c4nn[n-]n4)cn3)CCN2C1=O ZINC001590727736 1076094672 /nfs/dbraw/zinc/09/46/72/1076094672.db2.gz SMPZMSUDIPIKAK-SNVBAGLBSA-N -1 3 392.401 -1.081 20 0 GAADHM CCN1C(=O)[C@H]2CN(S(=O)(=O)c3ccc(-c4nnn[n-]4)cn3)CCN2C1=O ZINC001590727736 1076094667 /nfs/dbraw/zinc/09/46/67/1076094667.db2.gz SMPZMSUDIPIKAK-SNVBAGLBSA-N -1 3 392.401 -1.081 20 0 GAADHM CCN1C(=O)[C@H]2CN(S(=O)(=O)c3cncc(-c4nn[n-]n4)c3)CCN2C1=O ZINC001590727920 1076094557 /nfs/dbraw/zinc/09/45/57/1076094557.db2.gz ZWGYSYJFZHTRER-LLVKDONJSA-N -1 3 392.401 -1.081 20 0 GAADHM CCN1C(=O)[C@H]2CN(S(=O)(=O)c3cncc(-c4nnn[n-]4)c3)CCN2C1=O ZINC001590727920 1076094552 /nfs/dbraw/zinc/09/45/52/1076094552.db2.gz ZWGYSYJFZHTRER-LLVKDONJSA-N -1 3 392.401 -1.081 20 0 GAADHM CCN1C(=O)[C@@H]2CN(S(=O)(=O)c3cncc(-c4nn[n-]n4)c3)CCN2C1=O ZINC001590727921 1076094583 /nfs/dbraw/zinc/09/45/83/1076094583.db2.gz ZWGYSYJFZHTRER-NSHDSACASA-N -1 3 392.401 -1.081 20 0 GAADHM CCN1C(=O)[C@@H]2CN(S(=O)(=O)c3cncc(-c4nnn[n-]4)c3)CCN2C1=O ZINC001590727921 1076094579 /nfs/dbraw/zinc/09/45/79/1076094579.db2.gz ZWGYSYJFZHTRER-NSHDSACASA-N -1 3 392.401 -1.081 20 0 GAADHM CCN1C[C@@H](C(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]2O)CC1=O ZINC001590728960 1076094889 /nfs/dbraw/zinc/09/48/89/1076094889.db2.gz FRYWQCCNFKQJMT-CYZMBNFOSA-N -1 3 386.416 -1.204 20 0 GAADHM CCN1C[C@@H](C(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]2O)CC1=O ZINC001590728960 1076094884 /nfs/dbraw/zinc/09/48/84/1076094884.db2.gz FRYWQCCNFKQJMT-CYZMBNFOSA-N -1 3 386.416 -1.204 20 0 GAADHM CCN1C[C@H](C(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]2O)CC1=O ZINC001590728961 1076095235 /nfs/dbraw/zinc/09/52/35/1076095235.db2.gz FRYWQCCNFKQJMT-RAIGVLPGSA-N -1 3 386.416 -1.204 20 0 GAADHM CCN1C[C@H](C(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]2O)CC1=O ZINC001590728961 1076095230 /nfs/dbraw/zinc/09/52/30/1076095230.db2.gz FRYWQCCNFKQJMT-RAIGVLPGSA-N -1 3 386.416 -1.204 20 0 GAADHM CCN1CC[C@@H](NC(=O)C(=O)NCCNc2ncccc2-c2nn[n-]n2)C1=O ZINC001590729794 1076095074 /nfs/dbraw/zinc/09/50/74/1076095074.db2.gz SMTASLLIVDWMGS-LLVKDONJSA-N -1 3 387.404 -1.473 20 0 GAADHM CCN1CC[C@@H](NC(=O)C(=O)NCCNc2ncccc2-c2nnn[n-]2)C1=O ZINC001590729794 1076095067 /nfs/dbraw/zinc/09/50/67/1076095067.db2.gz SMTASLLIVDWMGS-LLVKDONJSA-N -1 3 387.404 -1.473 20 0 GAADHM CCN1CC[C@H](NC(=O)C(=O)NCCNc2ncccc2-c2nn[n-]n2)C1=O ZINC001590729795 1076094960 /nfs/dbraw/zinc/09/49/60/1076094960.db2.gz SMTASLLIVDWMGS-NSHDSACASA-N -1 3 387.404 -1.473 20 0 GAADHM CCN1CC[C@H](NC(=O)C(=O)NCCNc2ncccc2-c2nnn[n-]2)C1=O ZINC001590729795 1076094954 /nfs/dbraw/zinc/09/49/54/1076094954.db2.gz SMTASLLIVDWMGS-NSHDSACASA-N -1 3 387.404 -1.473 20 0 GAADHM CCN1CCN(CC(=O)NCCNc2ccc(-c3nn[n-]n3)cn2)C(=O)C1=O ZINC001590734712 1076095118 /nfs/dbraw/zinc/09/51/18/1076095118.db2.gz IVZIZGBTNNTEGR-UHFFFAOYSA-N -1 3 387.404 -1.520 20 0 GAADHM CCN1CCN(CC(=O)NCCNc2ccc(-c3nnn[n-]3)cn2)C(=O)C1=O ZINC001590734712 1076095113 /nfs/dbraw/zinc/09/51/13/1076095113.db2.gz IVZIZGBTNNTEGR-UHFFFAOYSA-N -1 3 387.404 -1.520 20 0 GAADHM CCN1CCN(C2CN(c3c(-c4nn[n-]n4)c(=O)n(C)c(=O)n3C)C2)CC1 ZINC001590735044 1076095027 /nfs/dbraw/zinc/09/50/27/1076095027.db2.gz OGPQUZNCOLFKOR-UHFFFAOYSA-N -1 3 375.437 -1.910 20 0 GAADHM CCN1CCN(C2CN(c3c(-c4nnn[n-]4)c(=O)n(C)c(=O)n3C)C2)CC1 ZINC001590735044 1076095019 /nfs/dbraw/zinc/09/50/19/1076095019.db2.gz OGPQUZNCOLFKOR-UHFFFAOYSA-N -1 3 375.437 -1.910 20 0 GAADHM CCN1CCN(C(=O)CNS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)CC1=O ZINC001590735243 1076095105 /nfs/dbraw/zinc/09/51/05/1076095105.db2.gz QIHZPGTXKGTKOU-UHFFFAOYSA-N -1 3 393.429 -1.164 20 0 GAADHM CCN1CCN(C(=O)CNS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)CC1=O ZINC001590735243 1076095101 /nfs/dbraw/zinc/09/51/01/1076095101.db2.gz QIHZPGTXKGTKOU-UHFFFAOYSA-N -1 3 393.429 -1.164 20 0 GAADHM CCN1CCO[C@H](C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]2O)C1 ZINC001590737188 1076095178 /nfs/dbraw/zinc/09/51/78/1076095178.db2.gz PTPQJQJDCAHKJM-MCIONIFRSA-N -1 3 388.432 -1.352 20 0 GAADHM CCN1CCO[C@@H](C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]2O)C1 ZINC001590737189 1076094991 /nfs/dbraw/zinc/09/49/91/1076094991.db2.gz PTPQJQJDCAHKJM-MGPQQGTHSA-N -1 3 388.432 -1.352 20 0 GAADHM CCN1CCO[C@@H](C(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@@H]2O)C1 ZINC001590737554 1076094939 /nfs/dbraw/zinc/09/49/39/1076094939.db2.gz ZRLNXSYPGVSMOO-HZSPNIEDSA-N -1 3 388.432 -1.352 20 0 GAADHM CCN1CCO[C@@H](C(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@@H]2O)C1 ZINC001590737554 1076094933 /nfs/dbraw/zinc/09/49/33/1076094933.db2.gz ZRLNXSYPGVSMOO-HZSPNIEDSA-N -1 3 388.432 -1.352 20 0 GAADHM CCN1CCO[C@H](C(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@@H]2O)C1 ZINC001590737555 1076094862 /nfs/dbraw/zinc/09/48/62/1076094862.db2.gz ZRLNXSYPGVSMOO-RDBSUJKOSA-N -1 3 388.432 -1.352 20 0 GAADHM CCN1CCO[C@H](C(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@@H]2O)C1 ZINC001590737555 1076094857 /nfs/dbraw/zinc/09/48/57/1076094857.db2.gz ZRLNXSYPGVSMOO-RDBSUJKOSA-N -1 3 388.432 -1.352 20 0 GAADHM CCN1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)CC1=O ZINC001590737628 1076095091 /nfs/dbraw/zinc/09/50/91/1076095091.db2.gz WHIOXWXHTFWLQG-UHFFFAOYSA-N -1 3 379.402 -1.207 20 0 GAADHM CCN1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)CC1=O ZINC001590737628 1076095087 /nfs/dbraw/zinc/09/50/87/1076095087.db2.gz WHIOXWXHTFWLQG-UHFFFAOYSA-N -1 3 379.402 -1.207 20 0 GAADHM CCN1CN(C(=O)CNS(=O)(=O)c2cccc(-c3nn[n-]n3)c2)CC1=O ZINC001590737639 1076095635 /nfs/dbraw/zinc/09/56/35/1076095635.db2.gz WOWAZFZSQVZHEI-UHFFFAOYSA-N -1 3 379.402 -1.207 20 0 GAADHM CCN1CN(C(=O)CNS(=O)(=O)c2cccc(-c3nnn[n-]3)c2)CC1=O ZINC001590737639 1076095629 /nfs/dbraw/zinc/09/56/29/1076095629.db2.gz WOWAZFZSQVZHEI-UHFFFAOYSA-N -1 3 379.402 -1.207 20 0 GAADHM CCNC(=O)[C@@H](C)NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001590737945 1076095415 /nfs/dbraw/zinc/09/54/15/1076095415.db2.gz LGFWKYNYFDCMFF-SECBINFHSA-N -1 3 381.418 -1.214 20 0 GAADHM CCNC(=O)[C@@H](C)NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001590737945 1076095409 /nfs/dbraw/zinc/09/54/09/1076095409.db2.gz LGFWKYNYFDCMFF-SECBINFHSA-N -1 3 381.418 -1.214 20 0 GAADHM CCNC(=O)[C@H](C)NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001590737946 1076095597 /nfs/dbraw/zinc/09/55/97/1076095597.db2.gz LGFWKYNYFDCMFF-VIFPVBQESA-N -1 3 381.418 -1.214 20 0 GAADHM CCNC(=O)[C@H](C)NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001590737946 1076095592 /nfs/dbraw/zinc/09/55/92/1076095592.db2.gz LGFWKYNYFDCMFF-VIFPVBQESA-N -1 3 381.418 -1.214 20 0 GAADHM CCNC(=O)C1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)C1 ZINC001590738056 1076095614 /nfs/dbraw/zinc/09/56/14/1076095614.db2.gz RCKCVRGWEYINND-UHFFFAOYSA-N -1 3 393.429 -1.261 20 0 GAADHM CCNC(=O)C1CN(C(=O)CNS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)C1 ZINC001590738056 1076095607 /nfs/dbraw/zinc/09/56/07/1076095607.db2.gz RCKCVRGWEYINND-UHFFFAOYSA-N -1 3 393.429 -1.261 20 0 GAADHM CCNC(=O)CC(=O)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@H](O)C1 ZINC001590738627 1076095434 /nfs/dbraw/zinc/09/54/34/1076095434.db2.gz BHOIOGWDHSNMQX-CMPLNLGQSA-N -1 3 390.404 -1.587 20 0 GAADHM CCNC(=O)CC(=O)N1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@H](O)C1 ZINC001590738627 1076095427 /nfs/dbraw/zinc/09/54/27/1076095427.db2.gz BHOIOGWDHSNMQX-CMPLNLGQSA-N -1 3 390.404 -1.587 20 0 GAADHM CCNC(=O)CC(=O)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001590738628 1076095695 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CCNC(=O)CC(=O)NCCN1CCN(c2cnc(-c3nnn[n-]3)cn2)CC1 ZINC001590743690 1076097252 /nfs/dbraw/zinc/09/72/52/1076097252.db2.gz XGWNXUGWZNSPDB-UHFFFAOYSA-N -1 3 388.436 -1.579 20 0 GAADHM CCNC(=O)CC(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001590743712 1076097165 /nfs/dbraw/zinc/09/71/65/1076097165.db2.gz YATYFYZVJZFOTH-GHMZBOCLSA-N -1 3 378.368 -1.407 20 0 GAADHM CCNC(=O)CC(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001590743712 1076097160 /nfs/dbraw/zinc/09/71/60/1076097160.db2.gz YATYFYZVJZFOTH-GHMZBOCLSA-N -1 3 378.368 -1.407 20 0 GAADHM CCNS(=O)(=O)CCNS(=O)(=O)c1cnc(C)c(-c2nn[n-]n2)c1 ZINC001590744962 1076097285 /nfs/dbraw/zinc/09/72/85/1076097285.db2.gz ALCJDYQXGPKIFQ-UHFFFAOYSA-N -1 3 375.436 -1.212 20 0 GAADHM CCNS(=O)(=O)CCNS(=O)(=O)c1cnc(C)c(-c2nnn[n-]2)c1 ZINC001590744962 1076097280 /nfs/dbraw/zinc/09/72/80/1076097280.db2.gz ALCJDYQXGPKIFQ-UHFFFAOYSA-N -1 3 375.436 -1.212 20 0 GAADHM CCNS(=O)(=O)CCNC(=O)C(=O)N(C)Cc1ccc(-c2nn[n-]n2)cc1 ZINC001590744969 1076097207 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-1.131 20 0 GAADHM CCOC(=O)C(=O)N1CCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001590748294 1076097869 /nfs/dbraw/zinc/09/78/69/1076097869.db2.gz BJNZJXDXKSIQIH-UHFFFAOYSA-N -1 3 395.401 -1.342 20 0 GAADHM CCOC(=O)C(=O)N1CCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001590748294 1076097862 /nfs/dbraw/zinc/09/78/62/1076097862.db2.gz BJNZJXDXKSIQIH-UHFFFAOYSA-N -1 3 395.401 -1.342 20 0 GAADHM CCOC(=O)C(=O)N1CCN(C(=O)CNc2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001590748667 1076097809 /nfs/dbraw/zinc/09/78/09/1076097809.db2.gz LCNXKNUUSSKNGL-UHFFFAOYSA-N -1 3 388.388 -1.093 20 0 GAADHM CCOC(=O)C(=O)N1CCN(C(=O)CNc2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001590748667 1076097801 /nfs/dbraw/zinc/09/78/01/1076097801.db2.gz LCNXKNUUSSKNGL-UHFFFAOYSA-N -1 3 388.388 -1.093 20 0 GAADHM CCOC(=O)C(=O)N1CCN(S(=O)(=O)c2cncc(-c3nn[n-]n3)c2)CC1 ZINC001590748694 1076097666 /nfs/dbraw/zinc/09/76/66/1076097666.db2.gz MAJJMKPJLAREDK-UHFFFAOYSA-N -1 3 395.401 -1.342 20 0 GAADHM CCOC(=O)C(=O)N1CCN(S(=O)(=O)c2cncc(-c3nnn[n-]3)c2)CC1 ZINC001590748694 1076097660 /nfs/dbraw/zinc/09/76/60/1076097660.db2.gz MAJJMKPJLAREDK-UHFFFAOYSA-N -1 3 395.401 -1.342 20 0 GAADHM CCOC(=O)[C@H](C)NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001590751397 1076097558 /nfs/dbraw/zinc/09/75/58/1076097558.db2.gz IDADYKYPVSGERB-BDAKNGLRSA-N -1 3 397.417 -1.004 20 0 GAADHM CCOC(=O)[C@H](C)NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001590751397 1076097551 /nfs/dbraw/zinc/09/75/51/1076097551.db2.gz IDADYKYPVSGERB-BDAKNGLRSA-N -1 3 397.417 -1.004 20 0 GAADHM CCOC(=O)[C@@H](C)NC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001590751398 1076097831 /nfs/dbraw/zinc/09/78/31/1076097831.db2.gz IDADYKYPVSGERB-DTWKUNHWSA-N -1 3 397.417 -1.004 20 0 GAADHM CCOC(=O)[C@@H](C)NC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001590751398 1076097824 /nfs/dbraw/zinc/09/78/24/1076097824.db2.gz IDADYKYPVSGERB-DTWKUNHWSA-N -1 3 397.417 -1.004 20 0 GAADHM CCOC(=O)[C@H](C)NC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001590751400 1076097582 /nfs/dbraw/zinc/09/75/82/1076097582.db2.gz IDADYKYPVSGERB-IUCAKERBSA-N -1 3 397.417 -1.004 20 0 GAADHM CCOC(=O)[C@H](C)NC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001590751400 1076097575 /nfs/dbraw/zinc/09/75/75/1076097575.db2.gz IDADYKYPVSGERB-IUCAKERBSA-N -1 3 397.417 -1.004 20 0 GAADHM CCOC(=O)[C@@H](C)NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001590751401 1076097626 /nfs/dbraw/zinc/09/76/26/1076097626.db2.gz IDADYKYPVSGERB-RKDXNWHRSA-N -1 3 397.417 -1.004 20 0 GAADHM CCOC(=O)[C@@H](C)NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001590751401 1076097620 /nfs/dbraw/zinc/09/76/20/1076097620.db2.gz IDADYKYPVSGERB-RKDXNWHRSA-N -1 3 397.417 -1.004 20 0 GAADHM CCOC(=O)[C@@H]1CN(C(=O)C(=O)Nc2ccc(-c3nn[n-]n3)cn2)CCO1 ZINC001590760308 1076098158 /nfs/dbraw/zinc/09/81/58/1076098158.db2.gz RQZSPJQREQLHFK-JTQLQIEISA-N -1 3 375.345 -1.009 20 0 GAADHM CCOC(=O)[C@@H]1CN(C(=O)C(=O)Nc2ccc(-c3nnn[n-]3)cn2)CCO1 ZINC001590760308 1076098153 /nfs/dbraw/zinc/09/81/53/1076098153.db2.gz RQZSPJQREQLHFK-JTQLQIEISA-N -1 3 375.345 -1.009 20 0 GAADHM CCOC(=O)[C@H]1CN(C(=O)C(=O)Nc2ccc(-c3nn[n-]n3)cn2)CCO1 ZINC001590760359 1076098130 /nfs/dbraw/zinc/09/81/30/1076098130.db2.gz RQZSPJQREQLHFK-SNVBAGLBSA-N -1 3 375.345 -1.009 20 0 GAADHM CCOC(=O)[C@H]1CN(C(=O)C(=O)Nc2ccc(-c3nnn[n-]3)cn2)CCO1 ZINC001590760359 1076098126 /nfs/dbraw/zinc/09/81/26/1076098126.db2.gz RQZSPJQREQLHFK-SNVBAGLBSA-N -1 3 375.345 -1.009 20 0 GAADHM CCOC(=O)C[C@H](CO)NCCS(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001590763644 1076098235 /nfs/dbraw/zinc/09/82/35/1076098235.db2.gz OXHZGRBUCNRNTC-LLVKDONJSA-N -1 3 384.418 -1.061 20 0 GAADHM CCOC(=O)C[C@H](CO)NCCS(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001590763644 1076098232 /nfs/dbraw/zinc/09/82/32/1076098232.db2.gz OXHZGRBUCNRNTC-LLVKDONJSA-N -1 3 384.418 -1.061 20 0 GAADHM CCOC(=O)C[C@@H](CO)NCCS(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001590763645 1076098198 /nfs/dbraw/zinc/09/81/98/1076098198.db2.gz OXHZGRBUCNRNTC-NSHDSACASA-N -1 3 384.418 -1.061 20 0 GAADHM CCOC(=O)C[C@@H](CO)NCCS(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001590763645 1076098194 /nfs/dbraw/zinc/09/81/94/1076098194.db2.gz OXHZGRBUCNRNTC-NSHDSACASA-N -1 3 384.418 -1.061 20 0 GAADHM CCOC(=O)C[C@@H](O)C(=O)N1CCN(c2c(-c3nn[n-]n3)c(C)nn2C)CC1 ZINC001590763878 1076098078 /nfs/dbraw/zinc/09/80/78/1076098078.db2.gz RLYGJEORTMRZKQ-LLVKDONJSA-N -1 3 392.420 -1.129 20 0 GAADHM CCOC(=O)C[C@@H](O)C(=O)N1CCN(c2c(-c3nnn[n-]3)c(C)nn2C)CC1 ZINC001590763878 1076098072 /nfs/dbraw/zinc/09/80/72/1076098072.db2.gz RLYGJEORTMRZKQ-LLVKDONJSA-N -1 3 392.420 -1.129 20 0 GAADHM CCOC(=O)C[C@H](O)C(=O)N1CCN(c2c(-c3nn[n-]n3)c(C)nn2C)CC1 ZINC001590763879 1076098270 /nfs/dbraw/zinc/09/82/70/1076098270.db2.gz RLYGJEORTMRZKQ-NSHDSACASA-N -1 3 392.420 -1.129 20 0 GAADHM CCOC(=O)C[C@H](O)C(=O)N1CCN(c2c(-c3nnn[n-]3)c(C)nn2C)CC1 ZINC001590763879 1076098267 /nfs/dbraw/zinc/09/82/67/1076098267.db2.gz RLYGJEORTMRZKQ-NSHDSACASA-N -1 3 392.420 -1.129 20 0 GAADHM CCOC(=O)CNC(=O)[C@H]1COCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001590764989 1076098532 /nfs/dbraw/zinc/09/85/32/1076098532.db2.gz MDSXLRZGKJNZON-LLVKDONJSA-N -1 3 377.361 -1.285 20 0 GAADHM CCOC(=O)CNC(=O)[C@H]1COCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001590764989 1076098527 /nfs/dbraw/zinc/09/85/27/1076098527.db2.gz MDSXLRZGKJNZON-LLVKDONJSA-N -1 3 377.361 -1.285 20 0 GAADHM CCOC(=O)CNC(=O)[C@@H]1COCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001590764990 1076098632 /nfs/dbraw/zinc/09/86/32/1076098632.db2.gz MDSXLRZGKJNZON-NSHDSACASA-N -1 3 377.361 -1.285 20 0 GAADHM CCOC(=O)CNC(=O)[C@@H]1COCCN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001590764990 1076098625 /nfs/dbraw/zinc/09/86/25/1076098625.db2.gz MDSXLRZGKJNZON-NSHDSACASA-N -1 3 377.361 -1.285 20 0 GAADHM CCOC(=O)CNC(=O)[C@H]1COCCN1C(=O)c1ccc(-c2nn[n-]n2)n1C ZINC001590765026 1076098610 /nfs/dbraw/zinc/09/86/10/1076098610.db2.gz OUXYFAXPBXPCDG-GFCCVEGCSA-N -1 3 391.388 -1.275 20 0 GAADHM CCOC(=O)CNC(=O)[C@H]1COCCN1C(=O)c1ccc(-c2nnn[n-]2)n1C ZINC001590765026 1076098603 /nfs/dbraw/zinc/09/86/03/1076098603.db2.gz OUXYFAXPBXPCDG-GFCCVEGCSA-N -1 3 391.388 -1.275 20 0 GAADHM CCOC(=O)CNC(=O)[C@@H]1COCCN1C(=O)c1ccc(-c2nn[n-]n2)n1C ZINC001590765027 1076098434 /nfs/dbraw/zinc/09/84/34/1076098434.db2.gz OUXYFAXPBXPCDG-LBPRGKRZSA-N -1 3 391.388 -1.275 20 0 GAADHM CCOC(=O)CNC(=O)[C@@H]1COCCN1C(=O)c1ccc(-c2nnn[n-]2)n1C ZINC001590765027 1076098427 /nfs/dbraw/zinc/09/84/27/1076098427.db2.gz OUXYFAXPBXPCDG-LBPRGKRZSA-N -1 3 391.388 -1.275 20 0 GAADHM CCOC(=O)c1cnn(CCNS(=O)(=O)c2cnn(C)c2)c1-c1nnn[n-]1 ZINC001590775227 1076098654 /nfs/dbraw/zinc/09/86/54/1076098654.db2.gz BEIWIFJBFAHXCF-UHFFFAOYSA-N -1 3 395.405 -1.048 20 0 GAADHM CCOCCOCC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001590813423 1076099131 /nfs/dbraw/zinc/09/91/31/1076099131.db2.gz CFPFTRWUIUTMQG-OLZOCXBDSA-N -1 3 377.405 -1.020 20 0 GAADHM CCOCCOCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001590813423 1076099123 /nfs/dbraw/zinc/09/91/23/1076099123.db2.gz CFPFTRWUIUTMQG-OLZOCXBDSA-N -1 3 377.405 -1.020 20 0 GAADHM CCOCCOCC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O ZINC001590813774 1076098950 /nfs/dbraw/zinc/09/89/50/1076098950.db2.gz IUMWOKXDVJNAJR-CHWSQXEVSA-N -1 3 393.404 -1.451 20 0 GAADHM CCOCCOCC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O ZINC001590813774 1076098944 /nfs/dbraw/zinc/09/89/44/1076098944.db2.gz IUMWOKXDVJNAJR-CHWSQXEVSA-N -1 3 393.404 -1.451 20 0 GAADHM CCOCCNC(=O)CN1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001590813821 1076099093 /nfs/dbraw/zinc/09/90/93/1076099093.db2.gz WXQLSFRGODHWIZ-CHWSQXEVSA-N -1 3 392.420 -1.878 20 0 GAADHM CCOCCNC(=O)CN1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001590813821 1076099086 /nfs/dbraw/zinc/09/90/86/1076099086.db2.gz WXQLSFRGODHWIZ-CHWSQXEVSA-N -1 3 392.420 -1.878 20 0 GAADHM CCOCCOCC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O ZINC001590813875 1076098966 /nfs/dbraw/zinc/09/89/66/1076098966.db2.gz IUMWOKXDVJNAJR-OLZOCXBDSA-N -1 3 393.404 -1.451 20 0 GAADHM CCOCCOCC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O ZINC001590813875 1076098960 /nfs/dbraw/zinc/09/89/60/1076098960.db2.gz IUMWOKXDVJNAJR-OLZOCXBDSA-N -1 3 393.404 -1.451 20 0 GAADHM CCOCCOCC(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001590815730 1076099601 /nfs/dbraw/zinc/09/96/01/1076099601.db2.gz UDLDDAFETNKSIT-CHWSQXEVSA-N -1 3 393.404 -1.451 20 0 GAADHM CCOCCOCC(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001590815730 1076099597 /nfs/dbraw/zinc/09/95/97/1076099597.db2.gz UDLDDAFETNKSIT-CHWSQXEVSA-N -1 3 393.404 -1.451 20 0 GAADHM CCON(C)C(=O)CNC(=O)C(=O)NCCNc1ccc(-c2nn[n-]n2)cn1 ZINC001590817709 1076099407 /nfs/dbraw/zinc/09/94/07/1076099407.db2.gz FFFMYHXWFCLJOR-UHFFFAOYSA-N -1 3 391.392 -1.684 20 0 GAADHM CCON(C)C(=O)CNC(=O)C(=O)NCCNc1ccc(-c2nnn[n-]2)cn1 ZINC001590817709 1076099401 /nfs/dbraw/zinc/09/94/01/1076099401.db2.gz FFFMYHXWFCLJOR-UHFFFAOYSA-N -1 3 391.392 -1.684 20 0 GAADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)C(=O)NCCNS(C)(=O)=O ZINC001590827795 1076099860 /nfs/dbraw/zinc/09/98/60/1076099860.db2.gz FMUMOHIAWYLJAA-UHFFFAOYSA-N -1 3 397.417 -1.131 20 0 GAADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)C(=O)NCCNS(C)(=O)=O ZINC001590827795 1076099855 /nfs/dbraw/zinc/09/98/55/1076099855.db2.gz FMUMOHIAWYLJAA-UHFFFAOYSA-N -1 3 397.417 -1.131 20 0 GAADHM CCOc1ccc(-c2nn[n-]n2)cc1NC(=O)C(=O)NCCS(=O)(=O)NC ZINC001590829019 1076099965 /nfs/dbraw/zinc/09/99/65/1076099965.db2.gz XJFLUTZXYWDJNX-UHFFFAOYSA-N -1 3 397.417 -1.131 20 0 GAADHM CCOc1ccc(-c2nnn[n-]2)cc1NC(=O)C(=O)NCCS(=O)(=O)NC ZINC001590829019 1076099959 /nfs/dbraw/zinc/09/99/59/1076099959.db2.gz XJFLUTZXYWDJNX-UHFFFAOYSA-N -1 3 397.417 -1.131 20 0 GAADHM CCS(=O)(=O)CCCN1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001590846172 1076099771 /nfs/dbraw/zinc/09/97/71/1076099771.db2.gz DJBHSJQIFUSUFD-OLZOCXBDSA-N -1 3 397.461 -1.206 20 0 GAADHM CCS(=O)(=O)CCCN1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001590846172 1076099766 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CNC(=O)C1(C(=O)NC[C@@H](O)CN(C)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001591201912 1076137485 /nfs/dbraw/zinc/13/74/85/1076137485.db2.gz HYZPWZYYKWWTDA-SECBINFHSA-N -1 3 390.404 -1.730 20 0 GAADHM CNC(=O)C1(C(=O)NC[C@@H](O)CN(C)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001591201912 1076137481 /nfs/dbraw/zinc/13/74/81/1076137481.db2.gz HYZPWZYYKWWTDA-SECBINFHSA-N -1 3 390.404 -1.730 20 0 GAADHM CNC(=O)C1(C(=O)NC[C@H](O)CN(C)C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001591201924 1076137432 /nfs/dbraw/zinc/13/74/32/1076137432.db2.gz HYZPWZYYKWWTDA-VIFPVBQESA-N -1 3 390.404 -1.730 20 0 GAADHM CNC(=O)C1(C(=O)NC[C@H](O)CN(C)C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001591201924 1076137427 /nfs/dbraw/zinc/13/74/27/1076137427.db2.gz HYZPWZYYKWWTDA-VIFPVBQESA-N -1 3 390.404 -1.730 20 0 GAADHM CNC(=O)[C@H]1CN(C(=O)C(=O)Nc2ccc(-c3nn[n-]n3)c(F)c2)CCO1 ZINC001591201988 1076137317 /nfs/dbraw/zinc/13/73/17/1076137317.db2.gz LROMOCHHBBXLIT-LLVKDONJSA-N -1 3 377.336 -1.082 20 0 GAADHM CNC(=O)[C@H]1CN(C(=O)C(=O)Nc2ccc(-c3nnn[n-]3)c(F)c2)CCO1 ZINC001591201988 1076137315 /nfs/dbraw/zinc/13/73/15/1076137315.db2.gz LROMOCHHBBXLIT-LLVKDONJSA-N -1 3 377.336 -1.082 20 0 GAADHM CNC(=O)[C@@H]1CN(C(=O)C(=O)Nc2ccc(-c3nn[n-]n3)c(F)c2)CCO1 ZINC001591201989 1076137287 /nfs/dbraw/zinc/13/72/87/1076137287.db2.gz LROMOCHHBBXLIT-NSHDSACASA-N -1 3 377.336 -1.082 20 0 GAADHM CNC(=O)[C@@H]1CN(C(=O)C(=O)Nc2ccc(-c3nnn[n-]3)c(F)c2)CCO1 ZINC001591201989 1076137282 /nfs/dbraw/zinc/13/72/82/1076137282.db2.gz LROMOCHHBBXLIT-NSHDSACASA-N -1 3 377.336 -1.082 20 0 GAADHM CNC(=O)[C@@H]1CN(C(=O)C(=O)N[C@H]2CCc3cc(-c4nn[n-]n4)ccc32)CCO1 ZINC001591202519 1076137308 /nfs/dbraw/zinc/13/73/08/1076137308.db2.gz SAHUONWWALPPFS-KBPBESRZSA-N -1 3 399.411 -1.056 20 0 GAADHM CNC(=O)[C@@H]1CN(C(=O)C(=O)N[C@H]2CCc3cc(-c4nnn[n-]4)ccc32)CCO1 ZINC001591202519 1076137306 /nfs/dbraw/zinc/13/73/06/1076137306.db2.gz SAHUONWWALPPFS-KBPBESRZSA-N -1 3 399.411 -1.056 20 0 GAADHM CNC(=O)[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCc3cc(-c4nn[n-]n4)ccc32)CCO1 ZINC001591202521 1076137463 /nfs/dbraw/zinc/13/74/63/1076137463.db2.gz SAHUONWWALPPFS-KGLIPLIRSA-N -1 3 399.411 -1.056 20 0 GAADHM CNC(=O)[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCc3cc(-c4nnn[n-]4)ccc32)CCO1 ZINC001591202521 1076137459 /nfs/dbraw/zinc/13/74/59/1076137459.db2.gz SAHUONWWALPPFS-KGLIPLIRSA-N -1 3 399.411 -1.056 20 0 GAADHM CNC(=O)[C@H]1CN(C(=O)C(=O)N[C@H]2CCc3cc(-c4nn[n-]n4)ccc32)CCO1 ZINC001591202523 1076137935 /nfs/dbraw/zinc/13/79/35/1076137935.db2.gz SAHUONWWALPPFS-UONOGXRCSA-N -1 3 399.411 -1.056 20 0 GAADHM CNC(=O)[C@H]1CN(C(=O)C(=O)N[C@H]2CCc3cc(-c4nnn[n-]4)ccc32)CCO1 ZINC001591202523 1076137930 /nfs/dbraw/zinc/13/79/30/1076137930.db2.gz SAHUONWWALPPFS-UONOGXRCSA-N -1 3 399.411 -1.056 20 0 GAADHM CNC(=O)[C@H]1CN(C(=O)C(=O)N[C@@H]2CCc3cc(-c4nn[n-]n4)ccc32)CCO1 ZINC001591202524 1076137842 /nfs/dbraw/zinc/13/78/42/1076137842.db2.gz SAHUONWWALPPFS-ZIAGYGMSSA-N -1 3 399.411 -1.056 20 0 GAADHM CNC(=O)[C@H]1CN(C(=O)C(=O)N[C@@H]2CCc3cc(-c4nnn[n-]4)ccc32)CCO1 ZINC001591202524 1076137837 /nfs/dbraw/zinc/13/78/37/1076137837.db2.gz SAHUONWWALPPFS-ZIAGYGMSSA-N -1 3 399.411 -1.056 20 0 GAADHM CNC(=O)[C@H]1CN(CCS(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)CCO1 ZINC001591202809 1076137907 /nfs/dbraw/zinc/13/79/07/1076137907.db2.gz YQEYNCSYBNRKBJ-LLVKDONJSA-N -1 3 381.418 -1.518 20 0 GAADHM CNC(=O)[C@H]1CN(CCS(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)CCO1 ZINC001591202809 1076137904 /nfs/dbraw/zinc/13/79/04/1076137904.db2.gz YQEYNCSYBNRKBJ-LLVKDONJSA-N -1 3 381.418 -1.518 20 0 GAADHM CNC(=O)[C@@H]1CN(CCS(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)CCO1 ZINC001591202810 1076137864 /nfs/dbraw/zinc/13/78/64/1076137864.db2.gz YQEYNCSYBNRKBJ-NSHDSACASA-N -1 3 381.418 -1.518 20 0 GAADHM CNC(=O)[C@@H]1CN(CCS(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)CCO1 ZINC001591202810 1076137863 /nfs/dbraw/zinc/13/78/63/1076137863.db2.gz YQEYNCSYBNRKBJ-NSHDSACASA-N -1 3 381.418 -1.518 20 0 GAADHM CNC(=O)C1(C(=O)NCCN(CCO)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001591203132 1076137858 /nfs/dbraw/zinc/13/78/58/1076137858.db2.gz SWCBIRMCUJUYTP-UHFFFAOYSA-N -1 3 390.404 -1.728 20 0 GAADHM CNC(=O)C1(C(=O)NCCN(CCO)C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CC1 ZINC001591203132 1076137855 /nfs/dbraw/zinc/13/78/55/1076137855.db2.gz SWCBIRMCUJUYTP-UHFFFAOYSA-N -1 3 390.404 -1.728 20 0 GAADHM CNC(=O)CC(=O)N1CC(CCO)(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001591203401 1076137901 /nfs/dbraw/zinc/13/79/01/1076137901.db2.gz BLILSTATEPGYGP-UHFFFAOYSA-N -1 3 376.377 -1.976 20 0 GAADHM CNC(=O)CC(=O)N1CC(CCO)(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001591203401 1076137899 /nfs/dbraw/zinc/13/78/99/1076137899.db2.gz BLILSTATEPGYGP-UHFFFAOYSA-N -1 3 376.377 -1.976 20 0 GAADHM CNC(=O)CC(=O)N(C)CCOCCN(C)C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001591203403 1076137874 /nfs/dbraw/zinc/13/78/74/1076137874.db2.gz BSTCAVZNSPUMBT-UHFFFAOYSA-N -1 3 392.420 -1.122 20 0 GAADHM CNC(=O)CC(=O)N(C)CCOCCN(C)C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001591203403 1076137871 /nfs/dbraw/zinc/13/78/71/1076137871.db2.gz BSTCAVZNSPUMBT-UHFFFAOYSA-N -1 3 392.420 -1.122 20 0 GAADHM CNC(=O)CC(=O)N(C)CCOCCNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001591203655 1076138345 /nfs/dbraw/zinc/13/83/45/1076138345.db2.gz DADZHWAGYXPTFK-UHFFFAOYSA-N -1 3 378.393 -1.464 20 0 GAADHM CNC(=O)CC(=O)N(C)CCOCCNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001591203655 1076138344 /nfs/dbraw/zinc/13/83/44/1076138344.db2.gz DADZHWAGYXPTFK-UHFFFAOYSA-N -1 3 378.393 -1.464 20 0 GAADHM CNC(=O)CC(=O)NC1(CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCOCC1 ZINC001591203690 1076138401 /nfs/dbraw/zinc/13/84/01/1076138401.db2.gz FAVVHVQBTJFVCF-UHFFFAOYSA-N -1 3 390.404 -1.274 20 0 GAADHM CNC(=O)CC(=O)NC1(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCOCC1 ZINC001591203690 1076138399 /nfs/dbraw/zinc/13/83/99/1076138399.db2.gz FAVVHVQBTJFVCF-UHFFFAOYSA-N -1 3 390.404 -1.274 20 0 GAADHM CNC(=O)CC(=O)N1CCOC[C@@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001591203713 1076138340 /nfs/dbraw/zinc/13/83/40/1076138340.db2.gz FTEPCIRLJZJNND-JTQLQIEISA-N -1 3 376.377 -1.712 20 0 GAADHM CNC(=O)CC(=O)N1CCOC[C@@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001591203713 1076138338 /nfs/dbraw/zinc/13/83/38/1076138338.db2.gz FTEPCIRLJZJNND-JTQLQIEISA-N -1 3 376.377 -1.712 20 0 GAADHM CNC(=O)CC(=O)N1CCOC[C@H]1CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001591203715 1076138290 /nfs/dbraw/zinc/13/82/90/1076138290.db2.gz FTEPCIRLJZJNND-SNVBAGLBSA-N -1 3 376.377 -1.712 20 0 GAADHM CNC(=O)CC(=O)N1CCOC[C@H]1CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001591203715 1076138287 /nfs/dbraw/zinc/13/82/87/1076138287.db2.gz FTEPCIRLJZJNND-SNVBAGLBSA-N -1 3 376.377 -1.712 20 0 GAADHM CNC(=O)CC(=O)N1CCOC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001591203717 1076138319 /nfs/dbraw/zinc/13/83/19/1076138319.db2.gz FTQHGGJGKWAVJP-JTQLQIEISA-N -1 3 376.377 -1.712 20 0 GAADHM CNC(=O)CC(=O)N1CCOC[C@@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001591203717 1076138318 /nfs/dbraw/zinc/13/83/18/1076138318.db2.gz FTQHGGJGKWAVJP-JTQLQIEISA-N -1 3 376.377 -1.712 20 0 GAADHM CNC(=O)CC(=O)N1CCOC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001591203719 1076138281 /nfs/dbraw/zinc/13/82/81/1076138281.db2.gz FTQHGGJGKWAVJP-SNVBAGLBSA-N -1 3 376.377 -1.712 20 0 GAADHM CNC(=O)CC(=O)N1CCOC[C@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001591203719 1076138279 /nfs/dbraw/zinc/13/82/79/1076138279.db2.gz FTQHGGJGKWAVJP-SNVBAGLBSA-N -1 3 376.377 -1.712 20 0 GAADHM CNC(=O)CC(=O)N(CCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)CCOC ZINC001591203752 1076138373 /nfs/dbraw/zinc/13/83/73/1076138373.db2.gz GEABNYFREYBIGB-UHFFFAOYSA-N -1 3 378.393 -1.464 20 0 GAADHM CNC(=O)CC(=O)N(CCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)CCOC ZINC001591203752 1076138371 /nfs/dbraw/zinc/13/83/71/1076138371.db2.gz GEABNYFREYBIGB-UHFFFAOYSA-N -1 3 378.393 -1.464 20 0 GAADHM CNC(=O)CC(=O)N1CCO[C@@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001591203754 1076138357 /nfs/dbraw/zinc/13/83/57/1076138357.db2.gz GFLXUYQFNWIJLN-JTQLQIEISA-N -1 3 376.377 -1.712 20 0 GAADHM CNC(=O)CC(=O)N1CCO[C@@H](CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001591203754 1076138355 /nfs/dbraw/zinc/13/83/55/1076138355.db2.gz GFLXUYQFNWIJLN-JTQLQIEISA-N -1 3 376.377 -1.712 20 0 GAADHM CNC(=O)CC(=O)N1CCO[C@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001591203755 1076138327 /nfs/dbraw/zinc/13/83/27/1076138327.db2.gz GFLXUYQFNWIJLN-SNVBAGLBSA-N -1 3 376.377 -1.712 20 0 GAADHM CNC(=O)CC(=O)N1CCO[C@H](CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001591203755 1076138325 /nfs/dbraw/zinc/13/83/25/1076138325.db2.gz GFLXUYQFNWIJLN-SNVBAGLBSA-N -1 3 376.377 -1.712 20 0 GAADHM CNC(=O)CC(=O)N1CC(CCO)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001591203769 1076138334 /nfs/dbraw/zinc/13/83/34/1076138334.db2.gz GKSMJUXPRGYSOE-UHFFFAOYSA-N -1 3 376.377 -1.976 20 0 GAADHM CNC(=O)CC(=O)N1CC(CCO)(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001591203769 1076138332 /nfs/dbraw/zinc/13/83/32/1076138332.db2.gz GKSMJUXPRGYSOE-UHFFFAOYSA-N -1 3 376.377 -1.976 20 0 GAADHM CNC(=O)CC(=O)NC1(CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCOCC1 ZINC001591204153 1076138868 /nfs/dbraw/zinc/13/88/68/1076138868.db2.gz JSVSFIWBOBUBLB-UHFFFAOYSA-N -1 3 390.404 -1.274 20 0 GAADHM CNC(=O)CC(=O)NC1(CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCOCC1 ZINC001591204153 1076138865 /nfs/dbraw/zinc/13/88/65/1076138865.db2.gz JSVSFIWBOBUBLB-UHFFFAOYSA-N -1 3 390.404 -1.274 20 0 GAADHM CNC(=O)CC(=O)N(CCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)CCOC ZINC001591204176 1076138943 /nfs/dbraw/zinc/13/89/43/1076138943.db2.gz KJQYHYXEFBYFPH-UHFFFAOYSA-N -1 3 378.393 -1.464 20 0 GAADHM CNC(=O)CC(=O)N(CCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)CCOC ZINC001591204176 1076138941 /nfs/dbraw/zinc/13/89/41/1076138941.db2.gz KJQYHYXEFBYFPH-UHFFFAOYSA-N -1 3 378.393 -1.464 20 0 GAADHM CNC(=O)CC(=O)N1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@H](OC)C1 ZINC001591204207 1076138839 /nfs/dbraw/zinc/13/88/39/1076138839.db2.gz LCTUTLLIGFHKFP-GHMZBOCLSA-N -1 3 376.377 -1.714 20 0 GAADHM CNC(=O)CC(=O)N1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@H](OC)C1 ZINC001591204207 1076138836 /nfs/dbraw/zinc/13/88/36/1076138836.db2.gz LCTUTLLIGFHKFP-GHMZBOCLSA-N -1 3 376.377 -1.714 20 0 GAADHM CNC(=O)CC(=O)N(C)CCOCCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001591204211 1076138958 /nfs/dbraw/zinc/13/89/58/1076138958.db2.gz LFCCAONETMYCKA-UHFFFAOYSA-N -1 3 378.393 -1.464 20 0 GAADHM CNC(=O)CC(=O)N(C)CCOCCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001591204211 1076138956 /nfs/dbraw/zinc/13/89/56/1076138956.db2.gz LFCCAONETMYCKA-UHFFFAOYSA-N -1 3 378.393 -1.464 20 0 GAADHM CNC(=O)[C@H]1CCCN1C(=O)CNS(=O)(=O)c1cncc(-c2nn[n-]n2)c1 ZINC001591204298 1076138921 /nfs/dbraw/zinc/13/89/21/1076138921.db2.gz UEPDKYCQWYWERG-LLVKDONJSA-N -1 3 394.417 -1.723 20 0 GAADHM CNC(=O)[C@H]1CCCN1C(=O)CNS(=O)(=O)c1cncc(-c2nnn[n-]2)c1 ZINC001591204298 1076138919 /nfs/dbraw/zinc/13/89/19/1076138919.db2.gz UEPDKYCQWYWERG-LLVKDONJSA-N -1 3 394.417 -1.723 20 0 GAADHM CNC(=O)[C@@H]1CCCN1C(=O)CNS(=O)(=O)c1cncc(-c2nn[n-]n2)c1 ZINC001591204299 1076138831 /nfs/dbraw/zinc/13/88/31/1076138831.db2.gz UEPDKYCQWYWERG-NSHDSACASA-N -1 3 394.417 -1.723 20 0 GAADHM CNC(=O)[C@@H]1CCCN1C(=O)CNS(=O)(=O)c1cncc(-c2nnn[n-]2)c1 ZINC001591204299 1076138828 /nfs/dbraw/zinc/13/88/28/1076138828.db2.gz UEPDKYCQWYWERG-NSHDSACASA-N -1 3 394.417 -1.723 20 0 GAADHM CNC(=O)CC(=O)N1CC2(C1)C[C@H](NC(=O)c1cc(-c3nn[n-]n3)c[nH]1)CO2 ZINC001591204534 1076138915 /nfs/dbraw/zinc/13/89/15/1076138915.db2.gz OXOFFVSVQIYKHK-JTQLQIEISA-N -1 3 388.388 -1.569 20 0 GAADHM CNC(=O)CC(=O)N1CC2(C1)C[C@H](NC(=O)c1cc(-c3nnn[n-]3)c[nH]1)CO2 ZINC001591204534 1076138913 /nfs/dbraw/zinc/13/89/13/1076138913.db2.gz OXOFFVSVQIYKHK-JTQLQIEISA-N -1 3 388.388 -1.569 20 0 GAADHM CNC(=O)CC(=O)N1CC2(C1)C[C@@H](NC(=O)c1cc(-c3nn[n-]n3)c[nH]1)CO2 ZINC001591204535 1076138891 /nfs/dbraw/zinc/13/88/91/1076138891.db2.gz OXOFFVSVQIYKHK-SNVBAGLBSA-N -1 3 388.388 -1.569 20 0 GAADHM CNC(=O)CC(=O)N1CC2(C1)C[C@@H](NC(=O)c1cc(-c3nnn[n-]3)c[nH]1)CO2 ZINC001591204535 1076138889 /nfs/dbraw/zinc/13/88/89/1076138889.db2.gz OXOFFVSVQIYKHK-SNVBAGLBSA-N -1 3 388.388 -1.569 20 0 GAADHM CNC(=O)C[C@@H](C)NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001591204985 1076138949 /nfs/dbraw/zinc/13/89/49/1076138949.db2.gz SPYAKXOLGANTLX-SECBINFHSA-N -1 3 381.418 -1.214 20 0 GAADHM CNC(=O)C[C@@H](C)NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001591204985 1076138947 /nfs/dbraw/zinc/13/89/47/1076138947.db2.gz SPYAKXOLGANTLX-SECBINFHSA-N -1 3 381.418 -1.214 20 0 GAADHM CNC(=O)C[C@H](C)NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001591204986 1076138883 /nfs/dbraw/zinc/13/88/83/1076138883.db2.gz SPYAKXOLGANTLX-VIFPVBQESA-N -1 3 381.418 -1.214 20 0 GAADHM CNC(=O)C[C@H](C)NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001591204986 1076138878 /nfs/dbraw/zinc/13/88/78/1076138878.db2.gz SPYAKXOLGANTLX-VIFPVBQESA-N -1 3 381.418 -1.214 20 0 GAADHM CNC(=O)CC(=O)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@H](O)C1 ZINC001591204992 1076138818 /nfs/dbraw/zinc/13/88/18/1076138818.db2.gz SSCOZNVQMAJBMW-GXSJLCMTSA-N -1 3 376.377 -1.978 20 0 GAADHM CNC(=O)CC(=O)N1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@H](O)C1 ZINC001591204992 1076138815 /nfs/dbraw/zinc/13/88/15/1076138815.db2.gz SSCOZNVQMAJBMW-GXSJLCMTSA-N -1 3 376.377 -1.978 20 0 GAADHM CNC(=O)CC(=O)N1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001591204993 1076138909 /nfs/dbraw/zinc/13/89/09/1076138909.db2.gz SSCOZNVQMAJBMW-KOLCDFICSA-N -1 3 376.377 -1.978 20 0 GAADHM CNC(=O)CC(=O)N1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001591204993 1076138907 /nfs/dbraw/zinc/13/89/07/1076138907.db2.gz SSCOZNVQMAJBMW-KOLCDFICSA-N -1 3 376.377 -1.978 20 0 GAADHM CNC(=O)CC(=O)N1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@H](O)C1 ZINC001591204994 1076138903 /nfs/dbraw/zinc/13/89/03/1076138903.db2.gz SSCOZNVQMAJBMW-MWLCHTKSSA-N -1 3 376.377 -1.978 20 0 GAADHM CNC(=O)CC(=O)N1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@H](O)C1 ZINC001591204994 1076138901 /nfs/dbraw/zinc/13/89/01/1076138901.db2.gz SSCOZNVQMAJBMW-MWLCHTKSSA-N -1 3 376.377 -1.978 20 0 GAADHM CNC(=O)CC(=O)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001591204995 1076138897 /nfs/dbraw/zinc/13/88/97/1076138897.db2.gz SSCOZNVQMAJBMW-ONGXEEELSA-N -1 3 376.377 -1.978 20 0 GAADHM CNC(=O)CC(=O)N1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001591204995 1076138895 /nfs/dbraw/zinc/13/88/95/1076138895.db2.gz SSCOZNVQMAJBMW-ONGXEEELSA-N -1 3 376.377 -1.978 20 0 GAADHM CNC(=O)CC(=O)N1CCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001591205572 1076138936 /nfs/dbraw/zinc/13/89/36/1076138936.db2.gz VXQKCOSUDFHUMX-UHFFFAOYSA-N -1 3 393.429 -1.164 20 0 GAADHM CNC(=O)CC(=O)N1CCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001591205572 1076138934 /nfs/dbraw/zinc/13/89/34/1076138934.db2.gz VXQKCOSUDFHUMX-UHFFFAOYSA-N -1 3 393.429 -1.164 20 0 GAADHM CNC(=O)C[C@@H](C)NC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001591205586 1076138797 /nfs/dbraw/zinc/13/87/97/1076138797.db2.gz WSBIJFVPNDXZTJ-SECBINFHSA-N -1 3 381.418 -1.214 20 0 GAADHM CNC(=O)C[C@@H](C)NC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001591205586 1076138793 /nfs/dbraw/zinc/13/87/93/1076138793.db2.gz WSBIJFVPNDXZTJ-SECBINFHSA-N -1 3 381.418 -1.214 20 0 GAADHM CNC(=O)C[C@H](C)NC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001591205587 1076138850 /nfs/dbraw/zinc/13/88/50/1076138850.db2.gz WSBIJFVPNDXZTJ-VIFPVBQESA-N -1 3 381.418 -1.214 20 0 GAADHM CNC(=O)C[C@H](C)NC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001591205587 1076138847 /nfs/dbraw/zinc/13/88/47/1076138847.db2.gz WSBIJFVPNDXZTJ-VIFPVBQESA-N -1 3 381.418 -1.214 20 0 GAADHM CNC(=O)CC(=O)N1CCC[C@](CO)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001591205595 1076139298 /nfs/dbraw/zinc/13/92/98/1076139298.db2.gz XCKOVFNNTMYIDA-INIZCTEOSA-N -1 3 390.404 -1.586 20 0 GAADHM CNC(=O)CC(=O)N1CCC[C@](CO)(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001591205595 1076139295 /nfs/dbraw/zinc/13/92/95/1076139295.db2.gz XCKOVFNNTMYIDA-INIZCTEOSA-N -1 3 390.404 -1.586 20 0 GAADHM CNC(=O)CC(=O)N1CCC[C@@](CO)(NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001591205596 1076139307 /nfs/dbraw/zinc/13/93/07/1076139307.db2.gz XCKOVFNNTMYIDA-MRXNPFEDSA-N -1 3 390.404 -1.586 20 0 GAADHM CNC(=O)CC(=O)N1CCC[C@@](CO)(NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001591205596 1076139304 /nfs/dbraw/zinc/13/93/04/1076139304.db2.gz XCKOVFNNTMYIDA-MRXNPFEDSA-N -1 3 390.404 -1.586 20 0 GAADHM CNC(=O)CC(=O)N1CC(CCO)(NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001591205611 1076139283 /nfs/dbraw/zinc/13/92/83/1076139283.db2.gz XOIQZXYGRIRDFM-UHFFFAOYSA-N -1 3 376.377 -1.976 20 0 GAADHM CNC(=O)CC(=O)N1CC(CCO)(NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001591205611 1076139280 /nfs/dbraw/zinc/13/92/80/1076139280.db2.gz XOIQZXYGRIRDFM-UHFFFAOYSA-N -1 3 376.377 -1.976 20 0 GAADHM CNC(=O)CCCNC(=O)C(=O)NCCNc1ncccc1-c1nn[n-]n1 ZINC001591207189 1076139365 /nfs/dbraw/zinc/13/93/65/1076139365.db2.gz UJRITKCPSWXMOY-UHFFFAOYSA-N -1 3 375.393 -1.568 20 0 GAADHM CNC(=O)CCCNC(=O)C(=O)NCCNc1ncccc1-c1nnn[n-]1 ZINC001591207189 1076139362 /nfs/dbraw/zinc/13/93/62/1076139362.db2.gz UJRITKCPSWXMOY-UHFFFAOYSA-N -1 3 375.393 -1.568 20 0 GAADHM CNC(=O)CCCNC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001591207202 1076139376 /nfs/dbraw/zinc/13/93/76/1076139376.db2.gz VLXVWZJCRIWWHV-UHFFFAOYSA-N -1 3 381.418 -1.213 20 0 GAADHM CNC(=O)CCCNC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001591207202 1076139373 /nfs/dbraw/zinc/13/93/73/1076139373.db2.gz VLXVWZJCRIWWHV-UHFFFAOYSA-N -1 3 381.418 -1.213 20 0 GAADHM CNC(=O)CN(CC(=O)NC)C(=O)COc1ccc(-c2nn[n-]n2)cc1OC ZINC001591208190 1076139260 /nfs/dbraw/zinc/13/92/60/1076139260.db2.gz CVDZXFFXJZVLMM-UHFFFAOYSA-N -1 3 391.388 -1.425 20 0 GAADHM CNC(=O)CN(CC(=O)NC)C(=O)COc1ccc(-c2nnn[n-]2)cc1OC ZINC001591208190 1076139256 /nfs/dbraw/zinc/13/92/56/1076139256.db2.gz CVDZXFFXJZVLMM-UHFFFAOYSA-N -1 3 391.388 -1.425 20 0 GAADHM CNC(=O)CN(CCS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)CC(=O)NC ZINC001591208737 1076139202 /nfs/dbraw/zinc/13/92/02/1076139202.db2.gz WFYDLWDHSCJSNR-UHFFFAOYSA-N -1 3 395.445 -1.566 20 0 GAADHM CNC(=O)CN(CCS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)CC(=O)NC ZINC001591208737 1076139198 /nfs/dbraw/zinc/13/91/98/1076139198.db2.gz WFYDLWDHSCJSNR-UHFFFAOYSA-N -1 3 395.445 -1.566 20 0 GAADHM CNC(=O)CN1CCN(CCCNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001591208856 1076139272 /nfs/dbraw/zinc/13/92/72/1076139272.db2.gz JTTLGMDKHZTMNH-UHFFFAOYSA-N -1 3 375.437 -1.322 20 0 GAADHM CNC(=O)CN1CCN(CCCNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001591209090 1076139246 /nfs/dbraw/zinc/13/92/46/1076139246.db2.gz SJMADVWLMRGICW-UHFFFAOYSA-N -1 3 375.437 -1.322 20 0 GAADHM CNC(=O)CN1CCN(CCCNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001591209090 1076139242 /nfs/dbraw/zinc/13/92/42/1076139242.db2.gz SJMADVWLMRGICW-UHFFFAOYSA-N -1 3 375.437 -1.322 20 0 GAADHM CNC(=O)CN1CCN(S(=O)(=O)c2cnc(C)c(-c3nn[n-]n3)c2)CC1 ZINC001591209120 1076139386 /nfs/dbraw/zinc/13/93/86/1076139386.db2.gz VODZKXABCYCTPV-UHFFFAOYSA-N -1 3 380.434 -1.378 20 0 GAADHM CNC(=O)CN1CCN(S(=O)(=O)c2cnc(C)c(-c3nnn[n-]3)c2)CC1 ZINC001591209120 1076139382 /nfs/dbraw/zinc/13/93/82/1076139382.db2.gz VODZKXABCYCTPV-UHFFFAOYSA-N -1 3 380.434 -1.378 20 0 GAADHM CNC(=O)CNC(=O)CC[C@H]1NC(=O)N(c2ccc(-c3nn[n-]n3)cc2)C1=O ZINC001591209160 1076139324 /nfs/dbraw/zinc/13/93/24/1076139324.db2.gz ZELAPEPHMPBXCP-LLVKDONJSA-N -1 3 386.372 -1.066 20 0 GAADHM CNC(=O)CNC(=O)CC[C@H]1NC(=O)N(c2ccc(-c3nnn[n-]3)cc2)C1=O ZINC001591209160 1076139321 /nfs/dbraw/zinc/13/93/21/1076139321.db2.gz ZELAPEPHMPBXCP-LLVKDONJSA-N -1 3 386.372 -1.066 20 0 GAADHM CNC(=O)CNC(=O)CC[C@@H]1NC(=O)N(c2ccc(-c3nn[n-]n3)cc2)C1=O ZINC001591209161 1076139351 /nfs/dbraw/zinc/13/93/51/1076139351.db2.gz ZELAPEPHMPBXCP-NSHDSACASA-N -1 3 386.372 -1.066 20 0 GAADHM CNC(=O)CNC(=O)CC[C@@H]1NC(=O)N(c2ccc(-c3nnn[n-]3)cc2)C1=O ZINC001591209161 1076139347 /nfs/dbraw/zinc/13/93/47/1076139347.db2.gz ZELAPEPHMPBXCP-NSHDSACASA-N -1 3 386.372 -1.066 20 0 GAADHM CNC(=O)NC(=O)[C@H](C)N1CCN(c2c(-c3nn[n-]n3)c(C)nn2C)CC1 ZINC001591209305 1076139795 /nfs/dbraw/zinc/13/97/95/1076139795.db2.gz CIELVWFROCMMFG-JTQLQIEISA-N -1 3 376.425 -1.125 20 0 GAADHM CNC(=O)NC(=O)[C@H](C)N1CCN(c2c(-c3nnn[n-]3)c(C)nn2C)CC1 ZINC001591209305 1076139794 /nfs/dbraw/zinc/13/97/94/1076139794.db2.gz CIELVWFROCMMFG-JTQLQIEISA-N -1 3 376.425 -1.125 20 0 GAADHM CNC(=O)NC(=O)[C@@H](C)N1CCN(c2c(-c3nn[n-]n3)c(C)nn2C)CC1 ZINC001591209306 1076139788 /nfs/dbraw/zinc/13/97/88/1076139788.db2.gz CIELVWFROCMMFG-SNVBAGLBSA-N -1 3 376.425 -1.125 20 0 GAADHM CNC(=O)NC(=O)[C@@H](C)N1CCN(c2c(-c3nnn[n-]3)c(C)nn2C)CC1 ZINC001591209306 1076139786 /nfs/dbraw/zinc/13/97/86/1076139786.db2.gz CIELVWFROCMMFG-SNVBAGLBSA-N -1 3 376.425 -1.125 20 0 GAADHM CNC(=O)Cc1noc(CN2CC(NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001591209714 1076139742 /nfs/dbraw/zinc/13/97/42/1076139742.db2.gz UILRRKPXLGNIQS-UHFFFAOYSA-N -1 3 386.376 -1.520 20 0 GAADHM CNC(=O)Cc1noc(CN2CC(NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001591209714 1076139739 /nfs/dbraw/zinc/13/97/39/1076139739.db2.gz UILRRKPXLGNIQS-UHFFFAOYSA-N -1 3 386.376 -1.520 20 0 GAADHM CNC(=O)Cc1noc(CNCCN(C)C(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001591209921 1076139842 /nfs/dbraw/zinc/13/98/42/1076139842.db2.gz ZFAGYRDTMDYPLP-UHFFFAOYSA-N -1 3 388.392 -1.272 20 0 GAADHM CNC(=O)Cc1noc(CNCCN(C)C(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001591209921 1076139840 /nfs/dbraw/zinc/13/98/40/1076139840.db2.gz ZFAGYRDTMDYPLP-UHFFFAOYSA-N -1 3 388.392 -1.272 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2Cl)C[C@@H]1O ZINC001591210277 1076139804 /nfs/dbraw/zinc/13/98/04/1076139804.db2.gz CDIAZMOVJRKNPC-ZJUUUORDSA-N -1 3 395.811 -1.490 20 0 GAADHM CNC(=O)NCC(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2Cl)C[C@@H]1O ZINC001591210277 1076139801 /nfs/dbraw/zinc/13/98/01/1076139801.db2.gz CDIAZMOVJRKNPC-ZJUUUORDSA-N -1 3 395.811 -1.490 20 0 GAADHM CNC(=O)NC[C@H]1CN(S(=O)(=O)c2cncc(-c3nn[n-]n3)c2)CCO1 ZINC001591210317 1076139658 /nfs/dbraw/zinc/13/96/58/1076139658.db2.gz FRYMYLFJDQUMGT-JTQLQIEISA-N -1 3 382.406 -1.420 20 0 GAADHM CNC(=O)NC[C@H]1CN(S(=O)(=O)c2cncc(-c3nnn[n-]3)c2)CCO1 ZINC001591210317 1076139653 /nfs/dbraw/zinc/13/96/53/1076139653.db2.gz FRYMYLFJDQUMGT-JTQLQIEISA-N -1 3 382.406 -1.420 20 0 GAADHM CNC(=O)NC[C@@H]1CN(S(=O)(=O)c2cncc(-c3nn[n-]n3)c2)CCO1 ZINC001591210318 1076139767 /nfs/dbraw/zinc/13/97/67/1076139767.db2.gz FRYMYLFJDQUMGT-SNVBAGLBSA-N -1 3 382.406 -1.420 20 0 GAADHM CNC(=O)NC[C@@H]1CN(S(=O)(=O)c2cncc(-c3nnn[n-]3)c2)CCO1 ZINC001591210318 1076139764 /nfs/dbraw/zinc/13/97/64/1076139764.db2.gz FRYMYLFJDQUMGT-SNVBAGLBSA-N -1 3 382.406 -1.420 20 0 GAADHM CNC(=O)NCC(=O)NCCOCCN(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001591210330 1076139780 /nfs/dbraw/zinc/13/97/80/1076139780.db2.gz GMQSYPRXNVSAHY-UHFFFAOYSA-N -1 3 377.409 -1.240 20 0 GAADHM CNC(=O)NCC(=O)NCCOCCN(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001591210330 1076139779 /nfs/dbraw/zinc/13/97/79/1076139779.db2.gz GMQSYPRXNVSAHY-UHFFFAOYSA-N -1 3 377.409 -1.240 20 0 GAADHM CNC(=O)NC[C@@H]1CN(C(=O)C(=O)Nc2cccc(-c3nn[n-]n3)c2)CCO1 ZINC001591210369 1076139759 /nfs/dbraw/zinc/13/97/59/1076139759.db2.gz JAAWNBBSKLURGO-GFCCVEGCSA-N -1 3 388.388 -1.038 20 0 GAADHM CNC(=O)NC[C@@H]1CN(C(=O)C(=O)Nc2cccc(-c3nnn[n-]3)c2)CCO1 ZINC001591210369 1076139756 /nfs/dbraw/zinc/13/97/56/1076139756.db2.gz JAAWNBBSKLURGO-GFCCVEGCSA-N -1 3 388.388 -1.038 20 0 GAADHM CNC(=O)NC[C@H]1CN(C(=O)C(=O)Nc2cccc(-c3nn[n-]n3)c2)CCO1 ZINC001591210370 1076139823 /nfs/dbraw/zinc/13/98/23/1076139823.db2.gz JAAWNBBSKLURGO-LBPRGKRZSA-N -1 3 388.388 -1.038 20 0 GAADHM CNC(=O)NC[C@H]1CN(C(=O)C(=O)Nc2cccc(-c3nnn[n-]3)c2)CCO1 ZINC001591210370 1076139820 /nfs/dbraw/zinc/13/98/20/1076139820.db2.gz JAAWNBBSKLURGO-LBPRGKRZSA-N -1 3 388.388 -1.038 20 0 GAADHM CNC(=O)NCC(=O)NCCOCCN(C)c1ncccc1-c1nn[n-]n1 ZINC001591210585 1076140112 /nfs/dbraw/zinc/14/01/12/1076140112.db2.gz VHOSFAGIFBOHRG-UHFFFAOYSA-N -1 3 377.409 -1.240 20 0 GAADHM CNC(=O)NCC(=O)NCCOCCN(C)c1ncccc1-c1nnn[n-]1 ZINC001591210585 1076140109 /nfs/dbraw/zinc/14/01/09/1076140109.db2.gz VHOSFAGIFBOHRG-UHFFFAOYSA-N -1 3 377.409 -1.240 20 0 GAADHM CNC(=O)NC[C@@H]1COCCN1C(=O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001591210610 1076140260 /nfs/dbraw/zinc/14/02/60/1076140260.db2.gz AQIIUMKUNZFEGV-LLVKDONJSA-N -1 3 375.393 -1.170 20 0 GAADHM CNC(=O)NC[C@@H]1COCCN1C(=O)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001591210610 1076140257 /nfs/dbraw/zinc/14/02/57/1076140257.db2.gz AQIIUMKUNZFEGV-LLVKDONJSA-N -1 3 375.393 -1.170 20 0 GAADHM CNC(=O)NC[C@H]1COCCN1C(=O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001591210612 1076140069 /nfs/dbraw/zinc/14/00/69/1076140069.db2.gz AQIIUMKUNZFEGV-NSHDSACASA-N -1 3 375.393 -1.170 20 0 GAADHM CNC(=O)NC[C@H]1COCCN1C(=O)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001591210612 1076140066 /nfs/dbraw/zinc/14/00/66/1076140066.db2.gz AQIIUMKUNZFEGV-NSHDSACASA-N -1 3 375.393 -1.170 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001591211577 1076140004 /nfs/dbraw/zinc/14/00/04/1076140004.db2.gz VWVJEQFMILDBCB-MNOVXSKESA-N -1 3 393.383 -1.614 20 0 GAADHM CNC(=O)NCCC(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001591211577 1076140000 /nfs/dbraw/zinc/14/00/00/1076140000.db2.gz VWVJEQFMILDBCB-MNOVXSKESA-N -1 3 393.383 -1.614 20 0 GAADHM CNS(=O)(=O)[C@H]1CCCN(S(=O)(=O)c2cncc(-c3nn[n-]n3)c2)C1 ZINC001591218963 1076140580 /nfs/dbraw/zinc/14/05/80/1076140580.db2.gz OHFLFOQAWJBGCP-JTQLQIEISA-N -1 3 387.447 -1.036 20 0 GAADHM CNS(=O)(=O)[C@H]1CCCN(S(=O)(=O)c2cncc(-c3nnn[n-]3)c2)C1 ZINC001591218963 1076140577 /nfs/dbraw/zinc/14/05/77/1076140577.db2.gz OHFLFOQAWJBGCP-JTQLQIEISA-N -1 3 387.447 -1.036 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCCN(S(=O)(=O)c2cncc(-c3nn[n-]n3)c2)C1 ZINC001591218964 1076140722 /nfs/dbraw/zinc/14/07/22/1076140722.db2.gz OHFLFOQAWJBGCP-SNVBAGLBSA-N -1 3 387.447 -1.036 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCCN(S(=O)(=O)c2cncc(-c3nnn[n-]3)c2)C1 ZINC001591218964 1076140721 /nfs/dbraw/zinc/14/07/21/1076140721.db2.gz OHFLFOQAWJBGCP-SNVBAGLBSA-N -1 3 387.447 -1.036 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(-c3nn[n-]n3)cc2)C1 ZINC001591219003 1076140751 /nfs/dbraw/zinc/14/07/51/1076140751.db2.gz PWPIBCGAVKHNQO-GFCCVEGCSA-N -1 3 393.429 -1.367 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(-c3nnn[n-]3)cc2)C1 ZINC001591219003 1076140748 /nfs/dbraw/zinc/14/07/48/1076140748.db2.gz PWPIBCGAVKHNQO-GFCCVEGCSA-N -1 3 393.429 -1.367 20 0 GAADHM CNS(=O)(=O)[C@H]1CCN(C(=O)C(=O)NCc2ccc(-c3nn[n-]n3)cc2)C1 ZINC001591219004 1076140684 /nfs/dbraw/zinc/14/06/84/1076140684.db2.gz PWPIBCGAVKHNQO-LBPRGKRZSA-N -1 3 393.429 -1.367 20 0 GAADHM CNS(=O)(=O)[C@H]1CCN(C(=O)C(=O)NCc2ccc(-c3nnn[n-]3)cc2)C1 ZINC001591219004 1076140680 /nfs/dbraw/zinc/14/06/80/1076140680.db2.gz PWPIBCGAVKHNQO-LBPRGKRZSA-N -1 3 393.429 -1.367 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O ZINC001591219111 1076140729 /nfs/dbraw/zinc/14/07/29/1076140729.db2.gz DDELJRDAHCRIPP-VXGBXAGGSA-N -1 3 396.433 -2.133 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O ZINC001591219111 1076140727 /nfs/dbraw/zinc/14/07/27/1076140727.db2.gz DDELJRDAHCRIPP-VXGBXAGGSA-N -1 3 396.433 -2.133 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001591219115 1076140675 /nfs/dbraw/zinc/14/06/75/1076140675.db2.gz RVRURKBQWAYKSV-SECBINFHSA-N -1 3 380.390 -1.650 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001591219115 1076140672 /nfs/dbraw/zinc/14/06/72/1076140672.db2.gz RVRURKBQWAYKSV-SECBINFHSA-N -1 3 380.390 -1.650 20 0 GAADHM CNS(=O)(=O)[C@H]1CCN(C(=O)C(=O)Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001591219122 1076140745 /nfs/dbraw/zinc/14/07/45/1076140745.db2.gz RVRURKBQWAYKSV-VIFPVBQESA-N -1 3 380.390 -1.650 20 0 GAADHM CNS(=O)(=O)[C@H]1CCN(C(=O)C(=O)Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001591219122 1076140743 /nfs/dbraw/zinc/14/07/43/1076140743.db2.gz RVRURKBQWAYKSV-VIFPVBQESA-N -1 3 380.390 -1.650 20 0 GAADHM CNS(=O)(=O)[C@H]1CCCN(C(=O)C(=O)Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001591219355 1076141183 /nfs/dbraw/zinc/14/11/83/1076141183.db2.gz XHMQFPCSQREYSA-JTQLQIEISA-N -1 3 394.417 -1.260 20 0 GAADHM CNS(=O)(=O)[C@H]1CCCN(C(=O)C(=O)Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001591219355 1076141180 /nfs/dbraw/zinc/14/11/80/1076141180.db2.gz XHMQFPCSQREYSA-JTQLQIEISA-N -1 3 394.417 -1.260 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCCN(C(=O)C(=O)Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001591219357 1076141147 /nfs/dbraw/zinc/14/11/47/1076141147.db2.gz XHMQFPCSQREYSA-SNVBAGLBSA-N -1 3 394.417 -1.260 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCCN(C(=O)C(=O)Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001591219357 1076141146 /nfs/dbraw/zinc/14/11/46/1076141146.db2.gz XHMQFPCSQREYSA-SNVBAGLBSA-N -1 3 394.417 -1.260 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@@H](C)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001591219364 1076141048 /nfs/dbraw/zinc/14/10/48/1076141048.db2.gz FCARCWXKJFBQRD-LDYMZIIASA-N -1 3 396.433 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N1C[C@@H](C)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001591219364 1076141046 /nfs/dbraw/zinc/14/10/46/1076141046.db2.gz FCARCWXKJFBQRD-LDYMZIIASA-N -1 3 396.433 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1C ZINC001591219387 1076141016 /nfs/dbraw/zinc/14/10/16/1076141016.db2.gz GJAUXDPCVIWPAT-LDYMZIIASA-N -1 3 396.433 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1C ZINC001591219387 1076141011 /nfs/dbraw/zinc/14/10/11/1076141011.db2.gz GJAUXDPCVIWPAT-LDYMZIIASA-N -1 3 396.433 -1.679 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(Cc2ccccc2-c2nn[n-]n2)C[C@@H]1O ZINC001591219407 1076141068 /nfs/dbraw/zinc/14/10/68/1076141068.db2.gz HBFVJFLABDIJBI-OLZOCXBDSA-N -1 3 395.445 -1.923 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2nc(C)ccc2-c2nn[n-]n2)C[C@@H]1O ZINC001591219447 1076141679 /nfs/dbraw/zinc/14/16/79/1076141679.db2.gz IDEXASPFYRHSSO-MNOVXSKESA-N -1 3 396.433 -2.215 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2nc(C)ccc2-c2nnn[n-]2)C[C@@H]1O ZINC001591219447 1076141676 /nfs/dbraw/zinc/14/16/76/1076141676.db2.gz IDEXASPFYRHSSO-MNOVXSKESA-N -1 3 396.433 -2.215 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)Nc2cc(C)c(-c3nn[n-]n3)cn2)C1 ZINC001591219452 1076141602 /nfs/dbraw/zinc/14/16/02/1076141602.db2.gz ZFPPGMJLDMSTRB-SECBINFHSA-N -1 3 394.417 -1.341 20 0 GAADHM CNS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)Nc2cc(C)c(-c3nnn[n-]3)cn2)C1 ZINC001591219452 1076141601 /nfs/dbraw/zinc/14/16/01/1076141601.db2.gz ZFPPGMJLDMSTRB-SECBINFHSA-N -1 3 394.417 -1.341 20 0 GAADHM CNS(=O)(=O)[C@H]1CCN(C(=O)C(=O)Nc2cc(C)c(-c3nn[n-]n3)cn2)C1 ZINC001591219454 1076141525 /nfs/dbraw/zinc/14/15/25/1076141525.db2.gz ZFPPGMJLDMSTRB-VIFPVBQESA-N -1 3 394.417 -1.341 20 0 GAADHM CNS(=O)(=O)[C@H]1CCN(C(=O)C(=O)Nc2cc(C)c(-c3nnn[n-]3)cn2)C1 ZINC001591219454 1076141523 /nfs/dbraw/zinc/14/15/23/1076141523.db2.gz ZFPPGMJLDMSTRB-VIFPVBQESA-N -1 3 394.417 -1.341 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001591219537 1076141659 /nfs/dbraw/zinc/14/16/59/1076141659.db2.gz OMUJVHVYUNTEQG-MNOVXSKESA-N -1 3 396.433 -2.133 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001591219537 1076141655 /nfs/dbraw/zinc/14/16/55/1076141655.db2.gz OMUJVHVYUNTEQG-MNOVXSKESA-N -1 3 396.433 -2.133 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCN(Cc2ccc(-c3nn[n-]n3)cc2)C1=O ZINC001591219615 1076141688 /nfs/dbraw/zinc/14/16/88/1076141688.db2.gz OZWLVYAQJOSWPB-GFCCVEGCSA-N -1 3 393.429 -1.367 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CCN(Cc2ccc(-c3nnn[n-]3)cc2)C1=O ZINC001591219615 1076141684 /nfs/dbraw/zinc/14/16/84/1076141684.db2.gz OZWLVYAQJOSWPB-GFCCVEGCSA-N -1 3 393.429 -1.367 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(Cc2ccc(-c3nn[n-]n3)cc2)C1=O ZINC001591219616 1076141544 /nfs/dbraw/zinc/14/15/44/1076141544.db2.gz OZWLVYAQJOSWPB-LBPRGKRZSA-N -1 3 393.429 -1.367 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(Cc2ccc(-c3nnn[n-]3)cc2)C1=O ZINC001591219616 1076141542 /nfs/dbraw/zinc/14/15/42/1076141542.db2.gz OZWLVYAQJOSWPB-LBPRGKRZSA-N -1 3 393.429 -1.367 20 0 GAADHM CNS(=O)(=O)CCCN1CCN(c2c(-c3nn[n-]n3)c(C)nn2C)CC1 ZINC001591219700 1076141616 /nfs/dbraw/zinc/14/16/16/1076141616.db2.gz RJGRTIFNKZLXIS-UHFFFAOYSA-N -1 3 383.482 -1.030 20 0 GAADHM CNS(=O)(=O)CCCN1CCN(c2c(-c3nnn[n-]3)c(C)nn2C)CC1 ZINC001591219700 1076141612 /nfs/dbraw/zinc/14/16/12/1076141612.db2.gz RJGRTIFNKZLXIS-UHFFFAOYSA-N -1 3 383.482 -1.030 20 0 GAADHM CNS(=O)(=O)CCCNC(=O)NCCNc1ccc(-c2nn[n-]n2)cn1 ZINC001591219761 1076142073 /nfs/dbraw/zinc/14/20/73/1076142073.db2.gz WZPSFEPGIJBNAI-UHFFFAOYSA-N -1 3 383.438 -1.088 20 0 GAADHM CNS(=O)(=O)CCCNC(=O)NCCNc1ccc(-c2nnn[n-]2)cn1 ZINC001591219761 1076142070 /nfs/dbraw/zinc/14/20/70/1076142070.db2.gz WZPSFEPGIJBNAI-UHFFFAOYSA-N -1 3 383.438 -1.088 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H]1C ZINC001591219810 1076142012 /nfs/dbraw/zinc/14/20/12/1076142012.db2.gz ZQLAZBJLXIGPDA-SCZZXKLOSA-N -1 3 396.433 -1.537 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@H]1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H]1C ZINC001591219810 1076142009 /nfs/dbraw/zinc/14/20/09/1076142009.db2.gz ZQLAZBJLXIGPDA-SCZZXKLOSA-N -1 3 396.433 -1.537 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCCNc1ncc(-c2nn[n-]n2)cc1F ZINC001591219848 1076142083 /nfs/dbraw/zinc/14/20/83/1076142083.db2.gz AYQRQDUSKAUQQG-UHFFFAOYSA-N -1 3 387.401 -1.627 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCCNc1ncc(-c2nnn[n-]2)cc1F ZINC001591219848 1076142080 /nfs/dbraw/zinc/14/20/80/1076142080.db2.gz AYQRQDUSKAUQQG-UHFFFAOYSA-N -1 3 387.401 -1.627 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCNc1snc(C)c1-c1nnn[n-]1 ZINC001591219960 1076142061 /nfs/dbraw/zinc/14/20/61/1076142061.db2.gz GKSLZAKNHNXBAT-UHFFFAOYSA-N -1 3 375.440 -1.786 20 0 GAADHM CNS(=O)(=O)CCNC(=O)C(=O)Nc1ccc(-c2nn[n-]n2)cc1OC ZINC001591219963 1076141993 /nfs/dbraw/zinc/14/19/93/1076141993.db2.gz FEMVKMUWPWMPAM-UHFFFAOYSA-N -1 3 383.390 -1.521 20 0 GAADHM CNS(=O)(=O)CCNC(=O)C(=O)Nc1ccc(-c2nnn[n-]2)cc1OC ZINC001591219963 1076141989 /nfs/dbraw/zinc/14/19/89/1076141989.db2.gz FEMVKMUWPWMPAM-UHFFFAOYSA-N -1 3 383.390 -1.521 20 0 GAADHM CNS(=O)(=O)NC1CCN(C(=O)[C@H](O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001591219972 1076142169 /nfs/dbraw/zinc/14/21/69/1076142169.db2.gz FIIOSHLWUHTXNU-CYBMUJFWSA-N -1 3 395.445 -1.055 20 0 GAADHM CNS(=O)(=O)NC1CCN(C(=O)[C@H](O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001591219972 1076142165 /nfs/dbraw/zinc/14/21/65/1076142165.db2.gz FIIOSHLWUHTXNU-CYBMUJFWSA-N -1 3 395.445 -1.055 20 0 GAADHM CNS(=O)(=O)NC1CCN(C(=O)[C@@H](O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001591219973 1076141980 /nfs/dbraw/zinc/14/19/80/1076141980.db2.gz FIIOSHLWUHTXNU-ZDUSSCGKSA-N -1 3 395.445 -1.055 20 0 GAADHM CNS(=O)(=O)NC1CCN(C(=O)[C@@H](O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001591219973 1076141977 /nfs/dbraw/zinc/14/19/77/1076141977.db2.gz FIIOSHLWUHTXNU-ZDUSSCGKSA-N -1 3 395.445 -1.055 20 0 GAADHM CNS(=O)(=O)N1CCN(C[C@@H](O)COc2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001591219983 1076142002 /nfs/dbraw/zinc/14/20/02/1076142002.db2.gz FXRALMSDEGDLOO-CYBMUJFWSA-N -1 3 397.461 -1.312 20 0 GAADHM CNS(=O)(=O)N1CCN(C[C@H](O)COc2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001591219985 1076142041 /nfs/dbraw/zinc/14/20/41/1076142041.db2.gz FXRALMSDEGDLOO-ZDUSSCGKSA-N -1 3 397.461 -1.312 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)CCCNc1ccc(-c2nn[n-]n2)nc1 ZINC001591220023 1076142090 /nfs/dbraw/zinc/14/20/90/1076142090.db2.gz GNWUJIYXKNHQAS-UHFFFAOYSA-N -1 3 383.438 -1.424 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)CCCNc1ccc(-c2nnn[n-]2)nc1 ZINC001591220023 1076142086 /nfs/dbraw/zinc/14/20/86/1076142086.db2.gz GNWUJIYXKNHQAS-UHFFFAOYSA-N -1 3 383.438 -1.424 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCN(Cc2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001591220042 1076142147 /nfs/dbraw/zinc/14/21/47/1076142147.db2.gz JQGNOYSXHIDUMF-UHFFFAOYSA-N -1 3 394.461 -1.435 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCCN(c2ccccc2-c2nn[n-]n2)CC1 ZINC001591220070 1076142103 /nfs/dbraw/zinc/14/21/03/1076142103.db2.gz KUOBKGGSEAHWBA-UHFFFAOYSA-N -1 3 394.461 -1.041 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCCN(c2ccccc2-c2nnn[n-]2)CC1 ZINC001591220070 1076142099 /nfs/dbraw/zinc/14/20/99/1076142099.db2.gz KUOBKGGSEAHWBA-UHFFFAOYSA-N -1 3 394.461 -1.041 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1C ZINC001591220117 1076142623 /nfs/dbraw/zinc/14/26/23/1076142623.db2.gz MKZLAUDBKLWRLH-MWLCHTKSSA-N -1 3 395.449 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@H]1C ZINC001591220117 1076142620 /nfs/dbraw/zinc/14/26/20/1076142620.db2.gz MKZLAUDBKLWRLH-MWLCHTKSSA-N -1 3 395.449 -1.744 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCCN(C)c1ccc(-c2nn[n-]n2)nc1 ZINC001591220119 1076142591 /nfs/dbraw/zinc/14/25/91/1076142591.db2.gz MMMSIUKLOOHSBQ-UHFFFAOYSA-N -1 3 383.438 -1.742 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCCN(C)c1ccc(-c2nnn[n-]2)nc1 ZINC001591220119 1076142588 /nfs/dbraw/zinc/14/25/88/1076142588.db2.gz MMMSIUKLOOHSBQ-UHFFFAOYSA-N -1 3 383.438 -1.742 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)cn2)[C@@H]1C ZINC001591220170 1076142530 /nfs/dbraw/zinc/14/25/30/1076142530.db2.gz QIKXHUBHLIZGFP-KOLCDFICSA-N -1 3 395.449 -1.601 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)cn2)[C@@H]1C ZINC001591220170 1076142528 /nfs/dbraw/zinc/14/25/28/1076142528.db2.gz QIKXHUBHLIZGFP-KOLCDFICSA-N -1 3 395.449 -1.601 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCN(c2c(-c3nn[n-]n3)c(C)nn2C)CC1 ZINC001591220175 1076142570 /nfs/dbraw/zinc/14/25/70/1076142570.db2.gz QLVQCWZLTYDJQF-UHFFFAOYSA-N -1 3 398.453 -2.389 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCN(c2c(-c3nnn[n-]3)c(C)nn2C)CC1 ZINC001591220175 1076142566 /nfs/dbraw/zinc/14/25/66/1076142566.db2.gz QLVQCWZLTYDJQF-UHFFFAOYSA-N -1 3 398.453 -2.389 20 0 GAADHM CNS(=O)(=O)CCNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1OC ZINC001591220198 1076142545 /nfs/dbraw/zinc/14/25/45/1076142545.db2.gz KNSPQETZKJWCLA-UHFFFAOYSA-N -1 3 376.420 -1.297 20 0 GAADHM CNS(=O)(=O)CCNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1OC ZINC001591220198 1076142543 /nfs/dbraw/zinc/14/25/43/1076142543.db2.gz KNSPQETZKJWCLA-UHFFFAOYSA-N -1 3 376.420 -1.297 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)CCCNc1ncccc1-c1nn[n-]n1 ZINC001591220202 1076142538 /nfs/dbraw/zinc/14/25/38/1076142538.db2.gz KQIYKYAIZUBGIZ-UHFFFAOYSA-N -1 3 383.438 -1.424 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)CCCNc1ncccc1-c1nnn[n-]1 ZINC001591220202 1076142535 /nfs/dbraw/zinc/14/25/35/1076142535.db2.gz KQIYKYAIZUBGIZ-UHFFFAOYSA-N -1 3 383.438 -1.424 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC=CCNc1ccc(-c2nn[n-]n2)cn1 ZINC001591220244 1076142515 /nfs/dbraw/zinc/14/25/15/1076142515.db2.gz VDFHTLHSBMGCNS-IHWYPQMZSA-N -1 3 381.422 -1.600 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC=CCNc1ccc(-c2nnn[n-]2)cn1 ZINC001591220244 1076142512 /nfs/dbraw/zinc/14/25/12/1076142512.db2.gz VDFHTLHSBMGCNS-IHWYPQMZSA-N -1 3 381.422 -1.600 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC=CCNc1ccc(-c2nn[n-]n2)cn1 ZINC001591220245 1076142597 /nfs/dbraw/zinc/14/25/97/1076142597.db2.gz VDFHTLHSBMGCNS-NSCUHMNNSA-N -1 3 381.422 -1.600 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC=CCNc1ccc(-c2nnn[n-]2)cn1 ZINC001591220245 1076142595 /nfs/dbraw/zinc/14/25/95/1076142595.db2.gz VDFHTLHSBMGCNS-NSCUHMNNSA-N -1 3 381.422 -1.600 20 0 GAADHM CNS(=O)(=O)CCNS(=O)(=O)Cc1ccc(-c2nn[n-]n2)cc1F ZINC001591220282 1076142577 /nfs/dbraw/zinc/14/25/77/1076142577.db2.gz LVLPBTJTOXYNNX-UHFFFAOYSA-N -1 3 378.411 -1.026 20 0 GAADHM CNS(=O)(=O)CCNS(=O)(=O)Cc1ccc(-c2nnn[n-]2)cc1F ZINC001591220282 1076142575 /nfs/dbraw/zinc/14/25/75/1076142575.db2.gz LVLPBTJTOXYNNX-UHFFFAOYSA-N -1 3 378.411 -1.026 20 0 GAADHM CNS(=O)(=O)CCNCCS(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001591220286 1076142639 /nfs/dbraw/zinc/14/26/39/1076142639.db2.gz LWWFXAGJIHWUPU-UHFFFAOYSA-N -1 3 375.436 -1.826 20 0 GAADHM CNS(=O)(=O)CCNCCS(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001591220286 1076142635 /nfs/dbraw/zinc/14/26/35/1076142635.db2.gz LWWFXAGJIHWUPU-UHFFFAOYSA-N -1 3 375.436 -1.826 20 0 GAADHM CNS(=O)(=O)CCNC(=O)C(=O)NCc1cc(-c2nn[n-]n2)ccc1F ZINC001591220315 1076142524 /nfs/dbraw/zinc/14/25/24/1076142524.db2.gz MVDFKHJOWWKURV-UHFFFAOYSA-N -1 3 385.381 -1.713 20 0 GAADHM CNS(=O)(=O)CCNC(=O)C(=O)NCc1cc(-c2nnn[n-]2)ccc1F ZINC001591220315 1076142521 /nfs/dbraw/zinc/14/25/21/1076142521.db2.gz MVDFKHJOWWKURV-UHFFFAOYSA-N -1 3 385.381 -1.713 20 0 GAADHM CNS(=O)(=O)CCNC(=O)[C@@H]1CC(=O)N(c2ccc(-c3nn[n-]n3)cc2)C1 ZINC001591220324 1076142506 /nfs/dbraw/zinc/14/25/06/1076142506.db2.gz NBIUJUNXLYNBAH-LLVKDONJSA-N -1 3 393.429 -1.115 20 0 GAADHM CNS(=O)(=O)CCNC(=O)[C@@H]1CC(=O)N(c2ccc(-c3nnn[n-]3)cc2)C1 ZINC001591220324 1076142502 /nfs/dbraw/zinc/14/25/02/1076142502.db2.gz NBIUJUNXLYNBAH-LLVKDONJSA-N -1 3 393.429 -1.115 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCCN(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001591220326 1076142647 /nfs/dbraw/zinc/14/26/47/1076142647.db2.gz XNNMJLXBKHBRSL-UHFFFAOYSA-N -1 3 383.438 -1.742 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCCN(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001591220326 1076142644 /nfs/dbraw/zinc/14/26/44/1076142644.db2.gz XNNMJLXBKHBRSL-UHFFFAOYSA-N -1 3 383.438 -1.742 20 0 GAADHM CNS(=O)(=O)CCNC(=O)[C@H]1CC(=O)N(c2ccc(-c3nn[n-]n3)cc2)C1 ZINC001591220329 1076142562 /nfs/dbraw/zinc/14/25/62/1076142562.db2.gz NBIUJUNXLYNBAH-NSHDSACASA-N -1 3 393.429 -1.115 20 0 GAADHM CNS(=O)(=O)CCNC(=O)[C@H]1CC(=O)N(c2ccc(-c3nnn[n-]3)cc2)C1 ZINC001591220329 1076142558 /nfs/dbraw/zinc/14/25/58/1076142558.db2.gz NBIUJUNXLYNBAH-NSHDSACASA-N -1 3 393.429 -1.115 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCN(c2ccc(F)cc2-c2nn[n-]n2)CC1 ZINC001591220396 1076142930 /nfs/dbraw/zinc/14/29/30/1076142930.db2.gz ZJKQILUAQGPPMM-UHFFFAOYSA-N -1 3 398.424 -1.292 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCN(c2ccc(F)cc2-c2nnn[n-]2)CC1 ZINC001591220396 1076142926 /nfs/dbraw/zinc/14/29/26/1076142926.db2.gz ZJKQILUAQGPPMM-UHFFFAOYSA-N -1 3 398.424 -1.292 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1 ZINC001591220403 1076142911 /nfs/dbraw/zinc/14/29/11/1076142911.db2.gz ZVSCEQKYDAGUEU-UHFFFAOYSA-N -1 3 381.422 -2.036 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1 ZINC001591220403 1076142907 /nfs/dbraw/zinc/14/29/07/1076142907.db2.gz ZVSCEQKYDAGUEU-UHFFFAOYSA-N -1 3 381.422 -2.036 20 0 GAADHM CNS(=O)(=O)CCNC(=O)N1CC[C@@H](Oc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001591220408 1076142964 /nfs/dbraw/zinc/14/29/64/1076142964.db2.gz PZHGXVXRZJUBTR-LLVKDONJSA-N -1 3 396.433 -1.026 20 0 GAADHM CNS(=O)(=O)CCNC(=O)N1CC[C@@H](Oc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001591220408 1076142955 /nfs/dbraw/zinc/14/29/55/1076142955.db2.gz PZHGXVXRZJUBTR-LLVKDONJSA-N -1 3 396.433 -1.026 20 0 GAADHM CNS(=O)(=O)CCNC(=O)N1CC[C@H](Oc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001591220409 1076143009 /nfs/dbraw/zinc/14/30/09/1076143009.db2.gz PZHGXVXRZJUBTR-NSHDSACASA-N -1 3 396.433 -1.026 20 0 GAADHM CNS(=O)(=O)CCNC(=O)N1CC[C@H](Oc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001591220409 1076143007 /nfs/dbraw/zinc/14/30/07/1076143007.db2.gz PZHGXVXRZJUBTR-NSHDSACASA-N -1 3 396.433 -1.026 20 0 GAADHM CNS(=O)(=O)CCNC(=O)C(=O)NCCc1ccc(-c2nn[n-]n2)cc1 ZINC001591220443 1076143087 /nfs/dbraw/zinc/14/30/87/1076143087.db2.gz RUJVLMNDNJBPJN-UHFFFAOYSA-N -1 3 381.418 -1.809 20 0 GAADHM CNS(=O)(=O)CCNC(=O)C(=O)NCCc1ccc(-c2nnn[n-]2)cc1 ZINC001591220443 1076143086 /nfs/dbraw/zinc/14/30/86/1076143086.db2.gz RUJVLMNDNJBPJN-UHFFFAOYSA-N -1 3 381.418 -1.809 20 0 GAADHM CNS(=O)(=O)N1CCN(C(=O)COc2ccccc2-c2nn[n-]n2)CC1 ZINC001591220486 1076142887 /nfs/dbraw/zinc/14/28/87/1076142887.db2.gz UWYWFYUPCSWHKM-UHFFFAOYSA-N -1 3 381.418 -1.146 20 0 GAADHM CNS(=O)(=O)N1CCN(C(=O)COc2ccccc2-c2nnn[n-]2)CC1 ZINC001591220486 1076142885 /nfs/dbraw/zinc/14/28/85/1076142885.db2.gz UWYWFYUPCSWHKM-UHFFFAOYSA-N -1 3 381.418 -1.146 20 0 GAADHM CNS(=O)(=O)NC1CCN(Cc2cnc3c(-c4nn[n-]n4)cnn3c2)CC1 ZINC001591220498 1076143098 /nfs/dbraw/zinc/14/30/98/1076143098.db2.gz VLTDDPHJRUHADA-UHFFFAOYSA-N -1 3 392.449 -1.072 20 0 GAADHM CNS(=O)(=O)NC1CCN(Cc2cnc3c(-c4nnn[n-]4)cnn3c2)CC1 ZINC001591220498 1076143095 /nfs/dbraw/zinc/14/30/95/1076143095.db2.gz VLTDDPHJRUHADA-UHFFFAOYSA-N -1 3 392.449 -1.072 20 0 GAADHM CNS(=O)(=O)N1CCN(C(=O)COc2cccc(-c3nn[n-]n3)c2)CC1 ZINC001591220500 1076142876 /nfs/dbraw/zinc/14/28/76/1076142876.db2.gz VOSFRQYKMHADFX-UHFFFAOYSA-N -1 3 381.418 -1.146 20 0 GAADHM CNS(=O)(=O)N1CCN(C(=O)COc2cccc(-c3nnn[n-]3)c2)CC1 ZINC001591220500 1076142874 /nfs/dbraw/zinc/14/28/74/1076142874.db2.gz VOSFRQYKMHADFX-UHFFFAOYSA-N -1 3 381.418 -1.146 20 0 GAADHM CNS(=O)(=O)N1CCN(C(=O)COc2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001591220516 1076143029 /nfs/dbraw/zinc/14/30/29/1076143029.db2.gz WNAMHYNYRAAANW-UHFFFAOYSA-N -1 3 381.418 -1.146 20 0 GAADHM CNS(=O)(=O)NC1CCN([C@@H](C(N)=O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001591220566 1076143071 /nfs/dbraw/zinc/14/30/71/1076143071.db2.gz YZSILBQYRIPETN-CYBMUJFWSA-N -1 3 394.461 -1.089 20 0 GAADHM CNS(=O)(=O)NC1CCN([C@@H](C(N)=O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001591220566 1076143067 /nfs/dbraw/zinc/14/30/67/1076143067.db2.gz YZSILBQYRIPETN-CYBMUJFWSA-N -1 3 394.461 -1.089 20 0 GAADHM CNS(=O)(=O)NC1CCN([C@H](C(N)=O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001591220567 1076142984 /nfs/dbraw/zinc/14/29/84/1076142984.db2.gz YZSILBQYRIPETN-ZDUSSCGKSA-N -1 3 394.461 -1.089 20 0 GAADHM CNS(=O)(=O)NC1CCN([C@H](C(N)=O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001591220567 1076142979 /nfs/dbraw/zinc/14/29/79/1076142979.db2.gz YZSILBQYRIPETN-ZDUSSCGKSA-N -1 3 394.461 -1.089 20 0 GAADHM COC(=O)[C@H](CF)NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001591232997 1076143552 /nfs/dbraw/zinc/14/35/52/1076143552.db2.gz VTRMFPFMARMKCE-JTQLQIEISA-N -1 3 386.365 -1.228 20 0 GAADHM COC(=O)[C@H](CF)NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001591232997 1076143549 /nfs/dbraw/zinc/14/35/49/1076143549.db2.gz VTRMFPFMARMKCE-JTQLQIEISA-N -1 3 386.365 -1.228 20 0 GAADHM COC(=O)[C@@H](CF)NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001591232998 1076143560 /nfs/dbraw/zinc/14/35/60/1076143560.db2.gz VTRMFPFMARMKCE-SNVBAGLBSA-N -1 3 386.365 -1.228 20 0 GAADHM COC(=O)[C@@H](CF)NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001591232998 1076143557 /nfs/dbraw/zinc/14/35/57/1076143557.db2.gz VTRMFPFMARMKCE-SNVBAGLBSA-N -1 3 386.365 -1.228 20 0 GAADHM COC(=O)[C@@H](Cn1cncn1)NC(=O)CNC(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001591234018 1076143427 /nfs/dbraw/zinc/14/34/27/1076143427.db2.gz DVXYDZGZBBUJLP-GFCCVEGCSA-N -1 3 399.371 -1.454 20 0 GAADHM COC(=O)[C@@H](Cn1cncn1)NC(=O)CNC(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001591234018 1076143426 /nfs/dbraw/zinc/14/34/26/1076143426.db2.gz DVXYDZGZBBUJLP-GFCCVEGCSA-N -1 3 399.371 -1.454 20 0 GAADHM COC(=O)[C@H](Cn1cncn1)NC(=O)CNC(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001591234020 1076143536 /nfs/dbraw/zinc/14/35/36/1076143536.db2.gz DVXYDZGZBBUJLP-LBPRGKRZSA-N -1 3 399.371 -1.454 20 0 GAADHM COC(=O)[C@H](Cn1cncn1)NC(=O)CNC(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001591234020 1076143531 /nfs/dbraw/zinc/14/35/31/1076143531.db2.gz DVXYDZGZBBUJLP-LBPRGKRZSA-N -1 3 399.371 -1.454 20 0 GAADHM COC(=O)[C@@H](c1ccc(-c2nn[n-]n2)cc1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001591239956 1076143431 /nfs/dbraw/zinc/14/34/31/1076143431.db2.gz ISRUUSPBQGMANL-CHWSQXEVSA-N -1 3 393.429 -1.085 20 0 GAADHM COC(=O)[C@@H](c1ccc(-c2nnn[n-]2)cc1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001591239956 1076143430 /nfs/dbraw/zinc/14/34/30/1076143430.db2.gz ISRUUSPBQGMANL-CHWSQXEVSA-N -1 3 393.429 -1.085 20 0 GAADHM COC(=O)[C@H](c1ccc(-c2nn[n-]n2)cc1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001591239957 1076143481 /nfs/dbraw/zinc/14/34/81/1076143481.db2.gz ISRUUSPBQGMANL-OLZOCXBDSA-N -1 3 393.429 -1.085 20 0 GAADHM COC(=O)[C@H](c1ccc(-c2nnn[n-]2)cc1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001591239957 1076143479 /nfs/dbraw/zinc/14/34/79/1076143479.db2.gz ISRUUSPBQGMANL-OLZOCXBDSA-N -1 3 393.429 -1.085 20 0 GAADHM COC(=O)[C@@H](c1ccc(-c2nn[n-]n2)cc1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001591239958 1076143487 /nfs/dbraw/zinc/14/34/87/1076143487.db2.gz ISRUUSPBQGMANL-QWHCGFSZSA-N -1 3 393.429 -1.085 20 0 GAADHM COC(=O)[C@@H](c1ccc(-c2nnn[n-]2)cc1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001591239958 1076143485 /nfs/dbraw/zinc/14/34/85/1076143485.db2.gz ISRUUSPBQGMANL-QWHCGFSZSA-N -1 3 393.429 -1.085 20 0 GAADHM COC(=O)[C@H](c1ccc(-c2nn[n-]n2)cc1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001591239959 1076143515 /nfs/dbraw/zinc/14/35/15/1076143515.db2.gz ISRUUSPBQGMANL-STQMWFEESA-N -1 3 393.429 -1.085 20 0 GAADHM COC(=O)[C@H](c1ccc(-c2nnn[n-]2)cc1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001591239959 1076143513 /nfs/dbraw/zinc/14/35/13/1076143513.db2.gz ISRUUSPBQGMANL-STQMWFEESA-N -1 3 393.429 -1.085 20 0 GAADHM COC(=O)[C@]1(OC)CCN(C(=O)C(=O)Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001591247040 1076143965 /nfs/dbraw/zinc/14/39/65/1076143965.db2.gz YDCUEDVVDKNAKR-HNNXBMFYSA-N -1 3 375.345 -1.009 20 0 GAADHM COC(=O)[C@]1(OC)CCN(C(=O)C(=O)Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001591247040 1076143962 /nfs/dbraw/zinc/14/39/62/1076143962.db2.gz YDCUEDVVDKNAKR-HNNXBMFYSA-N -1 3 375.345 -1.009 20 0 GAADHM COC(=O)[C@@]1(OC)CCN(C(=O)C(=O)Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001591247041 1076144070 /nfs/dbraw/zinc/14/40/70/1076144070.db2.gz YDCUEDVVDKNAKR-OAHLLOKOSA-N -1 3 375.345 -1.009 20 0 GAADHM COC(=O)[C@@]1(OC)CCN(C(=O)C(=O)Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001591247041 1076144067 /nfs/dbraw/zinc/14/40/67/1076144067.db2.gz YDCUEDVVDKNAKR-OAHLLOKOSA-N -1 3 375.345 -1.009 20 0 GAADHM COC(=O)[C@@H]1C[C@H](O)CN(c2ccc(S(N)(=O)=O)cc2-c2nn[n-]n2)C1 ZINC001591247322 1076144119 /nfs/dbraw/zinc/14/41/19/1076144119.db2.gz AVVYGRCKEYWHIL-BDAKNGLRSA-N -1 3 382.402 -1.126 20 0 GAADHM COC(=O)[C@@H]1C[C@H](O)CN(c2ccc(S(N)(=O)=O)cc2-c2nnn[n-]2)C1 ZINC001591247322 1076144115 /nfs/dbraw/zinc/14/41/15/1076144115.db2.gz AVVYGRCKEYWHIL-BDAKNGLRSA-N -1 3 382.402 -1.126 20 0 GAADHM COC(=O)[C@H]1C[C@@H](O)CN(c2ccc(S(N)(=O)=O)cc2-c2nn[n-]n2)C1 ZINC001591247323 1076143951 /nfs/dbraw/zinc/14/39/51/1076143951.db2.gz AVVYGRCKEYWHIL-DTWKUNHWSA-N -1 3 382.402 -1.126 20 0 GAADHM COC(=O)[C@H]1C[C@@H](O)CN(c2ccc(S(N)(=O)=O)cc2-c2nnn[n-]2)C1 ZINC001591247323 1076143948 /nfs/dbraw/zinc/14/39/48/1076143948.db2.gz AVVYGRCKEYWHIL-DTWKUNHWSA-N -1 3 382.402 -1.126 20 0 GAADHM COC(=O)[C@H]1C[C@H](O)CN(c2ccc(S(N)(=O)=O)cc2-c2nn[n-]n2)C1 ZINC001591247324 1076143927 /nfs/dbraw/zinc/14/39/27/1076143927.db2.gz AVVYGRCKEYWHIL-IUCAKERBSA-N -1 3 382.402 -1.126 20 0 GAADHM COC(=O)[C@H]1C[C@H](O)CN(c2ccc(S(N)(=O)=O)cc2-c2nnn[n-]2)C1 ZINC001591247324 1076143924 /nfs/dbraw/zinc/14/39/24/1076143924.db2.gz AVVYGRCKEYWHIL-IUCAKERBSA-N -1 3 382.402 -1.126 20 0 GAADHM COC(=O)[C@@H]1C[C@@H](O)CN(c2ccc(S(N)(=O)=O)cc2-c2nn[n-]n2)C1 ZINC001591247325 1076144095 /nfs/dbraw/zinc/14/40/95/1076144095.db2.gz AVVYGRCKEYWHIL-RKDXNWHRSA-N -1 3 382.402 -1.126 20 0 GAADHM COC(=O)[C@@H]1C[C@@H](O)CN(c2ccc(S(N)(=O)=O)cc2-c2nnn[n-]2)C1 ZINC001591247325 1076144091 /nfs/dbraw/zinc/14/40/91/1076144091.db2.gz AVVYGRCKEYWHIL-RKDXNWHRSA-N -1 3 382.402 -1.126 20 0 GAADHM COC(=O)C1(O)CCN(C(=O)C(=O)Nc2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001591247769 1076144081 /nfs/dbraw/zinc/14/40/81/1076144081.db2.gz WPGMKIMRPYSABU-UHFFFAOYSA-N -1 3 375.345 -1.273 20 0 GAADHM COC(=O)C1(O)CCN(C(=O)C(=O)Nc2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001591247769 1076144076 /nfs/dbraw/zinc/14/40/76/1076144076.db2.gz WPGMKIMRPYSABU-UHFFFAOYSA-N -1 3 375.345 -1.273 20 0 GAADHM COC(=O)[C@@H]1C[C@@H](O)CN(C(=O)C(=O)Nc2cc(C)c(-c3nn[n-]n3)cn2)C1 ZINC001591250606 1076144519 /nfs/dbraw/zinc/14/45/19/1076144519.db2.gz QZMDOXCTKGCQJH-NXEZZACHSA-N -1 3 389.372 -1.109 20 0 GAADHM COC(=O)[C@@H]1C[C@@H](O)CN(C(=O)C(=O)Nc2cc(C)c(-c3nnn[n-]3)cn2)C1 ZINC001591250606 1076144515 /nfs/dbraw/zinc/14/45/15/1076144515.db2.gz QZMDOXCTKGCQJH-NXEZZACHSA-N -1 3 389.372 -1.109 20 0 GAADHM COC(=O)[C@H]1C[C@H](O)CN(C(=O)C(=O)Nc2cc(C)c(-c3nn[n-]n3)cn2)C1 ZINC001591250607 1076144402 /nfs/dbraw/zinc/14/44/02/1076144402.db2.gz QZMDOXCTKGCQJH-UWVGGRQHSA-N -1 3 389.372 -1.109 20 0 GAADHM COC(=O)[C@H]1C[C@H](O)CN(C(=O)C(=O)Nc2cc(C)c(-c3nnn[n-]3)cn2)C1 ZINC001591250607 1076144396 /nfs/dbraw/zinc/14/43/96/1076144396.db2.gz QZMDOXCTKGCQJH-UWVGGRQHSA-N -1 3 389.372 -1.109 20 0 GAADHM COC(=O)[C@H]1C[C@@H](O)CN(C(=O)C(=O)Nc2cc(C)c(-c3nn[n-]n3)cn2)C1 ZINC001591250608 1076144435 /nfs/dbraw/zinc/14/44/35/1076144435.db2.gz QZMDOXCTKGCQJH-VHSXEESVSA-N -1 3 389.372 -1.109 20 0 GAADHM COC(=O)[C@H]1C[C@@H](O)CN(C(=O)C(=O)Nc2cc(C)c(-c3nnn[n-]3)cn2)C1 ZINC001591250608 1076144432 /nfs/dbraw/zinc/14/44/32/1076144432.db2.gz QZMDOXCTKGCQJH-VHSXEESVSA-N -1 3 389.372 -1.109 20 0 GAADHM COC(=O)[C@@H]1C[C@H](O)CN(C(=O)C(=O)Nc2cc(C)c(-c3nn[n-]n3)cn2)C1 ZINC001591250609 1076144346 /nfs/dbraw/zinc/14/43/46/1076144346.db2.gz QZMDOXCTKGCQJH-ZJUUUORDSA-N -1 3 389.372 -1.109 20 0 GAADHM COC(=O)[C@@H]1C[C@H](O)CN(C(=O)C(=O)Nc2cc(C)c(-c3nnn[n-]3)cn2)C1 ZINC001591250609 1076144343 /nfs/dbraw/zinc/14/43/43/1076144343.db2.gz QZMDOXCTKGCQJH-ZJUUUORDSA-N -1 3 389.372 -1.109 20 0 GAADHM COC(=O)[C@H]1CS(=O)(=O)CCN1C(=O)c1ccc(-c2nn[n-]n2)c(C)n1 ZINC001591252585 1076144426 /nfs/dbraw/zinc/14/44/26/1076144426.db2.gz FNSMSAYTUGUTPR-LLVKDONJSA-N -1 3 380.386 -1.018 20 0 GAADHM COC(=O)[C@H]1CS(=O)(=O)CCN1C(=O)c1ccc(-c2nnn[n-]2)c(C)n1 ZINC001591252585 1076144423 /nfs/dbraw/zinc/14/44/23/1076144423.db2.gz FNSMSAYTUGUTPR-LLVKDONJSA-N -1 3 380.386 -1.018 20 0 GAADHM COC(=O)[C@@H]1CS(=O)(=O)CCN1C(=O)c1ccc(-c2nn[n-]n2)c(C)n1 ZINC001591252589 1076144358 /nfs/dbraw/zinc/14/43/58/1076144358.db2.gz FNSMSAYTUGUTPR-NSHDSACASA-N -1 3 380.386 -1.018 20 0 GAADHM COC(=O)[C@@H]1CS(=O)(=O)CCN1C(=O)c1ccc(-c2nnn[n-]2)c(C)n1 ZINC001591252589 1076144355 /nfs/dbraw/zinc/14/43/55/1076144355.db2.gz FNSMSAYTUGUTPR-NSHDSACASA-N -1 3 380.386 -1.018 20 0 GAADHM COC(=O)C1CCN(CCCNC(=O)Cn2cnc(-c3nnn[n-]3)n2)CC1 ZINC001591253840 1076144777 /nfs/dbraw/zinc/14/47/77/1076144777.db2.gz VGQLLTMGSCQHAI-UHFFFAOYSA-N -1 3 377.409 -1.151 20 0 GAADHM COC(=O)[C@H]1CN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)C[C@H]1C(=O)OC ZINC001591255005 1076145029 /nfs/dbraw/zinc/14/50/29/1076145029.db2.gz NBPYJYRXCHVRKB-AOOOYVTPSA-N -1 3 396.385 -1.156 20 0 GAADHM COC(=O)[C@H]1CN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)C[C@H]1C(=O)OC ZINC001591255005 1076145026 /nfs/dbraw/zinc/14/50/26/1076145026.db2.gz NBPYJYRXCHVRKB-AOOOYVTPSA-N -1 3 396.385 -1.156 20 0 GAADHM COC(=O)[C@@H]1CN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)C[C@H]1C(=O)OC ZINC001591255006 1076144990 /nfs/dbraw/zinc/14/49/90/1076144990.db2.gz NBPYJYRXCHVRKB-NXEZZACHSA-N -1 3 396.385 -1.156 20 0 GAADHM COC(=O)[C@@H]1CN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)C[C@H]1C(=O)OC ZINC001591255006 1076144986 /nfs/dbraw/zinc/14/49/86/1076144986.db2.gz NBPYJYRXCHVRKB-NXEZZACHSA-N -1 3 396.385 -1.156 20 0 GAADHM COC(=O)[C@H]1CN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1C(=O)OC ZINC001591255007 1076144976 /nfs/dbraw/zinc/14/49/76/1076144976.db2.gz NBPYJYRXCHVRKB-UWVGGRQHSA-N -1 3 396.385 -1.156 20 0 GAADHM COC(=O)[C@H]1CN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1C(=O)OC ZINC001591255007 1076144972 /nfs/dbraw/zinc/14/49/72/1076144972.db2.gz NBPYJYRXCHVRKB-UWVGGRQHSA-N -1 3 396.385 -1.156 20 0 GAADHM COC(=O)[C@H]1CN(CCS(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)CCO1 ZINC001591255019 1076144829 /nfs/dbraw/zinc/14/48/29/1076144829.db2.gz NKHBIWCGXSVYES-LLVKDONJSA-N -1 3 382.402 -1.091 20 0 GAADHM COC(=O)[C@H]1CN(CCS(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)CCO1 ZINC001591255019 1076144824 /nfs/dbraw/zinc/14/48/24/1076144824.db2.gz NKHBIWCGXSVYES-LLVKDONJSA-N -1 3 382.402 -1.091 20 0 GAADHM COC(=O)[C@@H]1CN(CCS(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)CCO1 ZINC001591255020 1076145005 /nfs/dbraw/zinc/14/50/05/1076145005.db2.gz NKHBIWCGXSVYES-NSHDSACASA-N -1 3 382.402 -1.091 20 0 GAADHM COC(=O)[C@@H]1CN(CCS(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)CCO1 ZINC001591255020 1076145000 /nfs/dbraw/zinc/14/50/00/1076145000.db2.gz NKHBIWCGXSVYES-NSHDSACASA-N -1 3 382.402 -1.091 20 0 GAADHM COC(=O)[C@@H]1CN(C)CCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001591255050 1076144817 /nfs/dbraw/zinc/14/48/17/1076144817.db2.gz OFPKPSKMXDEASF-LLVKDONJSA-N -1 3 381.418 -1.013 20 0 GAADHM COC(=O)[C@@H]1CN(C)CCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001591255050 1076144815 /nfs/dbraw/zinc/14/48/15/1076144815.db2.gz OFPKPSKMXDEASF-LLVKDONJSA-N -1 3 381.418 -1.013 20 0 GAADHM COC(=O)[C@H]1CN(C)CCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001591255052 1076144847 /nfs/dbraw/zinc/14/48/47/1076144847.db2.gz OFPKPSKMXDEASF-NSHDSACASA-N -1 3 381.418 -1.013 20 0 GAADHM COC(=O)[C@H]1CN(C)CCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001591255052 1076144843 /nfs/dbraw/zinc/14/48/43/1076144843.db2.gz OFPKPSKMXDEASF-NSHDSACASA-N -1 3 381.418 -1.013 20 0 GAADHM COC(=O)[C@H]1CN(C)CCN(C(=O)NCCn2cnc(-c3nn[n-]n3)n2)C1 ZINC001591255060 1076144937 /nfs/dbraw/zinc/14/49/37/1076144937.db2.gz OJEQRHBZEUISHE-JTQLQIEISA-N -1 3 378.397 -1.796 20 0 GAADHM COC(=O)[C@H]1CN(C)CCN(C(=O)NCCn2cnc(-c3nnn[n-]3)n2)C1 ZINC001591255060 1076144935 /nfs/dbraw/zinc/14/49/35/1076144935.db2.gz OJEQRHBZEUISHE-JTQLQIEISA-N -1 3 378.397 -1.796 20 0 GAADHM COC(=O)[C@@H]1CN(C)CCN(C(=O)NCCn2cnc(-c3nn[n-]n3)n2)C1 ZINC001591255064 1076144760 /nfs/dbraw/zinc/14/47/60/1076144760.db2.gz OJEQRHBZEUISHE-SNVBAGLBSA-N -1 3 378.397 -1.796 20 0 GAADHM COC(=O)[C@@H]1CN(C)CCN(C(=O)NCCn2cnc(-c3nnn[n-]3)n2)C1 ZINC001591255064 1076144757 /nfs/dbraw/zinc/14/47/57/1076144757.db2.gz OJEQRHBZEUISHE-SNVBAGLBSA-N -1 3 378.397 -1.796 20 0 GAADHM COC(=O)[C@H]1CN(C)C(=O)CN1S(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001591255075 1076144874 /nfs/dbraw/zinc/14/48/74/1076144874.db2.gz OSSITCWJXWJXEO-LLVKDONJSA-N -1 3 380.386 -1.129 20 0 GAADHM COC(=O)[C@H]1CN(C)C(=O)CN1S(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001591255075 1076144871 /nfs/dbraw/zinc/14/48/71/1076144871.db2.gz OSSITCWJXWJXEO-LLVKDONJSA-N -1 3 380.386 -1.129 20 0 GAADHM COC(=O)[C@@H]1CN(C)C(=O)CN1S(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001591255077 1076144800 /nfs/dbraw/zinc/14/48/00/1076144800.db2.gz OSSITCWJXWJXEO-NSHDSACASA-N -1 3 380.386 -1.129 20 0 GAADHM COC(=O)[C@@H]1CN(C)C(=O)CN1S(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001591255077 1076144797 /nfs/dbraw/zinc/14/47/97/1076144797.db2.gz OSSITCWJXWJXEO-NSHDSACASA-N -1 3 380.386 -1.129 20 0 GAADHM COC(=O)[C@@H]1CS(=O)(=O)CCN1C(=O)c1ncc(-c2nn[n-]n2)cc1C ZINC001591255249 1076145308 /nfs/dbraw/zinc/14/53/08/1076145308.db2.gz YPKGUZZSOLYFRU-JTQLQIEISA-N -1 3 380.386 -1.018 20 0 GAADHM COC(=O)[C@@H]1CS(=O)(=O)CCN1C(=O)c1ncc(-c2nnn[n-]2)cc1C ZINC001591255249 1076145304 /nfs/dbraw/zinc/14/53/04/1076145304.db2.gz YPKGUZZSOLYFRU-JTQLQIEISA-N -1 3 380.386 -1.018 20 0 GAADHM COC(=O)[C@H]1CS(=O)(=O)CCN1C(=O)c1ncc(-c2nn[n-]n2)cc1C ZINC001591255252 1076145337 /nfs/dbraw/zinc/14/53/37/1076145337.db2.gz YPKGUZZSOLYFRU-SNVBAGLBSA-N -1 3 380.386 -1.018 20 0 GAADHM COC(=O)[C@H]1CS(=O)(=O)CCN1C(=O)c1ncc(-c2nnn[n-]2)cc1C ZINC001591255252 1076145333 /nfs/dbraw/zinc/14/53/33/1076145333.db2.gz YPKGUZZSOLYFRU-SNVBAGLBSA-N -1 3 380.386 -1.018 20 0 GAADHM COC(=O)[C@@H]1CN(C)CCN(c2c(-c3nn[n-]n3)c(=O)n(C)c(=O)n2C)C1 ZINC001591255964 1076145464 /nfs/dbraw/zinc/14/54/64/1076145464.db2.gz YDUSHBHDALOTSW-SECBINFHSA-N -1 3 378.393 -2.195 20 0 GAADHM COC(=O)[C@@H]1CN(C)CCN(c2c(-c3nnn[n-]3)c(=O)n(C)c(=O)n2C)C1 ZINC001591255964 1076145462 /nfs/dbraw/zinc/14/54/62/1076145462.db2.gz YDUSHBHDALOTSW-SECBINFHSA-N -1 3 378.393 -2.195 20 0 GAADHM COC(=O)[C@H]1CN(C)CCN(c2c(-c3nn[n-]n3)c(=O)n(C)c(=O)n2C)C1 ZINC001591255971 1076145438 /nfs/dbraw/zinc/14/54/38/1076145438.db2.gz YDUSHBHDALOTSW-VIFPVBQESA-N -1 3 378.393 -2.195 20 0 GAADHM COC(=O)[C@H]1CN(C)CCN(c2c(-c3nnn[n-]3)c(=O)n(C)c(=O)n2C)C1 ZINC001591255971 1076145436 /nfs/dbraw/zinc/14/54/36/1076145436.db2.gz YDUSHBHDALOTSW-VIFPVBQESA-N -1 3 378.393 -2.195 20 0 GAADHM COC(=O)[C@H]1COCCN1CCS(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001591256139 1076145478 /nfs/dbraw/zinc/14/54/78/1076145478.db2.gz ZKMQKYRGGOJHBQ-LLVKDONJSA-N -1 3 382.402 -1.091 20 0 GAADHM COC(=O)[C@H]1COCCN1CCS(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001591256139 1076145475 /nfs/dbraw/zinc/14/54/75/1076145475.db2.gz ZKMQKYRGGOJHBQ-LLVKDONJSA-N -1 3 382.402 -1.091 20 0 GAADHM COC(=O)[C@@H]1COCCN1CCS(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001591256141 1076145377 /nfs/dbraw/zinc/14/53/77/1076145377.db2.gz ZKMQKYRGGOJHBQ-NSHDSACASA-N -1 3 382.402 -1.091 20 0 GAADHM COC(=O)[C@@H]1COCCN1CCS(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001591256141 1076145374 /nfs/dbraw/zinc/14/53/74/1076145374.db2.gz ZKMQKYRGGOJHBQ-NSHDSACASA-N -1 3 382.402 -1.091 20 0 GAADHM COC(=O)C[C@@H](O)CNC(=O)C(=O)Nc1cc(OC)c(-c2nn[n-]n2)cc1F ZINC001591259278 1076145413 /nfs/dbraw/zinc/14/54/13/1076145413.db2.gz FYKUYMCCJIPTJL-SSDOTTSWSA-N -1 3 396.335 -1.007 20 0 GAADHM COC(=O)C[C@@H](O)CNC(=O)C(=O)Nc1cc(OC)c(-c2nnn[n-]2)cc1F ZINC001591259278 1076145411 /nfs/dbraw/zinc/14/54/11/1076145411.db2.gz FYKUYMCCJIPTJL-SSDOTTSWSA-N -1 3 396.335 -1.007 20 0 GAADHM COC(=O)C[C@H](O)CNC(=O)C(=O)Nc1cc(OC)c(-c2nn[n-]n2)cc1F ZINC001591259289 1076145390 /nfs/dbraw/zinc/14/53/90/1076145390.db2.gz FYKUYMCCJIPTJL-ZETCQYMHSA-N -1 3 396.335 -1.007 20 0 GAADHM COC(=O)C[C@H](O)CNC(=O)C(=O)Nc1cc(OC)c(-c2nnn[n-]2)cc1F ZINC001591259289 1076145385 /nfs/dbraw/zinc/14/53/85/1076145385.db2.gz FYKUYMCCJIPTJL-ZETCQYMHSA-N -1 3 396.335 -1.007 20 0 GAADHM COC(=O)C[C@@H](O)CNC(=O)C(=O)Nc1ccc(-c2nn[n-]n2)cc1OC ZINC001591259483 1076145398 /nfs/dbraw/zinc/14/53/98/1076145398.db2.gz HORHIIGMYVOMMD-SECBINFHSA-N -1 3 378.345 -1.146 20 0 GAADHM COC(=O)C[C@@H](O)CNC(=O)C(=O)Nc1ccc(-c2nnn[n-]2)cc1OC ZINC001591259483 1076145396 /nfs/dbraw/zinc/14/53/96/1076145396.db2.gz HORHIIGMYVOMMD-SECBINFHSA-N -1 3 378.345 -1.146 20 0 GAADHM COC(=O)C[C@H](O)CNC(=O)C(=O)Nc1ccc(-c2nn[n-]n2)cc1OC ZINC001591259715 1076145367 /nfs/dbraw/zinc/14/53/67/1076145367.db2.gz HORHIIGMYVOMMD-VIFPVBQESA-N -1 3 378.345 -1.146 20 0 GAADHM COC(=O)C[C@H](O)CNC(=O)C(=O)Nc1ccc(-c2nnn[n-]2)cc1OC ZINC001591259715 1076145366 /nfs/dbraw/zinc/14/53/66/1076145366.db2.gz HORHIIGMYVOMMD-VIFPVBQESA-N -1 3 378.345 -1.146 20 0 GAADHM COC(=O)C[C@@H](O)CNC(=O)C(=O)Nc1cc(-c2nn[n-]n2)ccc1OC ZINC001591260586 1076145493 /nfs/dbraw/zinc/14/54/93/1076145493.db2.gz OBCIBEGJZORKQR-SECBINFHSA-N -1 3 378.345 -1.146 20 0 GAADHM COC(=O)C[C@@H](O)CNC(=O)C(=O)Nc1cc(-c2nnn[n-]2)ccc1OC ZINC001591260586 1076145490 /nfs/dbraw/zinc/14/54/90/1076145490.db2.gz OBCIBEGJZORKQR-SECBINFHSA-N -1 3 378.345 -1.146 20 0 GAADHM COC(=O)C[C@H](O)CNC(=O)C(=O)Nc1cc(-c2nn[n-]n2)ccc1OC ZINC001591260587 1076145352 /nfs/dbraw/zinc/14/53/52/1076145352.db2.gz OBCIBEGJZORKQR-VIFPVBQESA-N -1 3 378.345 -1.146 20 0 GAADHM COC(=O)C[C@H](O)CNC(=O)C(=O)Nc1cc(-c2nnn[n-]2)ccc1OC ZINC001591260587 1076145347 /nfs/dbraw/zinc/14/53/47/1076145347.db2.gz OBCIBEGJZORKQR-VIFPVBQESA-N -1 3 378.345 -1.146 20 0 GAADHM COC(=O)C[C@@H]1C(=O)NCCN1C[C@H](O)COc1ccc(-c2nn[n-]n2)cc1 ZINC001591260625 1076145445 /nfs/dbraw/zinc/14/54/45/1076145445.db2.gz DVNLAFRQYXERFR-GXTWGEPZSA-N -1 3 390.400 -1.030 20 0 GAADHM COC(=O)C[C@H]1C(=O)NCCN1C[C@H](O)COc1ccc(-c2nn[n-]n2)cc1 ZINC001591260626 1076145324 /nfs/dbraw/zinc/14/53/24/1076145324.db2.gz DVNLAFRQYXERFR-JSGCOSHPSA-N -1 3 390.400 -1.030 20 0 GAADHM COC(=O)C[C@H]1C(=O)NCCN1C[C@@H](O)COc1ccc(-c2nn[n-]n2)cc1 ZINC001591260628 1076145469 /nfs/dbraw/zinc/14/54/69/1076145469.db2.gz DVNLAFRQYXERFR-OCCSQVGLSA-N -1 3 390.400 -1.030 20 0 GAADHM COC(=O)C[C@@H]1C(=O)NCCN1C[C@@H](O)COc1ccc(-c2nn[n-]n2)cc1 ZINC001591260630 1076145402 /nfs/dbraw/zinc/14/54/02/1076145402.db2.gz DVNLAFRQYXERFR-TZMCWYRMSA-N -1 3 390.400 -1.030 20 0 GAADHM COC(=O)C[C@@H]1C(=O)NCCN1CC(=O)NCc1cccc(-c2nn[n-]n2)c1 ZINC001591260711 1076145486 /nfs/dbraw/zinc/14/54/86/1076145486.db2.gz GGMPFELRTBFRSL-CYBMUJFWSA-N -1 3 387.400 -1.154 20 0 GAADHM COC(=O)C[C@@H]1C(=O)NCCN1CC(=O)NCc1cccc(-c2nnn[n-]2)c1 ZINC001591260711 1076145483 /nfs/dbraw/zinc/14/54/83/1076145483.db2.gz GGMPFELRTBFRSL-CYBMUJFWSA-N -1 3 387.400 -1.154 20 0 GAADHM COC(=O)C[C@H]1C(=O)NCCN1CC(=O)NCc1cccc(-c2nn[n-]n2)c1 ZINC001591260712 1076145422 /nfs/dbraw/zinc/14/54/22/1076145422.db2.gz GGMPFELRTBFRSL-ZDUSSCGKSA-N -1 3 387.400 -1.154 20 0 GAADHM COC(=O)C[C@H]1C(=O)NCCN1CC(=O)NCc1cccc(-c2nnn[n-]2)c1 ZINC001591260712 1076145419 /nfs/dbraw/zinc/14/54/19/1076145419.db2.gz GGMPFELRTBFRSL-ZDUSSCGKSA-N -1 3 387.400 -1.154 20 0 GAADHM COC(=O)C[C@@H]1C(=O)NCCN1CC(=O)NCc1ccc(-c2nn[n-]n2)cc1 ZINC001591261770 1076145960 /nfs/dbraw/zinc/14/59/60/1076145960.db2.gz ZBKNDUXMDLTHEB-CYBMUJFWSA-N -1 3 387.400 -1.154 20 0 GAADHM COC(=O)C[C@@H]1C(=O)NCCN1CC(=O)NCc1ccc(-c2nnn[n-]2)cc1 ZINC001591261770 1076145951 /nfs/dbraw/zinc/14/59/51/1076145951.db2.gz ZBKNDUXMDLTHEB-CYBMUJFWSA-N -1 3 387.400 -1.154 20 0 GAADHM COC(=O)C[C@H]1C(=O)NCCN1CC(=O)NCc1ccc(-c2nn[n-]n2)cc1 ZINC001591261771 1076146003 /nfs/dbraw/zinc/14/60/03/1076146003.db2.gz ZBKNDUXMDLTHEB-ZDUSSCGKSA-N -1 3 387.400 -1.154 20 0 GAADHM COC(=O)C[C@H]1C(=O)NCCN1CC(=O)NCc1ccc(-c2nnn[n-]2)cc1 ZINC001591261771 1076145996 /nfs/dbraw/zinc/14/59/96/1076145996.db2.gz ZBKNDUXMDLTHEB-ZDUSSCGKSA-N -1 3 387.400 -1.154 20 0 GAADHM COC(=O)CCNC(=O)CCNS(=O)(=O)c1cncc(-c2nn[n-]n2)c1 ZINC001591264437 1076145976 /nfs/dbraw/zinc/14/59/76/1076145976.db2.gz ATUCIZRKEHCIGP-UHFFFAOYSA-N -1 3 383.390 -1.391 20 0 GAADHM COC(=O)CCNC(=O)CCNS(=O)(=O)c1cncc(-c2nnn[n-]2)c1 ZINC001591264437 1076145971 /nfs/dbraw/zinc/14/59/71/1076145971.db2.gz ATUCIZRKEHCIGP-UHFFFAOYSA-N -1 3 383.390 -1.391 20 0 GAADHM COC(=O)CCNC(=O)CCNC(=O)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC001591264440 1076145888 /nfs/dbraw/zinc/14/58/88/1076145888.db2.gz AVMMOSZPGUWBCC-UHFFFAOYSA-N -1 3 389.372 -1.009 20 0 GAADHM COC(=O)CCNC(=O)CCNC(=O)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC001591264440 1076145882 /nfs/dbraw/zinc/14/58/82/1076145882.db2.gz AVMMOSZPGUWBCC-UHFFFAOYSA-N -1 3 389.372 -1.009 20 0 GAADHM COC(=O)C[C@H]1CN(C(=O)C(=O)Nc2ccc(-c3nn[n-]n3)cn2)CCO1 ZINC001591265071 1076145775 /nfs/dbraw/zinc/14/57/75/1076145775.db2.gz YSNFNMKWRAKEFG-JTQLQIEISA-N -1 3 375.345 -1.009 20 0 GAADHM COC(=O)C[C@H]1CN(C(=O)C(=O)Nc2ccc(-c3nnn[n-]3)cn2)CCO1 ZINC001591265071 1076145774 /nfs/dbraw/zinc/14/57/74/1076145774.db2.gz YSNFNMKWRAKEFG-JTQLQIEISA-N -1 3 375.345 -1.009 20 0 GAADHM COC(=O)C[C@@H]1CN(C(=O)C(=O)Nc2ccc(-c3nn[n-]n3)cn2)CCO1 ZINC001591265073 1076145903 /nfs/dbraw/zinc/14/59/03/1076145903.db2.gz YSNFNMKWRAKEFG-SNVBAGLBSA-N -1 3 375.345 -1.009 20 0 GAADHM COC(=O)C[C@@H]1CN(C(=O)C(=O)Nc2ccc(-c3nnn[n-]3)cn2)CCO1 ZINC001591265073 1076145899 /nfs/dbraw/zinc/14/58/99/1076145899.db2.gz YSNFNMKWRAKEFG-SNVBAGLBSA-N 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3 392.420 -1.122 20 0 GAADHM COCC(=O)N(C)CC(=O)NCCCN(C)C(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001591365419 1076149316 /nfs/dbraw/zinc/14/93/16/1076149316.db2.gz VJQHYZOXNQAGRR-UHFFFAOYSA-N -1 3 392.420 -1.122 20 0 GAADHM COCC(=O)N(C)CC(=O)NCCCN(C)C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001591365433 1076149400 /nfs/dbraw/zinc/14/94/00/1076149400.db2.gz WUSPRERTYQXQBD-UHFFFAOYSA-N -1 3 392.420 -1.122 20 0 GAADHM COCC(=O)N(C)CC(=O)NCCCN(C)C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001591365433 1076149398 /nfs/dbraw/zinc/14/93/98/1076149398.db2.gz WUSPRERTYQXQBD-UHFFFAOYSA-N -1 3 392.420 -1.122 20 0 GAADHM COCC(=O)N1CCN(C(=O)C(=O)NCc2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001591365705 1076149366 /nfs/dbraw/zinc/14/93/66/1076149366.db2.gz IOKVQIHUWBXMLO-UHFFFAOYSA-N -1 3 387.400 -1.200 20 0 GAADHM COCC(=O)N1CCN(C(=O)C(=O)NCc2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001591365705 1076149364 /nfs/dbraw/zinc/14/93/64/1076149364.db2.gz IOKVQIHUWBXMLO-UHFFFAOYSA-N -1 3 387.400 -1.200 20 0 GAADHM COCC(=O)N1CCN(CCS(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001591365799 1076149347 /nfs/dbraw/zinc/14/93/47/1076149347.db2.gz MIYAVDCJEUXJDP-UHFFFAOYSA-N -1 3 395.445 -1.174 20 0 GAADHM COCC(=O)N1CCN(CCS(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001591365799 1076149346 /nfs/dbraw/zinc/14/93/46/1076149346.db2.gz MIYAVDCJEUXJDP-UHFFFAOYSA-N -1 3 395.445 -1.174 20 0 GAADHM COCC(=O)N[C@H](C)C(=O)NCCCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001591366580 1076149372 /nfs/dbraw/zinc/14/93/72/1076149372.db2.gz AFVLIXREJYZMQI-SECBINFHSA-N -1 3 378.393 -1.418 20 0 GAADHM COCC(=O)N[C@H](C)C(=O)NCCCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001591366580 1076149371 /nfs/dbraw/zinc/14/93/71/1076149371.db2.gz AFVLIXREJYZMQI-SECBINFHSA-N -1 3 378.393 -1.418 20 0 GAADHM COCC(=O)N[C@@H](C)C(=O)NCCCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001591366581 1076149411 /nfs/dbraw/zinc/14/94/11/1076149411.db2.gz AFVLIXREJYZMQI-VIFPVBQESA-N -1 3 378.393 -1.418 20 0 GAADHM COCC(=O)N[C@@H](C)C(=O)NCCCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001591366581 1076149408 /nfs/dbraw/zinc/14/94/08/1076149408.db2.gz AFVLIXREJYZMQI-VIFPVBQESA-N -1 3 378.393 -1.418 20 0 GAADHM COCC(=O)N[C@@H](C)C(=O)N(C)CCCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001591366776 1076149255 /nfs/dbraw/zinc/14/92/55/1076149255.db2.gz LXOLWVLYODQMBR-JTQLQIEISA-N -1 3 392.420 -1.076 20 0 GAADHM COCC(=O)N[C@@H](C)C(=O)N(C)CCCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001591366776 1076149251 /nfs/dbraw/zinc/14/92/51/1076149251.db2.gz LXOLWVLYODQMBR-JTQLQIEISA-N -1 3 392.420 -1.076 20 0 GAADHM COCC(=O)N[C@H](C)C(=O)N(C)CCCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001591366777 1076149332 /nfs/dbraw/zinc/14/93/32/1076149332.db2.gz LXOLWVLYODQMBR-SNVBAGLBSA-N -1 3 392.420 -1.076 20 0 GAADHM COCC(=O)N[C@H](C)C(=O)N(C)CCCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001591366777 1076149328 /nfs/dbraw/zinc/14/93/28/1076149328.db2.gz LXOLWVLYODQMBR-SNVBAGLBSA-N -1 3 392.420 -1.076 20 0 GAADHM COCC(=O)N1CCN(c2cccc(S(N)(=O)=O)c2-c2nnn[n-]2)CC1 ZINC001591366819 1076149279 /nfs/dbraw/zinc/14/92/79/1076149279.db2.gz QUTBIBZGSAUSGA-UHFFFAOYSA-N -1 3 381.418 -1.191 20 0 GAADHM COCC(=O)N1CCN(c2ccc(-c3nn[n-]n3)cn2)[C@H]2CS(=O)(=O)C[C@H]21 ZINC001591366867 1076149441 /nfs/dbraw/zinc/14/94/41/1076149441.db2.gz WEMAKSVHUPCAKW-NWDGAFQWSA-N -1 3 393.429 -1.278 20 0 GAADHM COCC(=O)N1CCN(c2ccc(-c3nnn[n-]3)cn2)[C@H]2CS(=O)(=O)C[C@H]21 ZINC001591366867 1076149438 /nfs/dbraw/zinc/14/94/38/1076149438.db2.gz WEMAKSVHUPCAKW-NWDGAFQWSA-N -1 3 393.429 -1.278 20 0 GAADHM COCC(C)(C)N1CCN(C(=O)Cn2cc(-c3nn[n-]n3)c(=O)[nH]c2=O)CC1 ZINC001591369003 1076149904 /nfs/dbraw/zinc/14/99/04/1076149904.db2.gz FESKJOPCJZXUIY-UHFFFAOYSA-N -1 3 392.420 -1.302 20 0 GAADHM COC[C@](C)(CO)NC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001591370612 1076149857 /nfs/dbraw/zinc/14/98/57/1076149857.db2.gz POLZEVIXZKIHHI-AWEZNQCLSA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@](C)(CO)NC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001591370612 1076149853 /nfs/dbraw/zinc/14/98/53/1076149853.db2.gz POLZEVIXZKIHHI-AWEZNQCLSA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@@](C)(CO)NC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001591370616 1076149939 /nfs/dbraw/zinc/14/99/39/1076149939.db2.gz POLZEVIXZKIHHI-CQSZACIVSA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@@](C)(CO)NC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001591370616 1076149938 /nfs/dbraw/zinc/14/99/38/1076149938.db2.gz POLZEVIXZKIHHI-CQSZACIVSA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@@](C)(O)CNC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001591371665 1076149915 /nfs/dbraw/zinc/14/99/15/1076149915.db2.gz XXEDFVGMEUYJQM-AWEZNQCLSA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@@](C)(O)CNC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001591371665 1076149912 /nfs/dbraw/zinc/14/99/12/1076149912.db2.gz XXEDFVGMEUYJQM-AWEZNQCLSA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@](C)(O)CNC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001591371666 1076149764 /nfs/dbraw/zinc/14/97/64/1076149764.db2.gz XXEDFVGMEUYJQM-CQSZACIVSA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@](C)(O)CNC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001591371666 1076149761 /nfs/dbraw/zinc/14/97/61/1076149761.db2.gz XXEDFVGMEUYJQM-CQSZACIVSA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@@H](CCO)NC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001591375260 1076149809 /nfs/dbraw/zinc/14/98/09/1076149809.db2.gz CYJKFIWMVOIIOV-LLVKDONJSA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@@H](CCO)NC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001591375260 1076149808 /nfs/dbraw/zinc/14/98/08/1076149808.db2.gz CYJKFIWMVOIIOV-LLVKDONJSA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@H](CCO)NC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001591375262 1076149836 /nfs/dbraw/zinc/14/98/36/1076149836.db2.gz CYJKFIWMVOIIOV-NSHDSACASA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@H](CCO)NC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001591375262 1076149833 /nfs/dbraw/zinc/14/98/33/1076149833.db2.gz CYJKFIWMVOIIOV-NSHDSACASA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@H](CNC(=O)C(=O)NCCNc1ncccc1-c1nn[n-]n1)OC ZINC001591376621 1076149803 /nfs/dbraw/zinc/14/98/03/1076149803.db2.gz VKSKTOFGMRSZMZ-JTQLQIEISA-N -1 3 378.393 -1.433 20 0 GAADHM COC[C@H](CNC(=O)C(=O)NCCNc1ncccc1-c1nnn[n-]1)OC ZINC001591376621 1076149799 /nfs/dbraw/zinc/14/97/99/1076149799.db2.gz VKSKTOFGMRSZMZ-JTQLQIEISA-N -1 3 378.393 -1.433 20 0 GAADHM COC[C@@H](CNC(=O)C(=O)NCCNc1ncccc1-c1nn[n-]n1)OC ZINC001591376622 1076149785 /nfs/dbraw/zinc/14/97/85/1076149785.db2.gz VKSKTOFGMRSZMZ-SNVBAGLBSA-N -1 3 378.393 -1.433 20 0 GAADHM COC[C@@H](CNC(=O)C(=O)NCCNc1ncccc1-c1nnn[n-]1)OC ZINC001591376622 1076149781 /nfs/dbraw/zinc/14/97/81/1076149781.db2.gz VKSKTOFGMRSZMZ-SNVBAGLBSA-N -1 3 378.393 -1.433 20 0 GAADHM COCC(COC)NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001591376935 1076149848 /nfs/dbraw/zinc/14/98/48/1076149848.db2.gz CNOPEINEVRQGEA-UHFFFAOYSA-N -1 3 384.418 -1.077 20 0 GAADHM COCC(COC)NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001591376935 1076149845 /nfs/dbraw/zinc/14/98/45/1076149845.db2.gz CNOPEINEVRQGEA-UHFFFAOYSA-N -1 3 384.418 -1.077 20 0 GAADHM COC[C@@H](CO)NC(=O)[C@H](C)NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001591377264 1076149868 /nfs/dbraw/zinc/14/98/68/1076149868.db2.gz GDHCKQIROIVSBW-GXSJLCMTSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@@H](CO)NC(=O)[C@H](C)NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001591377264 1076149866 /nfs/dbraw/zinc/14/98/66/1076149866.db2.gz GDHCKQIROIVSBW-GXSJLCMTSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@H](CO)NC(=O)[C@@H](C)NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001591377265 1076149824 /nfs/dbraw/zinc/14/98/24/1076149824.db2.gz GDHCKQIROIVSBW-KOLCDFICSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@H](CO)NC(=O)[C@@H](C)NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001591377265 1076149821 /nfs/dbraw/zinc/14/98/21/1076149821.db2.gz GDHCKQIROIVSBW-KOLCDFICSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@@H](CO)NC(=O)[C@@H](C)NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001591377266 1076149879 /nfs/dbraw/zinc/14/98/79/1076149879.db2.gz GDHCKQIROIVSBW-MWLCHTKSSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@@H](CO)NC(=O)[C@@H](C)NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001591377266 1076149875 /nfs/dbraw/zinc/14/98/75/1076149875.db2.gz GDHCKQIROIVSBW-MWLCHTKSSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@H](CO)NC(=O)[C@H](C)NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001591377267 1076149888 /nfs/dbraw/zinc/14/98/88/1076149888.db2.gz GDHCKQIROIVSBW-ONGXEEELSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@H](CO)NC(=O)[C@H](C)NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001591377267 1076149885 /nfs/dbraw/zinc/14/98/85/1076149885.db2.gz GDHCKQIROIVSBW-ONGXEEELSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@@H](NC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)OC ZINC001591379210 1076150328 /nfs/dbraw/zinc/15/03/28/1076150328.db2.gz JQKMJRYQYXMLIF-LLVKDONJSA-N -1 3 398.401 -1.551 20 0 GAADHM COC[C@@H](NC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)OC ZINC001591379210 1076150326 /nfs/dbraw/zinc/15/03/26/1076150326.db2.gz JQKMJRYQYXMLIF-LLVKDONJSA-N -1 3 398.401 -1.551 20 0 GAADHM COC[C@H](NC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)OC ZINC001591379211 1076150285 /nfs/dbraw/zinc/15/02/85/1076150285.db2.gz 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COc1ccc(-c2nn[n-]n2)cc1NC(=O)C(=O)NCCNS(C)(=O)=O ZINC001591565481 1076161067 /nfs/dbraw/zinc/16/10/67/1076161067.db2.gz PINLKAKQMPMBMW-UHFFFAOYSA-N -1 3 383.390 -1.521 20 0 GAADHM COc1ccc(-c2nnn[n-]2)cc1NC(=O)C(=O)NCCNS(C)(=O)=O ZINC001591565481 1076161064 /nfs/dbraw/zinc/16/10/64/1076161064.db2.gz PINLKAKQMPMBMW-UHFFFAOYSA-N -1 3 383.390 -1.521 20 0 GAADHM COc1ccc(CN2CC(O)(CNC(=O)CC(N)=O)C2)cc1-c1nn[n-]n1 ZINC001591588318 1076160970 /nfs/dbraw/zinc/16/09/70/1076160970.db2.gz CMWIICRVCBGZDN-UHFFFAOYSA-N -1 3 375.389 -1.586 20 0 GAADHM COc1ccc(CN2CC(O)(CNC(=O)CC(N)=O)C2)cc1-c1nnn[n-]1 ZINC001591588318 1076160964 /nfs/dbraw/zinc/16/09/64/1076160964.db2.gz CMWIICRVCBGZDN-UHFFFAOYSA-N -1 3 375.389 -1.586 20 0 GAADHM COc1ccc(CN2CCN(CCNC(=O)C(N)=O)CC2)cc1-c1nn[n-]n1 ZINC001591589270 1076161108 /nfs/dbraw/zinc/16/11/08/1076161108.db2.gz MCKPOLJEODUSPD-UHFFFAOYSA-N -1 3 388.432 -1.406 20 0 GAADHM COc1ccc(CN2CCN(CCNC(=O)C(N)=O)CC2)cc1-c1nnn[n-]1 ZINC001591589270 1076161102 /nfs/dbraw/zinc/16/11/02/1076161102.db2.gz MCKPOLJEODUSPD-UHFFFAOYSA-N -1 3 388.432 -1.406 20 0 GAADHM COc1ccc(CN2C[C@@H](NC(=O)c3cnnn3C)[C@@H](O)C2)cc1-c1nn[n-]n1 ZINC001591589310 1076161088 /nfs/dbraw/zinc/16/10/88/1076161088.db2.gz DDSOALLKYHPXOH-OCCSQVGLSA-N -1 3 399.415 -1.021 20 0 GAADHM COc1ccc(CN2C[C@@H](NC(=O)c3cnnn3C)[C@@H](O)C2)cc1-c1nnn[n-]1 ZINC001591589310 1076161086 /nfs/dbraw/zinc/16/10/86/1076161086.db2.gz DDSOALLKYHPXOH-OCCSQVGLSA-N -1 3 399.415 -1.021 20 0 GAADHM COc1ccc(CN2C[C@@H](O)[C@H](NC(=O)c3cnnn3C)C2)cc1-c1nn[n-]n1 ZINC001591589313 1076161679 /nfs/dbraw/zinc/16/16/79/1076161679.db2.gz DDSOALLKYHPXOH-TZMCWYRMSA-N -1 3 399.415 -1.021 20 0 GAADHM COc1ccc(CN2C[C@@H](O)[C@H](NC(=O)c3cnnn3C)C2)cc1-c1nnn[n-]1 ZINC001591589313 1076161676 /nfs/dbraw/zinc/16/16/76/1076161676.db2.gz DDSOALLKYHPXOH-TZMCWYRMSA-N -1 3 399.415 -1.021 20 0 GAADHM COc1ccc(CN2C[C@@H](O)[C@H](NC(=O)c3ncn(C)n3)C2)cc1-c1nn[n-]n1 ZINC001591589362 1076161609 /nfs/dbraw/zinc/16/16/09/1076161609.db2.gz DQGLEUCDTAWYAO-CHWSQXEVSA-N -1 3 399.415 -1.021 20 0 GAADHM COc1ccc(CN2C[C@@H](O)[C@H](NC(=O)c3ncn(C)n3)C2)cc1-c1nnn[n-]1 ZINC001591589362 1076161605 /nfs/dbraw/zinc/16/16/05/1076161605.db2.gz DQGLEUCDTAWYAO-CHWSQXEVSA-N -1 3 399.415 -1.021 20 0 GAADHM COc1ccc(CN2C[C@@H](O)[C@H](NC(=O)c3cnn(C)n3)C2)cc1-c1nn[n-]n1 ZINC001591590024 1076161426 /nfs/dbraw/zinc/16/14/26/1076161426.db2.gz RHNJHKCAEOUEHR-ZIAGYGMSSA-N -1 3 399.415 -1.021 20 0 GAADHM COc1ccc(CN2C[C@@H](O)[C@H](NC(=O)c3cnn(C)n3)C2)cc1-c1nnn[n-]1 ZINC001591590024 1076161423 /nfs/dbraw/zinc/16/14/23/1076161423.db2.gz RHNJHKCAEOUEHR-ZIAGYGMSSA-N -1 3 399.415 -1.021 20 0 GAADHM COc1ccc(CN2CCOC[C@H]2CNC(=O)C(N)=O)cc1-c1nn[n-]n1 ZINC001591590527 1076161553 /nfs/dbraw/zinc/16/15/53/1076161553.db2.gz URZSGHLTJBUXGZ-LLVKDONJSA-N -1 3 375.389 -1.322 20 0 GAADHM COc1ccc(CN2CCOC[C@H]2CNC(=O)C(N)=O)cc1-c1nnn[n-]1 ZINC001591590527 1076161551 /nfs/dbraw/zinc/16/15/51/1076161551.db2.gz URZSGHLTJBUXGZ-LLVKDONJSA-N -1 3 375.389 -1.322 20 0 GAADHM COc1ccc(CN2CCOC[C@@H]2CNC(=O)C(N)=O)cc1-c1nn[n-]n1 ZINC001591590528 1076161462 /nfs/dbraw/zinc/16/14/62/1076161462.db2.gz URZSGHLTJBUXGZ-NSHDSACASA-N -1 3 375.389 -1.322 20 0 GAADHM COc1ccc(CN2CCOC[C@@H]2CNC(=O)C(N)=O)cc1-c1nnn[n-]1 ZINC001591590528 1076161455 /nfs/dbraw/zinc/16/14/55/1076161455.db2.gz URZSGHLTJBUXGZ-NSHDSACASA-N -1 3 375.389 -1.322 20 0 GAADHM COc1ccc(CNC(=O)C(=O)N[C@H]2CCS(=O)(=O)C2)cc1-c1nn[n-]n1 ZINC001591591053 1076161630 /nfs/dbraw/zinc/16/16/30/1076161630.db2.gz HDMZDYPPBUPHQA-JTQLQIEISA-N -1 3 394.413 -1.205 20 0 GAADHM COc1ccc(CNC(=O)C(=O)N[C@H]2CCS(=O)(=O)C2)cc1-c1nnn[n-]1 ZINC001591591053 1076161626 /nfs/dbraw/zinc/16/16/26/1076161626.db2.gz HDMZDYPPBUPHQA-JTQLQIEISA-N -1 3 394.413 -1.205 20 0 GAADHM COc1ccc(CNC(=O)C(=O)N[C@@H]2CCS(=O)(=O)C2)cc1-c1nn[n-]n1 ZINC001591591054 1076161655 /nfs/dbraw/zinc/16/16/55/1076161655.db2.gz HDMZDYPPBUPHQA-SNVBAGLBSA-N -1 3 394.413 -1.205 20 0 GAADHM COc1ccc(CNC(=O)C(=O)N[C@@H]2CCS(=O)(=O)C2)cc1-c1nnn[n-]1 ZINC001591591054 1076161652 /nfs/dbraw/zinc/16/16/52/1076161652.db2.gz HDMZDYPPBUPHQA-SNVBAGLBSA-N -1 3 394.413 -1.205 20 0 GAADHM COc1ccc(CNC(=O)C(=O)N2CC[C@H](NC(N)=O)C2)cc1-c1nn[n-]n1 ZINC001591591249 1076161530 /nfs/dbraw/zinc/16/15/30/1076161530.db2.gz JRCZVVINBCMUFQ-JTQLQIEISA-N -1 3 388.388 -1.239 20 0 GAADHM COc1ccc(CNC(=O)C(=O)N2CC[C@H](NC(N)=O)C2)cc1-c1nnn[n-]1 ZINC001591591249 1076161528 /nfs/dbraw/zinc/16/15/28/1076161528.db2.gz JRCZVVINBCMUFQ-JTQLQIEISA-N -1 3 388.388 -1.239 20 0 GAADHM COc1ccc(CNC(=O)C(=O)N2CC[C@@H](NC(N)=O)C2)cc1-c1nn[n-]n1 ZINC001591591251 1076161496 /nfs/dbraw/zinc/16/14/96/1076161496.db2.gz JRCZVVINBCMUFQ-SNVBAGLBSA-N -1 3 388.388 -1.239 20 0 GAADHM COc1ccc(CNC(=O)C(=O)N2CC[C@@H](NC(N)=O)C2)cc1-c1nnn[n-]1 ZINC001591591251 1076161493 /nfs/dbraw/zinc/16/14/93/1076161493.db2.gz JRCZVVINBCMUFQ-SNVBAGLBSA-N -1 3 388.388 -1.239 20 0 GAADHM COc1ccc(CNC(=O)C(=O)N2CCC(O)(CO)CC2)cc1-c1nn[n-]n1 ZINC001591591668 1076161512 /nfs/dbraw/zinc/16/15/12/1076161512.db2.gz RZNOJNHPHDWZAO-UHFFFAOYSA-N -1 3 390.400 -1.163 20 0 GAADHM COc1ccc(CNC(=O)C(=O)N2CCC(O)(CO)CC2)cc1-c1nnn[n-]1 ZINC001591591668 1076161507 /nfs/dbraw/zinc/16/15/07/1076161507.db2.gz RZNOJNHPHDWZAO-UHFFFAOYSA-N -1 3 390.400 -1.163 20 0 GAADHM COc1ccc(CNC(=O)N2CCN(CC(N)=O)C(=O)C2)cc1-c1nn[n-]n1 ZINC001591595128 1076161585 /nfs/dbraw/zinc/16/15/85/1076161585.db2.gz XJAQSMAUPGOROL-UHFFFAOYSA-N -1 3 388.388 -1.286 20 0 GAADHM COc1ccc(CNC(=O)N2CCN(CC(N)=O)C(=O)C2)cc1-c1nnn[n-]1 ZINC001591595128 1076161578 /nfs/dbraw/zinc/16/15/78/1076161578.db2.gz XJAQSMAUPGOROL-UHFFFAOYSA-N -1 3 388.388 -1.286 20 0 GAADHM CC(C)NC(=O)CNS(=O)(=O)CCC(=O)N1CCN(C)C[C@@H](C(=O)[O-])C1 ZINC001591645200 992963167 /nfs/dbraw/zinc/96/31/67/992963167.db2.gz PLMXULFOJNHLRI-GFCCVEGCSA-N -1 3 392.478 -1.705 20 0 GAADHM CC(C)NC(=O)CNS(=O)(=O)CCC(=O)N1CCN(C)C[C@H](C(=O)[O-])C1 ZINC001591645201 992963410 /nfs/dbraw/zinc/96/34/10/992963410.db2.gz PLMXULFOJNHLRI-LBPRGKRZSA-N -1 3 392.478 -1.705 20 0 GAADHM COc1cncc(CN2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001591659210 1076161883 /nfs/dbraw/zinc/16/18/83/1076161883.db2.gz VOLSEHWGPUEGME-CHWSQXEVSA-N -1 3 385.388 -1.032 20 0 GAADHM COc1cncc(CN2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001591659210 1076161881 /nfs/dbraw/zinc/16/18/81/1076161881.db2.gz VOLSEHWGPUEGME-CHWSQXEVSA-N -1 3 385.388 -1.032 20 0 GAADHM COc1ncc(NC(=O)NCCNS(=O)(=O)N(C)C)cc1-c1nnn[n-]1 ZINC001591665657 1076162578 /nfs/dbraw/zinc/16/25/78/1076162578.db2.gz JFYAJVIQJFEONI-UHFFFAOYSA-N -1 3 385.410 -1.212 20 0 GAADHM COc1ncc(NC(=O)N2CCN3[C@H](CNS3(=O)=O)C2)cc1-c1nnn[n-]1 ZINC001591666497 1076162570 /nfs/dbraw/zinc/16/25/70/1076162570.db2.gz REFXWXHIOYEASF-SECBINFHSA-N -1 3 395.405 -1.364 20 0 GAADHM COc1ncc(NC(=O)N2CCN3[C@@H](CNS3(=O)=O)C2)cc1-c1nnn[n-]1 ZINC001591666498 1076162664 /nfs/dbraw/zinc/16/26/64/1076162664.db2.gz REFXWXHIOYEASF-VIFPVBQESA-N -1 3 395.405 -1.364 20 0 GAADHM COc1nn(C)cc1C(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@H]1O ZINC001591670122 1076162648 /nfs/dbraw/zinc/16/26/48/1076162648.db2.gz RSNRBUJOOPRSDX-VXGBXAGGSA-N -1 3 385.388 -1.017 20 0 GAADHM COc1nn(C)cc1C(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@H]1O ZINC001591670122 1076162646 /nfs/dbraw/zinc/16/26/46/1076162646.db2.gz RSNRBUJOOPRSDX-VXGBXAGGSA-N -1 3 385.388 -1.017 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CN(Cc2ccccc2-c2nn[n-]n2)C[C@@H]1O ZINC001591671033 1076162587 /nfs/dbraw/zinc/16/25/87/1076162587.db2.gz FFDSVDKECHHXGG-KGLIPLIRSA-N -1 3 394.457 -1.037 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CN(Cc2ccccc2-c2nnn[n-]2)C[C@@H]1O ZINC001591671033 1076162585 /nfs/dbraw/zinc/16/25/85/1076162585.db2.gz FFDSVDKECHHXGG-KGLIPLIRSA-N -1 3 394.457 -1.037 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)cc2)C[C@H]1O ZINC001591671094 1076162710 /nfs/dbraw/zinc/16/27/10/1076162710.db2.gz HBOLEQLWJQPRKA-ZIAGYGMSSA-N -1 3 394.457 -1.037 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)cc2)C[C@H]1O ZINC001591671094 1076162707 /nfs/dbraw/zinc/16/27/07/1076162707.db2.gz HBOLEQLWJQPRKA-ZIAGYGMSSA-N -1 3 394.457 -1.037 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CN(Cc2cccc(-c3nn[n-]n3)c2)C[C@@H]1O ZINC001591671554 1076162675 /nfs/dbraw/zinc/16/26/75/1076162675.db2.gz QTMYWUKRQOWWKC-KGLIPLIRSA-N -1 3 394.457 -1.037 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CN(Cc2cccc(-c3nnn[n-]3)c2)C[C@@H]1O ZINC001591671554 1076162673 /nfs/dbraw/zinc/16/26/73/1076162673.db2.gz QTMYWUKRQOWWKC-KGLIPLIRSA-N -1 3 394.457 -1.037 20 0 GAADHM CS(=O)(=O)CC(=O)N1C[C@@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H]2C1 ZINC001591672919 1076162639 /nfs/dbraw/zinc/16/26/39/1076162639.db2.gz ABNXIAYCSKMHRM-JOYOIKCWSA-N -1 3 393.429 -1.088 20 0 GAADHM CS(=O)(=O)CC(=O)N1C[C@H]2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]21 ZINC001591672958 1076162613 /nfs/dbraw/zinc/16/26/13/1076162613.db2.gz AWXZRWHEAFJBLZ-BXKDBHETSA-N -1 3 393.429 -1.088 20 0 GAADHM 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C[C@@]12CN(C(=O)Cn3ncnn3)C[C@@H]1CN(C(=O)c1ccc(-c3nnn[n-]3)[nH]1)C2 ZINC001591759376 1076170114 /nfs/dbraw/zinc/17/01/14/1076170114.db2.gz MDUHGIJQWRDEMD-HWPZZCPQSA-N -1 3 397.403 -1.198 20 0 GAADHM C[C@@]12CN(C(=O)Cn3cnnn3)C[C@@H]1CN(C(=O)c1cc(-c3nn[n-]n3)c[nH]1)C2 ZINC001591759512 1076170009 /nfs/dbraw/zinc/17/00/09/1076170009.db2.gz QUWMKUPLWHROJY-BZNIZROVSA-N -1 3 397.403 -1.198 20 0 GAADHM C[C@@]12CN(C(=O)Cn3cnnn3)C[C@@H]1CN(C(=O)c1cc(-c3nnn[n-]3)c[nH]1)C2 ZINC001591759512 1076170004 /nfs/dbraw/zinc/17/00/04/1076170004.db2.gz QUWMKUPLWHROJY-BZNIZROVSA-N -1 3 397.403 -1.198 20 0 GAADHM C[C@H](CNC(=O)CCN1C(=O)CCC1=O)NC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001591760601 1076169925 /nfs/dbraw/zinc/16/99/25/1076169925.db2.gz OTRSPAGFWWCLHN-SECBINFHSA-N -1 3 388.388 -1.032 20 0 GAADHM C[C@H](CNC(=O)CCN1C(=O)CCC1=O)NC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001591760601 1076169920 /nfs/dbraw/zinc/16/99/20/1076169920.db2.gz OTRSPAGFWWCLHN-SECBINFHSA-N -1 3 388.388 -1.032 20 0 GAADHM C[C@H](CNC(=O)CN1C(=O)CN(C)C1=O)NC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001591760686 1076170160 /nfs/dbraw/zinc/17/01/60/1076170160.db2.gz VWTLHPRTGQFAQE-MRVPVSSYSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@H](CNC(=O)CN1C(=O)CN(C)C1=O)NC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001591760686 1076170157 /nfs/dbraw/zinc/17/01/57/1076170157.db2.gz VWTLHPRTGQFAQE-MRVPVSSYSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1)NC(=O)CN1CC(=O)N(C)C1=O ZINC001591760776 1076169967 /nfs/dbraw/zinc/16/99/67/1076169967.db2.gz KFXNMKWSOAUUTH-MRVPVSSYSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@H](CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1)NC(=O)CN1CC(=O)N(C)C1=O ZINC001591760776 1076169961 /nfs/dbraw/zinc/16/99/61/1076169961.db2.gz KFXNMKWSOAUUTH-MRVPVSSYSA-N -1 3 389.376 -1.677 20 0 GAADHM C[C@H](CNc1ncccc1-c1nn[n-]n1)NC(=O)CN1C(=O)C(=O)N(C)C1=O ZINC001591766004 1076170412 /nfs/dbraw/zinc/17/04/12/1076170412.db2.gz YRDWOAPGGOARNE-MRVPVSSYSA-N -1 3 387.360 -1.401 20 0 GAADHM C[C@H](CNc1ncccc1-c1nnn[n-]1)NC(=O)CN1C(=O)C(=O)N(C)C1=O ZINC001591766004 1076170407 /nfs/dbraw/zinc/17/04/07/1076170407.db2.gz YRDWOAPGGOARNE-MRVPVSSYSA-N -1 3 387.360 -1.401 20 0 GAADHM C[C@H](NC(=O)C(=O)NCCNc1ccc(-c2nn[n-]n2)cn1)C(=O)N(C)C ZINC001591766369 1076170584 /nfs/dbraw/zinc/17/05/84/1076170584.db2.gz QYRAFHWNYUQJQK-VIFPVBQESA-N -1 3 375.393 -1.617 20 0 GAADHM C[C@H](NC(=O)C(=O)NCCNc1ccc(-c2nnn[n-]2)cn1)C(=O)N(C)C ZINC001591766369 1076170581 /nfs/dbraw/zinc/17/05/81/1076170581.db2.gz QYRAFHWNYUQJQK-VIFPVBQESA-N -1 3 375.393 -1.617 20 0 GAADHM C[C@H](NC(N)=O)C(=O)NCCOCCN(C)c1ncccc1-c1nn[n-]n1 ZINC001591768864 1076170326 /nfs/dbraw/zinc/17/03/26/1076170326.db2.gz FEEPAFKVASNZEA-JTQLQIEISA-N -1 3 377.409 -1.113 20 0 GAADHM C[C@H](NC(N)=O)C(=O)NCCOCCN(C)c1ncccc1-c1nnn[n-]1 ZINC001591768864 1076170324 /nfs/dbraw/zinc/17/03/24/1076170324.db2.gz FEEPAFKVASNZEA-JTQLQIEISA-N -1 3 377.409 -1.113 20 0 GAADHM C[C@H]1CN(C(=O)C(=O)Nc2ccc(-c3nn[n-]n3)cn2)CCN1S(C)(=O)=O ZINC001591773993 1076170510 /nfs/dbraw/zinc/17/05/10/1076170510.db2.gz NONPBODUTSQXDG-VIFPVBQESA-N -1 3 394.417 -1.308 20 0 GAADHM C[C@H]1CN(C(=O)C(=O)Nc2ccc(-c3nnn[n-]3)cn2)CCN1S(C)(=O)=O ZINC001591773993 1076170508 /nfs/dbraw/zinc/17/05/08/1076170508.db2.gz NONPBODUTSQXDG-VIFPVBQESA-N -1 3 394.417 -1.308 20 0 GAADHM C[C@]12CN(C(=O)Cn3ncnn3)C[C@H]1CN(C(=O)c1cc(-c3nn[n-]n3)c[nH]1)C2 ZINC001591777593 1076171179 /nfs/dbraw/zinc/17/11/79/1076171179.db2.gz NOXHTLINNMNEKW-MEDUHNTESA-N -1 3 397.403 -1.198 20 0 GAADHM C[C@]12CN(C(=O)Cn3ncnn3)C[C@H]1CN(C(=O)c1cc(-c3nnn[n-]3)c[nH]1)C2 ZINC001591777593 1076171178 /nfs/dbraw/zinc/17/11/78/1076171178.db2.gz NOXHTLINNMNEKW-MEDUHNTESA-N -1 3 397.403 -1.198 20 0 GAADHM C[C@]12CN(C(=O)Cn3cnnn3)C[C@H]1CN(C(=O)c1c[nH]c(-c3nn[n-]n3)c1)C2 ZINC001591777777 1076171193 /nfs/dbraw/zinc/17/11/93/1076171193.db2.gz UHBYKXSQDYYEFL-MEDUHNTESA-N -1 3 397.403 -1.198 20 0 GAADHM C[C@]12CN(C(=O)Cn3cnnn3)C[C@H]1CN(C(=O)c1c[nH]c(-c3nnn[n-]3)c1)C2 ZINC001591777777 1076171190 /nfs/dbraw/zinc/17/11/90/1076171190.db2.gz UHBYKXSQDYYEFL-MEDUHNTESA-N -1 3 397.403 -1.198 20 0 GAADHM C[C@]12CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]1CN(C(=O)[C@H]1CNC(=O)N1)C2 ZINC001591778502 1076171154 /nfs/dbraw/zinc/17/11/54/1076171154.db2.gz IXLAYHDXHRMIHD-GSDQYQHOSA-N -1 3 399.415 -1.203 20 0 GAADHM C[C@]12CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]1CN(C(=O)[C@H]1CNC(=O)N1)C2 ZINC001591778502 1076171150 /nfs/dbraw/zinc/17/11/50/1076171150.db2.gz IXLAYHDXHRMIHD-GSDQYQHOSA-N -1 3 399.415 -1.203 20 0 GAADHM C[C@]12CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]1CN(C(=O)[C@@H]1CNC(=O)N1)C2 ZINC001591778503 1076171183 /nfs/dbraw/zinc/17/11/83/1076171183.db2.gz IXLAYHDXHRMIHD-QAGHZCBJSA-N -1 3 399.415 -1.203 20 0 GAADHM C[C@]12CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]1CN(C(=O)[C@@H]1CNC(=O)N1)C2 ZINC001591778503 1076171181 /nfs/dbraw/zinc/17/11/81/1076171181.db2.gz IXLAYHDXHRMIHD-QAGHZCBJSA-N -1 3 399.415 -1.203 20 0 GAADHM Cc1[nH]c(-c2nn[n-]n2)cc1C(=O)N1CCN([C@@H]2CS(=O)(=O)C[C@H]2O)CC1 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1076171129 /nfs/dbraw/zinc/17/11/29/1076171129.db2.gz ORWYTWZKADPROY-QWHCGFSZSA-N -1 3 395.445 -1.581 20 0 GAADHM Cc1[nH]c(-c2nn[n-]n2)cc1C(=O)N1CCN([C@H]2CS(=O)(=O)C[C@@H]2O)CC1 ZINC001591781776 1076171123 /nfs/dbraw/zinc/17/11/23/1076171123.db2.gz ORWYTWZKADPROY-STQMWFEESA-N -1 3 395.445 -1.581 20 0 GAADHM Cc1[nH]c(-c2nnn[n-]2)cc1C(=O)N1CCN([C@H]2CS(=O)(=O)C[C@@H]2O)CC1 ZINC001591781776 1076171121 /nfs/dbraw/zinc/17/11/21/1076171121.db2.gz ORWYTWZKADPROY-STQMWFEESA-N -1 3 395.445 -1.581 20 0 GAADHM Cc1nc[nH]c1CC(=O)N[C@H]1CCN(c2nccnc2-c2nn[n-]n2)C[C@H]1O ZINC001591790646 1076171161 /nfs/dbraw/zinc/17/11/61/1076171161.db2.gz AYALVVBWPZYXSY-CMPLNLGQSA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1nc[nH]c1CC(=O)N[C@H]1CCN(c2nccnc2-c2nnn[n-]2)C[C@H]1O ZINC001591790646 1076171160 /nfs/dbraw/zinc/17/11/60/1076171160.db2.gz AYALVVBWPZYXSY-CMPLNLGQSA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1nc[nH]c1CC(=O)N[C@H]1CCN(c2nccnc2-c2nn[n-]n2)C[C@@H]1O ZINC001591790649 1076171218 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AYALVVBWPZYXSY-ZYHUDNBSSA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1c(CC(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)cnn1C ZINC001591816341 1076171744 /nfs/dbraw/zinc/17/17/44/1076171744.db2.gz MJMDFPYSDNQCLP-KGLIPLIRSA-N -1 3 399.415 -1.219 20 0 GAADHM Cc1c(CC(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)cnn1C ZINC001591816341 1076171739 /nfs/dbraw/zinc/17/17/39/1076171739.db2.gz MJMDFPYSDNQCLP-KGLIPLIRSA-N -1 3 399.415 -1.219 20 0 GAADHM Cc1c(CC(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]2O)cnn1C ZINC001591816342 1076171624 /nfs/dbraw/zinc/17/16/24/1076171624.db2.gz MJMDFPYSDNQCLP-ZIAGYGMSSA-N -1 3 399.415 -1.219 20 0 GAADHM Cc1c(CC(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]2O)cnn1C ZINC001591816342 1076171617 /nfs/dbraw/zinc/17/16/17/1076171617.db2.gz MJMDFPYSDNQCLP-ZIAGYGMSSA-N -1 3 399.415 -1.219 20 0 GAADHM Cc1c(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)cnn1C ZINC001591817745 1076171525 /nfs/dbraw/zinc/17/15/25/1076171525.db2.gz OMZULSITBOVVJR-ZIAGYGMSSA-N -1 3 399.415 -1.219 20 0 GAADHM Cc1c(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)cnn1C ZINC001591817745 1076171516 /nfs/dbraw/zinc/17/15/16/1076171516.db2.gz OMZULSITBOVVJR-ZIAGYGMSSA-N -1 3 399.415 -1.219 20 0 GAADHM Cc1cc(-c2nn[n-]n2)ccc1S(=O)(=O)N1CCN(CC(N)=O)C(=O)C1 ZINC001591870719 1076172145 /nfs/dbraw/zinc/17/21/45/1076172145.db2.gz OWTBVMBLLIWZQP-UHFFFAOYSA-N -1 3 379.402 -1.507 20 0 GAADHM Cc1cc(-c2nnn[n-]2)ccc1S(=O)(=O)N1CCN(CC(N)=O)C(=O)C1 ZINC001591870719 1076172144 /nfs/dbraw/zinc/17/21/44/1076172144.db2.gz OWTBVMBLLIWZQP-UHFFFAOYSA-N -1 3 379.402 -1.507 20 0 GAADHM Cc1cc(-c2nn[n-]n2)ccc1S(=O)(=O)NC[C@H](O)CS(C)(=O)=O ZINC001591873582 1076172126 /nfs/dbraw/zinc/17/21/26/1076172126.db2.gz ZERVBMAZVMGFHQ-JTQLQIEISA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1cc(-c2nnn[n-]2)ccc1S(=O)(=O)NC[C@H](O)CS(C)(=O)=O ZINC001591873582 1076172123 /nfs/dbraw/zinc/17/21/23/1076172123.db2.gz ZERVBMAZVMGFHQ-JTQLQIEISA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1cc(-c2nn[n-]n2)ccc1S(=O)(=O)NC[C@@H](O)CS(C)(=O)=O ZINC001591873586 1076172251 /nfs/dbraw/zinc/17/22/51/1076172251.db2.gz ZERVBMAZVMGFHQ-SNVBAGLBSA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1cc(-c2nnn[n-]2)ccc1S(=O)(=O)NC[C@@H](O)CS(C)(=O)=O ZINC001591873586 1076172250 /nfs/dbraw/zinc/17/22/50/1076172250.db2.gz ZERVBMAZVMGFHQ-SNVBAGLBSA-N -1 3 375.432 -1.141 20 0 GAADHM Cc1cc(-c2nn[n-]n2)cnc1C(=O)N1CCOC[C@H]1CNS(C)(=O)=O ZINC001591876015 1076172166 /nfs/dbraw/zinc/17/21/66/1076172166.db2.gz JZPDJLRSZIXHMK-LLVKDONJSA-N -1 3 381.418 -1.040 20 0 GAADHM Cc1cc(-c2nnn[n-]2)cnc1C(=O)N1CCOC[C@H]1CNS(C)(=O)=O ZINC001591876015 1076172164 /nfs/dbraw/zinc/17/21/64/1076172164.db2.gz JZPDJLRSZIXHMK-LLVKDONJSA-N -1 3 381.418 -1.040 20 0 GAADHM Cc1cc(-c2nn[n-]n2)cnc1C(=O)N1CCOC[C@@H]1CNS(C)(=O)=O ZINC001591876017 1076172225 /nfs/dbraw/zinc/17/22/25/1076172225.db2.gz JZPDJLRSZIXHMK-NSHDSACASA-N -1 3 381.418 -1.040 20 0 GAADHM Cc1cc(-c2nnn[n-]2)cnc1C(=O)N1CCOC[C@@H]1CNS(C)(=O)=O ZINC001591876017 1076172223 /nfs/dbraw/zinc/17/22/23/1076172223.db2.gz JZPDJLRSZIXHMK-NSHDSACASA-N -1 3 381.418 -1.040 20 0 GAADHM Cc1cc(-c2nn[n-]n2)cnc1C(=O)N1CCN(C(=O)Cn2cnnn2)CC1 ZINC001591876548 1076172217 /nfs/dbraw/zinc/17/22/17/1076172217.db2.gz OKVHUTOYNUYEAD-UHFFFAOYSA-N -1 3 383.376 -1.459 20 0 GAADHM Cc1cc(-c2nnn[n-]2)cnc1C(=O)N1CCN(C(=O)Cn2cnnn2)CC1 ZINC001591876548 1076172214 /nfs/dbraw/zinc/17/22/14/1076172214.db2.gz OKVHUTOYNUYEAD-UHFFFAOYSA-N -1 3 383.376 -1.459 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(N2C[C@@H](NC(=O)c3cn(C)c(=O)[nH]3)[C@@H](O)C2)n1 ZINC001591890816 1076174640 /nfs/dbraw/zinc/17/46/40/1076174640.db2.gz QKQXNNTWOJABMT-KOLCDFICSA-N -1 3 386.376 -1.616 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(NC[C@H]2CN(C(=O)Cc3nnc[nH]3)CCO2)n1 ZINC001591896761 1076175847 /nfs/dbraw/zinc/17/58/47/1076175847.db2.gz QEOWYZZWIGZZPK-JTQLQIEISA-N -1 3 385.392 -1.035 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(NC[C@H]2CN(C(=O)Cc3nnc[nH]3)CCO2)n1 ZINC001591896761 1076175843 /nfs/dbraw/zinc/17/58/43/1076175843.db2.gz QEOWYZZWIGZZPK-JTQLQIEISA-N -1 3 385.392 -1.035 20 0 GAADHM Cc1cc(-c2nn[n-]n2)nc(NC[C@@H]2CN(C(=O)Cc3nnc[nH]3)CCO2)n1 ZINC001591896762 1076175934 /nfs/dbraw/zinc/17/59/34/1076175934.db2.gz QEOWYZZWIGZZPK-SNVBAGLBSA-N -1 3 385.392 -1.035 20 0 GAADHM Cc1cc(-c2nnn[n-]2)nc(NC[C@@H]2CN(C(=O)Cc3nnc[nH]3)CCO2)n1 ZINC001591896762 1076175931 /nfs/dbraw/zinc/17/59/31/1076175931.db2.gz QEOWYZZWIGZZPK-SNVBAGLBSA-N -1 3 385.392 -1.035 20 0 GAADHM Cc1cc(C(=O)N2CCN(C(=O)Cn3cnnn3)CC2)ncc1-c1nn[n-]n1 ZINC001591915114 1076176431 /nfs/dbraw/zinc/17/64/31/1076176431.db2.gz NTLUBPYVEQZUIJ-UHFFFAOYSA-N -1 3 383.376 -1.459 20 0 GAADHM Cc1cc(C(=O)N2CCN(C(=O)Cn3cnnn3)CC2)ncc1-c1nnn[n-]1 ZINC001591915114 1076176423 /nfs/dbraw/zinc/17/64/23/1076176423.db2.gz NTLUBPYVEQZUIJ-UHFFFAOYSA-N -1 3 383.376 -1.459 20 0 GAADHM Cc1cc(C(=O)N2CCOC[C@@H]2CNS(C)(=O)=O)ncc1-c1nn[n-]n1 ZINC001591915689 1076176500 /nfs/dbraw/zinc/17/65/00/1076176500.db2.gz JNDVPIMVDAKVBY-JTQLQIEISA-N -1 3 381.418 -1.040 20 0 GAADHM Cc1cc(C(=O)N2CCOC[C@@H]2CNS(C)(=O)=O)ncc1-c1nnn[n-]1 ZINC001591915689 1076176499 /nfs/dbraw/zinc/17/64/99/1076176499.db2.gz JNDVPIMVDAKVBY-JTQLQIEISA-N -1 3 381.418 -1.040 20 0 GAADHM Cc1cc(C(=O)N2CCOC[C@H]2CNS(C)(=O)=O)ncc1-c1nn[n-]n1 ZINC001591915690 1076176417 /nfs/dbraw/zinc/17/64/17/1076176417.db2.gz JNDVPIMVDAKVBY-SNVBAGLBSA-N -1 3 381.418 -1.040 20 0 GAADHM Cc1cc(C(=O)N2CCOC[C@H]2CNS(C)(=O)=O)ncc1-c1nnn[n-]1 ZINC001591915690 1076176414 /nfs/dbraw/zinc/17/64/14/1076176414.db2.gz JNDVPIMVDAKVBY-SNVBAGLBSA-N -1 3 381.418 -1.040 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)cnn1 ZINC001591917714 1076176343 /nfs/dbraw/zinc/17/63/43/1076176343.db2.gz XXVLYXRQYFAFQP-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)cnn1 ZINC001591917714 1076176338 /nfs/dbraw/zinc/17/63/38/1076176338.db2.gz XXVLYXRQYFAFQP-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)NCCC(=O)N[C@H]2CCS(=O)(=O)C2)ncc1-c1nn[n-]n1 ZINC001591926509 1076176359 /nfs/dbraw/zinc/17/63/59/1076176359.db2.gz IUOWJAYOKRKUBQ-JTQLQIEISA-N -1 3 393.429 -1.007 20 0 GAADHM Cc1cc(C(=O)NCCC(=O)N[C@H]2CCS(=O)(=O)C2)ncc1-c1nnn[n-]1 ZINC001591926509 1076176357 /nfs/dbraw/zinc/17/63/57/1076176357.db2.gz IUOWJAYOKRKUBQ-JTQLQIEISA-N -1 3 393.429 -1.007 20 0 GAADHM Cc1cc(C(=O)NCCC(=O)N[C@@H]2CCS(=O)(=O)C2)ncc1-c1nn[n-]n1 ZINC001591926514 1076176401 /nfs/dbraw/zinc/17/64/01/1076176401.db2.gz IUOWJAYOKRKUBQ-SNVBAGLBSA-N -1 3 393.429 -1.007 20 0 GAADHM Cc1cc(C(=O)NCCC(=O)N[C@@H]2CCS(=O)(=O)C2)ncc1-c1nnn[n-]1 ZINC001591926514 1076176395 /nfs/dbraw/zinc/17/63/95/1076176395.db2.gz IUOWJAYOKRKUBQ-SNVBAGLBSA-N -1 3 393.429 -1.007 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)cnn1 ZINC001591931908 1076176321 /nfs/dbraw/zinc/17/63/21/1076176321.db2.gz WYQWETJELFJNED-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)cnn1 ZINC001591931908 1076176318 /nfs/dbraw/zinc/17/63/18/1076176318.db2.gz WYQWETJELFJNED-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1cc(F)cc(-c2nnn[n-]2)c1S(=O)(=O)N1CC(S(N)(=O)=O)C1 ZINC001591988957 1076176580 /nfs/dbraw/zinc/17/65/80/1076176580.db2.gz KJICRQPIPPQDFO-UHFFFAOYSA-N -1 3 376.395 -1.024 20 0 GAADHM Cc1cc(N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n2ncnc2n1 ZINC001592010550 1076177016 /nfs/dbraw/zinc/17/70/16/1076177016.db2.gz PGJVALWXUYEWGR-VXGBXAGGSA-N -1 3 395.387 -1.080 20 0 GAADHM Cc1cc(N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n2ncnc2n1 ZINC001592010550 1076177012 /nfs/dbraw/zinc/17/70/12/1076177012.db2.gz PGJVALWXUYEWGR-VXGBXAGGSA-N -1 3 395.387 -1.080 20 0 GAADHM Cc1cc(N2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)n2ncnc2n1 ZINC001592010782 1076177416 /nfs/dbraw/zinc/17/74/16/1076177416.db2.gz JNIXRXYWDPQGNM-NEPJUHHUSA-N -1 3 395.387 -1.080 20 0 GAADHM Cc1cc(N2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)n2ncnc2n1 ZINC001592010782 1076177414 /nfs/dbraw/zinc/17/74/14/1076177414.db2.gz JNIXRXYWDPQGNM-NEPJUHHUSA-N -1 3 395.387 -1.080 20 0 GAADHM Cc1cc(NC(=O)C(=O)N(C)CC(=O)N2CCOCC2)ncc1-c1nn[n-]n1 ZINC001592011583 1076177460 /nfs/dbraw/zinc/17/74/60/1076177460.db2.gz KVQONXHCFNHNEX-UHFFFAOYSA-N -1 3 388.388 -1.174 20 0 GAADHM Cc1cc(NC(=O)C(=O)N(C)CC(=O)N2CCOCC2)ncc1-c1nnn[n-]1 ZINC001592011583 1076177457 /nfs/dbraw/zinc/17/74/57/1076177457.db2.gz KVQONXHCFNHNEX-UHFFFAOYSA-N -1 3 388.388 -1.174 20 0 GAADHM Cc1cc(NC(=O)C(=O)NCCN2CCCS2(=O)=O)ncc1-c1nn[n-]n1 ZINC001592013254 1076177331 /nfs/dbraw/zinc/17/73/31/1076177331.db2.gz OIZLZXOWALMXIX-UHFFFAOYSA-N -1 3 394.417 -1.340 20 0 GAADHM Cc1cc(NC(=O)C(=O)NCCN2CCCS2(=O)=O)ncc1-c1nnn[n-]1 ZINC001592013254 1076177328 /nfs/dbraw/zinc/17/73/28/1076177328.db2.gz OIZLZXOWALMXIX-UHFFFAOYSA-N -1 3 394.417 -1.340 20 0 GAADHM Cc1cc(NC(=O)C(=O)N[C@@H]2CCCN(CCO)C2=O)ncc1-c1nn[n-]n1 ZINC001592013316 1076177365 /nfs/dbraw/zinc/17/73/65/1076177365.db2.gz LHWFOZBZFHYOKY-LLVKDONJSA-N -1 3 388.388 -1.392 20 0 GAADHM Cc1cc(NC(=O)C(=O)N[C@@H]2CCCN(CCO)C2=O)ncc1-c1nnn[n-]1 ZINC001592013316 1076177363 /nfs/dbraw/zinc/17/73/63/1076177363.db2.gz LHWFOZBZFHYOKY-LLVKDONJSA-N -1 3 388.388 -1.392 20 0 GAADHM Cc1cc(NC(=O)C(=O)N[C@H]2CCCN(CCO)C2=O)ncc1-c1nn[n-]n1 ZINC001592013318 1076177425 /nfs/dbraw/zinc/17/74/25/1076177425.db2.gz LHWFOZBZFHYOKY-NSHDSACASA-N -1 3 388.388 -1.392 20 0 GAADHM Cc1cc(NC(=O)C(=O)N[C@H]2CCCN(CCO)C2=O)ncc1-c1nnn[n-]1 ZINC001592013318 1076177422 /nfs/dbraw/zinc/17/74/22/1076177422.db2.gz LHWFOZBZFHYOKY-NSHDSACASA-N -1 3 388.388 -1.392 20 0 GAADHM Cc1cc(NC(=O)C(=O)N[C@@H]2CCN(S(C)(=O)=O)C2)ncc1-c1nn[n-]n1 ZINC001592013440 1076177932 /nfs/dbraw/zinc/17/79/32/1076177932.db2.gz NYPKUFLWWUJKBJ-SECBINFHSA-N -1 3 394.417 -1.341 20 0 GAADHM Cc1cc(NC(=O)C(=O)N[C@@H]2CCN(S(C)(=O)=O)C2)ncc1-c1nnn[n-]1 ZINC001592013440 1076177930 /nfs/dbraw/zinc/17/79/30/1076177930.db2.gz NYPKUFLWWUJKBJ-SECBINFHSA-N -1 3 394.417 -1.341 20 0 GAADHM Cc1cc(NC(=O)C(=O)N[C@H]2CCN(S(C)(=O)=O)C2)ncc1-c1nn[n-]n1 ZINC001592013443 1076177940 /nfs/dbraw/zinc/17/79/40/1076177940.db2.gz NYPKUFLWWUJKBJ-VIFPVBQESA-N -1 3 394.417 -1.341 20 0 GAADHM Cc1cc(NC(=O)C(=O)N[C@H]2CCN(S(C)(=O)=O)C2)ncc1-c1nnn[n-]1 ZINC001592013443 1076177939 /nfs/dbraw/zinc/17/79/39/1076177939.db2.gz NYPKUFLWWUJKBJ-VIFPVBQESA-N -1 3 394.417 -1.341 20 0 GAADHM Cc1cc(NC(=O)C(=O)NCCCN(C)S(C)(=O)=O)ncc1-c1nn[n-]n1 ZINC001592014002 1076178040 /nfs/dbraw/zinc/17/80/40/1076178040.db2.gz WUGJJOXJWKGQAG-UHFFFAOYSA-N -1 3 396.433 -1.094 20 0 GAADHM Cc1cc(NC(=O)C(=O)NCCCN(C)S(C)(=O)=O)ncc1-c1nnn[n-]1 ZINC001592014002 1076178039 /nfs/dbraw/zinc/17/80/39/1076178039.db2.gz WUGJJOXJWKGQAG-UHFFFAOYSA-N -1 3 396.433 -1.094 20 0 GAADHM Cc1cc(NC(=O)C(=O)N2CC[C@@H]3OCC(=O)N[C@H]3C2)ncc1-c1nn[n-]n1 ZINC001592015896 1076178019 /nfs/dbraw/zinc/17/80/19/1076178019.db2.gz ZLALDGMDSNAZAV-QWRGUYRKSA-N -1 3 386.372 -1.375 20 0 GAADHM Cc1cc(NC(=O)C(=O)N2CC[C@@H]3OCC(=O)N[C@H]3C2)ncc1-c1nnn[n-]1 ZINC001592015896 1076178017 /nfs/dbraw/zinc/17/80/17/1076178017.db2.gz ZLALDGMDSNAZAV-QWRGUYRKSA-N -1 3 386.372 -1.375 20 0 GAADHM Cc1cc(NC(=O)N2CCN(C(=O)Cn3cnnn3)CC2)ncc1-c1nn[n-]n1 ZINC001592022918 1076177922 /nfs/dbraw/zinc/17/79/22/1076177922.db2.gz UGBNESXWLBWIOT-UHFFFAOYSA-N -1 3 398.391 -1.067 20 0 GAADHM Cc1cc(NC(=O)N2CCN(C(=O)Cn3cnnn3)CC2)ncc1-c1nnn[n-]1 ZINC001592022918 1076177919 /nfs/dbraw/zinc/17/79/19/1076177919.db2.gz UGBNESXWLBWIOT-UHFFFAOYSA-N -1 3 398.391 -1.067 20 0 GAADHM Cc1cc(S(=O)(=O)N2CCN3[C@@H](CNS3(=O)=O)C2)ccc1-c1nn[n-]n1 ZINC001592066533 1076178401 /nfs/dbraw/zinc/17/84/01/1076178401.db2.gz YNUFYPWDRPZCDE-JTQLQIEISA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1cc(S(=O)(=O)N2CCN3[C@@H](CNS3(=O)=O)C2)ccc1-c1nnn[n-]1 ZINC001592066533 1076178398 /nfs/dbraw/zinc/17/83/98/1076178398.db2.gz YNUFYPWDRPZCDE-JTQLQIEISA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1cc(S(=O)(=O)N2CCN3[C@H](CNS3(=O)=O)C2)ccc1-c1nn[n-]n1 ZINC001592066534 1076178548 /nfs/dbraw/zinc/17/85/48/1076178548.db2.gz YNUFYPWDRPZCDE-SNVBAGLBSA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1cc(S(=O)(=O)N2CCN3[C@H](CNS3(=O)=O)C2)ccc1-c1nnn[n-]1 ZINC001592066534 1076178546 /nfs/dbraw/zinc/17/85/46/1076178546.db2.gz YNUFYPWDRPZCDE-SNVBAGLBSA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N(C)CCOCCNC(=O)Cn2ncnn2)n1 ZINC001592076202 1076178429 /nfs/dbraw/zinc/17/84/29/1076178429.db2.gz FMELGBYIUZFNRS-UHFFFAOYSA-N -1 3 387.408 -1.174 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N(C)CCOCCNC(=O)Cn2ncnn2)n1 ZINC001592076202 1076178426 /nfs/dbraw/zinc/17/84/26/1076178426.db2.gz FMELGBYIUZFNRS-UHFFFAOYSA-N -1 3 387.408 -1.174 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@H](NC(=O)CN3C(=O)CNC3=O)C2)n1 ZINC001592078452 1076178419 /nfs/dbraw/zinc/17/84/19/1076178419.db2.gz FBRUOIKPMCWUGS-JTQLQIEISA-N -1 3 385.388 -1.183 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@H](NC(=O)CN3C(=O)CNC3=O)C2)n1 ZINC001592078452 1076178416 /nfs/dbraw/zinc/17/84/16/1076178416.db2.gz FBRUOIKPMCWUGS-JTQLQIEISA-N -1 3 385.388 -1.183 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@H](NC(=O)C3(C(N)=O)CC3)[C@@H](O)C2)n1 ZINC001592078786 1076179021 /nfs/dbraw/zinc/17/90/21/1076179021.db2.gz ZXFQDDHEXXRLMV-NEPJUHHUSA-N -1 3 386.416 -1.109 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@H](NC(=O)C3(C(N)=O)CC3)[C@@H](O)C2)n1 ZINC001592078786 1076179018 /nfs/dbraw/zinc/17/90/18/1076179018.db2.gz ZXFQDDHEXXRLMV-NEPJUHHUSA-N -1 3 386.416 -1.109 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@H](NC(=O)C3(C(N)=O)CC3)[C@H](O)C2)n1 ZINC001592078787 1076179044 /nfs/dbraw/zinc/17/90/44/1076179044.db2.gz ZXFQDDHEXXRLMV-NWDGAFQWSA-N -1 3 386.416 -1.109 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@H](NC(=O)C3(C(N)=O)CC3)[C@H](O)C2)n1 ZINC001592078787 1076179041 /nfs/dbraw/zinc/17/90/41/1076179041.db2.gz ZXFQDDHEXXRLMV-NWDGAFQWSA-N -1 3 386.416 -1.109 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@H](NC(=O)C3(C(N)=O)CC3)[C@@H](O)C2)n1 ZINC001592078788 1076178986 /nfs/dbraw/zinc/17/89/86/1076178986.db2.gz ZXFQDDHEXXRLMV-RYUDHWBXSA-N -1 3 386.416 -1.109 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@H](NC(=O)C3(C(N)=O)CC3)[C@@H](O)C2)n1 ZINC001592078788 1076178982 /nfs/dbraw/zinc/17/89/82/1076178982.db2.gz ZXFQDDHEXXRLMV-RYUDHWBXSA-N -1 3 386.416 -1.109 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@H](NC(=O)C3(C(N)=O)CC3)[C@H](O)C2)n1 ZINC001592078789 1076179066 /nfs/dbraw/zinc/17/90/66/1076179066.db2.gz ZXFQDDHEXXRLMV-VXGBXAGGSA-N -1 3 386.416 -1.109 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@H](NC(=O)C3(C(N)=O)CC3)[C@H](O)C2)n1 ZINC001592078789 1076179064 /nfs/dbraw/zinc/17/90/64/1076179064.db2.gz ZXFQDDHEXXRLMV-VXGBXAGGSA-N -1 3 386.416 -1.109 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@H](NC(=O)Cn3cnnn3)[C@@H](O)C2)n1 ZINC001592078952 1076178873 /nfs/dbraw/zinc/17/88/73/1076178873.db2.gz SFZSBXBIXKYWTR-NEPJUHHUSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@H](NC(=O)Cn3cnnn3)[C@@H](O)C2)n1 ZINC001592078952 1076178871 /nfs/dbraw/zinc/17/88/71/1076178871.db2.gz SFZSBXBIXKYWTR-NEPJUHHUSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@H](NC(=O)Cn3cnnn3)[C@H](O)C2)n1 ZINC001592078953 1076178887 /nfs/dbraw/zinc/17/88/87/1076178887.db2.gz SFZSBXBIXKYWTR-NWDGAFQWSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@H](NC(=O)Cn3cnnn3)[C@H](O)C2)n1 ZINC001592078953 1076178882 /nfs/dbraw/zinc/17/88/82/1076178882.db2.gz SFZSBXBIXKYWTR-NWDGAFQWSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@H](NC(=O)Cn3cnnn3)[C@@H](O)C2)n1 ZINC001592078954 1076178900 /nfs/dbraw/zinc/17/89/00/1076178900.db2.gz SFZSBXBIXKYWTR-RYUDHWBXSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@H](NC(=O)Cn3cnnn3)[C@@H](O)C2)n1 ZINC001592078954 1076178896 /nfs/dbraw/zinc/17/88/96/1076178896.db2.gz SFZSBXBIXKYWTR-RYUDHWBXSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@H](NC(=O)Cn3cnnn3)[C@H](O)C2)n1 ZINC001592078955 1076178973 /nfs/dbraw/zinc/17/89/73/1076178973.db2.gz SFZSBXBIXKYWTR-VXGBXAGGSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@H](NC(=O)Cn3cnnn3)[C@H](O)C2)n1 ZINC001592078955 1076178972 /nfs/dbraw/zinc/17/89/72/1076178972.db2.gz SFZSBXBIXKYWTR-VXGBXAGGSA-N -1 3 385.392 -1.687 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCN([C@@H]3CS(=O)(=O)C[C@H]3O)CC2)n1 ZINC001592079069 1076178937 /nfs/dbraw/zinc/17/89/37/1076178937.db2.gz CLSOTTZWTNAISR-CHWSQXEVSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCN([C@@H]3CS(=O)(=O)C[C@H]3O)CC2)n1 ZINC001592079069 1076178934 /nfs/dbraw/zinc/17/89/34/1076178934.db2.gz CLSOTTZWTNAISR-CHWSQXEVSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCN([C@@H]3CS(=O)(=O)C[C@@H]3O)CC2)n1 ZINC001592079070 1076179095 /nfs/dbraw/zinc/17/90/95/1076179095.db2.gz CLSOTTZWTNAISR-OLZOCXBDSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCN([C@@H]3CS(=O)(=O)C[C@@H]3O)CC2)n1 ZINC001592079070 1076179094 /nfs/dbraw/zinc/17/90/94/1076179094.db2.gz CLSOTTZWTNAISR-OLZOCXBDSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCN([C@H]3CS(=O)(=O)C[C@H]3O)CC2)n1 ZINC001592079071 1076178911 /nfs/dbraw/zinc/17/89/11/1076178911.db2.gz CLSOTTZWTNAISR-QWHCGFSZSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCN([C@H]3CS(=O)(=O)C[C@H]3O)CC2)n1 ZINC001592079071 1076178908 /nfs/dbraw/zinc/17/89/08/1076178908.db2.gz CLSOTTZWTNAISR-QWHCGFSZSA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCN([C@H]3CS(=O)(=O)C[C@@H]3O)CC2)n1 ZINC001592079072 1076179054 /nfs/dbraw/zinc/17/90/54/1076179054.db2.gz CLSOTTZWTNAISR-STQMWFEESA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCN([C@H]3CS(=O)(=O)C[C@@H]3O)CC2)n1 ZINC001592079072 1076179052 /nfs/dbraw/zinc/17/90/52/1076179052.db2.gz CLSOTTZWTNAISR-STQMWFEESA-N -1 3 379.446 -1.150 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCN(CCNC(=O)[C@H]3C[C@H]3C(N)=O)CC2)n1 ZINC001592079152 1076178999 /nfs/dbraw/zinc/17/89/99/1076178999.db2.gz LCQKDWGSOCXJTK-KGLIPLIRSA-N -1 3 399.459 -1.070 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCN(CCNC(=O)[C@H]3C[C@H]3C(N)=O)CC2)n1 ZINC001592079152 1076178996 /nfs/dbraw/zinc/17/89/96/1076178996.db2.gz LCQKDWGSOCXJTK-KGLIPLIRSA-N -1 3 399.459 -1.070 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)[C@H](C)S(C)(=O)=O)C2)n1 ZINC001592081000 1076179078 /nfs/dbraw/zinc/17/90/78/1076179078.db2.gz DLOPAYWQWDGVRA-MVWJERBFSA-N -1 3 395.445 -1.331 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)[C@H](C)S(C)(=O)=O)C2)n1 ZINC001592081000 1076179075 /nfs/dbraw/zinc/17/90/75/1076179075.db2.gz DLOPAYWQWDGVRA-MVWJERBFSA-N -1 3 395.445 -1.331 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)[C@@H](C)S(C)(=O)=O)C2)n1 ZINC001592081001 1076179034 /nfs/dbraw/zinc/17/90/34/1076179034.db2.gz DLOPAYWQWDGVRA-YUSALJHKSA-N -1 3 395.445 -1.331 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)[C@@H](C)S(C)(=O)=O)C2)n1 ZINC001592081001 1076179032 /nfs/dbraw/zinc/17/90/32/1076179032.db2.gz DLOPAYWQWDGVRA-YUSALJHKSA-N -1 3 395.445 -1.331 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCN(C)C3=O)C2)n1 ZINC001592081032 1076178951 /nfs/dbraw/zinc/17/89/51/1076178951.db2.gz FSTZWBOGJDVFQH-JHJVBQTASA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCN(C)C3=O)C2)n1 ZINC001592081032 1076178947 /nfs/dbraw/zinc/17/89/47/1076178947.db2.gz FSTZWBOGJDVFQH-JHJVBQTASA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCN(C)C3=O)C2)n1 ZINC001592081033 1076179087 /nfs/dbraw/zinc/17/90/87/1076179087.db2.gz FSTZWBOGJDVFQH-YNEHKIRRSA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCN(C)C3=O)C2)n1 ZINC001592081033 1076179085 /nfs/dbraw/zinc/17/90/85/1076179085.db2.gz FSTZWBOGJDVFQH-YNEHKIRRSA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](C)[C@H](NC(=O)CN3CCNC(=O)C3)C2)n1 ZINC001592081078 1076179009 /nfs/dbraw/zinc/17/90/09/1076179009.db2.gz JDNAKGSYXHHVRL-BXUZGUMPSA-N -1 3 399.459 -1.057 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](C)[C@H](NC(=O)CN3CCNC(=O)C3)C2)n1 ZINC001592081078 1076179007 /nfs/dbraw/zinc/17/90/07/1076179007.db2.gz JDNAKGSYXHHVRL-BXUZGUMPSA-N -1 3 399.459 -1.057 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)C[C@@H]3CCNC3=O)C2)n1 ZINC001592081099 1076178963 /nfs/dbraw/zinc/17/89/63/1076178963.db2.gz KLDDAYWGWBOTDF-CYZMBNFOSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)C[C@@H]3CCNC3=O)C2)n1 ZINC001592081099 1076178957 /nfs/dbraw/zinc/17/89/57/1076178957.db2.gz KLDDAYWGWBOTDF-CYZMBNFOSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)C[C@H]3CCNC3=O)C2)n1 ZINC001592081100 1076178923 /nfs/dbraw/zinc/17/89/23/1076178923.db2.gz KLDDAYWGWBOTDF-RAIGVLPGSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)C[C@H]3CCNC3=O)C2)n1 ZINC001592081100 1076178918 /nfs/dbraw/zinc/17/89/18/1076178918.db2.gz KLDDAYWGWBOTDF-RAIGVLPGSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)CCc3cnn(C)n3)C2)n1 ZINC001592081171 1076179295 /nfs/dbraw/zinc/17/92/95/1076179295.db2.gz PZWRKZFJPSRIAI-ZIAGYGMSSA-N -1 3 398.431 -1.003 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)CCc3cnn(C)n3)C2)n1 ZINC001592081171 1076179293 /nfs/dbraw/zinc/17/92/93/1076179293.db2.gz PZWRKZFJPSRIAI-ZIAGYGMSSA-N -1 3 398.431 -1.003 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)CCc3cn(C)nn3)C2)n1 ZINC001592081203 1076179401 /nfs/dbraw/zinc/17/94/01/1076179401.db2.gz SIRBPSHCZOCMDJ-ZIAGYGMSSA-N -1 3 398.431 -1.003 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)CCc3cn(C)nn3)C2)n1 ZINC001592081203 1076179399 /nfs/dbraw/zinc/17/93/99/1076179399.db2.gz SIRBPSHCZOCMDJ-ZIAGYGMSSA-N -1 3 398.431 -1.003 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)c3ccc(=O)n(C)n3)[C@@H](O)C2)n1 ZINC001592081328 1076179326 /nfs/dbraw/zinc/17/93/26/1076179326.db2.gz CZASMQZQBCQMGU-OLZOCXBDSA-N -1 3 397.399 -1.357 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)c3ccc(=O)n(C)n3)[C@@H](O)C2)n1 ZINC001592081328 1076179324 /nfs/dbraw/zinc/17/93/24/1076179324.db2.gz CZASMQZQBCQMGU-OLZOCXBDSA-N -1 3 397.399 -1.357 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@@H](C)S(C)(=O)=O)[C@@H](O)C2)n1 ZINC001592081331 1076179304 /nfs/dbraw/zinc/17/93/04/1076179304.db2.gz DLOPAYWQWDGVRA-JLLWLGSASA-N -1 3 395.445 -1.331 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@@H](C)S(C)(=O)=O)[C@@H](O)C2)n1 ZINC001592081331 1076179301 /nfs/dbraw/zinc/17/93/01/1076179301.db2.gz DLOPAYWQWDGVRA-JLLWLGSASA-N -1 3 395.445 -1.331 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@H](C)S(C)(=O)=O)[C@@H](O)C2)n1 ZINC001592081332 1076179333 /nfs/dbraw/zinc/17/93/33/1076179333.db2.gz DLOPAYWQWDGVRA-WCQGTBRESA-N -1 3 395.445 -1.331 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@H](C)S(C)(=O)=O)[C@@H](O)C2)n1 ZINC001592081332 1076179330 /nfs/dbraw/zinc/17/93/30/1076179330.db2.gz DLOPAYWQWDGVRA-WCQGTBRESA-N -1 3 395.445 -1.331 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)CCc3cnn(C)n3)[C@@H](O)C2)n1 ZINC001592081465 1076179458 /nfs/dbraw/zinc/17/94/58/1076179458.db2.gz PZWRKZFJPSRIAI-KGLIPLIRSA-N -1 3 398.431 -1.003 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)CCc3cnn(C)n3)[C@@H](O)C2)n1 ZINC001592081465 1076179453 /nfs/dbraw/zinc/17/94/53/1076179453.db2.gz PZWRKZFJPSRIAI-KGLIPLIRSA-N -1 3 398.431 -1.003 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)CCc3cn(C)nn3)[C@@H](O)C2)n1 ZINC001592081495 1076179420 /nfs/dbraw/zinc/17/94/20/1076179420.db2.gz SIRBPSHCZOCMDJ-KGLIPLIRSA-N -1 3 398.431 -1.003 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)CCc3cn(C)nn3)[C@@H](O)C2)n1 ZINC001592081495 1076179416 /nfs/dbraw/zinc/17/94/16/1076179416.db2.gz SIRBPSHCZOCMDJ-KGLIPLIRSA-N -1 3 398.431 -1.003 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@@H]3CCNC(=O)C3)[C@@H](O)C2)n1 ZINC001592081498 1076179360 /nfs/dbraw/zinc/17/93/60/1076179360.db2.gz SMCMEDUIXXASSC-RTXFEEFZSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@@H]3CCNC(=O)C3)[C@@H](O)C2)n1 ZINC001592081498 1076179357 /nfs/dbraw/zinc/17/93/57/1076179357.db2.gz SMCMEDUIXXASSC-RTXFEEFZSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@H]3CCNC(=O)C3)[C@@H](O)C2)n1 ZINC001592081499 1076179278 /nfs/dbraw/zinc/17/92/78/1076179278.db2.gz SMCMEDUIXXASSC-UHTWSYAYSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@H]3CCNC(=O)C3)[C@@H](O)C2)n1 ZINC001592081499 1076179275 /nfs/dbraw/zinc/17/92/75/1076179275.db2.gz SMCMEDUIXXASSC-UHTWSYAYSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)c3cn(C)c(=O)n3C)C2)n1 ZINC001592081988 1076179443 /nfs/dbraw/zinc/17/94/43/1076179443.db2.gz HBZYHUJVTXNNAQ-DGCLKSJQSA-N -1 3 399.415 -1.413 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)c3cn(C)c(=O)n3C)C2)n1 ZINC001592081988 1076179440 /nfs/dbraw/zinc/17/94/40/1076179440.db2.gz HBZYHUJVTXNNAQ-DGCLKSJQSA-N -1 3 399.415 -1.413 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H](O)CNC(=O)CN2C(=O)CCC2=O)n1 ZINC001592084430 1076179287 /nfs/dbraw/zinc/17/92/87/1076179287.db2.gz JXEJEQHDNDFTKM-JTQLQIEISA-N -1 3 388.388 -1.392 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H](O)CNC(=O)CN2C(=O)CCC2=O)n1 ZINC001592084430 1076179285 /nfs/dbraw/zinc/17/92/85/1076179285.db2.gz JXEJEQHDNDFTKM-JTQLQIEISA-N -1 3 388.388 -1.392 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H](O)CNC(=O)CN2C(=O)CCC2=O)n1 ZINC001592084431 1076179317 /nfs/dbraw/zinc/17/93/17/1076179317.db2.gz JXEJEQHDNDFTKM-SNVBAGLBSA-N -1 3 388.388 -1.392 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H](O)CNC(=O)CN2C(=O)CCC2=O)n1 ZINC001592084431 1076179313 /nfs/dbraw/zinc/17/93/13/1076179313.db2.gz JXEJEQHDNDFTKM-SNVBAGLBSA-N -1 3 388.388 -1.392 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NCCNC(=O)Cn2ccc(=O)n(C)c2=O)n1 ZINC001592091285 1076179432 /nfs/dbraw/zinc/17/94/32/1076179432.db2.gz KJDGREQLDUMQCK-UHFFFAOYSA-N -1 3 385.388 -1.341 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NCCNC(=O)Cn2ccc(=O)n(C)c2=O)n1 ZINC001592091285 1076179429 /nfs/dbraw/zinc/17/94/29/1076179429.db2.gz KJDGREQLDUMQCK-UHFFFAOYSA-N -1 3 385.388 -1.341 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NCCNC(=O)CNS(=O)(=O)N(C)C)n1 ZINC001592091523 1076179385 /nfs/dbraw/zinc/17/93/85/1076179385.db2.gz QSSXQVKYNUVYDX-UHFFFAOYSA-N -1 3 383.438 -1.506 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NCCNC(=O)CNS(=O)(=O)N(C)C)n1 ZINC001592091523 1076179381 /nfs/dbraw/zinc/17/93/81/1076179381.db2.gz QSSXQVKYNUVYDX-UHFFFAOYSA-N -1 3 383.438 -1.506 20 0 GAADHM Cc1cccc(-c2nn[n-]n2)c1S(=O)(=O)NCCOCCS(N)(=O)=O ZINC001592214908 1076179473 /nfs/dbraw/zinc/17/94/73/1076179473.db2.gz RCQNKUBTDZYZQH-UHFFFAOYSA-N -1 3 390.447 -1.241 20 0 GAADHM Cc1cccc(-c2nnn[n-]2)c1S(=O)(=O)NCCOCCS(N)(=O)=O ZINC001592214908 1076179469 /nfs/dbraw/zinc/17/94/69/1076179469.db2.gz RCQNKUBTDZYZQH-UHFFFAOYSA-N -1 3 390.447 -1.241 20 0 GAADHM Cc1cccc(-c2nn[n-]n2)c1S(=O)(=O)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001592215102 1076179394 /nfs/dbraw/zinc/17/93/94/1076179394.db2.gz ZVNSZGWZTNVRHW-JTQLQIEISA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1cccc(-c2nnn[n-]2)c1S(=O)(=O)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001592215102 1076179392 /nfs/dbraw/zinc/17/93/92/1076179392.db2.gz ZVNSZGWZTNVRHW-JTQLQIEISA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1cccc(-c2nn[n-]n2)c1S(=O)(=O)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001592215104 1076179350 /nfs/dbraw/zinc/17/93/50/1076179350.db2.gz ZVNSZGWZTNVRHW-SNVBAGLBSA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1cccc(-c2nnn[n-]2)c1S(=O)(=O)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001592215104 1076179348 /nfs/dbraw/zinc/17/93/48/1076179348.db2.gz ZVNSZGWZTNVRHW-SNVBAGLBSA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1cccc(NC(=O)C(=O)N2CC(NS(C)(=O)=O)C2)c1-c1nn[n-]n1 ZINC001592234016 1076179770 /nfs/dbraw/zinc/17/97/70/1076179770.db2.gz VVHCZPKJTDPWBM-UHFFFAOYSA-N -1 3 379.402 -1.126 20 0 GAADHM Cc1cccc(NC(=O)C(=O)N2CC(NS(C)(=O)=O)C2)c1-c1nnn[n-]1 ZINC001592234016 1076179768 /nfs/dbraw/zinc/17/97/68/1076179768.db2.gz VVHCZPKJTDPWBM-UHFFFAOYSA-N -1 3 379.402 -1.126 20 0 GAADHM Cc1cccc(S(=O)(=O)N2CCN(CC(N)=O)C(=O)C2)c1-c1nn[n-]n1 ZINC001592239185 1076179929 /nfs/dbraw/zinc/17/99/29/1076179929.db2.gz IDZQNURRVCAZBY-UHFFFAOYSA-N -1 3 379.402 -1.507 20 0 GAADHM Cc1cccc(S(=O)(=O)N2CCN(CC(N)=O)C(=O)C2)c1-c1nnn[n-]1 ZINC001592239185 1076179928 /nfs/dbraw/zinc/17/99/28/1076179928.db2.gz IDZQNURRVCAZBY-UHFFFAOYSA-N -1 3 379.402 -1.507 20 0 GAADHM Cc1cccc(S(=O)(=O)NCCNS(=O)(=O)N(C)C)c1-c1nn[n-]n1 ZINC001592239675 1076179764 /nfs/dbraw/zinc/17/97/64/1076179764.db2.gz MWSDHMGVWSWHIY-UHFFFAOYSA-N -1 3 389.463 -1.151 20 0 GAADHM Cc1cccc(S(=O)(=O)NCCNS(=O)(=O)N(C)C)c1-c1nnn[n-]1 ZINC001592239675 1076179762 /nfs/dbraw/zinc/17/97/62/1076179762.db2.gz MWSDHMGVWSWHIY-UHFFFAOYSA-N -1 3 389.463 -1.151 20 0 GAADHM Cc1ccnc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001592269213 1076179717 /nfs/dbraw/zinc/17/97/17/1076179717.db2.gz SLKJOHUVZHHNCR-VXGBXAGGSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001592269213 1076179713 /nfs/dbraw/zinc/17/97/13/1076179713.db2.gz SLKJOHUVZHHNCR-VXGBXAGGSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccnn1CC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O ZINC001592279530 1076179823 /nfs/dbraw/zinc/17/98/23/1076179823.db2.gz RJVUHFDMPAWPGF-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccnn1CC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O ZINC001592279530 1076179816 /nfs/dbraw/zinc/17/98/16/1076179816.db2.gz RJVUHFDMPAWPGF-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1cn(-c2ccc(-c3nn[n-]n3)cn2)nc1NC(=O)C(=O)N1CCNC(=O)C1 ZINC001592286690 1076180002 /nfs/dbraw/zinc/18/00/02/1076180002.db2.gz PVWKJMDXRKSTOI-UHFFFAOYSA-N -1 3 396.371 -1.347 20 0 GAADHM Cc1cn(-c2ccc(-c3nnn[n-]3)cn2)nc1NC(=O)C(=O)N1CCNC(=O)C1 ZINC001592286690 1076179999 /nfs/dbraw/zinc/17/99/99/1076179999.db2.gz PVWKJMDXRKSTOI-UHFFFAOYSA-N -1 3 396.371 -1.347 20 0 GAADHM Cc1cn(C)nc1C(=O)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1O ZINC001592287905 1076180017 /nfs/dbraw/zinc/18/00/17/1076180017.db2.gz VJDMCXQYMORGFY-VXGBXAGGSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cn(C)nc1C(=O)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1O ZINC001592287905 1076180011 /nfs/dbraw/zinc/18/00/11/1076180011.db2.gz VJDMCXQYMORGFY-VXGBXAGGSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1nnc(CC(=O)NCCOCCN(C)c2cnc(-c3nnn[n-]3)cn2)[nH]1 ZINC001592326491 1076180188 /nfs/dbraw/zinc/18/01/88/1076180188.db2.gz MERGETUVPSOHMM-UHFFFAOYSA-N -1 3 387.408 -1.105 20 0 GAADHM Cc1[nH]nc(NC(=O)[C@@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)c1-c1nnn[n-]1 ZINC001592327976 1076180326 /nfs/dbraw/zinc/18/03/26/1076180326.db2.gz OCCHQRQZTQHYAW-BDAKNGLRSA-N -1 3 394.417 -1.128 20 0 GAADHM Cc1[nH]nc(NC(=O)[C@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)c1-c1nnn[n-]1 ZINC001592327978 1076180213 /nfs/dbraw/zinc/18/02/13/1076180213.db2.gz OCCHQRQZTQHYAW-DTWKUNHWSA-N -1 3 394.417 -1.128 20 0 GAADHM Cc1[nH]nc(NC(=O)[C@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)c1-c1nnn[n-]1 ZINC001592327979 1076180297 /nfs/dbraw/zinc/18/02/97/1076180297.db2.gz OCCHQRQZTQHYAW-IUCAKERBSA-N -1 3 394.417 -1.128 20 0 GAADHM Cc1[nH]nc(NC(=O)[C@@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)c1-c1nnn[n-]1 ZINC001592327981 1076180285 /nfs/dbraw/zinc/18/02/85/1076180285.db2.gz OCCHQRQZTQHYAW-RKDXNWHRSA-N -1 3 394.417 -1.128 20 0 GAADHM Cc1nc(-c2nnn[n-]2)c(N2CCN(C(=O)CN3C[C@H]4[C@H](CO)[C@H]4C3)CC2)o1 ZINC001592336915 1076180358 /nfs/dbraw/zinc/18/03/58/1076180358.db2.gz HRUGOTZACXJDDJ-ITGUQSILSA-N -1 3 388.432 -1.018 20 0 GAADHM Cc1nc(-c2nnn[n-]2)c(N2CCN(C(=O)CN3CCc4nn[nH]c4C3)CC2)o1 ZINC001592336936 1076180315 /nfs/dbraw/zinc/18/03/15/1076180315.db2.gz ITSMJAALKTVKIN-UHFFFAOYSA-N -1 3 399.419 -1.012 20 0 GAADHM Cc1nc(-c2nn[n-]n2)c(N2CCN(C(=O)CN(C)CCOCCO)CC2)o1 ZINC001592336992 1076180253 /nfs/dbraw/zinc/18/02/53/1076180253.db2.gz LMADEOXUZYTYQV-UHFFFAOYSA-N -1 3 394.436 -1.248 20 0 GAADHM Cc1nc(-c2nnn[n-]2)c(N2CCN(C(=O)CN(C)CCOCCO)CC2)o1 ZINC001592336992 1076180249 /nfs/dbraw/zinc/18/02/49/1076180249.db2.gz LMADEOXUZYTYQV-UHFFFAOYSA-N -1 3 394.436 -1.248 20 0 GAADHM Cc1nc(-c2nn[n-]n2)c(N2CCN(C(=O)CN3C[C@H](O)[C@@H](O)C3)CC2)o1 ZINC001592337047 1076180435 /nfs/dbraw/zinc/18/04/35/1076180435.db2.gz NTCJIDPMZWBJCW-QWRGUYRKSA-N -1 3 378.393 -2.151 20 0 GAADHM Cc1nc(-c2nn[n-]n2)c(N2CCN(C(=O)CN3CC(C)(C(N)=O)C3)CC2)o1 ZINC001592337161 1076180344 /nfs/dbraw/zinc/18/03/44/1076180344.db2.gz OOIYPNNPOHCHHU-UHFFFAOYSA-N -1 3 389.420 -1.381 20 0 GAADHM Cc1nc(-c2nn[n-]n2)c(N2CCN(C(=O)CNC3(C(N)=O)CC3)CC2)o1 ZINC001592337190 1076180376 /nfs/dbraw/zinc/18/03/76/1076180376.db2.gz PHSMAHKNULWVOG-UHFFFAOYSA-N -1 3 375.393 -1.581 20 0 GAADHM Cc1nc(-c2nnn[n-]2)c(N2CCN(C(=O)CNC3(C(N)=O)CC3)CC2)o1 ZINC001592337190 1076180371 /nfs/dbraw/zinc/18/03/71/1076180371.db2.gz PHSMAHKNULWVOG-UHFFFAOYSA-N -1 3 375.393 -1.581 20 0 GAADHM Cc1nc(C(=O)N2CC(S(=O)(=O)N3CCNCC3)C2)ccc1-c1nn[n-]n1 ZINC001592343128 1076180273 /nfs/dbraw/zinc/18/02/73/1076180273.db2.gz SVGFQWBZIUCEPA-UHFFFAOYSA-N -1 3 392.445 -1.370 20 0 GAADHM Cc1nc(C(=O)N2CC(S(=O)(=O)N3CCNCC3)C2)ccc1-c1nnn[n-]1 ZINC001592343128 1076180266 /nfs/dbraw/zinc/18/02/66/1076180266.db2.gz SVGFQWBZIUCEPA-UHFFFAOYSA-N -1 3 392.445 -1.370 20 0 GAADHM Cc1nc(C(=O)N[C@@H](C)C(=O)N2CCS(=O)(=O)CC2)ccc1-c1nn[n-]n1 ZINC001592345142 1076180925 /nfs/dbraw/zinc/18/09/25/1076180925.db2.gz UVHLTQMNPJBVRO-JTQLQIEISA-N -1 3 393.429 -1.055 20 0 GAADHM Cc1nc(C(=O)N[C@@H](C)C(=O)N2CCS(=O)(=O)CC2)ccc1-c1nnn[n-]1 ZINC001592345142 1076180921 /nfs/dbraw/zinc/18/09/21/1076180921.db2.gz UVHLTQMNPJBVRO-JTQLQIEISA-N -1 3 393.429 -1.055 20 0 GAADHM Cc1nc(C(=O)N[C@H](C)C(=O)N2CCS(=O)(=O)CC2)ccc1-c1nn[n-]n1 ZINC001592345143 1076180937 /nfs/dbraw/zinc/18/09/37/1076180937.db2.gz UVHLTQMNPJBVRO-SNVBAGLBSA-N -1 3 393.429 -1.055 20 0 GAADHM Cc1nc(C(=O)N[C@H](C)C(=O)N2CCS(=O)(=O)CC2)ccc1-c1nnn[n-]1 ZINC001592345143 1076180933 /nfs/dbraw/zinc/18/09/33/1076180933.db2.gz UVHLTQMNPJBVRO-SNVBAGLBSA-N -1 3 393.429 -1.055 20 0 GAADHM Cc1nc(C(=O)NCCN2CCN(S(C)(=O)=O)CC2)ccc1-c1nn[n-]n1 ZINC001592348513 1076180850 /nfs/dbraw/zinc/18/08/50/1076180850.db2.gz XZSBHNLWPPOTHO-UHFFFAOYSA-N -1 3 394.461 -1.123 20 0 GAADHM Cc1nc(C(=O)NCCN2CCN(S(C)(=O)=O)CC2)ccc1-c1nnn[n-]1 ZINC001592348513 1076180849 /nfs/dbraw/zinc/18/08/49/1076180849.db2.gz XZSBHNLWPPOTHO-UHFFFAOYSA-N -1 3 394.461 -1.123 20 0 GAADHM Cc1nc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@@H]2O)c(=O)[nH]c1C ZINC001592350236 1076180817 /nfs/dbraw/zinc/18/08/17/1076180817.db2.gz XZYXVONFHGWUHV-OLZOCXBDSA-N -1 3 397.399 -1.059 20 0 GAADHM Cc1nc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@@H]2O)c(=O)[nH]c1C ZINC001592350236 1076180811 /nfs/dbraw/zinc/18/08/11/1076180811.db2.gz XZYXVONFHGWUHV-OLZOCXBDSA-N -1 3 397.399 -1.059 20 0 GAADHM Cc1nc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]2O)c(=O)[nH]c1C ZINC001592350237 1076180909 /nfs/dbraw/zinc/18/09/09/1076180909.db2.gz YDENWMQEXGNNNW-VXGBXAGGSA-N -1 3 397.399 -1.059 20 0 GAADHM Cc1nc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@H]2O)c(=O)[nH]c1C ZINC001592350237 1076180906 /nfs/dbraw/zinc/18/09/06/1076180906.db2.gz YDENWMQEXGNNNW-VXGBXAGGSA-N -1 3 397.399 -1.059 20 0 GAADHM Cc1nc(N(C)C)nc(N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001592363379 1076180900 /nfs/dbraw/zinc/18/09/00/1076180900.db2.gz BVRGWOXBDPIHMB-VXGBXAGGSA-N -1 3 399.419 -1.266 20 0 GAADHM Cc1nc(N(C)C)nc(N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001592363379 1076180897 /nfs/dbraw/zinc/18/08/97/1076180897.db2.gz BVRGWOXBDPIHMB-VXGBXAGGSA-N -1 3 399.419 -1.266 20 0 GAADHM Cc1nc(N(C)C)nc(N2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)n1 ZINC001592363936 1076180983 /nfs/dbraw/zinc/18/09/83/1076180983.db2.gz ZFNJLQGQPPHYEG-NEPJUHHUSA-N -1 3 399.419 -1.266 20 0 GAADHM Cc1nc(N(C)C)nc(N2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)n1 ZINC001592363936 1076180974 /nfs/dbraw/zinc/18/09/74/1076180974.db2.gz ZFNJLQGQPPHYEG-NEPJUHHUSA-N -1 3 399.419 -1.266 20 0 GAADHM Cc1nc(N(C)CCOCCNC(=O)Cn2cnnn2)ccc1-c1nn[n-]n1 ZINC001592367604 1076180964 /nfs/dbraw/zinc/18/09/64/1076180964.db2.gz GEGGBXWCFLMSRP-UHFFFAOYSA-N -1 3 387.408 -1.174 20 0 GAADHM Cc1nc(N(C)CCOCCNC(=O)Cn2cnnn2)ccc1-c1nnn[n-]1 ZINC001592367604 1076180962 /nfs/dbraw/zinc/18/09/62/1076180962.db2.gz GEGGBXWCFLMSRP-UHFFFAOYSA-N -1 3 387.408 -1.174 20 0 GAADHM Cc1nc(N(C)CCOCCNC(=O)c2nnn(C)n2)ccc1-c1nn[n-]n1 ZINC001592367963 1076180755 /nfs/dbraw/zinc/18/07/55/1076180755.db2.gz JNOQOMOIZMNQAT-UHFFFAOYSA-N -1 3 387.408 -1.024 20 0 GAADHM Cc1nc(N(C)CCOCCNC(=O)c2nnn(C)n2)ccc1-c1nnn[n-]1 ZINC001592367963 1076180751 /nfs/dbraw/zinc/18/07/51/1076180751.db2.gz JNOQOMOIZMNQAT-UHFFFAOYSA-N -1 3 387.408 -1.024 20 0 GAADHM Cc1nc(N(C)CCOCCNC(=O)Cn2ncnn2)ccc1-c1nn[n-]n1 ZINC001592368013 1076180768 /nfs/dbraw/zinc/18/07/68/1076180768.db2.gz MGXLHFVXMPRVEL-UHFFFAOYSA-N -1 3 387.408 -1.174 20 0 GAADHM Cc1nc(N(C)CCOCCNC(=O)Cn2ncnn2)ccc1-c1nnn[n-]1 ZINC001592368013 1076180766 /nfs/dbraw/zinc/18/07/66/1076180766.db2.gz MGXLHFVXMPRVEL-UHFFFAOYSA-N -1 3 387.408 -1.174 20 0 GAADHM Cc1nc(N(C)CCOCCNC(=O)[C@H]2CNC(=O)N2)ccc1-c1nn[n-]n1 ZINC001592368376 1076180829 /nfs/dbraw/zinc/18/08/29/1076180829.db2.gz XHKADTFKFOPOOH-GFCCVEGCSA-N -1 3 389.420 -1.179 20 0 GAADHM Cc1nc(N(C)CCOCCNC(=O)[C@H]2CNC(=O)N2)ccc1-c1nnn[n-]1 ZINC001592368376 1076180825 /nfs/dbraw/zinc/18/08/25/1076180825.db2.gz XHKADTFKFOPOOH-GFCCVEGCSA-N -1 3 389.420 -1.179 20 0 GAADHM Cc1nc(N(C)CCOCCNC(=O)[C@@H]2CNC(=O)N2)ccc1-c1nn[n-]n1 ZINC001592368397 1076180874 /nfs/dbraw/zinc/18/08/74/1076180874.db2.gz XHKADTFKFOPOOH-LBPRGKRZSA-N -1 3 389.420 -1.179 20 0 GAADHM Cc1nc(N(C)CCOCCNC(=O)[C@@H]2CNC(=O)N2)ccc1-c1nnn[n-]1 ZINC001592368397 1076180872 /nfs/dbraw/zinc/18/08/72/1076180872.db2.gz XHKADTFKFOPOOH-LBPRGKRZSA-N -1 3 389.420 -1.179 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)CN3C(=O)CNC3=O)C2)ccc1-c1nn[n-]n1 ZINC001592369471 1076180891 /nfs/dbraw/zinc/18/08/91/1076180891.db2.gz KFHVLQWZVATNSU-JTQLQIEISA-N -1 3 385.388 -1.183 20 0 GAADHM Cc1nc(N2CC[C@H](NC(=O)CN3C(=O)CNC3=O)C2)ccc1-c1nnn[n-]1 ZINC001592369471 1076180890 /nfs/dbraw/zinc/18/08/90/1076180890.db2.gz KFHVLQWZVATNSU-JTQLQIEISA-N -1 3 385.388 -1.183 20 0 GAADHM Cc1nc(N2CCN(C(=O)Cn3ncn(C)c3=O)CC2)ccc1-c1nn[n-]n1 ZINC001592372230 1076180791 /nfs/dbraw/zinc/18/07/91/1076180791.db2.gz KBNOAHAIPVHHGL-UHFFFAOYSA-N -1 3 384.404 -1.186 20 0 GAADHM Cc1nc(N2CCN(C(=O)Cn3ncn(C)c3=O)CC2)ccc1-c1nnn[n-]1 ZINC001592372230 1076180789 /nfs/dbraw/zinc/18/07/89/1076180789.db2.gz KBNOAHAIPVHHGL-UHFFFAOYSA-N -1 3 384.404 -1.186 20 0 GAADHM Cc1nc(N2CCO[C@@H](CNC(=O)[C@H]3CNC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001592372900 1076180882 /nfs/dbraw/zinc/18/08/82/1076180882.db2.gz IDNPDBPZABQLIM-CMPLNLGQSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1nc(N2CCO[C@@H](CNC(=O)[C@H]3CNC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001592372900 1076180880 /nfs/dbraw/zinc/18/08/80/1076180880.db2.gz IDNPDBPZABQLIM-CMPLNLGQSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1nc(N2CCO[C@@H](CNC(=O)[C@@H]3CNC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001592372901 1076180781 /nfs/dbraw/zinc/18/07/81/1076180781.db2.gz IDNPDBPZABQLIM-JQWIXIFHSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1nc(N2CCO[C@@H](CNC(=O)[C@@H]3CNC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001592372901 1076180780 /nfs/dbraw/zinc/18/07/80/1076180780.db2.gz IDNPDBPZABQLIM-JQWIXIFHSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1nc(N2CCO[C@H](CNC(=O)[C@@H]3CNC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001592372902 1076180863 /nfs/dbraw/zinc/18/08/63/1076180863.db2.gz IDNPDBPZABQLIM-PWSUYJOCSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1nc(N2CCO[C@H](CNC(=O)[C@@H]3CNC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001592372902 1076180860 /nfs/dbraw/zinc/18/08/60/1076180860.db2.gz IDNPDBPZABQLIM-PWSUYJOCSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1nc(N2CCO[C@H](CNC(=O)[C@H]3CNC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001592372903 1076180801 /nfs/dbraw/zinc/18/08/01/1076180801.db2.gz IDNPDBPZABQLIM-ZYHUDNBSSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1nc(N2CCO[C@H](CNC(=O)[C@H]3CNC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001592372903 1076180798 /nfs/dbraw/zinc/18/07/98/1076180798.db2.gz IDNPDBPZABQLIM-ZYHUDNBSSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1nc(N2CCO[C@@H](CNC(=O)c3nnn(C)n3)C2)ccc1-c1nn[n-]n1 ZINC001592372986 1076180949 /nfs/dbraw/zinc/18/09/49/1076180949.db2.gz NRYBPAZKJYQGIR-JTQLQIEISA-N -1 3 385.392 -1.271 20 0 GAADHM Cc1nc(N2CCO[C@@H](CNC(=O)c3nnn(C)n3)C2)ccc1-c1nnn[n-]1 ZINC001592372986 1076180947 /nfs/dbraw/zinc/18/09/47/1076180947.db2.gz NRYBPAZKJYQGIR-JTQLQIEISA-N -1 3 385.392 -1.271 20 0 GAADHM Cc1nc(N2CCO[C@H](CNC(=O)c3nnn(C)n3)C2)ccc1-c1nn[n-]n1 ZINC001592372987 1076181378 /nfs/dbraw/zinc/18/13/78/1076181378.db2.gz NRYBPAZKJYQGIR-SNVBAGLBSA-N -1 3 385.392 -1.271 20 0 GAADHM Cc1nc(N2CCO[C@H](CNC(=O)c3nnn(C)n3)C2)ccc1-c1nnn[n-]1 ZINC001592372987 1076181374 /nfs/dbraw/zinc/18/13/74/1076181374.db2.gz NRYBPAZKJYQGIR-SNVBAGLBSA-N -1 3 385.392 -1.271 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCCC(=O)N3)C2)ccc1-c1nn[n-]n1 ZINC001592373398 1076181471 /nfs/dbraw/zinc/18/14/71/1076181471.db2.gz HHDMWYNZJZUTPM-JHJVBQTASA-N -1 3 386.416 -1.095 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCCC(=O)N3)C2)ccc1-c1nnn[n-]1 ZINC001592373398 1076181470 /nfs/dbraw/zinc/18/14/70/1076181470.db2.gz HHDMWYNZJZUTPM-JHJVBQTASA-N -1 3 386.416 -1.095 20 0 GAADHM Cc1nc(N2C[C@@H](C)[C@H](NC(=O)CN3CCNC(=O)C3)C2)ccc1-c1nn[n-]n1 ZINC001592373452 1076181427 /nfs/dbraw/zinc/18/14/27/1076181427.db2.gz OTQUWSXTYCFHFC-BXUZGUMPSA-N -1 3 399.459 -1.057 20 0 GAADHM Cc1nc(N2C[C@@H](C)[C@H](NC(=O)CN3CCNC(=O)C3)C2)ccc1-c1nnn[n-]1 ZINC001592373452 1076181423 /nfs/dbraw/zinc/18/14/23/1076181423.db2.gz OTQUWSXTYCFHFC-BXUZGUMPSA-N -1 3 399.459 -1.057 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCCNC3=O)C2)ccc1-c1nn[n-]n1 ZINC001592373465 1076181450 /nfs/dbraw/zinc/18/14/50/1076181450.db2.gz IXWLYIBFWSDCEY-JHJVBQTASA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCCNC3=O)C2)ccc1-c1nnn[n-]1 ZINC001592373465 1076181448 /nfs/dbraw/zinc/18/14/48/1076181448.db2.gz IXWLYIBFWSDCEY-JHJVBQTASA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCCNC3=O)C2)ccc1-c1nn[n-]n1 ZINC001592373466 1076181464 /nfs/dbraw/zinc/18/14/64/1076181464.db2.gz IXWLYIBFWSDCEY-YNEHKIRRSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCCNC3=O)C2)ccc1-c1nnn[n-]1 ZINC001592373466 1076181463 /nfs/dbraw/zinc/18/14/63/1076181463.db2.gz IXWLYIBFWSDCEY-YNEHKIRRSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)CCc3cn(C)nn3)C2)ccc1-c1nn[n-]n1 ZINC001592373504 1076181476 /nfs/dbraw/zinc/18/14/76/1076181476.db2.gz LCFUIIAYLMZAKM-ZIAGYGMSSA-N -1 3 398.431 -1.003 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)CCc3cn(C)nn3)C2)ccc1-c1nnn[n-]1 ZINC001592373504 1076181474 /nfs/dbraw/zinc/18/14/74/1076181474.db2.gz LCFUIIAYLMZAKM-ZIAGYGMSSA-N -1 3 398.431 -1.003 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCC(=O)NC3)C2)ccc1-c1nn[n-]n1 ZINC001592373587 1076181458 /nfs/dbraw/zinc/18/14/58/1076181458.db2.gz OIUYHQZHJCMYKC-CYZMBNFOSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCC(=O)NC3)C2)ccc1-c1nnn[n-]1 ZINC001592373587 1076181457 /nfs/dbraw/zinc/18/14/57/1076181457.db2.gz OIUYHQZHJCMYKC-CYZMBNFOSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCC(=O)NC3)C2)ccc1-c1nn[n-]n1 ZINC001592373590 1076181389 /nfs/dbraw/zinc/18/13/89/1076181389.db2.gz OIUYHQZHJCMYKC-RAIGVLPGSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCC(=O)NC3)C2)ccc1-c1nnn[n-]1 ZINC001592373590 1076181386 /nfs/dbraw/zinc/18/13/86/1076181386.db2.gz OIUYHQZHJCMYKC-RAIGVLPGSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@H](C)S(C)(=O)=O)C2)ccc1-c1nn[n-]n1 ZINC001592373744 1076181357 /nfs/dbraw/zinc/18/13/57/1076181357.db2.gz TWNCRWHHDFVZMZ-MVWJERBFSA-N -1 3 395.445 -1.331 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@@H](C)S(C)(=O)=O)C2)ccc1-c1nn[n-]n1 ZINC001592373745 1076181330 /nfs/dbraw/zinc/18/13/30/1076181330.db2.gz TWNCRWHHDFVZMZ-YUSALJHKSA-N -1 3 395.445 -1.331 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@]3(C)CCNC3=O)C2)ccc1-c1nn[n-]n1 ZINC001592373759 1076181403 /nfs/dbraw/zinc/18/14/03/1076181403.db2.gz VIMVIJFRRPSUOH-PSTGCABASA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@]3(C)CCNC3=O)C2)ccc1-c1nnn[n-]1 ZINC001592373759 1076181399 /nfs/dbraw/zinc/18/13/99/1076181399.db2.gz VIMVIJFRRPSUOH-PSTGCABASA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@@]3(C)CCNC3=O)C2)ccc1-c1nn[n-]n1 ZINC001592373760 1076181350 /nfs/dbraw/zinc/18/13/50/1076181350.db2.gz VIMVIJFRRPSUOH-QFSBIZTOSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@@]3(C)CCNC3=O)C2)ccc1-c1nnn[n-]1 ZINC001592373760 1076181348 /nfs/dbraw/zinc/18/13/48/1076181348.db2.gz VIMVIJFRRPSUOH-QFSBIZTOSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)CCc3cnn(C)n3)C2)ccc1-c1nn[n-]n1 ZINC001592373764 1076181445 /nfs/dbraw/zinc/18/14/45/1076181445.db2.gz VMRNVOFMUXRSJF-ZIAGYGMSSA-N -1 3 398.431 -1.003 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)CCc3cnn(C)n3)C2)ccc1-c1nnn[n-]1 ZINC001592373764 1076181444 /nfs/dbraw/zinc/18/14/44/1076181444.db2.gz VMRNVOFMUXRSJF-ZIAGYGMSSA-N -1 3 398.431 -1.003 20 0 GAADHM Cc1nc(N2C[C@@H](NC(=O)c3ccc(=O)n(C)n3)[C@@H](O)C2)ccc1-c1nn[n-]n1 ZINC001592374539 1076181454 /nfs/dbraw/zinc/18/14/54/1076181454.db2.gz DYTUCJBKQQVUJH-OLZOCXBDSA-N -1 3 397.399 -1.357 20 0 GAADHM Cc1nc(N2C[C@@H](NC(=O)c3ccc(=O)n(C)n3)[C@@H](O)C2)ccc1-c1nnn[n-]1 ZINC001592374539 1076181453 /nfs/dbraw/zinc/18/14/53/1076181453.db2.gz DYTUCJBKQQVUJH-OLZOCXBDSA-N -1 3 397.399 -1.357 20 0 GAADHM Cc1nc(N2C[C@@H](NC(=O)CCc3cn(C)nn3)[C@@H](O)C2)ccc1-c1nn[n-]n1 ZINC001592374947 1076181366 /nfs/dbraw/zinc/18/13/66/1076181366.db2.gz LCFUIIAYLMZAKM-KGLIPLIRSA-N -1 3 398.431 -1.003 20 0 GAADHM Cc1nc(N2C[C@@H](NC(=O)CCc3cn(C)nn3)[C@@H](O)C2)ccc1-c1nnn[n-]1 ZINC001592374947 1076181363 /nfs/dbraw/zinc/18/13/63/1076181363.db2.gz LCFUIIAYLMZAKM-KGLIPLIRSA-N -1 3 398.431 -1.003 20 0 GAADHM Cc1nc(N2C[C@@H](NC(=O)[C@@H](C)S(C)(=O)=O)[C@@H](O)C2)ccc1-c1nn[n-]n1 ZINC001592375084 1076181467 /nfs/dbraw/zinc/18/14/67/1076181467.db2.gz TWNCRWHHDFVZMZ-JLLWLGSASA-N -1 3 395.445 -1.331 20 0 GAADHM Cc1nc(N2C[C@@H](NC(=O)[C@H](C)S(C)(=O)=O)[C@@H](O)C2)ccc1-c1nn[n-]n1 ZINC001592375086 1076181341 /nfs/dbraw/zinc/18/13/41/1076181341.db2.gz TWNCRWHHDFVZMZ-WCQGTBRESA-N -1 3 395.445 -1.331 20 0 GAADHM Cc1nc(N2C[C@@H](NC(=O)CCc3cnn(C)n3)[C@@H](O)C2)ccc1-c1nn[n-]n1 ZINC001592375256 1076181415 /nfs/dbraw/zinc/18/14/15/1076181415.db2.gz VMRNVOFMUXRSJF-KGLIPLIRSA-N -1 3 398.431 -1.003 20 0 GAADHM Cc1nc(N2C[C@@H](NC(=O)CCc3cnn(C)n3)[C@@H](O)C2)ccc1-c1nnn[n-]1 ZINC001592375256 1076181412 /nfs/dbraw/zinc/18/14/12/1076181412.db2.gz VMRNVOFMUXRSJF-KGLIPLIRSA-N -1 3 398.431 -1.003 20 0 GAADHM Cc1nc(NC(=O)Cn2c(=O)c3c(ncn3C)n(C)c2=O)ccc1-c1nn[n-]n1 ZINC001592376272 1076181441 /nfs/dbraw/zinc/18/14/41/1076181441.db2.gz BTJLVUNOPYIYOA-UHFFFAOYSA-N -1 3 396.371 -1.044 20 0 GAADHM Cc1nc(NC(=O)Cn2c(=O)c3c(ncn3C)n(C)c2=O)ccc1-c1nnn[n-]1 ZINC001592376272 1076181439 /nfs/dbraw/zinc/18/14/39/1076181439.db2.gz BTJLVUNOPYIYOA-UHFFFAOYSA-N -1 3 396.371 -1.044 20 0 GAADHM Cc1nc(NC(=O)C(=O)N2CCN(c3ccc(-c4nn[n-]n4)cn3)CC2)nn1C ZINC001592377855 1076181905 /nfs/dbraw/zinc/18/19/05/1076181905.db2.gz VDPWWYYTMPRKTP-UHFFFAOYSA-N -1 3 397.403 -1.014 20 0 GAADHM Cc1nc(NC(=O)C(=O)N2CCN(c3ccc(-c4nnn[n-]4)cn3)CC2)nn1C ZINC001592377855 1076181902 /nfs/dbraw/zinc/18/19/02/1076181902.db2.gz VDPWWYYTMPRKTP-UHFFFAOYSA-N -1 3 397.403 -1.014 20 0 GAADHM Cc1nc(NC(=O)C(=O)NCCCN(C)S(C)(=O)=O)ccc1-c1nn[n-]n1 ZINC001592377880 1076181756 /nfs/dbraw/zinc/18/17/56/1076181756.db2.gz VZOGSNHLKXDQET-UHFFFAOYSA-N -1 3 396.433 -1.094 20 0 GAADHM Cc1nc(NC(=O)C(=O)NCCCN(C)S(C)(=O)=O)ccc1-c1nnn[n-]1 ZINC001592377880 1076181752 /nfs/dbraw/zinc/18/17/52/1076181752.db2.gz VZOGSNHLKXDQET-UHFFFAOYSA-N -1 3 396.433 -1.094 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)CN2C(=O)CCC2=O)ccc1-c1nn[n-]n1 ZINC001592379949 1076181923 /nfs/dbraw/zinc/18/19/23/1076181923.db2.gz VDNQLKMUDAHUQE-JTQLQIEISA-N -1 3 388.388 -1.392 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)CN2C(=O)CCC2=O)ccc1-c1nnn[n-]1 ZINC001592379949 1076181920 /nfs/dbraw/zinc/18/19/20/1076181920.db2.gz VDNQLKMUDAHUQE-JTQLQIEISA-N -1 3 388.388 -1.392 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)CN2C(=O)CCC2=O)ccc1-c1nn[n-]n1 ZINC001592379950 1076181655 /nfs/dbraw/zinc/18/16/55/1076181655.db2.gz VDNQLKMUDAHUQE-SNVBAGLBSA-N -1 3 388.388 -1.392 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)CN2C(=O)CCC2=O)ccc1-c1nnn[n-]1 ZINC001592379950 1076181652 /nfs/dbraw/zinc/18/16/52/1076181652.db2.gz VDNQLKMUDAHUQE-SNVBAGLBSA-N -1 3 388.388 -1.392 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)C(=O)NCC(F)F)ccc1-c1nn[n-]n1 ZINC001592379995 1076181844 /nfs/dbraw/zinc/18/18/44/1076181844.db2.gz XIBLESIPGXDQGX-MRVPVSSYSA-N -1 3 384.347 -1.160 20 0 GAADHM Cc1nc(N[C@@H](CO)CNC(=O)C(=O)NCC(F)F)ccc1-c1nnn[n-]1 ZINC001592379995 1076181840 /nfs/dbraw/zinc/18/18/40/1076181840.db2.gz XIBLESIPGXDQGX-MRVPVSSYSA-N -1 3 384.347 -1.160 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)C(=O)NCC(F)F)ccc1-c1nn[n-]n1 ZINC001592380000 1076181637 /nfs/dbraw/zinc/18/16/37/1076181637.db2.gz XIBLESIPGXDQGX-QMMMGPOBSA-N -1 3 384.347 -1.160 20 0 GAADHM Cc1nc(N[C@H](CO)CNC(=O)C(=O)NCC(F)F)ccc1-c1nnn[n-]1 ZINC001592380000 1076181634 /nfs/dbraw/zinc/18/16/34/1076181634.db2.gz XIBLESIPGXDQGX-QMMMGPOBSA-N -1 3 384.347 -1.160 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)C(=O)NCC(F)F)ccc1-c1nn[n-]n1 ZINC001592385884 1076181895 /nfs/dbraw/zinc/18/18/95/1076181895.db2.gz KNCBVJUBAPIYBQ-MRVPVSSYSA-N -1 3 384.347 -1.160 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)C(=O)NCC(F)F)ccc1-c1nnn[n-]1 ZINC001592385884 1076181892 /nfs/dbraw/zinc/18/18/92/1076181892.db2.gz KNCBVJUBAPIYBQ-MRVPVSSYSA-N -1 3 384.347 -1.160 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)C(=O)NCC(F)F)ccc1-c1nn[n-]n1 ZINC001592385886 1076181833 /nfs/dbraw/zinc/18/18/33/1076181833.db2.gz KNCBVJUBAPIYBQ-QMMMGPOBSA-N -1 3 384.347 -1.160 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)C(=O)NCC(F)F)ccc1-c1nnn[n-]1 ZINC001592385886 1076181828 /nfs/dbraw/zinc/18/18/28/1076181828.db2.gz KNCBVJUBAPIYBQ-QMMMGPOBSA-N -1 3 384.347 -1.160 20 0 GAADHM Cc1nc(NCCNC(=O)Cn2ccc(=O)n(C)c2=O)ccc1-c1nn[n-]n1 ZINC001592392725 1076181793 /nfs/dbraw/zinc/18/17/93/1076181793.db2.gz OAAAKTZUXFQBNP-UHFFFAOYSA-N -1 3 385.388 -1.341 20 0 GAADHM Cc1nc(NCCNC(=O)Cn2ccc(=O)n(C)c2=O)ccc1-c1nnn[n-]1 ZINC001592392725 1076181790 /nfs/dbraw/zinc/18/17/90/1076181790.db2.gz OAAAKTZUXFQBNP-UHFFFAOYSA-N -1 3 385.388 -1.341 20 0 GAADHM Cc1nc(NCCNC(=O)CN2C(=O)C(=O)N(C)C2=O)ccc1-c1nn[n-]n1 ZINC001592393053 1076181777 /nfs/dbraw/zinc/18/17/77/1076181777.db2.gz WCSJIUGDRAVOLT-UHFFFAOYSA-N -1 3 387.360 -1.481 20 0 GAADHM Cc1nc(NCCNC(=O)CN2C(=O)C(=O)N(C)C2=O)ccc1-c1nnn[n-]1 ZINC001592393053 1076181772 /nfs/dbraw/zinc/18/17/72/1076181772.db2.gz WCSJIUGDRAVOLT-UHFFFAOYSA-N -1 3 387.360 -1.481 20 0 GAADHM Cc1nc(S(=O)(=O)NCC(=O)NCc2ccc(-c3nn[n-]n3)cn2)cn1C ZINC001592397303 1076181622 /nfs/dbraw/zinc/18/16/22/1076181622.db2.gz NRJDGXDYSUKDAB-UHFFFAOYSA-N -1 3 391.417 -1.102 20 0 GAADHM Cc1nc(S(=O)(=O)NCC(=O)NCc2ccc(-c3nnn[n-]3)cn2)cn1C ZINC001592397303 1076181620 /nfs/dbraw/zinc/18/16/20/1076181620.db2.gz NRJDGXDYSUKDAB-UHFFFAOYSA-N -1 3 391.417 -1.102 20 0 GAADHM Cc1ncc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)n1C ZINC001592408139 1076181703 /nfs/dbraw/zinc/18/17/03/1076181703.db2.gz DNKBOFNCEIKLPE-DGCLKSJQSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1ncc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)n1C ZINC001592408139 1076181700 /nfs/dbraw/zinc/18/17/00/1076181700.db2.gz DNKBOFNCEIKLPE-DGCLKSJQSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CCN3C(=O)C(=O)NC[C@@H]3C2)cc1-c1nn[n-]n1 ZINC001592411888 1076181913 /nfs/dbraw/zinc/18/19/13/1076181913.db2.gz BUILMGYDRBQCHD-SECBINFHSA-N -1 3 392.401 -2.099 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CCN3C(=O)C(=O)NC[C@@H]3C2)cc1-c1nnn[n-]1 ZINC001592411888 1076181910 /nfs/dbraw/zinc/18/19/10/1076181910.db2.gz BUILMGYDRBQCHD-SECBINFHSA-N -1 3 392.401 -2.099 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CCN3C(=O)C(=O)NC[C@H]3C2)cc1-c1nn[n-]n1 ZINC001592411892 1076181679 /nfs/dbraw/zinc/18/16/79/1076181679.db2.gz BUILMGYDRBQCHD-VIFPVBQESA-N -1 3 392.401 -2.099 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CCN3C(=O)C(=O)NC[C@H]3C2)cc1-c1nnn[n-]1 ZINC001592411892 1076181675 /nfs/dbraw/zinc/18/16/75/1076181675.db2.gz BUILMGYDRBQCHD-VIFPVBQESA-N -1 3 392.401 -2.099 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CCN(CC(=O)N(C)C)CC2)cc1-c1nn[n-]n1 ZINC001592411967 1076181933 /nfs/dbraw/zinc/18/19/33/1076181933.db2.gz DCWJCPYUIUJOQY-UHFFFAOYSA-N -1 3 394.461 -1.035 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CCN(CC(=O)N(C)C)CC2)cc1-c1nnn[n-]1 ZINC001592411967 1076181930 /nfs/dbraw/zinc/18/19/30/1076181930.db2.gz DCWJCPYUIUJOQY-UHFFFAOYSA-N -1 3 394.461 -1.035 20 0 GAADHM Cc1ncc(S(=O)(=O)NCCS(=O)(=O)NC2CC2)cc1-c1nn[n-]n1 ZINC001592411977 1076181723 /nfs/dbraw/zinc/18/17/23/1076181723.db2.gz CEMOLPHCXCAIPQ-UHFFFAOYSA-N -1 3 387.447 -1.070 20 0 GAADHM Cc1ncc(S(=O)(=O)NCCS(=O)(=O)NC2CC2)cc1-c1nnn[n-]1 ZINC001592411977 1076181720 /nfs/dbraw/zinc/18/17/20/1076181720.db2.gz CEMOLPHCXCAIPQ-UHFFFAOYSA-N -1 3 387.447 -1.070 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CCN(S(C)(=O)=O)CC2)cc1-c1nn[n-]n1 ZINC001592412230 1076181813 /nfs/dbraw/zinc/18/18/13/1076181813.db2.gz FOOSSFKNDJXAED-UHFFFAOYSA-N -1 3 387.447 -1.164 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CCN(S(C)(=O)=O)CC2)cc1-c1nnn[n-]1 ZINC001592412230 1076181810 /nfs/dbraw/zinc/18/18/10/1076181810.db2.gz FOOSSFKNDJXAED-UHFFFAOYSA-N -1 3 387.447 -1.164 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CCN(C(=O)[C@H](C)O)CC2)cc1-c1nn[n-]n1 ZINC001592412298 1076181858 /nfs/dbraw/zinc/18/18/58/1076181858.db2.gz HJHMUECZNOPFQS-JTQLQIEISA-N -1 3 381.418 -1.216 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CCN(C(=O)[C@H](C)O)CC2)cc1-c1nnn[n-]1 ZINC001592412298 1076181856 /nfs/dbraw/zinc/18/18/56/1076181856.db2.gz HJHMUECZNOPFQS-JTQLQIEISA-N -1 3 381.418 -1.216 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CCN(C(=O)[C@@H](C)O)CC2)cc1-c1nn[n-]n1 ZINC001592412299 1076182403 /nfs/dbraw/zinc/18/24/03/1076182403.db2.gz HJHMUECZNOPFQS-SNVBAGLBSA-N -1 3 381.418 -1.216 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CCN(C(=O)[C@@H](C)O)CC2)cc1-c1nnn[n-]1 ZINC001592412299 1076182401 /nfs/dbraw/zinc/18/24/01/1076182401.db2.gz HJHMUECZNOPFQS-SNVBAGLBSA-N -1 3 381.418 -1.216 20 0 GAADHM Cc1ncc(S(=O)(=O)NCC2CN(S(C)(=O)=O)C2)cc1-c1nn[n-]n1 ZINC001592412857 1076182254 /nfs/dbraw/zinc/18/22/54/1076182254.db2.gz IHUUBQDYTQYNDU-UHFFFAOYSA-N -1 3 387.447 -1.260 20 0 GAADHM Cc1ncc(S(=O)(=O)NCC2CN(S(C)(=O)=O)C2)cc1-c1nnn[n-]1 ZINC001592412857 1076182251 /nfs/dbraw/zinc/18/22/51/1076182251.db2.gz IHUUBQDYTQYNDU-UHFFFAOYSA-N -1 3 387.447 -1.260 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CC[C@@H](NS(C)(=O)=O)C2)cc1-c1nn[n-]n1 ZINC001592413175 1076182346 /nfs/dbraw/zinc/18/23/46/1076182346.db2.gz PBBCBTKOYGCGQQ-SECBINFHSA-N -1 3 387.447 -1.118 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CC[C@@H](NS(C)(=O)=O)C2)cc1-c1nnn[n-]1 ZINC001592413175 1076182342 /nfs/dbraw/zinc/18/23/42/1076182342.db2.gz PBBCBTKOYGCGQQ-SECBINFHSA-N -1 3 387.447 -1.118 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CC[C@H](NS(C)(=O)=O)C2)cc1-c1nn[n-]n1 ZINC001592413177 1076182380 /nfs/dbraw/zinc/18/23/80/1076182380.db2.gz PBBCBTKOYGCGQQ-VIFPVBQESA-N -1 3 387.447 -1.118 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CC[C@H](NS(C)(=O)=O)C2)cc1-c1nnn[n-]1 ZINC001592413177 1076182378 /nfs/dbraw/zinc/18/23/78/1076182378.db2.gz PBBCBTKOYGCGQQ-VIFPVBQESA-N -1 3 387.447 -1.118 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CCN3C(=O)NC(=O)[C@@H]3C2)cc1-c1nn[n-]n1 ZINC001592413419 1076182315 /nfs/dbraw/zinc/18/23/15/1076182315.db2.gz RTVIBTHGYHYXEE-JTQLQIEISA-N -1 3 378.374 -1.505 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CCN3C(=O)NC(=O)[C@@H]3C2)cc1-c1nnn[n-]1 ZINC001592413419 1076182312 /nfs/dbraw/zinc/18/23/12/1076182312.db2.gz RTVIBTHGYHYXEE-JTQLQIEISA-N -1 3 378.374 -1.505 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CCN3C(=O)NC(=O)[C@H]3C2)cc1-c1nn[n-]n1 ZINC001592413421 1076182410 /nfs/dbraw/zinc/18/24/10/1076182410.db2.gz RTVIBTHGYHYXEE-SNVBAGLBSA-N -1 3 378.374 -1.505 20 0 GAADHM Cc1ncc(S(=O)(=O)N2CCN3C(=O)NC(=O)[C@H]3C2)cc1-c1nnn[n-]1 ZINC001592413421 1076182408 /nfs/dbraw/zinc/18/24/08/1076182408.db2.gz RTVIBTHGYHYXEE-SNVBAGLBSA-N -1 3 378.374 -1.505 20 0 GAADHM Cc1ncc(S(=O)(=O)NC2CCN(CC(N)=O)CC2)cc1-c1nn[n-]n1 ZINC001592414198 1076182363 /nfs/dbraw/zinc/18/23/63/1076182363.db2.gz UITCXMOIWGNCPN-UHFFFAOYSA-N -1 3 380.434 -1.202 20 0 GAADHM Cc1ncc(S(=O)(=O)NC2CCN(CC(N)=O)CC2)cc1-c1nnn[n-]1 ZINC001592414198 1076182361 /nfs/dbraw/zinc/18/23/61/1076182361.db2.gz UITCXMOIWGNCPN-UHFFFAOYSA-N -1 3 380.434 -1.202 20 0 GAADHM Cc1ncc(S(=O)(=O)NCCN2CCCS2(=O)=O)cc1-c1nn[n-]n1 ZINC001592414484 1076182336 /nfs/dbraw/zinc/18/23/36/1076182336.db2.gz XFFLKJIMMYKESJ-UHFFFAOYSA-N -1 3 387.447 -1.116 20 0 GAADHM Cc1ncc(S(=O)(=O)NCCN2CCCS2(=O)=O)cc1-c1nnn[n-]1 ZINC001592414484 1076182334 /nfs/dbraw/zinc/18/23/34/1076182334.db2.gz XFFLKJIMMYKESJ-UHFFFAOYSA-N -1 3 387.447 -1.116 20 0 GAADHM Cc1ncc(S(=O)(=O)NCCCN2C(=O)CNC2=O)cc1-c1nn[n-]n1 ZINC001592414801 1076182294 /nfs/dbraw/zinc/18/22/94/1076182294.db2.gz YCZXMQOTGRMOAQ-UHFFFAOYSA-N -1 3 380.390 -1.210 20 0 GAADHM Cc1ncc(S(=O)(=O)NCCCN2C(=O)CNC2=O)cc1-c1nnn[n-]1 ZINC001592414801 1076182291 /nfs/dbraw/zinc/18/22/91/1076182291.db2.gz YCZXMQOTGRMOAQ-UHFFFAOYSA-N -1 3 380.390 -1.210 20 0 GAADHM Cc1ncc(S(=O)(=O)NC2CC(NS(C)(=O)=O)C2)cc1-c1nn[n-]n1 ZINC001592414826 1076182306 /nfs/dbraw/zinc/18/23/06/1076182306.db2.gz YOOHFCYHLWQTEI-UHFFFAOYSA-N -1 3 387.447 -1.071 20 0 GAADHM Cc1ncc(S(=O)(=O)NC2CC(NS(C)(=O)=O)C2)cc1-c1nnn[n-]1 ZINC001592414826 1076182300 /nfs/dbraw/zinc/18/23/00/1076182300.db2.gz YOOHFCYHLWQTEI-UHFFFAOYSA-N -1 3 387.447 -1.071 20 0 GAADHM Cc1nccc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)n1 ZINC001592416145 1076182418 /nfs/dbraw/zinc/18/24/18/1076182418.db2.gz XRZUDYKIUIOYDV-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1nccc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)n1 ZINC001592416145 1076182416 /nfs/dbraw/zinc/18/24/16/1076182416.db2.gz XRZUDYKIUIOYDV-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)Cn3cccnc3=O)CC2)c1-c1nn[n-]n1 ZINC001592430738 1076182270 /nfs/dbraw/zinc/18/22/70/1076182270.db2.gz BPUNGLNIDIKKPM-UHFFFAOYSA-N -1 3 384.404 -1.186 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)Cn3cccnc3=O)CC2)c1-c1nnn[n-]1 ZINC001592430738 1076182267 /nfs/dbraw/zinc/18/22/67/1076182267.db2.gz BPUNGLNIDIKKPM-UHFFFAOYSA-N -1 3 384.404 -1.186 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)C[C@@H]3CC(=O)NC3=O)CC2)c1-c1nn[n-]n1 ZINC001592430754 1076182389 /nfs/dbraw/zinc/18/23/89/1076182389.db2.gz BZOCWNYYPCVBNI-JTQLQIEISA-N -1 3 387.404 -1.390 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)C[C@@H]3CC(=O)NC3=O)CC2)c1-c1nnn[n-]1 ZINC001592430754 1076182386 /nfs/dbraw/zinc/18/23/86/1076182386.db2.gz BZOCWNYYPCVBNI-JTQLQIEISA-N -1 3 387.404 -1.390 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)C[C@H]3CC(=O)NC3=O)CC2)c1-c1nn[n-]n1 ZINC001592430755 1076182830 /nfs/dbraw/zinc/18/28/30/1076182830.db2.gz BZOCWNYYPCVBNI-SNVBAGLBSA-N -1 3 387.404 -1.390 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)C[C@H]3CC(=O)NC3=O)CC2)c1-c1nnn[n-]1 ZINC001592430755 1076182827 /nfs/dbraw/zinc/18/28/27/1076182827.db2.gz BZOCWNYYPCVBNI-SNVBAGLBSA-N -1 3 387.404 -1.390 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)C3(n4cnnn4)CC3)CC2)c1-c1nn[n-]n1 ZINC001592430772 1076182867 /nfs/dbraw/zinc/18/28/67/1076182867.db2.gz CWECLFPOPNOHJD-UHFFFAOYSA-N -1 3 384.408 -1.267 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)C3(n4cnnn4)CC3)CC2)c1-c1nnn[n-]1 ZINC001592430772 1076182865 /nfs/dbraw/zinc/18/28/65/1076182865.db2.gz CWECLFPOPNOHJD-UHFFFAOYSA-N -1 3 384.408 -1.267 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)CCCS(N)(=O)=O)CC2)c1-c1nn[n-]n1 ZINC001592430853 1076182803 /nfs/dbraw/zinc/18/28/03/1076182803.db2.gz HBPCCUMHKOPSKB-UHFFFAOYSA-N -1 3 397.465 -1.374 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)CCCS(N)(=O)=O)CC2)c1-c1nnn[n-]1 ZINC001592430853 1076182802 /nfs/dbraw/zinc/18/28/02/1076182802.db2.gz HBPCCUMHKOPSKB-UHFFFAOYSA-N -1 3 397.465 -1.374 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)CSCC(N)=O)CC2)c1-c1nn[n-]n1 ZINC001592430915 1076182723 /nfs/dbraw/zinc/18/27/23/1076182723.db2.gz JBJFSHRXRSEUFT-UHFFFAOYSA-N -1 3 379.450 -1.224 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)CSCC(N)=O)CC2)c1-c1nnn[n-]1 ZINC001592430915 1076182719 /nfs/dbraw/zinc/18/27/19/1076182719.db2.gz JBJFSHRXRSEUFT-UHFFFAOYSA-N -1 3 379.450 -1.224 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)CS(=O)(=O)N(C)C)CC2)c1-c1nn[n-]n1 ZINC001592430923 1076182819 /nfs/dbraw/zinc/18/28/19/1076182819.db2.gz JJUJVXUBQSEUPU-UHFFFAOYSA-N -1 3 397.465 -1.551 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)CS(=O)(=O)N(C)C)CC2)c1-c1nnn[n-]1 ZINC001592430923 1076182818 /nfs/dbraw/zinc/18/28/18/1076182818.db2.gz JJUJVXUBQSEUPU-UHFFFAOYSA-N -1 3 397.465 -1.551 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)C(=O)Nc3ccn(C)n3)CC2)c1-c1nn[n-]n1 ZINC001592431042 1076182795 /nfs/dbraw/zinc/18/27/95/1076182795.db2.gz LGIKDVJSNZZZSY-UHFFFAOYSA-N -1 3 399.419 -1.071 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)C(=O)Nc3ccn(C)n3)CC2)c1-c1nnn[n-]1 ZINC001592431042 1076182792 /nfs/dbraw/zinc/18/27/92/1076182792.db2.gz LGIKDVJSNZZZSY-UHFFFAOYSA-N -1 3 399.419 -1.071 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)N[C@@H]3CC(=O)N(C)C3)CC2)c1-c1nn[n-]n1 ZINC001592431140 1076182767 /nfs/dbraw/zinc/18/27/67/1076182767.db2.gz NBBCDEDCSPKYAP-LLVKDONJSA-N -1 3 388.436 -1.029 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)N[C@@H]3CC(=O)N(C)C3)CC2)c1-c1nnn[n-]1 ZINC001592431140 1076182762 /nfs/dbraw/zinc/18/27/62/1076182762.db2.gz NBBCDEDCSPKYAP-LLVKDONJSA-N -1 3 388.436 -1.029 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)N[C@H]3CC(=O)N(C)C3)CC2)c1-c1nn[n-]n1 ZINC001592431141 1076182810 /nfs/dbraw/zinc/18/28/10/1076182810.db2.gz NBBCDEDCSPKYAP-NSHDSACASA-N -1 3 388.436 -1.029 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)N[C@H]3CC(=O)N(C)C3)CC2)c1-c1nnn[n-]1 ZINC001592431141 1076182808 /nfs/dbraw/zinc/18/28/08/1076182808.db2.gz NBBCDEDCSPKYAP-NSHDSACASA-N -1 3 388.436 -1.029 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)Cn3ncn(C)c3=O)CC2)c1-c1nn[n-]n1 ZINC001592431165 1076182677 /nfs/dbraw/zinc/18/26/77/1076182677.db2.gz OKRSDVPCFQPWMH-UHFFFAOYSA-N -1 3 387.408 -1.847 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)Cn3ncn(C)c3=O)CC2)c1-c1nnn[n-]1 ZINC001592431165 1076182675 /nfs/dbraw/zinc/18/26/75/1076182675.db2.gz OKRSDVPCFQPWMH-UHFFFAOYSA-N -1 3 387.408 -1.847 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)NCC(=O)N(C)C)CC2)c1-c1nn[n-]n1 ZINC001592431201 1076182689 /nfs/dbraw/zinc/18/26/89/1076182689.db2.gz PXRMMNVRHCCABM-UHFFFAOYSA-N -1 3 376.425 -1.172 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)NCC(=O)N(C)C)CC2)c1-c1nnn[n-]1 ZINC001592431201 1076182684 /nfs/dbraw/zinc/18/26/84/1076182684.db2.gz PXRMMNVRHCCABM-UHFFFAOYSA-N -1 3 376.425 -1.172 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)[C@@H]3CCS(=O)(=O)N3)CC2)c1-c1nn[n-]n1 ZINC001592431411 1076182754 /nfs/dbraw/zinc/18/27/54/1076182754.db2.gz UUAPOVUNOBKYPM-JTQLQIEISA-N -1 3 395.449 -1.751 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)[C@@H]3CCS(=O)(=O)N3)CC2)c1-c1nnn[n-]1 ZINC001592431411 1076182750 /nfs/dbraw/zinc/18/27/50/1076182750.db2.gz UUAPOVUNOBKYPM-JTQLQIEISA-N -1 3 395.449 -1.751 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)[C@H]3CCS(=O)(=O)N3)CC2)c1-c1nn[n-]n1 ZINC001592431412 1076182711 /nfs/dbraw/zinc/18/27/11/1076182711.db2.gz UUAPOVUNOBKYPM-SNVBAGLBSA-N -1 3 395.449 -1.751 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)[C@H]3CCS(=O)(=O)N3)CC2)c1-c1nnn[n-]1 ZINC001592431412 1076182708 /nfs/dbraw/zinc/18/27/08/1076182708.db2.gz UUAPOVUNOBKYPM-SNVBAGLBSA-N -1 3 395.449 -1.751 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)CN(C)S(C)(=O)=O)CC2)c1-c1nn[n-]n1 ZINC001592431418 1076182856 /nfs/dbraw/zinc/18/28/56/1076182856.db2.gz UZTAVTVSJBGPRN-UHFFFAOYSA-N -1 3 397.465 -1.551 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)CN(C)S(C)(=O)=O)CC2)c1-c1nnn[n-]1 ZINC001592431418 1076182853 /nfs/dbraw/zinc/18/28/53/1076182853.db2.gz UZTAVTVSJBGPRN-UHFFFAOYSA-N -1 3 397.465 -1.551 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)CN3CCOCC3=O)CC2)c1-c1nn[n-]n1 ZINC001592431521 1076182813 /nfs/dbraw/zinc/18/28/13/1076182813.db2.gz XWXAWVHQUFKRMY-UHFFFAOYSA-N -1 3 389.420 -1.584 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)CN3CCOCC3=O)CC2)c1-c1nnn[n-]1 ZINC001592431521 1076182812 /nfs/dbraw/zinc/18/28/12/1076182812.db2.gz XWXAWVHQUFKRMY-UHFFFAOYSA-N -1 3 389.420 -1.584 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)c3ccc(=O)n(C)n3)CC2)c1-c1nn[n-]n1 ZINC001592431961 1076182842 /nfs/dbraw/zinc/18/28/42/1076182842.db2.gz GZCBRINBXNZVEH-UHFFFAOYSA-N -1 3 384.404 -1.035 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)c3ccc(=O)n(C)n3)CC2)c1-c1nnn[n-]1 ZINC001592431961 1076182837 /nfs/dbraw/zinc/18/28/37/1076182837.db2.gz GZCBRINBXNZVEH-UHFFFAOYSA-N -1 3 384.404 -1.035 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)NCCS(C)(=O)=O)CC2)c1-c1nn[n-]n1 ZINC001592431987 1076182698 /nfs/dbraw/zinc/18/26/98/1076182698.db2.gz IDPYVWCTYOSQAX-UHFFFAOYSA-N -1 3 397.465 -1.215 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)NCCS(C)(=O)=O)CC2)c1-c1nnn[n-]1 ZINC001592431987 1076182696 /nfs/dbraw/zinc/18/26/96/1076182696.db2.gz IDPYVWCTYOSQAX-UHFFFAOYSA-N -1 3 397.465 -1.215 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)c3nccnc3C(N)=O)CC2)c1-c1nn[n-]n1 ZINC001592432386 1076183381 /nfs/dbraw/zinc/18/33/81/1076183381.db2.gz NGBUFZHCKKHUCY-UHFFFAOYSA-N -1 3 397.403 -1.240 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)c3nccnc3C(N)=O)CC2)c1-c1nnn[n-]1 ZINC001592432386 1076183378 /nfs/dbraw/zinc/18/33/78/1076183378.db2.gz NGBUFZHCKKHUCY-UHFFFAOYSA-N -1 3 397.403 -1.240 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)c3nc4n(n3)CCCN4)CC2)c1-c1nn[n-]n1 ZINC001592432614 1076183158 /nfs/dbraw/zinc/18/31/58/1076183158.db2.gz RKCLALQWIPFUAX-UHFFFAOYSA-N -1 3 398.435 -1.464 20 0 GAADHM Cc1nn(C)c(N2CCN(C(=O)c3nc4n(n3)CCCN4)CC2)c1-c1nnn[n-]1 ZINC001592432614 1076183152 /nfs/dbraw/zinc/18/31/52/1076183152.db2.gz RKCLALQWIPFUAX-UHFFFAOYSA-N -1 3 398.435 -1.464 20 0 GAADHM Cc1nn(C)c(N2CCN(CC(=O)N3CCN(C)CC3)CC2)c1-c1nn[n-]n1 ZINC001592432717 1076183366 /nfs/dbraw/zinc/18/33/66/1076183366.db2.gz UNCFHHACTWBDCE-UHFFFAOYSA-N -1 3 388.480 -1.195 20 0 GAADHM Cc1nn(C)c(N2CCN(CC(=O)N3CCN(C)CC3)CC2)c1-c1nnn[n-]1 ZINC001592432717 1076183361 /nfs/dbraw/zinc/18/33/61/1076183361.db2.gz UNCFHHACTWBDCE-UHFFFAOYSA-N -1 3 388.480 -1.195 20 0 GAADHM Cc1nn(C)cc1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001592434651 1076183286 /nfs/dbraw/zinc/18/32/86/1076183286.db2.gz QTOQLGVDAMBGFC-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1nn(C)cc1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001592434651 1076183282 /nfs/dbraw/zinc/18/32/82/1076183282.db2.gz QTOQLGVDAMBGFC-CHWSQXEVSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1nn(C)cc1CC(=O)N1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001592435257 1076183314 /nfs/dbraw/zinc/18/33/14/1076183314.db2.gz MHDYGTZXDFRWAF-KGLIPLIRSA-N -1 3 399.415 -1.219 20 0 GAADHM Cc1nn(C)cc1CC(=O)N1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001592435257 1076183311 /nfs/dbraw/zinc/18/33/11/1076183311.db2.gz MHDYGTZXDFRWAF-KGLIPLIRSA-N -1 3 399.415 -1.219 20 0 GAADHM Cc1nn(C)cc1CC(=O)N1C[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001592435276 1076183302 /nfs/dbraw/zinc/18/33/02/1076183302.db2.gz NWAUQCYBAAMYPU-KGLIPLIRSA-N -1 3 399.415 -1.219 20 0 GAADHM Cc1nn(C)cc1CC(=O)N1C[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001592435276 1076183297 /nfs/dbraw/zinc/18/32/97/1076183297.db2.gz NWAUQCYBAAMYPU-KGLIPLIRSA-N -1 3 399.415 -1.219 20 0 GAADHM Cc1nn(C)cc1CC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O ZINC001592435699 1076183349 /nfs/dbraw/zinc/18/33/49/1076183349.db2.gz XBRRHMMQIYMBSU-KGLIPLIRSA-N -1 3 399.415 -1.219 20 0 GAADHM Cc1nn(C)cc1CC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O ZINC001592435699 1076183345 /nfs/dbraw/zinc/18/33/45/1076183345.db2.gz XBRRHMMQIYMBSU-KGLIPLIRSA-N -1 3 399.415 -1.219 20 0 GAADHM Cc1nn(C)cc1CC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1O ZINC001592435700 1076183248 /nfs/dbraw/zinc/18/32/48/1076183248.db2.gz XBRRHMMQIYMBSU-ZIAGYGMSSA-N -1 3 399.415 -1.219 20 0 GAADHM Cc1nn(C)cc1CC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1O ZINC001592435700 1076183244 /nfs/dbraw/zinc/18/32/44/1076183244.db2.gz XBRRHMMQIYMBSU-ZIAGYGMSSA-N -1 3 399.415 -1.219 20 0 GAADHM Cc1nn(CC(=O)NCCCNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)c(=O)n1C ZINC001592438429 1076183274 /nfs/dbraw/zinc/18/32/74/1076183274.db2.gz ADFDGNPUGNGWAI-UHFFFAOYSA-N -1 3 388.392 -1.665 20 0 GAADHM Cc1nn(CC(=O)NCCCNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)c(=O)n1C ZINC001592438429 1076183270 /nfs/dbraw/zinc/18/32/70/1076183270.db2.gz ADFDGNPUGNGWAI-UHFFFAOYSA-N -1 3 388.392 -1.665 20 0 GAADHM Cc1nn(CC(=O)OCC(=O)NCc2cccc(-c3nn[n-]n3)c2)c(=O)n1C ZINC001592438481 1076183128 /nfs/dbraw/zinc/18/31/28/1076183128.db2.gz COMZIEJQFCSJLJ-UHFFFAOYSA-N -1 3 386.372 -1.070 20 0 GAADHM Cc1nn(CC(=O)OCC(=O)NCc2cccc(-c3nnn[n-]3)c2)c(=O)n1C ZINC001592438481 1076183123 /nfs/dbraw/zinc/18/31/23/1076183123.db2.gz COMZIEJQFCSJLJ-UHFFFAOYSA-N -1 3 386.372 -1.070 20 0 GAADHM Cc1nn(CC(=O)N2CCN(c3cnccc3-c3nn[n-]n3)CC2)c(=O)n1C ZINC001592438841 1076183711 /nfs/dbraw/zinc/18/37/11/1076183711.db2.gz OYQQRQNMFLCASV-UHFFFAOYSA-N -1 3 384.404 -1.186 20 0 GAADHM Cc1nn(CC(=O)N2CCN(c3cnccc3-c3nnn[n-]3)CC2)c(=O)n1C ZINC001592438841 1076183709 /nfs/dbraw/zinc/18/37/09/1076183709.db2.gz OYQQRQNMFLCASV-UHFFFAOYSA-N -1 3 384.404 -1.186 20 0 GAADHM Cc1nn(CC(=O)N2CCN(c3cc(-c4nn[n-]n4)ccn3)CC2)c(=O)n1C ZINC001592438918 1076183703 /nfs/dbraw/zinc/18/37/03/1076183703.db2.gz VTHZUVJDQINGLL-UHFFFAOYSA-N -1 3 384.404 -1.186 20 0 GAADHM Cc1nn(CC(=O)N2CCN(c3cc(-c4nnn[n-]4)ccn3)CC2)c(=O)n1C ZINC001592438918 1076183702 /nfs/dbraw/zinc/18/37/02/1076183702.db2.gz VTHZUVJDQINGLL-UHFFFAOYSA-N -1 3 384.404 -1.186 20 0 GAADHM Cc1nnc(CNC(=O)C(=O)NCCNc2ncccc2-c2nn[n-]n2)n1C ZINC001592444530 1076183742 /nfs/dbraw/zinc/18/37/42/1076183742.db2.gz XGFWGZGGABNEOA-UHFFFAOYSA-N -1 3 385.392 -1.457 20 0 GAADHM Cc1nnc(CNC(=O)C(=O)NCCNc2ncccc2-c2nnn[n-]2)n1C ZINC001592444530 1076183741 /nfs/dbraw/zinc/18/37/41/1076183741.db2.gz XGFWGZGGABNEOA-UHFFFAOYSA-N -1 3 385.392 -1.457 20 0 GAADHM Cc1nnccc1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001592450540 1076183728 /nfs/dbraw/zinc/18/37/28/1076183728.db2.gz JEXUZHOBOBHMKW-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1nnccc1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001592450540 1076183726 /nfs/dbraw/zinc/18/37/26/1076183726.db2.gz JEXUZHOBOBHMKW-CHWSQXEVSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1noc(CNC(=O)C(=O)N2CCN(c3ncccc3-c3nn[n-]n3)CC2)n1 ZINC001592461989 1076183720 /nfs/dbraw/zinc/18/37/20/1076183720.db2.gz QMOJPIVJOJTUJT-UHFFFAOYSA-N -1 3 398.387 -1.082 20 0 GAADHM Cc1noc(CNC(=O)C(=O)N2CCN(c3ncccc3-c3nnn[n-]3)CC2)n1 ZINC001592461989 1076183718 /nfs/dbraw/zinc/18/37/18/1076183718.db2.gz QMOJPIVJOJTUJT-UHFFFAOYSA-N -1 3 398.387 -1.082 20 0 GAADHM Cc1noc(CNC(=O)C(=O)N2CCN(c3ccc(-c4nn[n-]n4)cn3)CC2)n1 ZINC001592462041 1076184120 /nfs/dbraw/zinc/18/41/20/1076184120.db2.gz VJJRWKKBJQGDIB-UHFFFAOYSA-N -1 3 398.387 -1.082 20 0 GAADHM Cc1noc(CNC(=O)C(=O)N2CCN(c3ccc(-c4nnn[n-]4)cn3)CC2)n1 ZINC001592462041 1076184118 /nfs/dbraw/zinc/18/41/18/1076184118.db2.gz VJJRWKKBJQGDIB-UHFFFAOYSA-N -1 3 398.387 -1.082 20 0 GAADHM Cc1nsc(N2CCC(CO)(NC(=O)CC(N)=O)CC2)c1-c1nnn[n-]1 ZINC001592472526 1076184221 /nfs/dbraw/zinc/18/42/21/1076184221.db2.gz OPUGRUKLCCFFQF-UHFFFAOYSA-N -1 3 380.434 -1.045 20 0 GAADHM Cc1nsc(N2CC[C@H](N3CCN(C(=O)C(N)=O)CC3)C2)c1-c1nnn[n-]1 ZINC001592472693 1076184257 /nfs/dbraw/zinc/18/42/57/1076184257.db2.gz AFSJKRDAHDOXOD-JTQLQIEISA-N -1 3 391.461 -1.160 20 0 GAADHM Cc1nsc(N2CC[C@@H](N3CCN(C(=O)C(N)=O)CC3)C2)c1-c1nnn[n-]1 ZINC001592472694 1076184241 /nfs/dbraw/zinc/18/42/41/1076184241.db2.gz AFSJKRDAHDOXOD-SNVBAGLBSA-N -1 3 391.461 -1.160 20 0 GAADHM Cc1nsc(N2CC[C@](O)(CNC(=O)C3(C(N)=O)CC3)C2)c1-c1nnn[n-]1 ZINC001592472851 1076184102 /nfs/dbraw/zinc/18/41/02/1076184102.db2.gz NCZZXQHPLHRPJP-AWEZNQCLSA-N -1 3 392.445 -1.045 20 0 GAADHM Cc1nsc(N2CC[C@@](O)(CNC(=O)C3(C(N)=O)CC3)C2)c1-c1nnn[n-]1 ZINC001592472853 1076184149 /nfs/dbraw/zinc/18/41/49/1076184149.db2.gz NCZZXQHPLHRPJP-CQSZACIVSA-N -1 3 392.445 -1.045 20 0 GAADHM Cc1nsc(N2CCN(C(=O)[C@@H](CO)NC(N)=O)CC2)c1-c1nnn[n-]1 ZINC001592473461 1076184330 /nfs/dbraw/zinc/18/43/30/1076184330.db2.gz AWDNVKYMXFCWKT-MRVPVSSYSA-N -1 3 381.422 -1.691 20 0 GAADHM Cc1nsc(N2CCN(C(=O)[C@H](CO)NC(N)=O)CC2)c1-c1nnn[n-]1 ZINC001592473462 1076184170 /nfs/dbraw/zinc/18/41/70/1076184170.db2.gz AWDNVKYMXFCWKT-QMMMGPOBSA-N -1 3 381.422 -1.691 20 0 GAADHM Cc1nsc(N2CCN(C(=O)C(=O)N(C)CCO)CC2)c1-c1nnn[n-]1 ZINC001592473480 1076184158 /nfs/dbraw/zinc/18/41/58/1076184158.db2.gz CJMIXXGDYGAOFV-UHFFFAOYSA-N -1 3 380.434 -1.269 20 0 GAADHM Cc1nsc(N2CCN(C(=O)CN3CC(=O)NC3=O)CC2)c1-c1nnn[n-]1 ZINC001592475307 1076184207 /nfs/dbraw/zinc/18/42/07/1076184207.db2.gz ONYRTXDQVXFBKQ-UHFFFAOYSA-N -1 3 391.417 -1.168 20 0 GAADHM Cc1nsc(N2CCN(CC(=O)N3CCNC(=O)C3)CC2)c1-c1nnn[n-]1 ZINC001592475949 1076184320 /nfs/dbraw/zinc/18/43/20/1076184320.db2.gz QTBOJPMIXBVHIV-UHFFFAOYSA-N -1 3 391.461 -1.288 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@H]3CN(C)CCO3)[C@@H](O)C2)c1-c1nn[n-]n1 ZINC001592476781 1076184309 /nfs/dbraw/zinc/18/43/09/1076184309.db2.gz CUVVLANUSVWSSY-OUAUKWLOSA-N -1 3 394.461 -1.372 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@H]3CN(C)CCO3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001592476781 1076184305 /nfs/dbraw/zinc/18/43/05/1076184305.db2.gz CUVVLANUSVWSSY-OUAUKWLOSA-N -1 3 394.461 -1.372 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@@H]3CN(C)CCO3)[C@@H](O)C2)c1-c1nn[n-]n1 ZINC001592476784 1076184291 /nfs/dbraw/zinc/18/42/91/1076184291.db2.gz CUVVLANUSVWSSY-VWYCJHECSA-N -1 3 394.461 -1.372 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@@H]3CN(C)CCO3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001592476784 1076184289 /nfs/dbraw/zinc/18/42/89/1076184289.db2.gz CUVVLANUSVWSSY-VWYCJHECSA-N -1 3 394.461 -1.372 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@@H]3CCN(C)C3=O)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001592476814 1076184339 /nfs/dbraw/zinc/18/43/39/1076184339.db2.gz FKOBVXLULJWJSH-AEJSXWLSSA-N -1 3 392.445 -1.224 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@H]3CCN(C)C3=O)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001592476816 1076184191 /nfs/dbraw/zinc/18/41/91/1076184191.db2.gz FKOBVXLULJWJSH-BBBLOLIVSA-N -1 3 392.445 -1.224 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@H]3CCCNC3=O)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001592476844 1076184716 /nfs/dbraw/zinc/18/47/16/1076184716.db2.gz GNVHQNKZUBLKHQ-AEJSXWLSSA-N -1 3 392.445 -1.176 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@@H]3CCCNC3=O)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001592476845 1076184661 /nfs/dbraw/zinc/18/46/61/1076184661.db2.gz GNVHQNKZUBLKHQ-BBBLOLIVSA-N -1 3 392.445 -1.176 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@H]3CN(C)C(=O)N3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001592476866 1076184733 /nfs/dbraw/zinc/18/47/33/1076184733.db2.gz HVVHZWOHHUKERU-HLTSFMKQSA-N -1 3 393.433 -1.679 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@@H]3CN(C)C(=O)N3)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001592476869 1076184693 /nfs/dbraw/zinc/18/46/93/1076184693.db2.gz HVVHZWOHHUKERU-VGMNWLOBSA-N -1 3 393.433 -1.679 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@]3(C)CCNC3=O)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001592476890 1076184561 /nfs/dbraw/zinc/18/45/61/1076184561.db2.gz JIMASWKWFFFKGP-CEFVDNRUSA-N -1 3 392.445 -1.176 20 0 GAADHM Cc1nsc(N2C[C@@H](NC(=O)[C@@]3(C)CCNC3=O)[C@@H](O)C2)c1-c1nnn[n-]1 ZINC001592476891 1076184583 /nfs/dbraw/zinc/18/45/83/1076184583.db2.gz JIMASWKWFFFKGP-OLBFVZFUSA-N -1 3 392.445 -1.176 20 0 GAADHM Cc1nsc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CN(C)CCO3)C2)c1-c1nn[n-]n1 ZINC001592477721 1076184637 /nfs/dbraw/zinc/18/46/37/1076184637.db2.gz CUVVLANUSVWSSY-GMTAPVOTSA-N -1 3 394.461 -1.372 20 0 GAADHM Cc1nsc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CN(C)CCO3)C2)c1-c1nnn[n-]1 ZINC001592477721 1076184632 /nfs/dbraw/zinc/18/46/32/1076184632.db2.gz CUVVLANUSVWSSY-GMTAPVOTSA-N -1 3 394.461 -1.372 20 0 GAADHM Cc1nsc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CN(C)CCO3)C2)c1-c1nn[n-]n1 ZINC001592477722 1076184707 /nfs/dbraw/zinc/18/47/07/1076184707.db2.gz CUVVLANUSVWSSY-MXWKQRLJSA-N -1 3 394.461 -1.372 20 0 GAADHM Cc1nsc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CN(C)CCO3)C2)c1-c1nnn[n-]1 ZINC001592477722 1076184704 /nfs/dbraw/zinc/18/47/04/1076184704.db2.gz CUVVLANUSVWSSY-MXWKQRLJSA-N -1 3 394.461 -1.372 20 0 GAADHM Cc1nsc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCC(=O)N3C)C2)c1-c1nnn[n-]1 ZINC001592477741 1076184724 /nfs/dbraw/zinc/18/47/24/1076184724.db2.gz GBUVECAEJPRYAG-KXUCPTDWSA-N -1 3 392.445 -1.082 20 0 GAADHM Cc1nsc(N2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(=O)cn3)C2)c1-c1nnn[n-]1 ZINC001592478379 1076184741 /nfs/dbraw/zinc/18/47/41/1076184741.db2.gz UZDKAFBMEQZANH-RKDXNWHRSA-N -1 3 389.401 -1.306 20 0 GAADHM Cc1nsc(N2C[C@@H](O)[C@H](NC(=O)Cn3cncn3)C2)c1-c1nnn[n-]1 ZINC001592478455 1076184611 /nfs/dbraw/zinc/18/46/11/1076184611.db2.gz XSBSHNBXGRTFAJ-RKDXNWHRSA-N -1 3 376.406 -1.411 20 0 GAADHM Cc1nsc(N[C@@H](CO)CNC(=O)[C@@H]2CCN(C)C2=O)c1-c1nnn[n-]1 ZINC001592482942 1076184650 /nfs/dbraw/zinc/18/46/50/1076184650.db2.gz UDFGXXGJPIUBOU-BDAKNGLRSA-N -1 3 380.434 -1.001 20 0 GAADHM Cc1nsc(N[C@H](CO)CNC(=O)[C@H]2CCN(C)C2=O)c1-c1nnn[n-]1 ZINC001592482943 1076184575 /nfs/dbraw/zinc/18/45/75/1076184575.db2.gz UDFGXXGJPIUBOU-DTWKUNHWSA-N -1 3 380.434 -1.001 20 0 GAADHM Cc1nsc(N[C@H](CO)CNC(=O)[C@@H]2CCN(C)C2=O)c1-c1nnn[n-]1 ZINC001592482944 1076184525 /nfs/dbraw/zinc/18/45/25/1076184525.db2.gz UDFGXXGJPIUBOU-IUCAKERBSA-N -1 3 380.434 -1.001 20 0 GAADHM Cc1nsc(N[C@@H](CO)CNC(=O)[C@H]2CCN(C)C2=O)c1-c1nnn[n-]1 ZINC001592482945 1076184592 /nfs/dbraw/zinc/18/45/92/1076184592.db2.gz UDFGXXGJPIUBOU-RKDXNWHRSA-N -1 3 380.434 -1.001 20 0 GAADHM Cc1nsc(N[C@H](CO)CNC(=O)C(=O)NCC(F)F)c1-c1nnn[n-]1 ZINC001592483012 1076184670 /nfs/dbraw/zinc/18/46/70/1076184670.db2.gz XNAOQLLJUHZQRV-LURJTMIESA-N -1 3 390.376 -1.098 20 0 GAADHM Cc1nsc(N[C@@H](CO)CNC(=O)C(=O)NCC(F)F)c1-c1nnn[n-]1 ZINC001592483013 1076184677 /nfs/dbraw/zinc/18/46/77/1076184677.db2.gz XNAOQLLJUHZQRV-ZCFIWIBFSA-N -1 3 390.376 -1.098 20 0 GAADHM Cc1nsc(NC[C@@H](O)CNC(=O)C(=O)NCC(F)F)c1-c1nnn[n-]1 ZINC001592488061 1076184537 /nfs/dbraw/zinc/18/45/37/1076184537.db2.gz SGGPGDUZHAZROW-LURJTMIESA-N -1 3 390.376 -1.098 20 0 GAADHM Cc1nsc(NC[C@H](O)CNC(=O)C(=O)NCC(F)F)c1-c1nnn[n-]1 ZINC001592488062 1076184686 /nfs/dbraw/zinc/18/46/86/1076184686.db2.gz SGGPGDUZHAZROW-ZCFIWIBFSA-N -1 3 390.376 -1.098 20 0 GAADHM Cc1nsc(NCCNC(=O)c2cn(C)c(=O)n(C)c2=O)c1-c1nnn[n-]1 ZINC001592492295 1076184550 /nfs/dbraw/zinc/18/45/50/1076184550.db2.gz XGQAUHFRDIZAST-UHFFFAOYSA-N -1 3 391.417 -1.129 20 0 GAADHM Cc1oc(NC(=O)CN2CCN3[C@@H](CNS3(=O)=O)C2)c(-c2nnn[n-]2)c1C ZINC001592509190 1076185312 /nfs/dbraw/zinc/18/53/12/1076185312.db2.gz AIOSEAGUVCJAQY-JTQLQIEISA-N -1 3 396.433 -1.151 20 0 GAADHM Cc1oc(NC(=O)CN2CCN3[C@H](CNS3(=O)=O)C2)c(-c2nnn[n-]2)c1C ZINC001592509196 1076185238 /nfs/dbraw/zinc/18/52/38/1076185238.db2.gz AIOSEAGUVCJAQY-SNVBAGLBSA-N -1 3 396.433 -1.151 20 0 GAADHM Cn1c(-c2cccc(-c3nn[n-]n3)c2)nnc1N1CCN2C(=O)C(=O)NC[C@@H]2C1 ZINC001592544595 1076185347 /nfs/dbraw/zinc/18/53/47/1076185347.db2.gz KKQYYBOAYUXXHR-GFCCVEGCSA-N -1 3 394.399 -1.191 20 0 GAADHM Cn1c(-c2cccc(-c3nnn[n-]3)c2)nnc1N1CCN2C(=O)C(=O)NC[C@@H]2C1 ZINC001592544595 1076185345 /nfs/dbraw/zinc/18/53/45/1076185345.db2.gz KKQYYBOAYUXXHR-GFCCVEGCSA-N -1 3 394.399 -1.191 20 0 GAADHM Cn1c(-c2cccc(-c3nn[n-]n3)c2)nnc1N1CCN2C(=O)C(=O)NC[C@H]2C1 ZINC001592544597 1076185269 /nfs/dbraw/zinc/18/52/69/1076185269.db2.gz KKQYYBOAYUXXHR-LBPRGKRZSA-N -1 3 394.399 -1.191 20 0 GAADHM Cn1c(-c2cccc(-c3nnn[n-]3)c2)nnc1N1CCN2C(=O)C(=O)NC[C@H]2C1 ZINC001592544597 1076185267 /nfs/dbraw/zinc/18/52/67/1076185267.db2.gz KKQYYBOAYUXXHR-LBPRGKRZSA-N -1 3 394.399 -1.191 20 0 GAADHM Cn1c(=O)ccn(CC(=O)N2CCN(c3cc(-c4nn[n-]n4)ccn3)CC2)c1=O ZINC001592547047 1076185622 /nfs/dbraw/zinc/18/56/22/1076185622.db2.gz CSUYNPMBTPWJKE-UHFFFAOYSA-N -1 3 397.399 -1.529 20 0 GAADHM Cn1c(=O)ccn(CC(=O)N2CCN(c3cc(-c4nnn[n-]4)ccn3)CC2)c1=O ZINC001592547047 1076185619 /nfs/dbraw/zinc/18/56/19/1076185619.db2.gz CSUYNPMBTPWJKE-UHFFFAOYSA-N -1 3 397.399 -1.529 20 0 GAADHM Cn1c2ncn(CC(=O)NCc3ccc(-c4nn[n-]n4)cn3)c2c(=O)n(C)c1=O ZINC001592547087 1076185614 /nfs/dbraw/zinc/18/56/14/1076185614.db2.gz FTLRDRYNGQMUBZ-UHFFFAOYSA-N -1 3 396.371 -1.675 20 0 GAADHM Cn1c2ncn(CC(=O)NCc3ccc(-c4nnn[n-]4)cn3)c2c(=O)n(C)c1=O ZINC001592547087 1076185609 /nfs/dbraw/zinc/18/56/09/1076185609.db2.gz FTLRDRYNGQMUBZ-UHFFFAOYSA-N -1 3 396.371 -1.675 20 0 GAADHM Cn1c(=O)ccn(CC(=O)N2CCN(c3ccc(-c4nn[n-]n4)nc3)CC2)c1=O ZINC001592547102 1076185632 /nfs/dbraw/zinc/18/56/32/1076185632.db2.gz GOFFKSRZZKZZNQ-UHFFFAOYSA-N -1 3 397.399 -1.529 20 0 GAADHM Cn1c(=O)ccn(CC(=O)N2CCN(c3ccc(-c4nnn[n-]4)nc3)CC2)c1=O ZINC001592547102 1076185631 /nfs/dbraw/zinc/18/56/31/1076185631.db2.gz GOFFKSRZZKZZNQ-UHFFFAOYSA-N -1 3 397.399 -1.529 20 0 GAADHM Cn1c(=O)ccn(CC(=O)NCCNc2ncc(-c3nn[n-]n3)cc2F)c1=O ZINC001592547124 1076185689 /nfs/dbraw/zinc/18/56/89/1076185689.db2.gz HVYRGIOGWVGJPJ-UHFFFAOYSA-N -1 3 389.351 -1.511 20 0 GAADHM Cn1c(=O)ccn(CC(=O)NCCNc2ncc(-c3nnn[n-]3)cc2F)c1=O ZINC001592547124 1076185687 /nfs/dbraw/zinc/18/56/87/1076185687.db2.gz HVYRGIOGWVGJPJ-UHFFFAOYSA-N -1 3 389.351 -1.511 20 0 GAADHM Cn1c2ncn(CC(=O)OCc3ccc(-c4nn[n-]n4)cn3)c2c(=O)n(C)c1=O ZINC001592547134 1076185748 /nfs/dbraw/zinc/18/57/48/1076185748.db2.gz IGMJJGQDDKJCKZ-UHFFFAOYSA-N -1 3 397.355 -1.248 20 0 GAADHM Cn1c2ncn(CC(=O)OCc3ccc(-c4nnn[n-]4)cn3)c2c(=O)n(C)c1=O ZINC001592547134 1076185744 /nfs/dbraw/zinc/18/57/44/1076185744.db2.gz IGMJJGQDDKJCKZ-UHFFFAOYSA-N -1 3 397.355 -1.248 20 0 GAADHM Cn1c(=O)ccn(CC(=O)NCCCNc2ncccc2-c2nn[n-]n2)c1=O ZINC001592547305 1076185780 /nfs/dbraw/zinc/18/57/80/1076185780.db2.gz RZIZYRGATPVTHB-UHFFFAOYSA-N -1 3 385.388 -1.260 20 0 GAADHM Cn1c(=O)ccn(CC(=O)NCCCNc2ncccc2-c2nnn[n-]2)c1=O ZINC001592547305 1076185776 /nfs/dbraw/zinc/18/57/76/1076185776.db2.gz RZIZYRGATPVTHB-UHFFFAOYSA-N -1 3 385.388 -1.260 20 0 GAADHM Cn1c(=O)ccn(CC(=O)OCC(=O)NCc2ccc(-c3nn[n-]n3)cc2)c1=O ZINC001592547315 1076185718 /nfs/dbraw/zinc/18/57/18/1076185718.db2.gz STLPVSXBTJCFRH-UHFFFAOYSA-N -1 3 399.367 -1.413 20 0 GAADHM Cn1c(=O)ccn(CC(=O)OCC(=O)NCc2ccc(-c3nnn[n-]3)cc2)c1=O ZINC001592547315 1076185716 /nfs/dbraw/zinc/18/57/16/1076185716.db2.gz STLPVSXBTJCFRH-UHFFFAOYSA-N -1 3 399.367 -1.413 20 0 GAADHM Cn1c(=O)ccn(CC(=O)NCCCNc2ccc(-c3nn[n-]n3)nc2)c1=O ZINC001592547317 1076185699 /nfs/dbraw/zinc/18/56/99/1076185699.db2.gz STZHAKJJVYNIPW-UHFFFAOYSA-N -1 3 385.388 -1.260 20 0 GAADHM Cn1c(=O)ccn(CC(=O)NCCCNc2ccc(-c3nnn[n-]3)nc2)c1=O ZINC001592547317 1076185697 /nfs/dbraw/zinc/18/56/97/1076185697.db2.gz STZHAKJJVYNIPW-UHFFFAOYSA-N -1 3 385.388 -1.260 20 0 GAADHM Cn1c(=O)ccn(CC(=O)N2CCc3c(sc(N)c3-c3nn[n-]n3)C2)c1=O ZINC001592547348 1076186077 /nfs/dbraw/zinc/18/60/77/1076186077.db2.gz VKPSAZZUYHZPID-UHFFFAOYSA-N -1 3 388.413 -1.044 20 0 GAADHM Cn1c(=O)ccn(CC(=O)N2CCc3c(sc(N)c3-c3nnn[n-]3)C2)c1=O ZINC001592547348 1076186073 /nfs/dbraw/zinc/18/60/73/1076186073.db2.gz VKPSAZZUYHZPID-UHFFFAOYSA-N -1 3 388.413 -1.044 20 0 GAADHM Cn1c(=O)cccc1C(=O)N1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001592548034 1076186140 /nfs/dbraw/zinc/18/61/40/1076186140.db2.gz NZAHFJYJFSNVIM-YPMHNXCESA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1c(=O)cccc1C(=O)N1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001592548034 1076186136 /nfs/dbraw/zinc/18/61/36/1076186136.db2.gz NZAHFJYJFSNVIM-YPMHNXCESA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1c(=O)cccc1C(=O)N1C[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001592548306 1076186041 /nfs/dbraw/zinc/18/60/41/1076186041.db2.gz VEGBJJRPFLXBOD-YPMHNXCESA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1c(=O)cccc1C(=O)N1C[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001592548306 1076186038 /nfs/dbraw/zinc/18/60/38/1076186038.db2.gz VEGBJJRPFLXBOD-YPMHNXCESA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1c(=O)cccc1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001592548407 1076186178 /nfs/dbraw/zinc/18/61/78/1076186178.db2.gz WUZLTDIUHQMOOM-DGCLKSJQSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1c(=O)cccc1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001592548407 1076186174 /nfs/dbraw/zinc/18/61/74/1076186174.db2.gz WUZLTDIUHQMOOM-DGCLKSJQSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1c(=O)cccc1C(=O)N1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001592548408 1076186220 /nfs/dbraw/zinc/18/62/20/1076186220.db2.gz WUZLTDIUHQMOOM-YPMHNXCESA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1c(=O)cccc1C(=O)N1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001592548408 1076186213 /nfs/dbraw/zinc/18/62/13/1076186213.db2.gz WUZLTDIUHQMOOM-YPMHNXCESA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1c(C(=O)N2CCN([C@@H]3CS(=O)(=O)C[C@H]3O)CC2)ccc1-c1nn[n-]n1 ZINC001592548827 1076186088 /nfs/dbraw/zinc/18/60/88/1076186088.db2.gz RAHGITCGHYBAAE-CHWSQXEVSA-N -1 3 395.445 -1.879 20 0 GAADHM Cn1c(C(=O)N2CCN([C@@H]3CS(=O)(=O)C[C@H]3O)CC2)ccc1-c1nnn[n-]1 ZINC001592548827 1076186085 /nfs/dbraw/zinc/18/60/85/1076186085.db2.gz RAHGITCGHYBAAE-CHWSQXEVSA-N -1 3 395.445 -1.879 20 0 GAADHM Cn1c(C(=O)N2CCN([C@@H]3CS(=O)(=O)C[C@@H]3O)CC2)ccc1-c1nn[n-]n1 ZINC001592548828 1076186187 /nfs/dbraw/zinc/18/61/87/1076186187.db2.gz RAHGITCGHYBAAE-OLZOCXBDSA-N -1 3 395.445 -1.879 20 0 GAADHM Cn1c(C(=O)N2CCN([C@@H]3CS(=O)(=O)C[C@@H]3O)CC2)ccc1-c1nnn[n-]1 ZINC001592548828 1076186185 /nfs/dbraw/zinc/18/61/85/1076186185.db2.gz RAHGITCGHYBAAE-OLZOCXBDSA-N -1 3 395.445 -1.879 20 0 GAADHM Cn1c(C(=O)N2CCN([C@H]3CS(=O)(=O)C[C@H]3O)CC2)ccc1-c1nn[n-]n1 ZINC001592548829 1076186064 /nfs/dbraw/zinc/18/60/64/1076186064.db2.gz RAHGITCGHYBAAE-QWHCGFSZSA-N -1 3 395.445 -1.879 20 0 GAADHM Cn1c(C(=O)N2CCN([C@H]3CS(=O)(=O)C[C@H]3O)CC2)ccc1-c1nnn[n-]1 ZINC001592548829 1076186060 /nfs/dbraw/zinc/18/60/60/1076186060.db2.gz RAHGITCGHYBAAE-QWHCGFSZSA-N -1 3 395.445 -1.879 20 0 GAADHM Cn1c(C(=O)N2CCN([C@H]3CS(=O)(=O)C[C@@H]3O)CC2)ccc1-c1nn[n-]n1 ZINC001592548830 1076186114 /nfs/dbraw/zinc/18/61/14/1076186114.db2.gz RAHGITCGHYBAAE-STQMWFEESA-N -1 3 395.445 -1.879 20 0 GAADHM Cn1c(C(=O)N2CCN([C@H]3CS(=O)(=O)C[C@@H]3O)CC2)ccc1-c1nnn[n-]1 ZINC001592548830 1076186109 /nfs/dbraw/zinc/18/61/09/1076186109.db2.gz RAHGITCGHYBAAE-STQMWFEESA-N -1 3 395.445 -1.879 20 0 GAADHM Cn1c(=O)[nH]cc1C(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001592552632 1076186167 /nfs/dbraw/zinc/18/61/67/1076186167.db2.gz DEIVSZOJUHIBNQ-KOLCDFICSA-N -1 3 389.351 -1.181 20 0 GAADHM Cn1c(=O)[nH]cc1C(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001592552632 1076186161 /nfs/dbraw/zinc/18/61/61/1076186161.db2.gz DEIVSZOJUHIBNQ-KOLCDFICSA-N -1 3 389.351 -1.181 20 0 GAADHM Cn1c(=O)cccc1C(=O)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O ZINC001592552662 1076186030 /nfs/dbraw/zinc/18/60/30/1076186030.db2.gz FGKDJQMMKHLGND-YPMHNXCESA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1c(=O)cccc1C(=O)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O ZINC001592552662 1076186027 /nfs/dbraw/zinc/18/60/27/1076186027.db2.gz FGKDJQMMKHLGND-YPMHNXCESA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1c(=O)cccc1C(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O ZINC001592553085 1076186006 /nfs/dbraw/zinc/18/60/06/1076186006.db2.gz WPVYXGZJQKKKHN-DGCLKSJQSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1c(=O)cccc1C(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O ZINC001592553085 1076186003 /nfs/dbraw/zinc/18/60/03/1076186003.db2.gz WPVYXGZJQKKKHN-DGCLKSJQSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1c(=O)c(-c2nnn[n-]2)c(N2CCN(CCCCCO)CC2)n(C)c1=O ZINC001592553532 1076187023 /nfs/dbraw/zinc/18/70/23/1076187023.db2.gz RWWVBJAGFFVRNB-UHFFFAOYSA-N -1 3 378.437 -1.451 20 0 GAADHM Cn1c(=O)c(-c2nn[n-]n2)c(N2CCN(CCCCCO)CC2)n(C)c1=O ZINC001592553532 1076187018 /nfs/dbraw/zinc/18/70/18/1076187018.db2.gz RWWVBJAGFFVRNB-UHFFFAOYSA-N -1 3 378.437 -1.451 20 0 GAADHM Cn1c(=O)c(-c2nn[n-]n2)c(N2CCC(C)(N3CCOCC3)CC2)n(C)c1=O ZINC001592553719 1076187155 /nfs/dbraw/zinc/18/71/55/1076187155.db2.gz WUWGZNBCSMZPBF-UHFFFAOYSA-N -1 3 390.448 -1.045 20 0 GAADHM Cn1c(=O)c(-c2nnn[n-]2)c(N2CCC(C)(N3CCOCC3)CC2)n(C)c1=O ZINC001592553719 1076187153 /nfs/dbraw/zinc/18/71/53/1076187153.db2.gz WUWGZNBCSMZPBF-UHFFFAOYSA-N -1 3 390.448 -1.045 20 0 GAADHM Cn1c(CN2CCN(c3cccc(-c4nn[n-]n4)n3)CC2)cc(=O)n(C)c1=O ZINC001592555049 1076187468 /nfs/dbraw/zinc/18/74/68/1076187468.db2.gz MLRYYXBVVYNJJN-UHFFFAOYSA-N -1 3 383.416 -1.019 20 0 GAADHM Cn1c(CN2CCN(c3cccc(-c4nnn[n-]4)n3)CC2)cc(=O)n(C)c1=O ZINC001592555049 1076187466 /nfs/dbraw/zinc/18/74/66/1076187466.db2.gz MLRYYXBVVYNJJN-UHFFFAOYSA-N -1 3 383.416 -1.019 20 0 GAADHM Cn1c(CN2CCN(c3ccc(-c4nn[n-]n4)nc3)CC2)cc(=O)n(C)c1=O ZINC001592555504 1076187496 /nfs/dbraw/zinc/18/74/96/1076187496.db2.gz YFKWMFPSWRWJEU-UHFFFAOYSA-N -1 3 383.416 -1.019 20 0 GAADHM Cn1c(CN2CCN(c3ccc(-c4nnn[n-]4)nc3)CC2)cc(=O)n(C)c1=O ZINC001592555504 1076187493 /nfs/dbraw/zinc/18/74/93/1076187493.db2.gz YFKWMFPSWRWJEU-UHFFFAOYSA-N -1 3 383.416 -1.019 20 0 GAADHM Cn1c(NCCCN2CCC[C@H]2C(N)=O)c(-c2nnn[n-]2)c(=O)n(C)c1=O ZINC001592555676 1076187581 /nfs/dbraw/zinc/18/75/81/1076187581.db2.gz PRJBJJNOQRXUNR-VIFPVBQESA-N -1 3 377.409 -1.984 20 0 GAADHM Cn1c(NCCCN2CCC[C@H]2C(N)=O)c(-c2nn[n-]n2)c(=O)n(C)c1=O ZINC001592555676 1076187575 /nfs/dbraw/zinc/18/75/75/1076187575.db2.gz PRJBJJNOQRXUNR-VIFPVBQESA-N -1 3 377.409 -1.984 20 0 GAADHM Cn1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)ccc1=O ZINC001592564671 1076188071 /nfs/dbraw/zinc/18/80/71/1076188071.db2.gz DYTYZCQZFLGAAW-CHWSQXEVSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)ccc1=O ZINC001592564671 1076188066 /nfs/dbraw/zinc/18/80/66/1076188066.db2.gz DYTYZCQZFLGAAW-CHWSQXEVSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1cc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)ccc1=O ZINC001592564672 1076188146 /nfs/dbraw/zinc/18/81/46/1076188146.db2.gz DYTYZCQZFLGAAW-OLZOCXBDSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1cc(C(=O)N2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)ccc1=O ZINC001592564672 1076188143 /nfs/dbraw/zinc/18/81/43/1076188143.db2.gz DYTYZCQZFLGAAW-OLZOCXBDSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)ccc1=O ZINC001592564763 1076188806 /nfs/dbraw/zinc/18/88/06/1076188806.db2.gz OHNOGZHETREUKL-CHWSQXEVSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1cc(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)ccc1=O ZINC001592564763 1076188803 /nfs/dbraw/zinc/18/88/03/1076188803.db2.gz OHNOGZHETREUKL-CHWSQXEVSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ncc(-c4nn[n-]n4)cc3F)C[C@@H]2O)[nH]c1=O ZINC001592564960 1076188789 /nfs/dbraw/zinc/18/87/89/1076188789.db2.gz BEYXAOCPXLNGOY-KOLCDFICSA-N -1 3 389.351 -1.181 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)ccc1=O ZINC001592565002 1076188607 /nfs/dbraw/zinc/18/86/07/1076188607.db2.gz KUZFDPYSRHNMFC-OLZOCXBDSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)ccc1=O ZINC001592565002 1076188602 /nfs/dbraw/zinc/18/86/02/1076188602.db2.gz KUZFDPYSRHNMFC-OLZOCXBDSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)ccc1=O ZINC001592565031 1076188528 /nfs/dbraw/zinc/18/85/28/1076188528.db2.gz PZZMTLIDDIFSTH-CHWSQXEVSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)ccc1=O ZINC001592565031 1076188524 /nfs/dbraw/zinc/18/85/24/1076188524.db2.gz PZZMTLIDDIFSTH-CHWSQXEVSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]2O)n(C)c1=O ZINC001592565032 1076188620 /nfs/dbraw/zinc/18/86/20/1076188620.db2.gz QAEZOQUIUNMNLB-DGCLKSJQSA-N -1 3 385.388 -1.722 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]2O)n(C)c1=O ZINC001592565032 1076188616 /nfs/dbraw/zinc/18/86/16/1076188616.db2.gz QAEZOQUIUNMNLB-DGCLKSJQSA-N -1 3 385.388 -1.722 20 0 GAADHM Cn1cc(C(=O)NCCOCCCNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)nn1 ZINC001592565151 1076188771 /nfs/dbraw/zinc/18/87/71/1076188771.db2.gz GAQXYPCMOWRDFQ-UHFFFAOYSA-N -1 3 388.392 -1.110 20 0 GAADHM Cn1cc(C(=O)NCCOCCCNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)nn1 ZINC001592565151 1076188764 /nfs/dbraw/zinc/18/87/64/1076188764.db2.gz GAQXYPCMOWRDFQ-UHFFFAOYSA-N -1 3 388.392 -1.110 20 0 GAADHM Cn1cc(C(=O)NCCCNc2ccc(-c3nn[n-]n3)cn2)c(=O)n(C)c1=O ZINC001592565474 1076189248 /nfs/dbraw/zinc/18/92/48/1076189248.db2.gz QKLYKDHODBXTRD-UHFFFAOYSA-N -1 3 385.388 -1.109 20 0 GAADHM Cn1cc(C(=O)NCCCNc2ccc(-c3nnn[n-]3)cn2)c(=O)n(C)c1=O ZINC001592565474 1076189245 /nfs/dbraw/zinc/18/92/45/1076189245.db2.gz QKLYKDHODBXTRD-UHFFFAOYSA-N -1 3 385.388 -1.109 20 0 GAADHM Cn1cc(C(=O)NCCOCCCNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)nn1 ZINC001592565629 1076189298 /nfs/dbraw/zinc/18/92/98/1076189298.db2.gz WROGBMKBHAPDKR-UHFFFAOYSA-N -1 3 388.392 -1.110 20 0 GAADHM Cn1cc(C(=O)NCCOCCCNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)nn1 ZINC001592565629 1076189297 /nfs/dbraw/zinc/18/92/97/1076189297.db2.gz WROGBMKBHAPDKR-UHFFFAOYSA-N -1 3 388.392 -1.110 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(c3nccnc3-c3nnn[n-]3)C[C@H]2O)[nH]c1=O ZINC001592565713 1076189232 /nfs/dbraw/zinc/18/92/32/1076189232.db2.gz XOCYYIRZFLFCDJ-PSASIEDQSA-N -1 3 386.376 -1.535 20 0 GAADHM Cn1cc(C(=O)N[C@@H]2CCN(c3nccnc3-c3nnn[n-]3)C[C@@H]2O)[nH]c1=O ZINC001592565714 1076189257 /nfs/dbraw/zinc/18/92/57/1076189257.db2.gz XOCYYIRZFLFCDJ-SCZZXKLOSA-N -1 3 386.376 -1.535 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(c3nccnc3-c3nnn[n-]3)C[C@H]2O)[nH]c1=O ZINC001592565715 1076189408 /nfs/dbraw/zinc/18/94/08/1076189408.db2.gz XOCYYIRZFLFCDJ-WCBMZHEXSA-N -1 3 386.376 -1.535 20 0 GAADHM Cn1cc(C(=O)N[C@H]2CCN(c3nccnc3-c3nnn[n-]3)C[C@@H]2O)[nH]c1=O ZINC001592565716 1076189213 /nfs/dbraw/zinc/18/92/13/1076189213.db2.gz XOCYYIRZFLFCDJ-WPRPVWTQSA-N -1 3 386.376 -1.535 20 0 GAADHM Cn1cc(C=CC(=O)NCCNc2ccc(-c3nn[n-]n3)cn2)c(=O)n(C)c1=O ZINC001592567274 1076189222 /nfs/dbraw/zinc/18/92/22/1076189222.db2.gz VBQLOSZNTPNJHM-GQCTYLIASA-N -1 3 397.399 -1.099 20 0 GAADHM Cn1cc(C=CC(=O)NCCNc2ccc(-c3nnn[n-]3)cn2)c(=O)n(C)c1=O ZINC001592567274 1076189219 /nfs/dbraw/zinc/18/92/19/1076189219.db2.gz VBQLOSZNTPNJHM-GQCTYLIASA-N -1 3 397.399 -1.099 20 0 GAADHM Cn1cc(C=CC(=O)NCCNc2ccc(-c3nn[n-]n3)cn2)c(=O)n(C)c1=O ZINC001592567281 1076189329 /nfs/dbraw/zinc/18/93/29/1076189329.db2.gz VBQLOSZNTPNJHM-XQRVVYSFSA-N -1 3 397.399 -1.099 20 0 GAADHM Cn1cc(C=CC(=O)NCCNc2ccc(-c3nnn[n-]3)cn2)c(=O)n(C)c1=O ZINC001592567281 1076189324 /nfs/dbraw/zinc/18/93/24/1076189324.db2.gz VBQLOSZNTPNJHM-XQRVVYSFSA-N -1 3 397.399 -1.099 20 0 GAADHM Cn1cc(CC(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)cn1 ZINC001592568771 1076189291 /nfs/dbraw/zinc/18/92/91/1076189291.db2.gz HZTMNQFKHMGSKU-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1cc(CC(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)cn1 ZINC001592568771 1076189287 /nfs/dbraw/zinc/18/92/87/1076189287.db2.gz HZTMNQFKHMGSKU-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1cc(CCNC(=O)C(=O)NCCNc2ncccc2-c2nn[n-]n2)cn1 ZINC001592569480 1076189276 /nfs/dbraw/zinc/18/92/76/1076189276.db2.gz QHGCRUOLWDUVHL-UHFFFAOYSA-N -1 3 384.404 -1.118 20 0 GAADHM Cn1cc(CCNC(=O)C(=O)NCCNc2ncccc2-c2nnn[n-]2)cn1 ZINC001592569480 1076189273 /nfs/dbraw/zinc/18/92/73/1076189273.db2.gz QHGCRUOLWDUVHL-UHFFFAOYSA-N -1 3 384.404 -1.118 20 0 GAADHM Cn1cc(CN2CCN(c3ccc(-c4nnn[n-]4)nc3)CC2)c(=O)n(C)c1=O ZINC001592571411 1076189241 /nfs/dbraw/zinc/18/92/41/1076189241.db2.gz FPXVIOMAYYRSTI-UHFFFAOYSA-N -1 3 383.416 -1.019 20 0 GAADHM Cn1cc(CNC(=O)C(=O)N2CCN(c3ncccc3-c3nn[n-]n3)CC2)nn1 ZINC001592571756 1076189347 /nfs/dbraw/zinc/18/93/47/1076189347.db2.gz QNVUZUSRMRRLEW-UHFFFAOYSA-N -1 3 397.403 -1.645 20 0 GAADHM Cn1cc(CNC(=O)C(=O)N2CCN(c3ncccc3-c3nnn[n-]3)CC2)nn1 ZINC001592571756 1076189344 /nfs/dbraw/zinc/18/93/44/1076189344.db2.gz QNVUZUSRMRRLEW-UHFFFAOYSA-N -1 3 397.403 -1.645 20 0 GAADHM Cn1cc(CNC(=O)CNS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)nn1 ZINC001592571922 1076189921 /nfs/dbraw/zinc/18/99/21/1076189921.db2.gz VYEJKWPZRPLTOV-UHFFFAOYSA-N -1 3 377.390 -1.410 20 0 GAADHM Cn1cc(CNC(=O)CNS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)nn1 ZINC001592571922 1076189918 /nfs/dbraw/zinc/18/99/18/1076189918.db2.gz VYEJKWPZRPLTOV-UHFFFAOYSA-N -1 3 377.390 -1.410 20 0 GAADHM Cn1cc(CNC(=O)C(=O)N2CCN(c3ccccc3-c3nn[n-]n3)CC2)nn1 ZINC001592571968 1076189665 /nfs/dbraw/zinc/18/96/65/1076189665.db2.gz ZDWRQKGVWCZAFN-UHFFFAOYSA-N -1 3 396.415 -1.040 20 0 GAADHM Cn1cc(CNC(=O)C(=O)N2CCN(c3ccccc3-c3nnn[n-]3)CC2)nn1 ZINC001592571968 1076189661 /nfs/dbraw/zinc/18/96/61/1076189661.db2.gz ZDWRQKGVWCZAFN-UHFFFAOYSA-N -1 3 396.415 -1.040 20 0 GAADHM Cn1cc(S(=O)(=O)N2Cc3cccc(-c4nn[n-]n4)c3C2)c(=O)n(C)c1=O ZINC001592574304 1076189711 /nfs/dbraw/zinc/18/97/11/1076189711.db2.gz AHGUKPQOQLSPLM-UHFFFAOYSA-N -1 3 389.397 -1.031 20 0 GAADHM Cn1cc(S(=O)(=O)N2Cc3cccc(-c4nnn[n-]4)c3C2)c(=O)n(C)c1=O ZINC001592574304 1076189707 /nfs/dbraw/zinc/18/97/07/1076189707.db2.gz AHGUKPQOQLSPLM-UHFFFAOYSA-N -1 3 389.397 -1.031 20 0 GAADHM Cn1cc(S(=O)(=O)NCC(=O)NCc2ccc(-c3nn[n-]n3)cn2)cn1 ZINC001592574881 1076189842 /nfs/dbraw/zinc/18/98/42/1076189842.db2.gz RDWBBZVYFUHAKB-UHFFFAOYSA-N -1 3 377.390 -1.410 20 0 GAADHM Cn1cc(S(=O)(=O)NCC(=O)NCc2ccc(-c3nnn[n-]3)cn2)cn1 ZINC001592574881 1076189839 /nfs/dbraw/zinc/18/98/39/1076189839.db2.gz RDWBBZVYFUHAKB-UHFFFAOYSA-N -1 3 377.390 -1.410 20 0 GAADHM Cn1cc(NC(=O)CNC(=O)c2ccc(-c3nn[n-]n3)cc2)c(=O)n(C)c1=O ZINC001592575977 1076189772 /nfs/dbraw/zinc/18/97/72/1076189772.db2.gz IQYCKANIJFVIQC-UHFFFAOYSA-N -1 3 384.356 -1.367 20 0 GAADHM Cn1cc(NC(=O)CNC(=O)c2ccc(-c3nnn[n-]3)cc2)c(=O)n(C)c1=O ZINC001592575977 1076189769 /nfs/dbraw/zinc/18/97/69/1076189769.db2.gz IQYCKANIJFVIQC-UHFFFAOYSA-N -1 3 384.356 -1.367 20 0 GAADHM Cn1cc([C@@H]2C[C@H]2C(=O)NC[C@@H](O)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)cn1 ZINC001592577009 1076189860 /nfs/dbraw/zinc/18/98/60/1076189860.db2.gz KOPQSJLSZNFVCR-GRYCIOLGSA-N -1 3 399.415 -1.061 20 0 GAADHM Cn1cc([C@@H]2C[C@H]2C(=O)NC[C@@H](O)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cn1 ZINC001592577009 1076189856 /nfs/dbraw/zinc/18/98/56/1076189856.db2.gz KOPQSJLSZNFVCR-GRYCIOLGSA-N -1 3 399.415 -1.061 20 0 GAADHM Cn1cc([C@@H]2C[C@H]2C(=O)NC[C@H](O)CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)cn1 ZINC001592577010 1076189931 /nfs/dbraw/zinc/18/99/31/1076189931.db2.gz KOPQSJLSZNFVCR-SDDRHHMPSA-N -1 3 399.415 -1.061 20 0 GAADHM Cn1cc([C@@H]2C[C@H]2C(=O)NC[C@H](O)CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)cn1 ZINC001592577010 1076189927 /nfs/dbraw/zinc/18/99/27/1076189927.db2.gz KOPQSJLSZNFVCR-SDDRHHMPSA-N -1 3 399.415 -1.061 20 0 GAADHM Cn1cc([C@@H]2C[C@H]2C(=O)NC[C@H](CO)NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)cn1 ZINC001592577177 1076189833 /nfs/dbraw/zinc/18/98/33/1076189833.db2.gz VNIVTSCAIBVOAN-FRRDWIJNSA-N -1 3 399.415 -1.061 20 0 GAADHM Cn1cc([C@@H]2C[C@H]2C(=O)NC[C@H](CO)NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cn1 ZINC001592577177 1076189828 /nfs/dbraw/zinc/18/98/28/1076189828.db2.gz VNIVTSCAIBVOAN-FRRDWIJNSA-N -1 3 399.415 -1.061 20 0 GAADHM Cn1cc([C@@H]2C[C@H]2C(=O)NC[C@@H](CO)NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)cn1 ZINC001592577178 1076189696 /nfs/dbraw/zinc/18/96/96/1076189696.db2.gz VNIVTSCAIBVOAN-RWMBFGLXSA-N -1 3 399.415 -1.061 20 0 GAADHM Cn1cc([C@@H]2C[C@H]2C(=O)NC[C@@H](CO)NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)cn1 ZINC001592577178 1076189685 /nfs/dbraw/zinc/18/96/85/1076189685.db2.gz VNIVTSCAIBVOAN-RWMBFGLXSA-N -1 3 399.415 -1.061 20 0 GAADHM Cn1ccc(=O)c(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)c1 ZINC001592577546 1076190378 /nfs/dbraw/zinc/19/03/78/1076190378.db2.gz GVGPWLGQDYNEFQ-TZMCWYRMSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(=O)c(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)c1 ZINC001592577546 1076190374 /nfs/dbraw/zinc/19/03/74/1076190374.db2.gz GVGPWLGQDYNEFQ-TZMCWYRMSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(=O)c(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)c1 ZINC001592577919 1076190287 /nfs/dbraw/zinc/19/02/87/1076190287.db2.gz UWDAXMIIONQHJG-TZMCWYRMSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(=O)c(C(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)c1 ZINC001592577919 1076190283 /nfs/dbraw/zinc/19/02/83/1076190283.db2.gz UWDAXMIIONQHJG-TZMCWYRMSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(=O)c(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)c1 ZINC001592578249 1076190388 /nfs/dbraw/zinc/19/03/88/1076190388.db2.gz LJRQDFPPBYSRSR-OCCSQVGLSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(=O)c(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)c1 ZINC001592578249 1076190384 /nfs/dbraw/zinc/19/03/84/1076190384.db2.gz LJRQDFPPBYSRSR-OCCSQVGLSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(=O)n(CCCNS(=O)(=O)c2cncc(-c3nn[n-]n3)c2)c1=O ZINC001592578326 1076190346 /nfs/dbraw/zinc/19/03/46/1076190346.db2.gz SELGGDIPBRBGMG-UHFFFAOYSA-N -1 3 392.401 -1.509 20 0 GAADHM Cn1ccc(=O)n(CCCNS(=O)(=O)c2cncc(-c3nnn[n-]3)c2)c1=O ZINC001592578326 1076190340 /nfs/dbraw/zinc/19/03/40/1076190340.db2.gz SELGGDIPBRBGMG-UHFFFAOYSA-N -1 3 392.401 -1.509 20 0 GAADHM Cn1ccc(=O)n(CCCNC(=O)[C@@H](O)c2ccc(-c3nn[n-]n3)cc2)c1=O ZINC001592578336 1076190296 /nfs/dbraw/zinc/19/02/96/1076190296.db2.gz UCXPSMKJXFWOGO-AWEZNQCLSA-N -1 3 385.384 -1.033 20 0 GAADHM Cn1ccc(=O)n(CCCNC(=O)[C@@H](O)c2ccc(-c3nnn[n-]3)cc2)c1=O ZINC001592578336 1076190294 /nfs/dbraw/zinc/19/02/94/1076190294.db2.gz UCXPSMKJXFWOGO-AWEZNQCLSA-N -1 3 385.384 -1.033 20 0 GAADHM Cn1ccc(=O)n(CCCNC(=O)[C@H](O)c2ccc(-c3nn[n-]n3)cc2)c1=O ZINC001592578337 1076190320 /nfs/dbraw/zinc/19/03/20/1076190320.db2.gz UCXPSMKJXFWOGO-CQSZACIVSA-N -1 3 385.384 -1.033 20 0 GAADHM Cn1ccc(=O)n(CCCNC(=O)[C@H](O)c2ccc(-c3nnn[n-]3)cc2)c1=O ZINC001592578337 1076190316 /nfs/dbraw/zinc/19/03/16/1076190316.db2.gz UCXPSMKJXFWOGO-CQSZACIVSA-N -1 3 385.384 -1.033 20 0 GAADHM Cn1ccc(=O)c(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)c1 ZINC001592578368 1076190275 /nfs/dbraw/zinc/19/02/75/1076190275.db2.gz XMDTYVUEJDXWSD-TZMCWYRMSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(=O)c(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)c1 ZINC001592578368 1076190274 /nfs/dbraw/zinc/19/02/74/1076190274.db2.gz XMDTYVUEJDXWSD-TZMCWYRMSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(CCC(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001592578828 1076190246 /nfs/dbraw/zinc/19/02/46/1076190246.db2.gz FVAAKRCTMOWIDK-ZIAGYGMSSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccc(CCC(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001592578828 1076190241 /nfs/dbraw/zinc/19/02/41/1076190241.db2.gz FVAAKRCTMOWIDK-ZIAGYGMSSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccc(CCC(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)n1 ZINC001592578858 1076190366 /nfs/dbraw/zinc/19/03/66/1076190366.db2.gz GLUPNLBLFXCYIL-KGLIPLIRSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccc(CCC(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)n1 ZINC001592578858 1076190362 /nfs/dbraw/zinc/19/03/62/1076190362.db2.gz GLUPNLBLFXCYIL-KGLIPLIRSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)cc1=O ZINC001592579032 1076190332 /nfs/dbraw/zinc/19/03/32/1076190332.db2.gz CFTQFYAIOQOITR-CHWSQXEVSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)cc1=O ZINC001592579032 1076190330 /nfs/dbraw/zinc/19/03/30/1076190330.db2.gz CFTQFYAIOQOITR-CHWSQXEVSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(CCC(=O)N2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)n1 ZINC001592579096 1076190355 /nfs/dbraw/zinc/19/03/55/1076190355.db2.gz JJABEPOGVWMYTI-KGLIPLIRSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccc(CCC(=O)N2C[C@@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)[C@@H](O)C2)n1 ZINC001592579096 1076190352 /nfs/dbraw/zinc/19/03/52/1076190352.db2.gz JJABEPOGVWMYTI-KGLIPLIRSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccc(CCC(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)n1 ZINC001592579257 1076190717 /nfs/dbraw/zinc/19/07/17/1076190717.db2.gz LWFVGYFOFQBQTM-KGLIPLIRSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccc(CCC(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)n1 ZINC001592579257 1076190715 /nfs/dbraw/zinc/19/07/15/1076190715.db2.gz LWFVGYFOFQBQTM-KGLIPLIRSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccc(CCC(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)n1 ZINC001592579291 1076190798 /nfs/dbraw/zinc/19/07/98/1076190798.db2.gz NBQINLWNRLESKP-ZIAGYGMSSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccc(CCC(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)n1 ZINC001592579291 1076190797 /nfs/dbraw/zinc/19/07/97/1076190797.db2.gz NBQINLWNRLESKP-ZIAGYGMSSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccc(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001592579427 1076190652 /nfs/dbraw/zinc/19/06/52/1076190652.db2.gz WNHCTKIEQZJKNT-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001592579427 1076190648 /nfs/dbraw/zinc/19/06/48/1076190648.db2.gz WNHCTKIEQZJKNT-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@H]2O)n1 ZINC001592579450 1076190755 /nfs/dbraw/zinc/19/07/55/1076190755.db2.gz YXAASNFQOWEQKT-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(CC(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@H]2O)n1 ZINC001592579450 1076190752 /nfs/dbraw/zinc/19/07/52/1076190752.db2.gz YXAASNFQOWEQKT-CHWSQXEVSA-N -1 3 385.388 -1.528 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@@H]2O)cc1=O ZINC001592579593 1076190637 /nfs/dbraw/zinc/19/06/37/1076190637.db2.gz PYCGOAMNGDXPED-OLZOCXBDSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@@H]2O)cc1=O ZINC001592579593 1076190634 /nfs/dbraw/zinc/19/06/34/1076190634.db2.gz PYCGOAMNGDXPED-OLZOCXBDSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)C[C@@H]2O)cc1=O ZINC001592579719 1076190696 /nfs/dbraw/zinc/19/06/96/1076190696.db2.gz XUFMKDFZWCNFNS-OLZOCXBDSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(C(=O)N[C@@H]2CN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)C[C@@H]2O)cc1=O ZINC001592579719 1076190695 /nfs/dbraw/zinc/19/06/95/1076190695.db2.gz XUFMKDFZWCNFNS-OLZOCXBDSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccc(CCNC(=O)C(=O)NCCNc2ccc(-c3nn[n-]n3)cn2)n1 ZINC001592579776 1076190691 /nfs/dbraw/zinc/19/06/91/1076190691.db2.gz REUIQDKDOMIOAT-UHFFFAOYSA-N -1 3 384.404 -1.118 20 0 GAADHM Cn1ccc(CCNC(=O)C(=O)NCCNc2ccc(-c3nnn[n-]3)cn2)n1 ZINC001592579776 1076190689 /nfs/dbraw/zinc/19/06/89/1076190689.db2.gz REUIQDKDOMIOAT-UHFFFAOYSA-N -1 3 384.404 -1.118 20 0 GAADHM Cn1ccc(NC(=O)CNS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)nc1=O ZINC001592580652 1076190808 /nfs/dbraw/zinc/19/08/08/1076190808.db2.gz VMNBCIQVNSALLT-UHFFFAOYSA-N -1 3 390.385 -1.288 20 0 GAADHM Cn1ccc(NC(=O)CNS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)nc1=O ZINC001592580652 1076190805 /nfs/dbraw/zinc/19/08/05/1076190805.db2.gz VMNBCIQVNSALLT-UHFFFAOYSA-N -1 3 390.385 -1.288 20 0 GAADHM Cn1ccc(CNC(=O)C(=O)N2CCN(c3ncccc3-c3nn[n-]n3)CC2)n1 ZINC001592580763 1076190704 /nfs/dbraw/zinc/19/07/04/1076190704.db2.gz FFEYPXDTDLJGND-UHFFFAOYSA-N -1 3 396.415 -1.040 20 0 GAADHM Cn1ccc(CNC(=O)C(=O)N2CCN(c3ncccc3-c3nnn[n-]3)CC2)n1 ZINC001592580763 1076190702 /nfs/dbraw/zinc/19/07/02/1076190702.db2.gz FFEYPXDTDLJGND-UHFFFAOYSA-N -1 3 396.415 -1.040 20 0 GAADHM Cn1ccc(CNC(=O)C(=O)N2CCN(c3cc(-c4nn[n-]n4)ccn3)CC2)n1 ZINC001592580884 1076190790 /nfs/dbraw/zinc/19/07/90/1076190790.db2.gz PWVNAQZZOMKPBV-UHFFFAOYSA-N -1 3 396.415 -1.040 20 0 GAADHM Cn1ccc(CNC(=O)C(=O)N2CCN(c3cc(-c4nnn[n-]4)ccn3)CC2)n1 ZINC001592580884 1076190787 /nfs/dbraw/zinc/19/07/87/1076190787.db2.gz PWVNAQZZOMKPBV-UHFFFAOYSA-N -1 3 396.415 -1.040 20 0 GAADHM Cn1ccc(CNC(=O)C(=O)N2CCN(c3ccc(-c4nn[n-]n4)cn3)CC2)n1 ZINC001592581050 1076190831 /nfs/dbraw/zinc/19/08/31/1076190831.db2.gz XTKHWRSEKTWUPM-UHFFFAOYSA-N -1 3 396.415 -1.040 20 0 GAADHM Cn1ccc(CNC(=O)C(=O)N2CCN(c3ccc(-c4nnn[n-]4)cn3)CC2)n1 ZINC001592581050 1076190827 /nfs/dbraw/zinc/19/08/27/1076190827.db2.gz XTKHWRSEKTWUPM-UHFFFAOYSA-N -1 3 396.415 -1.040 20 0 GAADHM Cn1cccc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)[C@@H](O)C2)c1=O ZINC001592581691 1076190819 /nfs/dbraw/zinc/19/08/19/1076190819.db2.gz BYAJMBJAQILKLT-OLZOCXBDSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1cccc(C(=O)N2C[C@@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)[C@@H](O)C2)c1=O ZINC001592581691 1076190817 /nfs/dbraw/zinc/19/08/17/1076190817.db2.gz BYAJMBJAQILKLT-OLZOCXBDSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1cccc(C(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]2O)c1=O ZINC001592581692 1076190773 /nfs/dbraw/zinc/19/07/73/1076190773.db2.gz BZUBXIXHZKLSTL-CHWSQXEVSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cccc(C(=O)N[C@@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]2O)c1=O ZINC001592581692 1076190771 /nfs/dbraw/zinc/19/07/71/1076190771.db2.gz BZUBXIXHZKLSTL-CHWSQXEVSA-N -1 3 382.384 -1.060 20 0 GAADHM Cn1cccc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)c1=O ZINC001592581725 1076190726 /nfs/dbraw/zinc/19/07/26/1076190726.db2.gz FZDUQVVWZCXHCL-OLZOCXBDSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1cccc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)c1=O ZINC001592581725 1076190721 /nfs/dbraw/zinc/19/07/21/1076190721.db2.gz FZDUQVVWZCXHCL-OLZOCXBDSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1cccc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]2O)c1=O ZINC001592581860 1076191236 /nfs/dbraw/zinc/19/12/36/1076191236.db2.gz ORHSVHJQDFUOGM-CHWSQXEVSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1cccc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]2O)c1=O ZINC001592581860 1076191230 /nfs/dbraw/zinc/19/12/30/1076191230.db2.gz ORHSVHJQDFUOGM-CHWSQXEVSA-N -1 3 398.383 -1.491 20 0 GAADHM Cn1ccnc1CCC(=O)N1C[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001592584511 1076191291 /nfs/dbraw/zinc/19/12/91/1076191291.db2.gz ADHUGUFJIFGRKP-OLZOCXBDSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccnc1CCC(=O)N1C[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001592584511 1076191284 /nfs/dbraw/zinc/19/12/84/1076191284.db2.gz ADHUGUFJIFGRKP-OLZOCXBDSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccnc1CCC(=O)N1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001592584875 1076191195 /nfs/dbraw/zinc/19/11/95/1076191195.db2.gz HNKJAOLCADOUAL-OLZOCXBDSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccnc1CCC(=O)N1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001592584875 1076191189 /nfs/dbraw/zinc/19/11/89/1076191189.db2.gz HNKJAOLCADOUAL-OLZOCXBDSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccnc1CCC(=O)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001592585270 1076191404 /nfs/dbraw/zinc/19/14/04/1076191404.db2.gz YTKVXLRYHOQOGV-CHWSQXEVSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccnc1CCC(=O)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001592585270 1076191403 /nfs/dbraw/zinc/19/14/03/1076191403.db2.gz YTKVXLRYHOQOGV-CHWSQXEVSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1ccnc1COCC(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001592585385 1076191319 /nfs/dbraw/zinc/19/13/19/1076191319.db2.gz GYBDKFYOXMLCGA-OLZOCXBDSA-N -1 3 399.415 -1.122 20 0 GAADHM Cn1ccnc1COCC(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001592585385 1076191313 /nfs/dbraw/zinc/19/13/13/1076191313.db2.gz GYBDKFYOXMLCGA-OLZOCXBDSA-N -1 3 399.415 -1.122 20 0 GAADHM Cn1ccnc1COCC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001592585708 1076191336 /nfs/dbraw/zinc/19/13/36/1076191336.db2.gz PUPJGYWLSWKZGP-OLZOCXBDSA-N -1 3 399.415 -1.122 20 0 GAADHM Cn1ccnc1COCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001592585708 1076191331 /nfs/dbraw/zinc/19/13/31/1076191331.db2.gz PUPJGYWLSWKZGP-OLZOCXBDSA-N -1 3 399.415 -1.122 20 0 GAADHM Cn1cnc(C(=O)NCCOCCCNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)n1 ZINC001592586779 1076191407 /nfs/dbraw/zinc/19/14/07/1076191407.db2.gz MEGCYOUUEVAHLY-UHFFFAOYSA-N -1 3 388.392 -1.110 20 0 GAADHM Cn1cnc(C(=O)NCCOCCCNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)n1 ZINC001592586779 1076191406 /nfs/dbraw/zinc/19/14/06/1076191406.db2.gz MEGCYOUUEVAHLY-UHFFFAOYSA-N -1 3 388.392 -1.110 20 0 GAADHM Cn1cnc(C(=O)N[C@@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]2O)cc1=O ZINC001592586836 1076191378 /nfs/dbraw/zinc/19/13/78/1076191378.db2.gz RTPJDMIPCANORE-VXGBXAGGSA-N -1 3 383.372 -1.665 20 0 GAADHM 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/nfs/dbraw/zinc/19/44/18/1076194418.db2.gz KJZVCTWTVPDDCP-QJPTWQEYSA-N -1 3 399.415 -1.061 20 0 GAADHM Cn1nccc1[C@@H]1C[C@H]1C(=O)N[C@H](CO)CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001592606798 1076194414 /nfs/dbraw/zinc/19/44/14/1076194414.db2.gz KJZVCTWTVPDDCP-QJPTWQEYSA-N -1 3 399.415 -1.061 20 0 GAADHM Cn1nccc1[C@@H]1C[C@H]1C(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001592606961 1076194270 /nfs/dbraw/zinc/19/42/70/1076194270.db2.gz OTCOYSMYCKRWLV-IJLUTSLNSA-N -1 3 399.415 -1.061 20 0 GAADHM Cn1nccc1[C@@H]1C[C@H]1C(=O)N[C@@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001592606961 1076194265 /nfs/dbraw/zinc/19/42/65/1076194265.db2.gz OTCOYSMYCKRWLV-IJLUTSLNSA-N -1 3 399.415 -1.061 20 0 GAADHM Cn1nccc1[C@@H]1C[C@H]1C(=O)N[C@H](CO)CNC(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001592606962 1076194290 /nfs/dbraw/zinc/19/42/90/1076194290.db2.gz OTCOYSMYCKRWLV-QJPTWQEYSA-N -1 3 399.415 -1.061 20 0 GAADHM Cn1nccc1[C@@H]1C[C@H]1C(=O)N[C@H](CO)CNC(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001592606962 1076194285 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/nfs/dbraw/zinc/19/47/75/1076194775.db2.gz OBWJSLVMGYBDBT-UHFFFAOYSA-N -1 3 396.415 -1.040 20 0 GAADHM Cn1nccc1CNC(=O)C(=O)N1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001592607671 1076194769 /nfs/dbraw/zinc/19/47/69/1076194769.db2.gz OBWJSLVMGYBDBT-UHFFFAOYSA-N -1 3 396.415 -1.040 20 0 GAADHM Cn1nccc1COCC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001592607676 1076194727 /nfs/dbraw/zinc/19/47/27/1076194727.db2.gz OPQIKUSSLMWSDD-CABCVRRESA-N -1 3 399.415 -1.122 20 0 GAADHM Cn1nccc1COCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001592607676 1076194718 /nfs/dbraw/zinc/19/47/18/1076194718.db2.gz OPQIKUSSLMWSDD-CABCVRRESA-N -1 3 399.415 -1.122 20 0 GAADHM Cn1nccc1CCC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O ZINC001592607766 1076194996 /nfs/dbraw/zinc/19/49/96/1076194996.db2.gz NAPHEOKFFKFMGJ-KGLIPLIRSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1nccc1CCC(=O)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O ZINC001592607766 1076194992 /nfs/dbraw/zinc/19/49/92/1076194992.db2.gz NAPHEOKFFKFMGJ-KGLIPLIRSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1nccc1CCC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O ZINC001592607783 1076194793 /nfs/dbraw/zinc/19/47/93/1076194793.db2.gz NVJSCDCVHSUDLD-KGLIPLIRSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1nccc1CCC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O ZINC001592607783 1076194788 /nfs/dbraw/zinc/19/47/88/1076194788.db2.gz NVJSCDCVHSUDLD-KGLIPLIRSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1nccc1CCC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O ZINC001592607784 1076194688 /nfs/dbraw/zinc/19/46/88/1076194688.db2.gz NVJSCDCVHSUDLD-ZIAGYGMSSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1nccc1CCC(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O ZINC001592607784 1076194684 /nfs/dbraw/zinc/19/46/84/1076194684.db2.gz NVJSCDCVHSUDLD-ZIAGYGMSSA-N -1 3 399.415 -1.137 20 0 GAADHM Cn1nnc(C(=O)N2CC3(C2)CCN(C(=O)c2c[nH]c(-c4nn[n-]n4)c2)C3)n1 ZINC001592608179 1076194908 /nfs/dbraw/zinc/19/49/08/1076194908.db2.gz MOROSCBLJUQBGZ-UHFFFAOYSA-N -1 3 383.376 -1.293 20 0 GAADHM Cn1nnc(C(=O)N2CC3(C2)CCN(C(=O)c2c[nH]c(-c4nnn[n-]4)c2)C3)n1 ZINC001592608179 1076194904 /nfs/dbraw/zinc/19/49/04/1076194904.db2.gz MOROSCBLJUQBGZ-UHFFFAOYSA-N -1 3 383.376 -1.293 20 0 GAADHM Cn1nnc(C(=O)N2CC=C(CNC(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)n1 ZINC001592608319 1076194880 /nfs/dbraw/zinc/19/48/80/1076194880.db2.gz YVRMHNXZHHRSIS-UHFFFAOYSA-N -1 3 383.376 -1.079 20 0 GAADHM Cn1nnc(C(=O)N2CC=C(CNC(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)n1 ZINC001592608319 1076194874 /nfs/dbraw/zinc/19/48/74/1076194874.db2.gz YVRMHNXZHHRSIS-UHFFFAOYSA-N -1 3 383.376 -1.079 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H]3CN(C(=O)c4c[nH]c(-c5nn[n-]n5)c4)C[C@]3(C)C2)n1 ZINC001592608358 1076194818 /nfs/dbraw/zinc/19/48/18/1076194818.db2.gz CZTOBNSTECTFJQ-MGPLVRAMSA-N -1 3 397.403 -1.047 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H]3CN(C(=O)c4c[nH]c(-c5nnn[n-]5)c4)C[C@]3(C)C2)n1 ZINC001592608358 1076194809 /nfs/dbraw/zinc/19/48/09/1076194809.db2.gz CZTOBNSTECTFJQ-MGPLVRAMSA-N -1 3 397.403 -1.047 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H]3CCN(C(=O)c4cc(-c5nn[n-]n5)c[nH]4)C[C@H]3C2)n1 ZINC001592608374 1076194956 /nfs/dbraw/zinc/19/49/56/1076194956.db2.gz HEZLZXIXUXGONA-KOLCDFICSA-N -1 3 397.403 -1.047 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H]3CCN(C(=O)c4cc(-c5nnn[n-]5)c[nH]4)C[C@H]3C2)n1 ZINC001592608374 1076194953 /nfs/dbraw/zinc/19/49/53/1076194953.db2.gz HEZLZXIXUXGONA-KOLCDFICSA-N -1 3 397.403 -1.047 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H]3CN(C(=O)c4ccc(-c5nn[n-]n5)[nH]4)C[C@@]3(C)C2)n1 ZINC001592608390 1076194894 /nfs/dbraw/zinc/19/48/94/1076194894.db2.gz ISGNKQCRYRIVPW-ABKXIKBNSA-N -1 3 397.403 -1.047 20 0 GAADHM Cn1nnc(C(=O)N2C[C@H]3CN(C(=O)c4ccc(-c5nnn[n-]5)[nH]4)C[C@@]3(C)C2)n1 ZINC001592608390 1076194891 /nfs/dbraw/zinc/19/48/91/1076194891.db2.gz ISGNKQCRYRIVPW-ABKXIKBNSA-N -1 3 397.403 -1.047 20 0 GAADHM Cn1nnc(C(=O)NC[C@H]2CN(c3ncccc3-c3nn[n-]n3)CCCO2)n1 ZINC001592608447 1076194750 /nfs/dbraw/zinc/19/47/50/1076194750.db2.gz QTKAWOSHZIMWLK-JTQLQIEISA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)NC[C@H]2CN(c3ncccc3-c3nnn[n-]3)CCCO2)n1 ZINC001592608447 1076194740 /nfs/dbraw/zinc/19/47/40/1076194740.db2.gz QTKAWOSHZIMWLK-JTQLQIEISA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)NC[C@@H]2CN(c3ncccc3-c3nn[n-]n3)CCCO2)n1 ZINC001592608448 1076194861 /nfs/dbraw/zinc/19/48/61/1076194861.db2.gz QTKAWOSHZIMWLK-SNVBAGLBSA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)NC[C@@H]2CN(c3ncccc3-c3nnn[n-]3)CCCO2)n1 ZINC001592608448 1076194856 /nfs/dbraw/zinc/19/48/56/1076194856.db2.gz QTKAWOSHZIMWLK-SNVBAGLBSA-N -1 3 385.392 -1.190 20 0 GAADHM Cn1nnc(C(=O)N2CC[C@@H]3CN(C(=O)c4ccc(-c5nn[n-]n5)[nH]4)C[C@@H]3C2)n1 ZINC001592608464 1076194919 /nfs/dbraw/zinc/19/49/19/1076194919.db2.gz UFJNXHCXEIHGMK-ZJUUUORDSA-N -1 3 397.403 -1.047 20 0 GAADHM Cn1nnc(C(=O)N2CC[C@@H]3CN(C(=O)c4ccc(-c5nnn[n-]5)[nH]4)C[C@@H]3C2)n1 ZINC001592608464 1076194915 /nfs/dbraw/zinc/19/49/15/1076194915.db2.gz UFJNXHCXEIHGMK-ZJUUUORDSA-N -1 3 397.403 -1.047 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2(C)C)n1 ZINC001592608468 1076194708 /nfs/dbraw/zinc/19/47/08/1076194708.db2.gz UXAKCFKEPISQHK-JTQLQIEISA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2(C)C)n1 ZINC001592608468 1076194703 /nfs/dbraw/zinc/19/47/03/1076194703.db2.gz UXAKCFKEPISQHK-JTQLQIEISA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2(C)C)n1 ZINC001592608469 1076194984 /nfs/dbraw/zinc/19/49/84/1076194984.db2.gz UXAKCFKEPISQHK-SNVBAGLBSA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2(C)C)n1 ZINC001592608469 1076194980 /nfs/dbraw/zinc/19/49/80/1076194980.db2.gz UXAKCFKEPISQHK-SNVBAGLBSA-N -1 3 385.392 -1.001 20 0 GAADHM Cn1nnc(C(=O)NCC2=CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)n1 ZINC001592608482 1076195251 /nfs/dbraw/zinc/19/52/51/1076195251.db2.gz VYJPWCUNCNDGQK-UHFFFAOYSA-N -1 3 383.376 -1.079 20 0 GAADHM Cn1nnc(C(=O)NCC2=CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)n1 ZINC001592608482 1076195248 /nfs/dbraw/zinc/19/52/48/1076195248.db2.gz VYJPWCUNCNDGQK-UHFFFAOYSA-N -1 3 383.376 -1.079 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H]3CN(C(=O)c4cc(-c5nn[n-]n5)c[nH]4)C[C@]3(C)C2)n1 ZINC001592608492 1076195320 /nfs/dbraw/zinc/19/53/20/1076195320.db2.gz XILULSFZRXCNLB-MGPLVRAMSA-N -1 3 397.403 -1.047 20 0 GAADHM Cn1nnc(C(=O)N2C[C@@H]3CN(C(=O)c4cc(-c5nnn[n-]5)c[nH]4)C[C@]3(C)C2)n1 ZINC001592608492 1076195317 /nfs/dbraw/zinc/19/53/17/1076195317.db2.gz XILULSFZRXCNLB-MGPLVRAMSA-N -1 3 397.403 -1.047 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2CCN(c3cccc(F)c3-c3nn[n-]n3)C[C@H]2O)n1 ZINC001592608496 1076195195 /nfs/dbraw/zinc/19/51/95/1076195195.db2.gz YFLZPJXHQKEUBR-GXSJLCMTSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2CCN(c3cccc(F)c3-c3nnn[n-]3)C[C@H]2O)n1 ZINC001592608496 1076195194 /nfs/dbraw/zinc/19/51/94/1076195194.db2.gz YFLZPJXHQKEUBR-GXSJLCMTSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CCN(c3cccc(F)c3-c3nn[n-]n3)C[C@@H]2O)n1 ZINC001592608497 1076195328 /nfs/dbraw/zinc/19/53/28/1076195328.db2.gz YFLZPJXHQKEUBR-KOLCDFICSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CCN(c3cccc(F)c3-c3nnn[n-]3)C[C@@H]2O)n1 ZINC001592608497 1076195325 /nfs/dbraw/zinc/19/53/25/1076195325.db2.gz YFLZPJXHQKEUBR-KOLCDFICSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CCN(c3cccc(F)c3-c3nn[n-]n3)C[C@H]2O)n1 ZINC001592608498 1076195300 /nfs/dbraw/zinc/19/53/00/1076195300.db2.gz YFLZPJXHQKEUBR-MWLCHTKSSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CCN(c3cccc(F)c3-c3nnn[n-]3)C[C@H]2O)n1 ZINC001592608498 1076195299 /nfs/dbraw/zinc/19/52/99/1076195299.db2.gz YFLZPJXHQKEUBR-MWLCHTKSSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2CCN(c3cccc(F)c3-c3nn[n-]n3)C[C@@H]2O)n1 ZINC001592608499 1076195222 /nfs/dbraw/zinc/19/52/22/1076195222.db2.gz YFLZPJXHQKEUBR-ONGXEEELSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1nnc(C(=O)N[C@H]2CCN(c3cccc(F)c3-c3nnn[n-]3)C[C@@H]2O)n1 ZINC001592608499 1076195219 /nfs/dbraw/zinc/19/52/19/1076195219.db2.gz YFLZPJXHQKEUBR-ONGXEEELSA-N -1 3 388.367 -1.101 20 0 GAADHM Cn1nnc(CNC[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)CCCO2)n1 ZINC001592608864 1076195209 /nfs/dbraw/zinc/19/52/09/1076195209.db2.gz NIRUUXKBPASFSO-LLVKDONJSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CNC[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)CCCO2)n1 ZINC001592608864 1076195206 /nfs/dbraw/zinc/19/52/06/1076195206.db2.gz NIRUUXKBPASFSO-LLVKDONJSA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CNC[C@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)CCCO2)n1 ZINC001592608867 1076195180 /nfs/dbraw/zinc/19/51/80/1076195180.db2.gz NIRUUXKBPASFSO-NSHDSACASA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CNC[C@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)CCCO2)n1 ZINC001592608867 1076195179 /nfs/dbraw/zinc/19/51/79/1076195179.db2.gz NIRUUXKBPASFSO-NSHDSACASA-N -1 3 387.408 -1.261 20 0 GAADHM Cn1nnc(CNC(=O)N[C@@H]2CCN(Cc3ccc(-c4nn[n-]n4)cc3)C2=O)n1 ZINC001592608897 1076195243 /nfs/dbraw/zinc/19/52/43/1076195243.db2.gz OIVADOFNMKIJKS-GFCCVEGCSA-N -1 3 397.403 -1.010 20 0 GAADHM Cn1nnc(CNC(=O)N[C@@H]2CCN(Cc3ccc(-c4nnn[n-]4)cc3)C2=O)n1 ZINC001592608897 1076195242 /nfs/dbraw/zinc/19/52/42/1076195242.db2.gz OIVADOFNMKIJKS-GFCCVEGCSA-N -1 3 397.403 -1.010 20 0 GAADHM Cn1nnc(CNC(=O)N[C@H]2CCN(Cc3ccc(-c4nn[n-]n4)cc3)C2=O)n1 ZINC001592608900 1076195294 /nfs/dbraw/zinc/19/52/94/1076195294.db2.gz OIVADOFNMKIJKS-LBPRGKRZSA-N -1 3 397.403 -1.010 20 0 GAADHM Cn1nnc(CNC(=O)N[C@H]2CCN(Cc3ccc(-c4nnn[n-]4)cc3)C2=O)n1 ZINC001592608900 1076195293 /nfs/dbraw/zinc/19/52/93/1076195293.db2.gz OIVADOFNMKIJKS-LBPRGKRZSA-N -1 3 397.403 -1.010 20 0 GAADHM Cn1nnc(CNC(=O)C(=O)N2CCO[C@@H](c3cccc(-c4nn[n-]n4)c3)C2)n1 ZINC001592608932 1076195189 /nfs/dbraw/zinc/19/51/89/1076195189.db2.gz OQVUXRRPDQJRGZ-GFCCVEGCSA-N -1 3 398.387 -1.394 20 0 GAADHM Cn1nnc(CNC(=O)C(=O)N2CCO[C@@H](c3cccc(-c4nnn[n-]4)c3)C2)n1 ZINC001592608932 1076195187 /nfs/dbraw/zinc/19/51/87/1076195187.db2.gz OQVUXRRPDQJRGZ-GFCCVEGCSA-N -1 3 398.387 -1.394 20 0 GAADHM Cn1nnc(CNC(=O)C(=O)N2CCO[C@H](c3cccc(-c4nn[n-]n4)c3)C2)n1 ZINC001592608934 1076195202 /nfs/dbraw/zinc/19/52/02/1076195202.db2.gz OQVUXRRPDQJRGZ-LBPRGKRZSA-N -1 3 398.387 -1.394 20 0 GAADHM Cn1nnc(CNC(=O)C(=O)N2CCO[C@H](c3cccc(-c4nnn[n-]4)c3)C2)n1 ZINC001592608934 1076195200 /nfs/dbraw/zinc/19/52/00/1076195200.db2.gz OQVUXRRPDQJRGZ-LBPRGKRZSA-N -1 3 398.387 -1.394 20 0 GAADHM Cn1nnc(CN2CCN(S(=O)(=O)c3ccc(-c4nn[n-]n4)cc3)CC2)n1 ZINC001592608959 1076195273 /nfs/dbraw/zinc/19/52/73/1076195273.db2.gz PSRWBZONTDJRFX-UHFFFAOYSA-N -1 3 390.433 -1.103 20 0 GAADHM Cn1nnc(CN2CCN(S(=O)(=O)c3ccc(-c4nnn[n-]4)cc3)CC2)n1 ZINC001592608959 1076195270 /nfs/dbraw/zinc/19/52/70/1076195270.db2.gz PSRWBZONTDJRFX-UHFFFAOYSA-N -1 3 390.433 -1.103 20 0 GAADHM Cn1nnc(CNC(=O)C(=O)N2CCN(c3ccc(-c4nn[n-]n4)cn3)CC2)n1 ZINC001592608969 1076195236 /nfs/dbraw/zinc/19/52/36/1076195236.db2.gz PUZNCJLGLITVGM-UHFFFAOYSA-N -1 3 398.391 -2.250 20 0 GAADHM Cn1nnc(CNC(=O)C(=O)N2CCN(c3ccc(-c4nnn[n-]4)cn3)CC2)n1 ZINC001592608969 1076195234 /nfs/dbraw/zinc/19/52/34/1076195234.db2.gz PUZNCJLGLITVGM-UHFFFAOYSA-N -1 3 398.391 -2.250 20 0 GAADHM Cn1nnc(CNC(=O)C(=O)N2CCN(c3ccccc3-c3nn[n-]n3)CC2)n1 ZINC001592609031 1076195230 /nfs/dbraw/zinc/19/52/30/1076195230.db2.gz TUKYJXSZXBOGFH-UHFFFAOYSA-N -1 3 397.403 -1.645 20 0 GAADHM Cn1nnc(CNC(=O)C(=O)N2CCN(c3ccccc3-c3nnn[n-]3)CC2)n1 ZINC001592609031 1076195228 /nfs/dbraw/zinc/19/52/28/1076195228.db2.gz TUKYJXSZXBOGFH-UHFFFAOYSA-N -1 3 397.403 -1.645 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(Cc3ccc(-c4nn[n-]n4)c(F)c3)C[C@H]2O)n1 ZINC001592609174 1076195287 /nfs/dbraw/zinc/19/52/87/1076195287.db2.gz YOXMYBLUTAMMDI-VXGBXAGGSA-N -1 3 388.367 -1.496 20 0 GAADHM Cn1nnc(C(=O)N[C@@H]2CN(Cc3ccc(-c4nnn[n-]4)c(F)c3)C[C@H]2O)n1 ZINC001592609174 1076195286 /nfs/dbraw/zinc/19/52/86/1076195286.db2.gz YOXMYBLUTAMMDI-VXGBXAGGSA-N -1 3 388.367 -1.496 20 0 GAADHM Cn1nnc(COC(=O)CNS(=O)(=O)c2cccc(-c3nn[n-]n3)c2)n1 ZINC001592609475 1076195266 /nfs/dbraw/zinc/19/52/66/1076195266.db2.gz YXXQNZJVYZRXQD-UHFFFAOYSA-N -1 3 379.362 -1.588 20 0 GAADHM Cn1nnc(COC(=O)CNS(=O)(=O)c2cccc(-c3nnn[n-]3)c2)n1 ZINC001592609475 1076195263 /nfs/dbraw/zinc/19/52/63/1076195263.db2.gz YXXQNZJVYZRXQD-UHFFFAOYSA-N -1 3 379.362 -1.588 20 0 GAADHM Cn1nncc1CNC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001592611189 1076195777 /nfs/dbraw/zinc/19/57/77/1076195777.db2.gz DXHLFCZFINDCGX-UHFFFAOYSA-N -1 3 377.390 -1.410 20 0 GAADHM Cn1nncc1CNC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001592611189 1076195771 /nfs/dbraw/zinc/19/57/71/1076195771.db2.gz DXHLFCZFINDCGX-UHFFFAOYSA-N -1 3 377.390 -1.410 20 0 GAADHM Cn1nncc1NC(=O)C(=O)N1CCN(c2cnccc2-c2nn[n-]n2)CC1 ZINC001592611859 1076195800 /nfs/dbraw/zinc/19/58/00/1076195800.db2.gz UYNCCJSGGMBEGB-UHFFFAOYSA-N -1 3 383.376 -1.323 20 0 GAADHM Cn1nncc1NC(=O)C(=O)N1CCN(c2cnccc2-c2nnn[n-]2)CC1 ZINC001592611859 1076195793 /nfs/dbraw/zinc/19/57/93/1076195793.db2.gz UYNCCJSGGMBEGB-UHFFFAOYSA-N -1 3 383.376 -1.323 20 0 GAADHM Cn1nncc1CS(=O)(=O)CCS(=O)(=O)c1ccc(-c2nn[n-]n2)cn1 ZINC001592611878 1076195940 /nfs/dbraw/zinc/19/59/40/1076195940.db2.gz VKIKBFRXNLLWBZ-UHFFFAOYSA-N -1 3 398.430 -1.221 20 0 GAADHM Cn1nncc1CS(=O)(=O)CCS(=O)(=O)c1ccc(-c2nnn[n-]2)cn1 ZINC001592611878 1076195937 /nfs/dbraw/zinc/19/59/37/1076195937.db2.gz VKIKBFRXNLLWBZ-UHFFFAOYSA-N -1 3 398.430 -1.221 20 0 GAADHM Cn1nncc1C(=O)NCCCOCCNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001592612326 1076195682 /nfs/dbraw/zinc/19/56/82/1076195682.db2.gz AXDTXINQNXOTQZ-UHFFFAOYSA-N -1 3 388.392 -1.110 20 0 GAADHM Cn1nncc1C(=O)NCCCOCCNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001592612326 1076195673 /nfs/dbraw/zinc/19/56/73/1076195673.db2.gz AXDTXINQNXOTQZ-UHFFFAOYSA-N -1 3 388.392 -1.110 20 0 GAADHM Cn1nnnc1CN1CCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001592612824 1076195634 /nfs/dbraw/zinc/19/56/34/1076195634.db2.gz RYOKVYRZFBWKME-UHFFFAOYSA-N -1 3 390.433 -1.103 20 0 GAADHM Cn1nnnc1CN1CCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001592612824 1076195629 /nfs/dbraw/zinc/19/56/29/1076195629.db2.gz RYOKVYRZFBWKME-UHFFFAOYSA-N -1 3 390.433 -1.103 20 0 GAADHM Cn1nncc1S(=O)(=O)N1CCN(c2cnccc2-c2nn[n-]n2)CC1 ZINC001592612911 1076195951 /nfs/dbraw/zinc/19/59/51/1076195951.db2.gz DDPZZVUMOSYEIU-UHFFFAOYSA-N -1 3 376.406 -1.099 20 0 GAADHM Cn1nncc1S(=O)(=O)N1CCN(c2cnccc2-c2nnn[n-]2)CC1 ZINC001592612911 1076195947 /nfs/dbraw/zinc/19/59/47/1076195947.db2.gz DDPZZVUMOSYEIU-UHFFFAOYSA-N -1 3 376.406 -1.099 20 0 GAADHM Cn1nnnc1CCNC(=O)N1CCN(c2cnccc2-c2nn[n-]n2)CC1 ZINC001592613302 1076195902 /nfs/dbraw/zinc/19/59/02/1076195902.db2.gz PKSVVLLXRMDWNP-UHFFFAOYSA-N -1 3 384.408 -1.141 20 0 GAADHM Cn1nnnc1CCNC(=O)N1CCN(c2cnccc2-c2nnn[n-]2)CC1 ZINC001592613302 1076195898 /nfs/dbraw/zinc/19/58/98/1076195898.db2.gz PKSVVLLXRMDWNP-UHFFFAOYSA-N -1 3 384.408 -1.141 20 0 GAADHM NC(=O)C(=O)N1CCC(F)(F)[C@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001592711088 1076196735 /nfs/dbraw/zinc/19/67/35/1076196735.db2.gz HYDJJGSIEXRYQB-MRVPVSSYSA-N -1 3 382.331 -1.106 20 0 GAADHM NC(=O)C(=O)N1CCC(F)(F)[C@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001592711088 1076196733 /nfs/dbraw/zinc/19/67/33/1076196733.db2.gz HYDJJGSIEXRYQB-MRVPVSSYSA-N -1 3 382.331 -1.106 20 0 GAADHM NC(=O)C(=O)N1CCC(F)(F)[C@@H](CNC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001592711089 1076196764 /nfs/dbraw/zinc/19/67/64/1076196764.db2.gz HYDJJGSIEXRYQB-QMMMGPOBSA-N -1 3 382.331 -1.106 20 0 GAADHM NC(=O)C(=O)N1CCC(F)(F)[C@@H](CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001592711089 1076196760 /nfs/dbraw/zinc/19/67/60/1076196760.db2.gz HYDJJGSIEXRYQB-QMMMGPOBSA-N -1 3 382.331 -1.106 20 0 GAADHM NC(=O)C(=O)N1CCC(F)(F)[C@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001592711138 1076196658 /nfs/dbraw/zinc/19/66/58/1076196658.db2.gz JZTIOKNBRWRTNW-SSDOTTSWSA-N -1 3 382.331 -1.106 20 0 GAADHM NC(=O)C(=O)N1CCC(F)(F)[C@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001592711138 1076196655 /nfs/dbraw/zinc/19/66/55/1076196655.db2.gz JZTIOKNBRWRTNW-SSDOTTSWSA-N -1 3 382.331 -1.106 20 0 GAADHM NC(=O)C(=O)N1CCC(F)(F)[C@@H](CNC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001592711139 1076196610 /nfs/dbraw/zinc/19/66/10/1076196610.db2.gz JZTIOKNBRWRTNW-ZETCQYMHSA-N -1 3 382.331 -1.106 20 0 GAADHM NC(=O)C(=O)N1CCC(F)(F)[C@@H](CNC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001592711139 1076196608 /nfs/dbraw/zinc/19/66/08/1076196608.db2.gz JZTIOKNBRWRTNW-ZETCQYMHSA-N -1 3 382.331 -1.106 20 0 GAADHM NC(=O)C(=O)N1CCC(N(CCO)c2ncc(-c3nn[n-]n3)cc2F)CC1 ZINC001592711211 1076197195 /nfs/dbraw/zinc/19/71/95/1076197195.db2.gz MFZDBQFEXKZVTI-UHFFFAOYSA-N -1 3 378.368 -1.324 20 0 GAADHM NC(=O)C(=O)N1CCC(N(CCO)c2ncc(-c3nnn[n-]3)cc2F)CC1 ZINC001592711211 1076197194 /nfs/dbraw/zinc/19/71/94/1076197194.db2.gz MFZDBQFEXKZVTI-UHFFFAOYSA-N -1 3 378.368 -1.324 20 0 GAADHM NC(=O)C(=O)N1CC[C@@H](N2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2)C1 ZINC001592711270 1076197147 /nfs/dbraw/zinc/19/71/47/1076197147.db2.gz OKHJMSYTNFZQSU-LLVKDONJSA-N -1 3 387.404 -1.961 20 0 GAADHM NC(=O)C(=O)N1CC[C@@H](N2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2)C1 ZINC001592711270 1076197144 /nfs/dbraw/zinc/19/71/44/1076197144.db2.gz OKHJMSYTNFZQSU-LLVKDONJSA-N -1 3 387.404 -1.961 20 0 GAADHM NC(=O)C(=O)N1CC[C@H](N2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)CC2)C1 ZINC001592711271 1076197186 /nfs/dbraw/zinc/19/71/86/1076197186.db2.gz OKHJMSYTNFZQSU-NSHDSACASA-N -1 3 387.404 -1.961 20 0 GAADHM NC(=O)C(=O)N1CC[C@H](N2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)CC2)C1 ZINC001592711271 1076197183 /nfs/dbraw/zinc/19/71/83/1076197183.db2.gz OKHJMSYTNFZQSU-NSHDSACASA-N -1 3 387.404 -1.961 20 0 GAADHM NC(=O)C(=O)N1CC(n2cc(CNCc3ccc(-c4nn[n-]n4)cc3)nn2)C1 ZINC001592711455 1076197075 /nfs/dbraw/zinc/19/70/75/1076197075.db2.gz RHWNDYVTVCMJJG-UHFFFAOYSA-N -1 3 382.388 -1.383 20 0 GAADHM NC(=O)C(=O)N1CC[C@H](N2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)C1 ZINC001592711654 1076197159 /nfs/dbraw/zinc/19/71/59/1076197159.db2.gz VEMSKOQBSLTBLF-JTQLQIEISA-N -1 3 387.404 -1.961 20 0 GAADHM NC(=O)C(=O)N1CC[C@H](N2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)C1 ZINC001592711654 1076197156 /nfs/dbraw/zinc/19/71/56/1076197156.db2.gz VEMSKOQBSLTBLF-JTQLQIEISA-N -1 3 387.404 -1.961 20 0 GAADHM NC(=O)C(=O)N1CC[C@@H](N2CCN(C(=O)c3ccc(-c4nn[n-]n4)[nH]3)CC2)C1 ZINC001592711655 1076197216 /nfs/dbraw/zinc/19/72/16/1076197216.db2.gz VEMSKOQBSLTBLF-SNVBAGLBSA-N -1 3 387.404 -1.961 20 0 GAADHM NC(=O)C(=O)N1CC[C@@H](N2CCN(C(=O)c3ccc(-c4nnn[n-]4)[nH]3)CC2)C1 ZINC001592711655 1076197212 /nfs/dbraw/zinc/19/72/12/1076197212.db2.gz VEMSKOQBSLTBLF-SNVBAGLBSA-N -1 3 387.404 -1.961 20 0 GAADHM NC(=O)C(=O)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001592711656 1076197227 /nfs/dbraw/zinc/19/72/27/1076197227.db2.gz VITDEUHGRTWWKL-DJFWLOJKSA-N -1 3 384.400 -1.011 20 0 GAADHM NC(=O)C(=O)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001592711656 1076197224 /nfs/dbraw/zinc/19/72/24/1076197224.db2.gz VITDEUHGRTWWKL-DJFWLOJKSA-N -1 3 384.400 -1.011 20 0 GAADHM NC(=O)C(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001592711657 1076197066 /nfs/dbraw/zinc/19/70/66/1076197066.db2.gz VITDEUHGRTWWKL-MGAJZRQESA-N -1 3 384.400 -1.011 20 0 GAADHM NC(=O)C(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001592711657 1076197063 /nfs/dbraw/zinc/19/70/63/1076197063.db2.gz VITDEUHGRTWWKL-MGAJZRQESA-N -1 3 384.400 -1.011 20 0 GAADHM NC(=O)C(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001592711658 1076197135 /nfs/dbraw/zinc/19/71/35/1076197135.db2.gz VITDEUHGRTWWKL-UKKREREHSA-N -1 3 384.400 -1.011 20 0 GAADHM NC(=O)C(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001592711658 1076197133 /nfs/dbraw/zinc/19/71/33/1076197133.db2.gz VITDEUHGRTWWKL-UKKREREHSA-N -1 3 384.400 -1.011 20 0 GAADHM NC(=O)C(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001592711659 1076197167 /nfs/dbraw/zinc/19/71/67/1076197167.db2.gz VITDEUHGRTWWKL-WHIUSJLISA-N -1 3 384.400 -1.011 20 0 GAADHM NC(=O)C(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001592711659 1076197165 /nfs/dbraw/zinc/19/71/65/1076197165.db2.gz VITDEUHGRTWWKL-WHIUSJLISA-N -1 3 384.400 -1.011 20 0 GAADHM NC(=O)C(=O)N1CCC2(CC1)CN(C(=O)c1c[nH]c(-c3nn[n-]n3)c1)CCO2 ZINC001592711766 1076197113 /nfs/dbraw/zinc/19/71/13/1076197113.db2.gz XYQMKLOVOKUJQH-UHFFFAOYSA-N -1 3 388.388 -1.486 20 0 GAADHM NC(=O)C(=O)N1CCC2(CC1)CN(C(=O)c1c[nH]c(-c3nnn[n-]3)c1)CCO2 ZINC001592711766 1076197110 /nfs/dbraw/zinc/19/71/10/1076197110.db2.gz XYQMKLOVOKUJQH-UHFFFAOYSA-N -1 3 388.388 -1.486 20 0 GAADHM NC(=O)C(=O)N1CCC(OC2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)CC1 ZINC001592711825 1076197602 /nfs/dbraw/zinc/19/76/02/1076197602.db2.gz YQWVRCPMDYWULP-UHFFFAOYSA-N -1 3 388.388 -1.488 20 0 GAADHM NC(=O)C(=O)N1CCC(OC2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)CC1 ZINC001592711825 1076197598 /nfs/dbraw/zinc/19/75/98/1076197598.db2.gz YQWVRCPMDYWULP-UHFFFAOYSA-N -1 3 388.388 -1.488 20 0 GAADHM NC(=O)C(=O)NCCCN1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CC1 ZINC001592712310 1076197539 /nfs/dbraw/zinc/19/75/39/1076197539.db2.gz AABVGBAQLINTHN-UHFFFAOYSA-N -1 3 375.393 -2.056 20 0 GAADHM NC(=O)C(=O)NCCN1CCN(c2ncc(-c3nn[n-]n3)cc2Cl)CC1 ZINC001592712697 1076197565 /nfs/dbraw/zinc/19/75/65/1076197565.db2.gz GZEDFLXPIBWSED-UHFFFAOYSA-N -1 3 379.812 -1.361 20 0 GAADHM NC(=O)C(=O)NCCN1CCN(c2ncc(-c3nnn[n-]3)cc2Cl)CC1 ZINC001592712697 1076197560 /nfs/dbraw/zinc/19/75/60/1076197560.db2.gz GZEDFLXPIBWSED-UHFFFAOYSA-N -1 3 379.812 -1.361 20 0 GAADHM NC(=O)C(=O)N[C@@H]1COC2(CN(Cc3ccc(F)c(-c4nn[n-]n4)c3)C2)C1 ZINC001592712973 1076197491 /nfs/dbraw/zinc/19/74/91/1076197491.db2.gz MDLMKSYIBIVQKJ-JTQLQIEISA-N -1 3 375.364 -1.049 20 0 GAADHM NC(=O)C(=O)N[C@@H]1COC2(CN(Cc3ccc(F)c(-c4nnn[n-]4)c3)C2)C1 ZINC001592712973 1076197489 /nfs/dbraw/zinc/19/74/89/1076197489.db2.gz MDLMKSYIBIVQKJ-JTQLQIEISA-N -1 3 375.364 -1.049 20 0 GAADHM NC(=O)C(=O)N[C@H]1COC2(CN(Cc3ccc(F)c(-c4nn[n-]n4)c3)C2)C1 ZINC001592712974 1076197554 /nfs/dbraw/zinc/19/75/54/1076197554.db2.gz MDLMKSYIBIVQKJ-SNVBAGLBSA-N -1 3 375.364 -1.049 20 0 GAADHM NC(=O)C(=O)N[C@H]1COC2(CN(Cc3ccc(F)c(-c4nnn[n-]4)c3)C2)C1 ZINC001592712974 1076197552 /nfs/dbraw/zinc/19/75/52/1076197552.db2.gz MDLMKSYIBIVQKJ-SNVBAGLBSA-N -1 3 375.364 -1.049 20 0 GAADHM NC(=O)C(=O)NCCCCCN1CCN(c2ccnc(-c3nnn[n-]3)n2)CC1 ZINC001592712981 1076197658 /nfs/dbraw/zinc/19/76/58/1076197658.db2.gz MIPLWBXBUUWXMO-UHFFFAOYSA-N -1 3 388.436 -1.450 20 0 GAADHM NC(=O)C(=O)N[C@@H]1COC2(CN(Cc3ccc(-c4nn[n-]n4)c(F)c3)C2)C1 ZINC001592712999 1076197589 /nfs/dbraw/zinc/19/75/89/1076197589.db2.gz MZPVQGHVFPGCLY-JTQLQIEISA-N -1 3 375.364 -1.049 20 0 GAADHM NC(=O)C(=O)N[C@@H]1COC2(CN(Cc3ccc(-c4nnn[n-]4)c(F)c3)C2)C1 ZINC001592712999 1076197586 /nfs/dbraw/zinc/19/75/86/1076197586.db2.gz MZPVQGHVFPGCLY-JTQLQIEISA-N -1 3 375.364 -1.049 20 0 GAADHM NC(=O)C(=O)N[C@H]1COC2(CN(Cc3ccc(-c4nn[n-]n4)c(F)c3)C2)C1 ZINC001592713000 1076197669 /nfs/dbraw/zinc/19/76/69/1076197669.db2.gz MZPVQGHVFPGCLY-SNVBAGLBSA-N -1 3 375.364 -1.049 20 0 GAADHM NC(=O)C(=O)N[C@H]1COC2(CN(Cc3ccc(-c4nnn[n-]4)c(F)c3)C2)C1 ZINC001592713000 1076197667 /nfs/dbraw/zinc/19/76/67/1076197667.db2.gz MZPVQGHVFPGCLY-SNVBAGLBSA-N -1 3 375.364 -1.049 20 0 GAADHM NC(=O)C(=O)NCCN1CCN(Cc2cc(-c3nn[n-]n3)ccc2F)CC1 ZINC001592713300 1076197630 /nfs/dbraw/zinc/19/76/30/1076197630.db2.gz QZPSSPDFPWFVGR-UHFFFAOYSA-N -1 3 376.396 -1.275 20 0 GAADHM NC(=O)C(=O)NCCCN1CCN(c2ncc(-c3nn[n-]n3)cc2F)CC1 ZINC001592713374 1076197646 /nfs/dbraw/zinc/19/76/46/1076197646.db2.gz UCYYIFRHGMAKPE-UHFFFAOYSA-N -1 3 377.384 -1.486 20 0 GAADHM NC(=O)C(=O)NCCCN1CCN(c2ncc(-c3nnn[n-]3)cc2F)CC1 ZINC001592713374 1076197643 /nfs/dbraw/zinc/19/76/43/1076197643.db2.gz UCYYIFRHGMAKPE-UHFFFAOYSA-N -1 3 377.384 -1.486 20 0 GAADHM NC(=O)C(=O)N[C@H]1COC2(CN(Cc3cc(F)ccc3-c3nn[n-]n3)C2)C1 ZINC001592713421 1076198164 /nfs/dbraw/zinc/19/81/64/1076198164.db2.gz VOTQOHICZMLMCG-LLVKDONJSA-N -1 3 375.364 -1.049 20 0 GAADHM NC(=O)C(=O)N[C@H]1COC2(CN(Cc3cc(F)ccc3-c3nnn[n-]3)C2)C1 ZINC001592713421 1076198162 /nfs/dbraw/zinc/19/81/62/1076198162.db2.gz VOTQOHICZMLMCG-LLVKDONJSA-N -1 3 375.364 -1.049 20 0 GAADHM NC(=O)C(=O)N[C@@H]1COC2(CN(Cc3cc(F)ccc3-c3nn[n-]n3)C2)C1 ZINC001592713422 1076198103 /nfs/dbraw/zinc/19/81/03/1076198103.db2.gz VOTQOHICZMLMCG-NSHDSACASA-N -1 3 375.364 -1.049 20 0 GAADHM NC(=O)C(=O)N[C@@H]1COC2(CN(Cc3cc(F)ccc3-c3nnn[n-]3)C2)C1 ZINC001592713422 1076198100 /nfs/dbraw/zinc/19/81/00/1076198100.db2.gz VOTQOHICZMLMCG-NSHDSACASA-N -1 3 375.364 -1.049 20 0 GAADHM NC(=O)C(=O)NCCCN1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CC1 ZINC001592713592 1076198185 /nfs/dbraw/zinc/19/81/85/1076198185.db2.gz ZRVNKUFBLOCPLE-UHFFFAOYSA-N -1 3 375.393 -2.056 20 0 GAADHM NC(=O)C(=O)NCCCN1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CC1 ZINC001592713592 1076198183 /nfs/dbraw/zinc/19/81/83/1076198183.db2.gz ZRVNKUFBLOCPLE-UHFFFAOYSA-N -1 3 375.393 -2.056 20 0 GAADHM NC(=O)C(=O)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1C(F)(F)F ZINC001592713638 1076198063 /nfs/dbraw/zinc/19/80/63/1076198063.db2.gz BWDINYXHJHVCEW-HTRCEHHLSA-N -1 3 386.294 -1.201 20 0 GAADHM NC(=O)C(=O)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1C(F)(F)F ZINC001592713638 1076198056 /nfs/dbraw/zinc/19/80/56/1076198056.db2.gz BWDINYXHJHVCEW-HTRCEHHLSA-N -1 3 386.294 -1.201 20 0 GAADHM NC(=O)C(=O)NC1(CO)CCN(Cc2ccc(-c3nnn[n-]3)c(F)c2)CC1 ZINC001592713702 1076198177 /nfs/dbraw/zinc/19/81/77/1076198177.db2.gz ABDVUEHFJCZMIX-UHFFFAOYSA-N -1 3 377.380 -1.066 20 0 GAADHM NC(=O)C(=O)N[C@@H]1CC(=O)N(C2CN(Cc3ccc(-c4nn[n-]n4)cc3)C2)C1 ZINC001592713722 1076198197 /nfs/dbraw/zinc/19/81/97/1076198197.db2.gz AOFIMZLXMFTXNF-GFCCVEGCSA-N -1 3 384.400 -1.747 20 0 GAADHM NC(=O)C(=O)N[C@@H]1CC(=O)N(C2CN(Cc3ccc(-c4nnn[n-]4)cc3)C2)C1 ZINC001592713722 1076198194 /nfs/dbraw/zinc/19/81/94/1076198194.db2.gz AOFIMZLXMFTXNF-GFCCVEGCSA-N -1 3 384.400 -1.747 20 0 GAADHM NC(=O)C(=O)N[C@H]1CC(=O)N(C2CN(Cc3ccc(-c4nn[n-]n4)cc3)C2)C1 ZINC001592713723 1076198171 /nfs/dbraw/zinc/19/81/71/1076198171.db2.gz AOFIMZLXMFTXNF-LBPRGKRZSA-N -1 3 384.400 -1.747 20 0 GAADHM NC(=O)C(=O)N[C@H]1CC(=O)N(C2CN(Cc3ccc(-c4nnn[n-]4)cc3)C2)C1 ZINC001592713723 1076198170 /nfs/dbraw/zinc/19/81/70/1076198170.db2.gz AOFIMZLXMFTXNF-LBPRGKRZSA-N -1 3 384.400 -1.747 20 0 GAADHM NC(=O)C(=O)N[C@@]1(CO)CCCN(Cc2ccc(-c3nn[n-]n3)cc2F)C1 ZINC001592713732 1076198093 /nfs/dbraw/zinc/19/80/93/1076198093.db2.gz AYNKSIYHQCTKBO-INIZCTEOSA-N -1 3 377.380 -1.066 20 0 GAADHM NC(=O)C(=O)N[C@@]1(CO)CCCN(Cc2ccc(-c3nnn[n-]3)cc2F)C1 ZINC001592713732 1076198091 /nfs/dbraw/zinc/19/80/91/1076198091.db2.gz AYNKSIYHQCTKBO-INIZCTEOSA-N -1 3 377.380 -1.066 20 0 GAADHM NC(=O)C(=O)N[C@]1(CO)CCCN(Cc2ccc(-c3nn[n-]n3)cc2F)C1 ZINC001592713733 1076198149 /nfs/dbraw/zinc/19/81/49/1076198149.db2.gz AYNKSIYHQCTKBO-MRXNPFEDSA-N -1 3 377.380 -1.066 20 0 GAADHM NC(=O)C(=O)N[C@]1(CO)CCCN(Cc2ccc(-c3nnn[n-]3)cc2F)C1 ZINC001592713733 1076198144 /nfs/dbraw/zinc/19/81/44/1076198144.db2.gz AYNKSIYHQCTKBO-MRXNPFEDSA-N -1 3 377.380 -1.066 20 0 GAADHM NC(=O)C(=O)N1CCN(c2ccc(-c3nn[n-]n3)nc2)[C@H]2CS(=O)(=O)C[C@H]21 ZINC001592713957 1076198204 /nfs/dbraw/zinc/19/82/04/1076198204.db2.gz DKWOVRCRFGHWCZ-WDEREUQCSA-N -1 3 392.401 -2.439 20 0 GAADHM NC(=O)C(=O)N1CCN(c2ccc(-c3nnn[n-]3)nc2)[C@H]2CS(=O)(=O)C[C@H]21 ZINC001592713957 1076198203 /nfs/dbraw/zinc/19/82/03/1076198203.db2.gz DKWOVRCRFGHWCZ-WDEREUQCSA-N -1 3 392.401 -2.439 20 0 GAADHM NC(=O)C(=O)NCc1cn(C2CN(Cc3ccccc3-c3nn[n-]n3)C2)nn1 ZINC001592714098 1076198119 /nfs/dbraw/zinc/19/81/19/1076198119.db2.gz JFIGVLVMMCCUQO-UHFFFAOYSA-N -1 3 382.388 -1.383 20 0 GAADHM NC(=O)C(=O)NCc1cn(C2CN(Cc3ccccc3-c3nnn[n-]3)C2)nn1 ZINC001592714098 1076198117 /nfs/dbraw/zinc/19/81/17/1076198117.db2.gz JFIGVLVMMCCUQO-UHFFFAOYSA-N -1 3 382.388 -1.383 20 0 GAADHM NC(=O)C(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1C(F)(F)F ZINC001592714429 1076198544 /nfs/dbraw/zinc/19/85/44/1076198544.db2.gz ORSFGGXCWLGKLL-SVGQVSJJSA-N -1 3 386.294 -1.201 20 0 GAADHM NC(=O)C(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1C(F)(F)F ZINC001592714429 1076198542 /nfs/dbraw/zinc/19/85/42/1076198542.db2.gz ORSFGGXCWLGKLL-SVGQVSJJSA-N -1 3 386.294 -1.201 20 0 GAADHM NC(=O)C(=O)N1CCN(C2CN(Cc3ccc(-c4nn[n-]n4)s3)C2)CC1 ZINC001592714546 1076198437 /nfs/dbraw/zinc/19/84/37/1076198437.db2.gz OGKRZKWMMIMGTI-UHFFFAOYSA-N -1 3 376.446 -1.258 20 0 GAADHM NC(=O)C(=O)N1CCN(C2CN(Cc3ccc(-c4nnn[n-]4)s3)C2)CC1 ZINC001592714546 1076198434 /nfs/dbraw/zinc/19/84/34/1076198434.db2.gz OGKRZKWMMIMGTI-UHFFFAOYSA-N -1 3 376.446 -1.258 20 0 GAADHM NC(=O)C(=O)N[C@@]1(CO)CCCN(Cc2cc(-c3nn[n-]n3)ccc2F)C1 ZINC001592714553 1076198553 /nfs/dbraw/zinc/19/85/53/1076198553.db2.gz ONAVATSLWUNQSY-INIZCTEOSA-N -1 3 377.380 -1.066 20 0 GAADHM NC(=O)C(=O)N[C@]1(CO)CCCN(Cc2cc(-c3nn[n-]n3)ccc2F)C1 ZINC001592714554 1076198477 /nfs/dbraw/zinc/19/84/77/1076198477.db2.gz ONAVATSLWUNQSY-MRXNPFEDSA-N -1 3 377.380 -1.066 20 0 GAADHM NC(=O)C(=O)NC1(CO)CCN(c2ncc(-c3nn[n-]n3)cc2Cl)CC1 ZINC001592714691 1076198531 /nfs/dbraw/zinc/19/85/31/1076198531.db2.gz QYTUJHIPFARHGO-UHFFFAOYSA-N -1 3 380.796 -1.152 20 0 GAADHM NC(=O)C(=O)NC1(CO)CCN(c2ncc(-c3nnn[n-]3)cc2Cl)CC1 ZINC001592714691 1076198529 /nfs/dbraw/zinc/19/85/29/1076198529.db2.gz QYTUJHIPFARHGO-UHFFFAOYSA-N -1 3 380.796 -1.152 20 0 GAADHM NC(=O)C(=O)N1CCOC2(CN(Cc3cc(F)ccc3-c3nn[n-]n3)C2)C1 ZINC001592715239 1076198386 /nfs/dbraw/zinc/19/83/86/1076198386.db2.gz WQENOLMFSGSBJX-UHFFFAOYSA-N -1 3 375.364 -1.096 20 0 GAADHM NC(=O)C(=O)N1CCOC2(CN(Cc3cc(F)ccc3-c3nnn[n-]3)C2)C1 ZINC001592715239 1076198384 /nfs/dbraw/zinc/19/83/84/1076198384.db2.gz WQENOLMFSGSBJX-UHFFFAOYSA-N -1 3 375.364 -1.096 20 0 GAADHM NC(=O)C(=O)N[C@@H]1CC(=O)N(C2CN(Cc3ccc(-c4nnn[n-]4)s3)C2)C1 ZINC001592715496 1076198520 /nfs/dbraw/zinc/19/85/20/1076198520.db2.gz XMFLYDUPXRGVLP-MRVPVSSYSA-N -1 3 390.429 -1.685 20 0 GAADHM NC(=O)C(=O)N[C@H]1CC(=O)N(C2CN(Cc3ccc(-c4nnn[n-]4)s3)C2)C1 ZINC001592715498 1076198537 /nfs/dbraw/zinc/19/85/37/1076198537.db2.gz XMFLYDUPXRGVLP-QMMMGPOBSA-N -1 3 390.429 -1.685 20 0 GAADHM NC(=O)C(=O)N1C[C@@H](C(F)(F)F)[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001592715533 1076198464 /nfs/dbraw/zinc/19/84/64/1076198464.db2.gz XRQBKMMMYPXNNN-HTRCEHHLSA-N -1 3 386.294 -1.201 20 0 GAADHM NC(=O)C(=O)N1C[C@@H](C(F)(F)F)[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001592715533 1076198461 /nfs/dbraw/zinc/19/84/61/1076198461.db2.gz XRQBKMMMYPXNNN-HTRCEHHLSA-N -1 3 386.294 -1.201 20 0 GAADHM NC(=O)C(=O)N1CCOC2(CN(Cc3ccc(F)c(-c4nn[n-]n4)c3)C2)C1 ZINC001592715605 1076198421 /nfs/dbraw/zinc/19/84/21/1076198421.db2.gz YSQSFECNQPENID-UHFFFAOYSA-N -1 3 375.364 -1.096 20 0 GAADHM NC(=O)C(=O)N1CCOC2(CN(Cc3ccc(F)c(-c4nnn[n-]4)c3)C2)C1 ZINC001592715605 1076198416 /nfs/dbraw/zinc/19/84/16/1076198416.db2.gz YSQSFECNQPENID-UHFFFAOYSA-N -1 3 375.364 -1.096 20 0 GAADHM NC(=O)C1(C(=O)N2C[C@@H]3[C@@H](CNC(=O)c4c[nH]c(-c5nn[n-]n5)c4)[C@@H]3C2)CC1 ZINC001592715750 1076198380 /nfs/dbraw/zinc/19/83/80/1076198380.db2.gz CJRBHXGZYXQDEZ-RTCCRHLQSA-N -1 3 384.400 -1.106 20 0 GAADHM NC(=O)C1(C(=O)N2C[C@@H]3[C@@H](CNC(=O)c4c[nH]c(-c5nnn[n-]5)c4)[C@@H]3C2)CC1 ZINC001592715750 1076198379 /nfs/dbraw/zinc/19/83/79/1076198379.db2.gz CJRBHXGZYXQDEZ-RTCCRHLQSA-N -1 3 384.400 -1.106 20 0 GAADHM NC(=O)[C@H](OC(=O)CN1CCS(=O)(=O)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC001592716727 1076198511 /nfs/dbraw/zinc/19/85/11/1076198511.db2.gz LXRFJLBERBOBEE-CYBMUJFWSA-N -1 3 394.413 -1.333 20 0 GAADHM NC(=O)[C@H](OC(=O)CN1CCS(=O)(=O)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC001592716727 1076198510 /nfs/dbraw/zinc/19/85/10/1076198510.db2.gz LXRFJLBERBOBEE-CYBMUJFWSA-N -1 3 394.413 -1.333 20 0 GAADHM NC(=O)[C@@H](OC(=O)CN1CCS(=O)(=O)CC1)c1ccc(-c2nn[n-]n2)cc1 ZINC001592716729 1076199199 /nfs/dbraw/zinc/19/91/99/1076199199.db2.gz LXRFJLBERBOBEE-ZDUSSCGKSA-N -1 3 394.413 -1.333 20 0 GAADHM NC(=O)[C@@H](OC(=O)CN1CCS(=O)(=O)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC001592716729 1076199197 /nfs/dbraw/zinc/19/91/97/1076199197.db2.gz LXRFJLBERBOBEE-ZDUSSCGKSA-N -1 3 394.413 -1.333 20 0 GAADHM NC(=O)C1(C(=O)N[C@@H]2CN(Cc3ccc(-c4nn[n-]n4)cc3F)C[C@@H]2O)CC1 ZINC001592717026 1076199101 /nfs/dbraw/zinc/19/91/01/1076199101.db2.gz AHXUNHDFEDIROK-OLZOCXBDSA-N -1 3 389.391 -1.067 20 0 GAADHM NC(=O)C1(C(=O)N[C@@H]2CN(Cc3ccc(-c4nnn[n-]4)cc3F)C[C@@H]2O)CC1 ZINC001592717026 1076199099 /nfs/dbraw/zinc/19/90/99/1076199099.db2.gz AHXUNHDFEDIROK-OLZOCXBDSA-N -1 3 389.391 -1.067 20 0 GAADHM NC(=O)C1(C(=O)N[C@@H]2CN(Cc3ccc(-c4nn[n-]n4)c(F)c3)C[C@H]2O)CC1 ZINC001592717076 1076199213 /nfs/dbraw/zinc/19/92/13/1076199213.db2.gz BPCBXLLQRMKGAO-CHWSQXEVSA-N -1 3 389.391 -1.067 20 0 GAADHM NC(=O)C1(C(=O)N[C@@H]2CN(Cc3ccc(-c4nnn[n-]4)c(F)c3)C[C@H]2O)CC1 ZINC001592717076 1076199212 /nfs/dbraw/zinc/19/92/12/1076199212.db2.gz BPCBXLLQRMKGAO-CHWSQXEVSA-N -1 3 389.391 -1.067 20 0 GAADHM NC(=O)C1(C(=O)N[C@@H]2CN(Cc3ccc(F)c(-c4nn[n-]n4)c3)C[C@H]2O)CC1 ZINC001592717110 1076199066 /nfs/dbraw/zinc/19/90/66/1076199066.db2.gz FDMOSXUYGXXQFL-CHWSQXEVSA-N -1 3 389.391 -1.067 20 0 GAADHM NC(=O)C1(C(=O)N[C@@H]2CN(Cc3ccc(F)c(-c4nnn[n-]4)c3)C[C@H]2O)CC1 ZINC001592717110 1076199064 /nfs/dbraw/zinc/19/90/64/1076199064.db2.gz FDMOSXUYGXXQFL-CHWSQXEVSA-N -1 3 389.391 -1.067 20 0 GAADHM NC(=O)[C@@H](O)CNC(=O)[C@H]1CC(=O)N(c2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC001592717218 1076199036 /nfs/dbraw/zinc/19/90/36/1076199036.db2.gz UBQMJYQVZROPEB-CPCISQLKSA-N -1 3 393.791 -1.165 20 0 GAADHM NC(=O)[C@@H](O)CNC(=O)[C@H]1CC(=O)N(c2ccc(-c3nnn[n-]3)c(Cl)c2)C1 ZINC001592717218 1076199030 /nfs/dbraw/zinc/19/90/30/1076199030.db2.gz UBQMJYQVZROPEB-CPCISQLKSA-N -1 3 393.791 -1.165 20 0 GAADHM NC(=O)[C@@H](O)CNC(=O)[C@@H]1CC(=O)N(c2ccc(-c3nn[n-]n3)c(Cl)c2)C1 ZINC001592717219 1076199171 /nfs/dbraw/zinc/19/91/71/1076199171.db2.gz UBQMJYQVZROPEB-HQJQHLMTSA-N -1 3 393.791 -1.165 20 0 GAADHM 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NC(=O)C1(C(=O)N[C@@H]2CN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]2O)CC1 ZINC001592717227 1076199050 /nfs/dbraw/zinc/19/90/50/1076199050.db2.gz HPQXKEQATJYVGL-NXEZZACHSA-N -1 3 376.352 -1.668 20 0 GAADHM NC(=O)C1(C(=O)N[C@@H]2CN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]2O)CC1 ZINC001592717227 1076199047 /nfs/dbraw/zinc/19/90/47/1076199047.db2.gz HPQXKEQATJYVGL-NXEZZACHSA-N -1 3 376.352 -1.668 20 0 GAADHM NC(=O)C1(C(=O)N[C@@H]2CN(c3ncc(-c4nn[n-]n4)cc3F)C[C@@H]2O)CC1 ZINC001592717230 1076199163 /nfs/dbraw/zinc/19/91/63/1076199163.db2.gz HPQXKEQATJYVGL-ZJUUUORDSA-N -1 3 376.352 -1.668 20 0 GAADHM NC(=O)C1(C(=O)N[C@@H]2CN(c3ncc(-c4nnn[n-]4)cc3F)C[C@@H]2O)CC1 ZINC001592717230 1076199160 /nfs/dbraw/zinc/19/91/60/1076199160.db2.gz HPQXKEQATJYVGL-ZJUUUORDSA-N -1 3 376.352 -1.668 20 0 GAADHM NC(=O)[C@@]1(NC(=O)[C@H]2CC(=O)N(c3ccc(-c4nn[n-]n4)cc3)C2)CCOC1 ZINC001592717537 1076199135 /nfs/dbraw/zinc/19/91/35/1076199135.db2.gz OGPCTCNVXKNCOT-APPDUMDISA-N -1 3 385.384 -1.020 20 0 GAADHM 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NC(=O)[C@@H]1C[C@@H]1C(=O)N[C@@H]1CN(Cc2ccc(F)c(-c3nn[n-]n3)c2)C[C@@H]1O ZINC001592732311 1076202335 /nfs/dbraw/zinc/20/23/35/1076202335.db2.gz HDKTXGBEQQGNRW-QOBDMFJFSA-N -1 3 389.391 -1.212 20 0 GAADHM NC(=O)[C@@H]1C[C@@H]1C(=O)N[C@@H]1CN(Cc2ccc(F)c(-c3nnn[n-]3)c2)C[C@@H]1O ZINC001592732311 1076202332 /nfs/dbraw/zinc/20/23/32/1076202332.db2.gz HDKTXGBEQQGNRW-QOBDMFJFSA-N -1 3 389.391 -1.212 20 0 GAADHM NC(=O)[C@@H]1CCCN1C(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001592732400 1076202266 /nfs/dbraw/zinc/20/22/66/1076202266.db2.gz GIGICYFBZHTZEN-NSHDSACASA-N -1 3 379.402 -1.379 20 0 GAADHM NC(=O)[C@@H]1CCCN1C(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001592732400 1076202264 /nfs/dbraw/zinc/20/22/64/1076202264.db2.gz GIGICYFBZHTZEN-NSHDSACASA-N -1 3 379.402 -1.379 20 0 GAADHM NC(=O)[C@@H]1CC[C@H](C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]2O)C1 ZINC001592732488 1076202183 /nfs/dbraw/zinc/20/21/83/1076202183.db2.gz DDEOXEZFNNAORM-RDBQEKCUSA-N -1 3 386.416 -1.171 20 0 GAADHM NC(=O)[C@@H]1CC[C@H](C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]2O)C1 ZINC001592732488 1076202177 /nfs/dbraw/zinc/20/21/77/1076202177.db2.gz DDEOXEZFNNAORM-RDBQEKCUSA-N -1 3 386.416 -1.171 20 0 GAADHM NC(=O)[C@@H]1CCCN1CCCNS(=O)(=O)c1ccc(-c2nn[n-]n2)nc1 ZINC001592732738 1076202721 /nfs/dbraw/zinc/20/27/21/1076202721.db2.gz IFYDNKUPSBOQGR-LBPRGKRZSA-N -1 3 380.434 -1.120 20 0 GAADHM NC(=O)[C@@H]1CCCN1CCCNS(=O)(=O)c1ccc(-c2nnn[n-]2)nc1 ZINC001592732738 1076202714 /nfs/dbraw/zinc/20/27/14/1076202714.db2.gz IFYDNKUPSBOQGR-LBPRGKRZSA-N -1 3 380.434 -1.120 20 0 GAADHM NC(=O)[C@@H]1CCCN1C(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001592732783 1076202672 /nfs/dbraw/zinc/20/26/72/1076202672.db2.gz LJKUQOUFNDVMNO-NSHDSACASA-N -1 3 379.402 -1.379 20 0 GAADHM NC(=O)[C@@H]1CCCN1C(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001592732783 1076202667 /nfs/dbraw/zinc/20/26/67/1076202667.db2.gz LJKUQOUFNDVMNO-NSHDSACASA-N -1 3 379.402 -1.379 20 0 GAADHM NC(=O)[C@@H]1CCCN1CCCNS(=O)(=O)c1cccnc1-c1nn[n-]n1 ZINC001592733318 1076202963 /nfs/dbraw/zinc/20/29/63/1076202963.db2.gz TVGKSQLQBVUYGN-JTQLQIEISA-N -1 3 380.434 -1.120 20 0 GAADHM NC(=O)c1ncn(CC(=O)N2CCN(c3ccccc3-c3nn[n-]n3)CC2)n1 ZINC001592738176 1076203356 /nfs/dbraw/zinc/20/33/56/1076203356.db2.gz DCYNZOZBKWFAQB-UHFFFAOYSA-N -1 3 382.388 -1.094 20 0 GAADHM NC(=O)c1ncn(CC(=O)N2CCN(c3ccccc3-c3nnn[n-]3)CC2)n1 ZINC001592738176 1076203352 /nfs/dbraw/zinc/20/33/52/1076203352.db2.gz DCYNZOZBKWFAQB-UHFFFAOYSA-N -1 3 382.388 -1.094 20 0 GAADHM NC(=O)c1ncn(CC(=O)N2CCN(c3cnccc3-c3nn[n-]n3)CC2)n1 ZINC001592738818 1076203482 /nfs/dbraw/zinc/20/34/82/1076203482.db2.gz WUZLUUYYUXPSMG-UHFFFAOYSA-N -1 3 383.376 -1.699 20 0 GAADHM NC(=O)c1ncn(CC(=O)N2CCN(c3cnccc3-c3nnn[n-]3)CC2)n1 ZINC001592738818 1076203478 /nfs/dbraw/zinc/20/34/78/1076203478.db2.gz WUZLUUYYUXPSMG-UHFFFAOYSA-N -1 3 383.376 -1.699 20 0 GAADHM NC(=O)c1ncn(CC(=O)N2CCN(c3cc(-c4nn[n-]n4)ccn3)CC2)n1 ZINC001592738894 1076203432 /nfs/dbraw/zinc/20/34/32/1076203432.db2.gz YGJVNABRFHPOPF-UHFFFAOYSA-N -1 3 383.376 -1.699 20 0 GAADHM NC(=O)c1ncn(CC(=O)N2CCN(c3cc(-c4nnn[n-]4)ccn3)CC2)n1 ZINC001592738894 1076203429 /nfs/dbraw/zinc/20/34/29/1076203429.db2.gz YGJVNABRFHPOPF-UHFFFAOYSA-N -1 3 383.376 -1.699 20 0 GAADHM NCC(F)(F)CNC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001592740156 1076203519 /nfs/dbraw/zinc/20/35/19/1076203519.db2.gz FIHLCPKPCCCUMF-UHFFFAOYSA-N -1 3 375.361 -1.145 20 0 GAADHM NCC(F)(F)CNC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001592740156 1076203515 /nfs/dbraw/zinc/20/35/15/1076203515.db2.gz FIHLCPKPCCCUMF-UHFFFAOYSA-N -1 3 375.361 -1.145 20 0 GAADHM NCC(F)(F)CNC(=O)C(=O)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1 ZINC001592741798 1076203953 /nfs/dbraw/zinc/20/39/53/1076203953.db2.gz QILPYTMADLQMNY-UHFFFAOYSA-N -1 3 395.374 -1.380 20 0 GAADHM NS(=O)(=O)CCN1CCN(C(=O)Nc2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001592746399 1076203801 /nfs/dbraw/zinc/20/38/01/1076203801.db2.gz BBBIKOMGZQIHHP-UHFFFAOYSA-N -1 3 381.422 -1.300 20 0 GAADHM NS(=O)(=O)CCN1CCN(C(=O)Nc2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001592746399 1076203796 /nfs/dbraw/zinc/20/37/96/1076203796.db2.gz BBBIKOMGZQIHHP-UHFFFAOYSA-N -1 3 381.422 -1.300 20 0 GAADHM NS(=O)(=O)CCOCCNS(=O)(=O)c1ccccc1-c1nn[n-]n1 ZINC001592746406 1076203900 /nfs/dbraw/zinc/20/39/00/1076203900.db2.gz BSEBMUGXHKBMGY-UHFFFAOYSA-N -1 3 376.420 -1.550 20 0 GAADHM NS(=O)(=O)CCOCCNS(=O)(=O)c1ccccc1-c1nnn[n-]1 ZINC001592746406 1076203893 /nfs/dbraw/zinc/20/38/93/1076203893.db2.gz BSEBMUGXHKBMGY-UHFFFAOYSA-N -1 3 376.420 -1.550 20 0 GAADHM NS(=O)(=O)CCCNC(=O)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1 ZINC001592746421 1076203970 /nfs/dbraw/zinc/20/39/70/1076203970.db2.gz CNOQRIMRMBEAOT-UHFFFAOYSA-N -1 3 395.449 -1.228 20 0 GAADHM NS(=O)(=O)CCCNC(=O)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1 ZINC001592746421 1076203965 /nfs/dbraw/zinc/20/39/65/1076203965.db2.gz CNOQRIMRMBEAOT-UHFFFAOYSA-N -1 3 395.449 -1.228 20 0 GAADHM NS(=O)(=O)CCOCCNS(=O)(=O)Cc1ccc(-c2nn[n-]n2)cc1 ZINC001592746462 1076203843 /nfs/dbraw/zinc/20/38/43/1076203843.db2.gz GCBBJAMQBSLGQX-UHFFFAOYSA-N -1 3 390.447 -1.409 20 0 GAADHM NS(=O)(=O)CCOCCNS(=O)(=O)Cc1ccc(-c2nnn[n-]2)cc1 ZINC001592746462 1076203838 /nfs/dbraw/zinc/20/38/38/1076203838.db2.gz GCBBJAMQBSLGQX-UHFFFAOYSA-N -1 3 390.447 -1.409 20 0 GAADHM NS(=O)(=O)CCNC(=O)[C@H]1CC(=O)N(c2ccc(-c3nn[n-]n3)cc2)C1 ZINC001592746479 1076203856 /nfs/dbraw/zinc/20/38/56/1076203856.db2.gz GYVBJQHWDGQEHE-JTQLQIEISA-N -1 3 379.402 -1.376 20 0 GAADHM NS(=O)(=O)CCNC(=O)[C@H]1CC(=O)N(c2ccc(-c3nnn[n-]3)cc2)C1 ZINC001592746479 1076203851 /nfs/dbraw/zinc/20/38/51/1076203851.db2.gz GYVBJQHWDGQEHE-JTQLQIEISA-N -1 3 379.402 -1.376 20 0 GAADHM NS(=O)(=O)CCNC(=O)[C@@H]1CC(=O)N(c2ccc(-c3nn[n-]n3)cc2)C1 ZINC001592746480 1076204055 /nfs/dbraw/zinc/20/40/55/1076204055.db2.gz GYVBJQHWDGQEHE-SNVBAGLBSA-N -1 3 379.402 -1.376 20 0 GAADHM NS(=O)(=O)CCNC(=O)[C@@H]1CC(=O)N(c2ccc(-c3nnn[n-]3)cc2)C1 ZINC001592746480 1076204051 /nfs/dbraw/zinc/20/40/51/1076204051.db2.gz GYVBJQHWDGQEHE-SNVBAGLBSA-N -1 3 379.402 -1.376 20 0 GAADHM NS(=O)(=O)CCCNC(=O)N1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001592746536 1076204032 /nfs/dbraw/zinc/20/40/32/1076204032.db2.gz JXNBSOCMZQOVBR-UHFFFAOYSA-N -1 3 395.449 -1.228 20 0 GAADHM NS(=O)(=O)CCCNC(=O)N1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001592746536 1076204028 /nfs/dbraw/zinc/20/40/28/1076204028.db2.gz JXNBSOCMZQOVBR-UHFFFAOYSA-N -1 3 395.449 -1.228 20 0 GAADHM NS(=O)(=O)CCN1CCN(C[C@H](O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001592746564 1076204015 /nfs/dbraw/zinc/20/40/15/1076204015.db2.gz LCCAVCXUWAHXBC-AWEZNQCLSA-N -1 3 381.462 -1.194 20 0 GAADHM NS(=O)(=O)CCN1CCN(C[C@@H](O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001592746565 1076204000 /nfs/dbraw/zinc/20/40/00/1076204000.db2.gz LCCAVCXUWAHXBC-CQSZACIVSA-N -1 3 381.462 -1.194 20 0 GAADHM NS(=O)(=O)CCOCCNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001592746617 1076204365 /nfs/dbraw/zinc/20/43/65/1076204365.db2.gz NPRIWRSRZFFLBN-UHFFFAOYSA-N -1 3 376.420 -1.550 20 0 GAADHM NS(=O)(=O)CCOCCNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001592746617 1076204362 /nfs/dbraw/zinc/20/43/62/1076204362.db2.gz NPRIWRSRZFFLBN-UHFFFAOYSA-N -1 3 376.420 -1.550 20 0 GAADHM NS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)NCCc2ccc(-c3nn[n-]n3)cc2)C1 ZINC001592746863 1076204352 /nfs/dbraw/zinc/20/43/52/1076204352.db2.gz MHMFYWOUKXORJF-GFCCVEGCSA-N -1 3 393.429 -1.585 20 0 GAADHM NS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)NCCc2ccc(-c3nnn[n-]3)cc2)C1 ZINC001592746863 1076204346 /nfs/dbraw/zinc/20/43/46/1076204346.db2.gz MHMFYWOUKXORJF-GFCCVEGCSA-N -1 3 393.429 -1.585 20 0 GAADHM NS(=O)(=O)[C@H]1CCN(C(=O)C(=O)NCCc2ccc(-c3nn[n-]n3)cc2)C1 ZINC001592746864 1076204418 /nfs/dbraw/zinc/20/44/18/1076204418.db2.gz MHMFYWOUKXORJF-LBPRGKRZSA-N -1 3 393.429 -1.585 20 0 GAADHM NS(=O)(=O)[C@H]1CCN(C(=O)C(=O)NCCc2ccc(-c3nnn[n-]3)cc2)C1 ZINC001592746864 1076204410 /nfs/dbraw/zinc/20/44/10/1076204410.db2.gz MHMFYWOUKXORJF-LBPRGKRZSA-N -1 3 393.429 -1.585 20 0 GAADHM NS(=O)(=O)CCOCCNS(=O)(=O)Cc1cccc(-c2nn[n-]n2)c1 ZINC001592746905 1076204445 /nfs/dbraw/zinc/20/44/45/1076204445.db2.gz ULSUPYFXUYZIFK-UHFFFAOYSA-N -1 3 390.447 -1.409 20 0 GAADHM NS(=O)(=O)CCOCCNS(=O)(=O)Cc1cccc(-c2nnn[n-]2)c1 ZINC001592746905 1076204441 /nfs/dbraw/zinc/20/44/41/1076204441.db2.gz ULSUPYFXUYZIFK-UHFFFAOYSA-N -1 3 390.447 -1.409 20 0 GAADHM NS(=O)(=O)CCOCCNS(=O)(=O)c1cc(F)cc(-c2nn[n-]n2)c1 ZINC001592746969 1076204523 /nfs/dbraw/zinc/20/45/23/1076204523.db2.gz YSKGGYZVHFZBNK-UHFFFAOYSA-N -1 3 394.410 -1.411 20 0 GAADHM NS(=O)(=O)CCOCCNS(=O)(=O)c1cc(F)cc(-c2nnn[n-]2)c1 ZINC001592746969 1076204519 /nfs/dbraw/zinc/20/45/19/1076204519.db2.gz YSKGGYZVHFZBNK-UHFFFAOYSA-N -1 3 394.410 -1.411 20 0 GAADHM NS(=O)(=O)CCCNC(=O)C(=O)N1CCc2ccc(-c3nn[n-]n3)cc21 ZINC001592746973 1076204335 /nfs/dbraw/zinc/20/43/35/1076204335.db2.gz YZIXHJIRBBTCLK-UHFFFAOYSA-N -1 3 379.402 -1.449 20 0 GAADHM NS(=O)(=O)CCCNC(=O)C(=O)N1CCc2ccc(-c3nnn[n-]3)cc21 ZINC001592746973 1076204330 /nfs/dbraw/zinc/20/43/30/1076204330.db2.gz YZIXHJIRBBTCLK-UHFFFAOYSA-N -1 3 379.402 -1.449 20 0 GAADHM NS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(-c3nn[n-]n3)cc2)C1 ZINC001592747223 1076204380 /nfs/dbraw/zinc/20/43/80/1076204380.db2.gz WIUFGBYFCZDGQW-LLVKDONJSA-N -1 3 379.402 -1.628 20 0 GAADHM NS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)NCc2ccc(-c3nnn[n-]3)cc2)C1 ZINC001592747223 1076204378 /nfs/dbraw/zinc/20/43/78/1076204378.db2.gz WIUFGBYFCZDGQW-LLVKDONJSA-N -1 3 379.402 -1.628 20 0 GAADHM NS(=O)(=O)[C@H]1CCN(C(=O)C(=O)NCc2ccc(-c3nn[n-]n3)cc2)C1 ZINC001592747224 1076204472 /nfs/dbraw/zinc/20/44/72/1076204472.db2.gz WIUFGBYFCZDGQW-NSHDSACASA-N -1 3 379.402 -1.628 20 0 GAADHM NS(=O)(=O)[C@H]1CCN(C(=O)C(=O)NCc2ccc(-c3nnn[n-]3)cc2)C1 ZINC001592747224 1076204469 /nfs/dbraw/zinc/20/44/69/1076204469.db2.gz WIUFGBYFCZDGQW-NSHDSACASA-N -1 3 379.402 -1.628 20 0 GAADHM NS(=O)(=O)C1(C(=O)OCC(=O)NCc2cccc(-c3nn[n-]n3)c2)CC1 ZINC001592747430 1076204282 /nfs/dbraw/zinc/20/42/82/1076204282.db2.gz MMQGVURXNIXNSF-UHFFFAOYSA-N -1 3 380.386 -1.153 20 0 GAADHM NS(=O)(=O)C1(C(=O)OCC(=O)NCc2cccc(-c3nnn[n-]3)c2)CC1 ZINC001592747430 1076204279 /nfs/dbraw/zinc/20/42/79/1076204279.db2.gz MMQGVURXNIXNSF-UHFFFAOYSA-N -1 3 380.386 -1.153 20 0 GAADHM NS(=O)(=O)C1(C(=O)N2CCN(c3cnccc3-c3nn[n-]n3)CC2)CC1 ZINC001592747527 1076204495 /nfs/dbraw/zinc/20/44/95/1076204495.db2.gz QQQBDERXSARLFG-UHFFFAOYSA-N -1 3 378.418 -1.269 20 0 GAADHM NS(=O)(=O)C1(C(=O)N2CCN(c3cnccc3-c3nnn[n-]3)CC2)CC1 ZINC001592747527 1076204493 /nfs/dbraw/zinc/20/44/93/1076204493.db2.gz QQQBDERXSARLFG-UHFFFAOYSA-N -1 3 378.418 -1.269 20 0 GAADHM NS(=O)(=O)C1(C(=O)OCC(=O)NCc2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001592747590 1076204251 /nfs/dbraw/zinc/20/42/51/1076204251.db2.gz UKCYBGNOXBHKQW-UHFFFAOYSA-N -1 3 380.386 -1.153 20 0 GAADHM NS(=O)(=O)C1(C(=O)OCC(=O)NCc2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001592747590 1076204245 /nfs/dbraw/zinc/20/42/45/1076204245.db2.gz UKCYBGNOXBHKQW-UHFFFAOYSA-N -1 3 380.386 -1.153 20 0 GAADHM NS(=O)(=O)c1cccc(NCCN2CCCS2(=O)=O)c1-c1nn[n-]n1 ZINC001592747711 1076204432 /nfs/dbraw/zinc/20/44/32/1076204432.db2.gz AGXHNTPUBHOETC-UHFFFAOYSA-N -1 3 387.447 -1.039 20 0 GAADHM NS(=O)(=O)c1cccc(NCCN2CCCS2(=O)=O)c1-c1nnn[n-]1 ZINC001592747711 1076204426 /nfs/dbraw/zinc/20/44/26/1076204426.db2.gz AGXHNTPUBHOETC-UHFFFAOYSA-N -1 3 387.447 -1.039 20 0 GAADHM NS(=O)(=O)c1cccc(N2CCN3C(=O)C(=O)NC[C@@H]3C2)c1-c1nn[n-]n1 ZINC001592747931 1076204397 /nfs/dbraw/zinc/20/43/97/1076204397.db2.gz GCZFTHCEINAEPC-MRVPVSSYSA-N -1 3 392.401 -2.339 20 0 GAADHM NS(=O)(=O)c1cccc(N2CCN3C(=O)C(=O)NC[C@@H]3C2)c1-c1nnn[n-]1 ZINC001592747931 1076204393 /nfs/dbraw/zinc/20/43/93/1076204393.db2.gz GCZFTHCEINAEPC-MRVPVSSYSA-N -1 3 392.401 -2.339 20 0 GAADHM NS(=O)(=O)c1cccc(N2CCN3C(=O)C(=O)NC[C@H]3C2)c1-c1nn[n-]n1 ZINC001592747935 1076204461 /nfs/dbraw/zinc/20/44/61/1076204461.db2.gz GCZFTHCEINAEPC-QMMMGPOBSA-N -1 3 392.401 -2.339 20 0 GAADHM NS(=O)(=O)c1cccc(N2CCN3C(=O)C(=O)NC[C@H]3C2)c1-c1nnn[n-]1 ZINC001592747935 1076204457 /nfs/dbraw/zinc/20/44/57/1076204457.db2.gz GCZFTHCEINAEPC-QMMMGPOBSA-N -1 3 392.401 -2.339 20 0 GAADHM NS(=O)(=O)c1cccc(N2CCC(C(=O)NCCO)CC2)c1-c1nn[n-]n1 ZINC001592747983 1076204296 /nfs/dbraw/zinc/20/42/96/1076204296.db2.gz HQXSVYXTHFXVDR-UHFFFAOYSA-N -1 3 395.445 -1.161 20 0 GAADHM NS(=O)(=O)c1cccc(N2CCC(C(=O)NCCO)CC2)c1-c1nnn[n-]1 ZINC001592747983 1076204290 /nfs/dbraw/zinc/20/42/90/1076204290.db2.gz HQXSVYXTHFXVDR-UHFFFAOYSA-N -1 3 395.445 -1.161 20 0 GAADHM NS(=O)(=O)N1CCN(CC(=O)NCc2cccc(-c3nn[n-]n3)c2)CC1 ZINC001592749445 1076204903 /nfs/dbraw/zinc/20/49/03/1076204903.db2.gz DHKGOKMPABAOQC-UHFFFAOYSA-N -1 3 380.434 -1.696 20 0 GAADHM NS(=O)(=O)N1CCN(CC(=O)NCc2cccc(-c3nnn[n-]3)c2)CC1 ZINC001592749445 1076204897 /nfs/dbraw/zinc/20/48/97/1076204897.db2.gz DHKGOKMPABAOQC-UHFFFAOYSA-N -1 3 380.434 -1.696 20 0 GAADHM NS(=O)(=O)NC1CN(C(=O)c2cnc(C(F)(F)F)c(-c3nnn[n-]3)c2)C1 ZINC001592749567 1076204749 /nfs/dbraw/zinc/20/47/49/1076204749.db2.gz GKUANDDIYHXIQL-UHFFFAOYSA-N -1 3 392.323 -1.102 20 0 GAADHM NS(=O)(=O)N1CCN(S(=O)(=O)Cc2csc(-c3nnn[n-]3)c2)CC1 ZINC001592750014 1076204977 /nfs/dbraw/zinc/20/49/77/1076204977.db2.gz IYADMDCOHUQWQX-UHFFFAOYSA-N -1 3 393.476 -1.421 20 0 GAADHM NS(=O)(=O)N1CCN(S(=O)(=O)Cc2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001592750069 1076204967 /nfs/dbraw/zinc/20/49/67/1076204967.db2.gz JHJALEVSEGXUOC-UHFFFAOYSA-N -1 3 387.447 -1.482 20 0 GAADHM NS(=O)(=O)N1CCN(S(=O)(=O)Cc2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001592750069 1076204963 /nfs/dbraw/zinc/20/49/63/1076204963.db2.gz JHJALEVSEGXUOC-UHFFFAOYSA-N -1 3 387.447 -1.482 20 0 GAADHM NS(=O)(=O)N1CCN([C@@H]2CCN(c3ccc(-c4nn[n-]n4)cc3)C2=O)CC1 ZINC001592750508 1076204693 /nfs/dbraw/zinc/20/46/93/1076204693.db2.gz NPPKZUYEAHOMQM-CYBMUJFWSA-N -1 3 392.445 -1.207 20 0 GAADHM NS(=O)(=O)N1CCN([C@@H]2CCN(c3ccc(-c4nnn[n-]4)cc3)C2=O)CC1 ZINC001592750508 1076204691 /nfs/dbraw/zinc/20/46/91/1076204691.db2.gz NPPKZUYEAHOMQM-CYBMUJFWSA-N -1 3 392.445 -1.207 20 0 GAADHM NS(=O)(=O)N1CCN([C@H]2CCN(c3ccc(-c4nn[n-]n4)cc3)C2=O)CC1 ZINC001592750511 1076204926 /nfs/dbraw/zinc/20/49/26/1076204926.db2.gz NPPKZUYEAHOMQM-ZDUSSCGKSA-N -1 3 392.445 -1.207 20 0 GAADHM NS(=O)(=O)N1CCN([C@H]2CCN(c3ccc(-c4nnn[n-]4)cc3)C2=O)CC1 ZINC001592750511 1076204922 /nfs/dbraw/zinc/20/49/22/1076204922.db2.gz NPPKZUYEAHOMQM-ZDUSSCGKSA-N -1 3 392.445 -1.207 20 0 GAADHM NS(=O)(=O)NC1CCN(S(=O)(=O)c2ccccc2-c2nn[n-]n2)CC1 ZINC001592750561 1076204841 /nfs/dbraw/zinc/20/48/41/1076204841.db2.gz OUUJHAYJYNTNCF-UHFFFAOYSA-N -1 3 387.447 -1.187 20 0 GAADHM NS(=O)(=O)NC1CCN(S(=O)(=O)c2ccccc2-c2nnn[n-]2)CC1 ZINC001592750561 1076204839 /nfs/dbraw/zinc/20/48/39/1076204839.db2.gz OUUJHAYJYNTNCF-UHFFFAOYSA-N -1 3 387.447 -1.187 20 0 GAADHM NS(=O)(=O)N1CCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)c(F)c2)CC1 ZINC001592750898 1076204887 /nfs/dbraw/zinc/20/48/87/1076204887.db2.gz UPGBYYMIXPJUMP-UHFFFAOYSA-N -1 3 391.410 -1.484 20 0 GAADHM NS(=O)(=O)c1ccc(N2CCC(C(=O)NCCO)CC2)c(-c2nn[n-]n2)c1 ZINC001592751478 1076204986 /nfs/dbraw/zinc/20/49/86/1076204986.db2.gz CPCVNOVRZAKKPB-UHFFFAOYSA-N -1 3 395.445 -1.161 20 0 GAADHM NS(=O)(=O)c1ccc(N2CCC(C(=O)NCCO)CC2)c(-c2nnn[n-]2)c1 ZINC001592751478 1076204983 /nfs/dbraw/zinc/20/49/83/1076204983.db2.gz CPCVNOVRZAKKPB-UHFFFAOYSA-N -1 3 395.445 -1.161 20 0 GAADHM Nc1c(-c2nn[n-]n2)cnn1C(=O)CCN1CCN(C(=O)[C@H]2CCCO2)CC1 ZINC001592753514 1076204792 /nfs/dbraw/zinc/20/47/92/1076204792.db2.gz VBLILTFNNSFWQF-GFCCVEGCSA-N -1 3 389.420 -1.001 20 0 GAADHM Nc1c(-c2nnn[n-]2)cnn1C(=O)CCN1CCN(C(=O)[C@H]2CCCO2)CC1 ZINC001592753514 1076204788 /nfs/dbraw/zinc/20/47/88/1076204788.db2.gz VBLILTFNNSFWQF-GFCCVEGCSA-N -1 3 389.420 -1.001 20 0 GAADHM Nc1c(-c2nn[n-]n2)cnn1C(=O)CCN1CCN(C(=O)[C@@H]2CCCO2)CC1 ZINC001592753516 1076204828 /nfs/dbraw/zinc/20/48/28/1076204828.db2.gz VBLILTFNNSFWQF-LBPRGKRZSA-N -1 3 389.420 -1.001 20 0 GAADHM Nc1c(-c2nnn[n-]2)cnn1C(=O)CCN1CCN(C(=O)[C@@H]2CCCO2)CC1 ZINC001592753516 1076204823 /nfs/dbraw/zinc/20/48/23/1076204823.db2.gz VBLILTFNNSFWQF-LBPRGKRZSA-N -1 3 389.420 -1.001 20 0 GAADHM Nc1c(-c2nn[n-]n2)cnn1CCOC(=O)[C@@H]1[C@H]2CC[C@]3(COC(=O)[C@H]13)O2 ZINC001592754010 1076204871 /nfs/dbraw/zinc/20/48/71/1076204871.db2.gz ILTYJFXNNCEWBM-KFRQHLNQSA-N -1 3 375.345 -1.091 20 0 GAADHM Nc1c(-c2nnn[n-]2)cnn1CCOC(=O)[C@@H]1[C@H]2CC[C@]3(COC(=O)[C@H]13)O2 ZINC001592754010 1076204867 /nfs/dbraw/zinc/20/48/67/1076204867.db2.gz ILTYJFXNNCEWBM-KFRQHLNQSA-N -1 3 375.345 -1.091 20 0 GAADHM Nc1c(-c2nnn[n-]2)cnn1C(=O)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 ZINC001592754714 1076205358 /nfs/dbraw/zinc/20/53/58/1076205358.db2.gz RXCQBAGAIJZCPE-HTQZYQBOSA-N -1 3 380.390 -1.679 20 0 GAADHM Nc1c(-c2nnn[n-]2)cnn1C(=O)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 ZINC001592754716 1076205374 /nfs/dbraw/zinc/20/53/74/1076205374.db2.gz RXCQBAGAIJZCPE-JGVFFNPUSA-N -1 3 380.390 -1.679 20 0 GAADHM Nc1c(-c2nnn[n-]2)cnn1C(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 ZINC001592754717 1076205339 /nfs/dbraw/zinc/20/53/39/1076205339.db2.gz RXCQBAGAIJZCPE-SFYZADRCSA-N -1 3 380.390 -1.679 20 0 GAADHM Nc1c(-c2nnn[n-]2)cnn1C(=O)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 ZINC001592754718 1076205282 /nfs/dbraw/zinc/20/52/82/1076205282.db2.gz RXCQBAGAIJZCPE-YUMQZZPRSA-N -1 3 380.390 -1.679 20 0 GAADHM O=C(C(=O)N1CCN(c2cnccc2-c2nn[n-]n2)CC1)N1CCC[C@@H]1CO ZINC001592766257 1076205216 /nfs/dbraw/zinc/20/52/16/1076205216.db2.gz ANJCSCAJZWHOKV-GFCCVEGCSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCN(c2cnccc2-c2nnn[n-]2)CC1)N1CCC[C@@H]1CO ZINC001592766257 1076205213 /nfs/dbraw/zinc/20/52/13/1076205213.db2.gz ANJCSCAJZWHOKV-GFCCVEGCSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCN(c2cnccc2-c2nn[n-]n2)CC1)N1CCC[C@H]1CO ZINC001592766258 1076205308 /nfs/dbraw/zinc/20/53/08/1076205308.db2.gz ANJCSCAJZWHOKV-LBPRGKRZSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCN(c2cnccc2-c2nnn[n-]2)CC1)N1CCC[C@H]1CO ZINC001592766258 1076205305 /nfs/dbraw/zinc/20/53/05/1076205305.db2.gz ANJCSCAJZWHOKV-LBPRGKRZSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCC[C@H](O)C1)N1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001592766268 1076205350 /nfs/dbraw/zinc/20/53/50/1076205350.db2.gz BJRMPRANDFZLGH-ZDUSSCGKSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCC[C@H](O)C1)N1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001592766268 1076205346 /nfs/dbraw/zinc/20/53/46/1076205346.db2.gz BJRMPRANDFZLGH-ZDUSSCGKSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCC[C@@H](O)C1)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1 ZINC001592766451 1076205300 /nfs/dbraw/zinc/20/53/00/1076205300.db2.gz FMHUDCXCOWXBBI-CYBMUJFWSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCC[C@@H](O)C1)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1 ZINC001592766451 1076205297 /nfs/dbraw/zinc/20/52/97/1076205297.db2.gz FMHUDCXCOWXBBI-CYBMUJFWSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCC[C@H](O)C1)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1 ZINC001592766452 1076205198 /nfs/dbraw/zinc/20/51/98/1076205198.db2.gz FMHUDCXCOWXBBI-ZDUSSCGKSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCC[C@H](O)C1)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1 ZINC001592766452 1076205196 /nfs/dbraw/zinc/20/51/96/1076205196.db2.gz FMHUDCXCOWXBBI-ZDUSSCGKSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCC[C@H](O)C1)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001592766773 1076205161 /nfs/dbraw/zinc/20/51/61/1076205161.db2.gz JKZFINGIBBBNHF-LBPRGKRZSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCC[C@H](O)C1)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001592766773 1076205154 /nfs/dbraw/zinc/20/51/54/1076205154.db2.gz JKZFINGIBBBNHF-LBPRGKRZSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1)N1CCC[C@@H]1CO ZINC001592766813 1076205271 /nfs/dbraw/zinc/20/52/71/1076205271.db2.gz KWKVYISAHQEMEF-CYBMUJFWSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1)N1CCC[C@@H]1CO ZINC001592766813 1076205265 /nfs/dbraw/zinc/20/52/65/1076205265.db2.gz KWKVYISAHQEMEF-CYBMUJFWSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1)N1CCC[C@H]1CO ZINC001592766814 1076205182 /nfs/dbraw/zinc/20/51/82/1076205182.db2.gz KWKVYISAHQEMEF-ZDUSSCGKSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1)N1CCC[C@H]1CO ZINC001592766814 1076205174 /nfs/dbraw/zinc/20/51/74/1076205174.db2.gz KWKVYISAHQEMEF-ZDUSSCGKSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1)N1CCC[C@@H]1CO ZINC001592766822 1076205232 /nfs/dbraw/zinc/20/52/32/1076205232.db2.gz LCLWSSNRSVEDOR-CYBMUJFWSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1)N1CCC[C@@H]1CO ZINC001592766822 1076205227 /nfs/dbraw/zinc/20/52/27/1076205227.db2.gz LCLWSSNRSVEDOR-CYBMUJFWSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1)N1CCC[C@H]1CO ZINC001592766823 1076205331 /nfs/dbraw/zinc/20/53/31/1076205331.db2.gz LCLWSSNRSVEDOR-ZDUSSCGKSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1)N1CCC[C@H]1CO ZINC001592766823 1076205329 /nfs/dbraw/zinc/20/53/29/1076205329.db2.gz LCLWSSNRSVEDOR-ZDUSSCGKSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCC[C@H](O)C1)N1CCN(c2cnccc2-c2nn[n-]n2)CC1 ZINC001592767069 1076205258 /nfs/dbraw/zinc/20/52/58/1076205258.db2.gz MLQMENHKLQRJST-LBPRGKRZSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCC[C@H](O)C1)N1CCN(c2cnccc2-c2nnn[n-]2)CC1 ZINC001592767069 1076205255 /nfs/dbraw/zinc/20/52/55/1076205255.db2.gz MLQMENHKLQRJST-LBPRGKRZSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CC[C@@]2(O)C[C@H]2C1)N1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001592767157 1076205559 /nfs/dbraw/zinc/20/55/59/1076205559.db2.gz OTENRVQIOOQRJW-SCLBCKFNSA-N -1 3 398.427 -1.106 20 0 GAADHM O=C(C(=O)N1CC[C@@]2(O)C[C@H]2C1)N1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001592767157 1076205557 /nfs/dbraw/zinc/20/55/57/1076205557.db2.gz OTENRVQIOOQRJW-SCLBCKFNSA-N -1 3 398.427 -1.106 20 0 GAADHM O=C(C(=O)N1CC[C@@]2(O)C[C@H]2C1)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1 ZINC001592767226 1076205694 /nfs/dbraw/zinc/20/56/94/1076205694.db2.gz QPORUPDDWBQVFP-SCLBCKFNSA-N -1 3 398.427 -1.106 20 0 GAADHM O=C(C(=O)N1CC[C@@]2(O)C[C@H]2C1)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1 ZINC001592767226 1076205689 /nfs/dbraw/zinc/20/56/89/1076205689.db2.gz QPORUPDDWBQVFP-SCLBCKFNSA-N -1 3 398.427 -1.106 20 0 GAADHM O=C(C(=O)N1CCN(c2ncccc2-c2nn[n-]n2)CC1)N1CCC[C@@H]1CO ZINC001592767441 1076205605 /nfs/dbraw/zinc/20/56/05/1076205605.db2.gz UVYSBLFVMGJAET-GFCCVEGCSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCN(c2ncccc2-c2nnn[n-]2)CC1)N1CCC[C@@H]1CO ZINC001592767441 1076205602 /nfs/dbraw/zinc/20/56/02/1076205602.db2.gz UVYSBLFVMGJAET-GFCCVEGCSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCN(c2ncccc2-c2nn[n-]n2)CC1)N1CCC[C@H]1CO ZINC001592767443 1076205582 /nfs/dbraw/zinc/20/55/82/1076205582.db2.gz UVYSBLFVMGJAET-LBPRGKRZSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCN(c2ncccc2-c2nnn[n-]2)CC1)N1CCC[C@H]1CO ZINC001592767443 1076205577 /nfs/dbraw/zinc/20/55/77/1076205577.db2.gz UVYSBLFVMGJAET-LBPRGKRZSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCN2C(=O)NC[C@@H]2C1)N1Cc2cccc(-c3nn[n-]n3)c2C1 ZINC001592767613 1076205640 /nfs/dbraw/zinc/20/56/40/1076205640.db2.gz XMOMXPJGBIQALN-LLVKDONJSA-N -1 3 382.384 -1.055 20 0 GAADHM O=C(C(=O)N1CCN2C(=O)NC[C@@H]2C1)N1Cc2cccc(-c3nnn[n-]3)c2C1 ZINC001592767613 1076205637 /nfs/dbraw/zinc/20/56/37/1076205637.db2.gz XMOMXPJGBIQALN-LLVKDONJSA-N -1 3 382.384 -1.055 20 0 GAADHM O=C(C(=O)N1CCN2C(=O)NC[C@H]2C1)N1Cc2cccc(-c3nn[n-]n3)c2C1 ZINC001592767615 1076205525 /nfs/dbraw/zinc/20/55/25/1076205525.db2.gz XMOMXPJGBIQALN-NSHDSACASA-N -1 3 382.384 -1.055 20 0 GAADHM O=C(C(=O)N1CCN2C(=O)NC[C@H]2C1)N1Cc2cccc(-c3nnn[n-]3)c2C1 ZINC001592767615 1076205520 /nfs/dbraw/zinc/20/55/20/1076205520.db2.gz XMOMXPJGBIQALN-NSHDSACASA-N -1 3 382.384 -1.055 20 0 GAADHM O=C(C(=O)N1CCN2C(=O)NC[C@@H]2C1)N1Cc2ccc(-c3nn[n-]n3)cc2C1 ZINC001592767745 1076205707 /nfs/dbraw/zinc/20/57/07/1076205707.db2.gz ZZWAQEGTQXANQI-CYBMUJFWSA-N -1 3 382.384 -1.055 20 0 GAADHM O=C(C(=O)N1CCN2C(=O)NC[C@@H]2C1)N1Cc2ccc(-c3nnn[n-]3)cc2C1 ZINC001592767745 1076205704 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395.401 -1.287 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)NCCN1CCNC1=O ZINC001592875176 1076215448 /nfs/dbraw/zinc/21/54/48/1076215448.db2.gz CCHKRVDKHIMBMU-UHFFFAOYSA-N -1 3 394.417 -1.714 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)NCCN1CCNC1=O ZINC001592875176 1076215442 /nfs/dbraw/zinc/21/54/42/1076215442.db2.gz CCHKRVDKHIMBMU-UHFFFAOYSA-N -1 3 394.417 -1.714 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)OC[C@H]1CNC(=O)O1 ZINC001592875193 1076215388 /nfs/dbraw/zinc/21/53/88/1076215388.db2.gz CUCQWTJHEDSAPF-SECBINFHSA-N -1 3 382.358 -1.203 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)OC[C@H]1CNC(=O)O1 ZINC001592875193 1076215385 /nfs/dbraw/zinc/21/53/85/1076215385.db2.gz CUCQWTJHEDSAPF-SECBINFHSA-N -1 3 382.358 -1.203 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)OC[C@@H]1CNC(=O)O1 ZINC001592875194 1076215534 /nfs/dbraw/zinc/21/55/34/1076215534.db2.gz CUCQWTJHEDSAPF-VIFPVBQESA-N -1 3 382.358 -1.203 20 0 GAADHM 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O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)N1CC[C@@H](O)[C@H](CO)C1 ZINC001592875208 1076215420 /nfs/dbraw/zinc/21/54/20/1076215420.db2.gz DFQRQZDAAAKYLK-WCQYABFASA-N -1 3 396.429 -1.653 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)N1CC[C@@H](O)[C@H](CO)C1 ZINC001592875208 1076215417 /nfs/dbraw/zinc/21/54/17/1076215417.db2.gz DFQRQZDAAAKYLK-WCQYABFASA-N -1 3 396.429 -1.653 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)N1CC[C@H](O)[C@@H](CO)C1 ZINC001592875209 1076215579 /nfs/dbraw/zinc/21/55/79/1076215579.db2.gz DFQRQZDAAAKYLK-YPMHNXCESA-N -1 3 396.429 -1.653 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)N1CC[C@H](O)[C@@H](CO)C1 ZINC001592875209 1076215576 /nfs/dbraw/zinc/21/55/76/1076215576.db2.gz DFQRQZDAAAKYLK-YPMHNXCESA-N -1 3 396.429 -1.653 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)NCC1(CO)COC1 ZINC001592875224 1076215658 /nfs/dbraw/zinc/21/56/58/1076215658.db2.gz FJMGCVGNEUOLMP-UHFFFAOYSA-N -1 3 382.402 -1.730 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)NCC1(CO)COC1 ZINC001592875224 1076215656 /nfs/dbraw/zinc/21/56/56/1076215656.db2.gz FJMGCVGNEUOLMP-UHFFFAOYSA-N -1 3 382.402 -1.730 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)N1CCn2ncnc2C1 ZINC001592875263 1076215404 /nfs/dbraw/zinc/21/54/04/1076215404.db2.gz HDEPEXALDJDYNN-UHFFFAOYSA-N -1 3 389.401 -1.221 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)N1CCn2ncnc2C1 ZINC001592875263 1076215400 /nfs/dbraw/zinc/21/54/00/1076215400.db2.gz HDEPEXALDJDYNN-UHFFFAOYSA-N -1 3 389.401 -1.221 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)NCCn1ccnn1 ZINC001592875275 1076215600 /nfs/dbraw/zinc/21/56/00/1076215600.db2.gz HOQXCEKEVICEAZ-UHFFFAOYSA-N -1 3 377.390 -1.447 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)NCCn1ccnn1 ZINC001592875275 1076215598 /nfs/dbraw/zinc/21/55/98/1076215598.db2.gz HOQXCEKEVICEAZ-UHFFFAOYSA-N -1 3 377.390 -1.447 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)NCC[C@]1(O)CCOC1 ZINC001592875276 1076215516 /nfs/dbraw/zinc/21/55/16/1076215516.db2.gz HTMBAPDRPGLRDD-HNNXBMFYSA-N -1 3 396.429 -1.197 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)NCC[C@]1(O)CCOC1 ZINC001592875276 1076215513 /nfs/dbraw/zinc/21/55/13/1076215513.db2.gz HTMBAPDRPGLRDD-HNNXBMFYSA-N -1 3 396.429 -1.197 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)NCC[C@@]1(O)CCOC1 ZINC001592875277 1076215566 /nfs/dbraw/zinc/21/55/66/1076215566.db2.gz HTMBAPDRPGLRDD-OAHLLOKOSA-N -1 3 396.429 -1.197 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)NCC[C@@]1(O)CCOC1 ZINC001592875277 1076215561 /nfs/dbraw/zinc/21/55/61/1076215561.db2.gz HTMBAPDRPGLRDD-OAHLLOKOSA-N -1 3 396.429 -1.197 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)N[C@@H](CO)[C@H]1CCOC1 ZINC001592875487 1076215504 /nfs/dbraw/zinc/21/55/04/1076215504.db2.gz OGBBYYBVGVEYOM-AAEUAGOBSA-N -1 3 396.429 -1.341 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)N[C@@H](CO)[C@H]1CCOC1 ZINC001592875487 1076215500 /nfs/dbraw/zinc/21/55/00/1076215500.db2.gz OGBBYYBVGVEYOM-AAEUAGOBSA-N -1 3 396.429 -1.341 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)N[C@H](CO)[C@@H]1CCOC1 ZINC001592875488 1076216043 /nfs/dbraw/zinc/21/60/43/1076216043.db2.gz OGBBYYBVGVEYOM-DGCLKSJQSA-N -1 3 396.429 -1.341 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)N[C@H](CO)[C@@H]1CCOC1 ZINC001592875488 1076216037 /nfs/dbraw/zinc/21/60/37/1076216037.db2.gz OGBBYYBVGVEYOM-DGCLKSJQSA-N -1 3 396.429 -1.341 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)N[C@H](CO)[C@H]1CCOC1 ZINC001592875489 1076215821 /nfs/dbraw/zinc/21/58/21/1076215821.db2.gz OGBBYYBVGVEYOM-WCQYABFASA-N -1 3 396.429 -1.341 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)N[C@H](CO)[C@H]1CCOC1 ZINC001592875489 1076215810 /nfs/dbraw/zinc/21/58/10/1076215810.db2.gz OGBBYYBVGVEYOM-WCQYABFASA-N -1 3 396.429 -1.341 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)N[C@@H](CO)[C@@H]1CCOC1 ZINC001592875490 1076215896 /nfs/dbraw/zinc/21/58/96/1076215896.db2.gz OGBBYYBVGVEYOM-YPMHNXCESA-N -1 3 396.429 -1.341 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)N[C@@H](CO)[C@@H]1CCOC1 ZINC001592875490 1076215892 /nfs/dbraw/zinc/21/58/92/1076215892.db2.gz OGBBYYBVGVEYOM-YPMHNXCESA-N -1 3 396.429 -1.341 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)NCCn1ccnn1 ZINC001592875506 1076215796 /nfs/dbraw/zinc/21/57/96/1076215796.db2.gz ONTGTGILCUNFIV-UHFFFAOYSA-N -1 3 377.390 -1.447 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)NCCn1ccnn1 ZINC001592875506 1076215784 /nfs/dbraw/zinc/21/57/84/1076215784.db2.gz ONTGTGILCUNFIV-UHFFFAOYSA-N -1 3 377.390 -1.447 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)NCC[C@@H]1CNC(=O)C1 ZINC001592875515 1076215917 /nfs/dbraw/zinc/21/59/17/1076215917.db2.gz OYNUHWZUAVEOIM-JTQLQIEISA-N -1 3 393.429 -1.213 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)NCC[C@@H]1CNC(=O)C1 ZINC001592875515 1076215913 /nfs/dbraw/zinc/21/59/13/1076215913.db2.gz OYNUHWZUAVEOIM-JTQLQIEISA-N -1 3 393.429 -1.213 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)NCC[C@H]1CNC(=O)C1 ZINC001592875516 1076215767 /nfs/dbraw/zinc/21/57/67/1076215767.db2.gz OYNUHWZUAVEOIM-SNVBAGLBSA-N -1 3 393.429 -1.213 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)NCC[C@H]1CNC(=O)C1 ZINC001592875516 1076215761 /nfs/dbraw/zinc/21/57/61/1076215761.db2.gz OYNUHWZUAVEOIM-SNVBAGLBSA-N -1 3 393.429 -1.213 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)NC[C@@H]1COCCO1 ZINC001592875525 1076216002 /nfs/dbraw/zinc/21/60/02/1076216002.db2.gz PGOLZPGYUYVUHN-LLVKDONJSA-N -1 3 382.402 -1.323 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)NC[C@@H]1COCCO1 ZINC001592875525 1076215998 /nfs/dbraw/zinc/21/59/98/1076215998.db2.gz PGOLZPGYUYVUHN-LLVKDONJSA-N -1 3 382.402 -1.323 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)NC[C@H]1COCCO1 ZINC001592875526 1076215943 /nfs/dbraw/zinc/21/59/43/1076215943.db2.gz PGOLZPGYUYVUHN-NSHDSACASA-N -1 3 382.402 -1.323 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)NC[C@H]1COCCO1 ZINC001592875526 1076215939 /nfs/dbraw/zinc/21/59/39/1076215939.db2.gz PGOLZPGYUYVUHN-NSHDSACASA-N -1 3 382.402 -1.323 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)N1CCS(=O)CC1 ZINC001592875533 1076215966 /nfs/dbraw/zinc/21/59/66/1076215966.db2.gz PTBVUDUQNUHRQM-UHFFFAOYSA-N -1 3 384.443 -1.264 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)N1CCS(=O)CC1 ZINC001592875533 1076215962 /nfs/dbraw/zinc/21/59/62/1076215962.db2.gz PTBVUDUQNUHRQM-UHFFFAOYSA-N -1 3 384.443 -1.264 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)N1CCC(O)(CO)CC1 ZINC001592875642 1076215909 /nfs/dbraw/zinc/21/59/09/1076215909.db2.gz QBGZDHOYZDAGFD-UHFFFAOYSA-N -1 3 396.429 -1.509 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)N1CCC(O)(CO)CC1 ZINC001592875642 1076215906 /nfs/dbraw/zinc/21/59/06/1076215906.db2.gz QBGZDHOYZDAGFD-UHFFFAOYSA-N -1 3 396.429 -1.509 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)N1CC(=O)N(C2CC2)C1 ZINC001592875719 1076215887 /nfs/dbraw/zinc/21/58/87/1076215887.db2.gz SSJIYYSMVGEORW-UHFFFAOYSA-N -1 3 391.413 -1.064 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)N1CC(=O)N(C2CC2)C1 ZINC001592875719 1076215883 /nfs/dbraw/zinc/21/58/83/1076215883.db2.gz SSJIYYSMVGEORW-UHFFFAOYSA-N -1 3 391.413 -1.064 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)N1C[C@@H](CO)[C@H](CO)C1 ZINC001592875959 1076216014 /nfs/dbraw/zinc/21/60/14/1076216014.db2.gz YFDOECWHIJLDKW-RYUDHWBXSA-N -1 3 396.429 -1.796 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)N1C[C@@H](CO)[C@H](CO)C1 ZINC001592875959 1076216010 /nfs/dbraw/zinc/21/60/10/1076216010.db2.gz YFDOECWHIJLDKW-RYUDHWBXSA-N -1 3 396.429 -1.796 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)OCCN1CCNC1=O ZINC001592875978 1076216028 /nfs/dbraw/zinc/21/60/28/1076216028.db2.gz YMHCEDOGTPYHQA-UHFFFAOYSA-N -1 3 395.401 -1.287 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)OCCN1CCNC1=O ZINC001592875978 1076216024 /nfs/dbraw/zinc/21/60/24/1076216024.db2.gz YMHCEDOGTPYHQA-UHFFFAOYSA-N -1 3 395.401 -1.287 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)NC[C@@H](O)[C@H]1CCCO1 ZINC001592875980 1076215990 /nfs/dbraw/zinc/21/59/90/1076215990.db2.gz YPHQFVYDHIZCNV-CHWSQXEVSA-N -1 3 396.429 -1.199 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)NC[C@@H](O)[C@H]1CCCO1 ZINC001592875980 1076215986 /nfs/dbraw/zinc/21/59/86/1076215986.db2.gz YPHQFVYDHIZCNV-CHWSQXEVSA-N -1 3 396.429 -1.199 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)NC[C@@H](O)[C@@H]1CCCO1 ZINC001592875985 1076215976 /nfs/dbraw/zinc/21/59/76/1076215976.db2.gz YPHQFVYDHIZCNV-OLZOCXBDSA-N -1 3 396.429 -1.199 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)NC[C@@H](O)[C@@H]1CCCO1 ZINC001592875985 1076215973 /nfs/dbraw/zinc/21/59/73/1076215973.db2.gz YPHQFVYDHIZCNV-OLZOCXBDSA-N -1 3 396.429 -1.199 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)NC[C@H](O)[C@H]1CCCO1 ZINC001592875987 1076215854 /nfs/dbraw/zinc/21/58/54/1076215854.db2.gz YPHQFVYDHIZCNV-QWHCGFSZSA-N -1 3 396.429 -1.199 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)NC[C@H](O)[C@H]1CCCO1 ZINC001592875987 1076215849 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ZINC001593044106 1076225627 /nfs/dbraw/zinc/22/56/27/1076225627.db2.gz RMLPZKZGQBALNB-NSHDSACASA-N -1 3 389.420 -1.349 20 0 GAADHM O=C(NC[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001593044264 1076225672 /nfs/dbraw/zinc/22/56/72/1076225672.db2.gz CVFPBVBHOVXUAW-CMPLNLGQSA-N -1 3 392.445 -1.104 20 0 GAADHM O=C(NC[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001593044264 1076225670 /nfs/dbraw/zinc/22/56/70/1076225670.db2.gz CVFPBVBHOVXUAW-CMPLNLGQSA-N -1 3 392.445 -1.104 20 0 GAADHM O=C(NC[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001593044265 1076225750 /nfs/dbraw/zinc/22/57/50/1076225750.db2.gz CVFPBVBHOVXUAW-JQWIXIFHSA-N -1 3 392.445 -1.104 20 0 GAADHM O=C(NC[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001593044265 1076225748 /nfs/dbraw/zinc/22/57/48/1076225748.db2.gz CVFPBVBHOVXUAW-JQWIXIFHSA-N -1 3 392.445 -1.104 20 0 GAADHM O=C(NC[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001593044266 1076225784 /nfs/dbraw/zinc/22/57/84/1076225784.db2.gz CVFPBVBHOVXUAW-PWSUYJOCSA-N -1 3 392.445 -1.104 20 0 GAADHM O=C(NC[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C1)[C@@H]1CCS(=O)(=O)N1 ZINC001593044266 1076225778 /nfs/dbraw/zinc/22/57/78/1076225778.db2.gz CVFPBVBHOVXUAW-PWSUYJOCSA-N -1 3 392.445 -1.104 20 0 GAADHM O=C(NC[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001593044267 1076225689 /nfs/dbraw/zinc/22/56/89/1076225689.db2.gz CVFPBVBHOVXUAW-ZYHUDNBSSA-N -1 3 392.445 -1.104 20 0 GAADHM O=C(NC[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C1)[C@H]1CCS(=O)(=O)N1 ZINC001593044267 1076225682 /nfs/dbraw/zinc/22/56/82/1076225682.db2.gz CVFPBVBHOVXUAW-ZYHUDNBSSA-N -1 3 392.445 -1.104 20 0 GAADHM O=C(NC[C@@H]1CN(CCN2CCNC2=O)CCO1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001593044338 1076225617 /nfs/dbraw/zinc/22/56/17/1076225617.db2.gz UNSWXYYVTRZZGB-GFCCVEGCSA-N -1 3 389.420 -1.349 20 0 GAADHM O=C(NC[C@@H]1CN(CCN2CCNC2=O)CCO1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001593044338 1076225613 /nfs/dbraw/zinc/22/56/13/1076225613.db2.gz UNSWXYYVTRZZGB-GFCCVEGCSA-N -1 3 389.420 -1.349 20 0 GAADHM O=C(NC[C@H]1CN(CCN2CCNC2=O)CCO1)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001593044339 1076225606 /nfs/dbraw/zinc/22/56/06/1076225606.db2.gz UNSWXYYVTRZZGB-LBPRGKRZSA-N -1 3 389.420 -1.349 20 0 GAADHM O=C(NC[C@H]1CN(CCN2CCNC2=O)CCO1)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001593044339 1076225602 /nfs/dbraw/zinc/22/56/02/1076225602.db2.gz UNSWXYYVTRZZGB-LBPRGKRZSA-N -1 3 389.420 -1.349 20 0 GAADHM O=C(NC[C@@H]1CN(C(=O)[C@@H]2CCNC2=O)CCO1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001593044526 1076225769 /nfs/dbraw/zinc/22/57/69/1076225769.db2.gz LJLRPOTYABODFE-GHMZBOCLSA-N -1 3 388.388 -1.712 20 0 GAADHM O=C(NC[C@@H]1CN(C(=O)[C@@H]2CCNC2=O)CCO1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001593044526 1076225764 /nfs/dbraw/zinc/22/57/64/1076225764.db2.gz LJLRPOTYABODFE-GHMZBOCLSA-N -1 3 388.388 -1.712 20 0 GAADHM O=C(NC[C@@H]1CN(C(=O)[C@H]2CCNC2=O)CCO1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001593044529 1076225922 /nfs/dbraw/zinc/22/59/22/1076225922.db2.gz LJLRPOTYABODFE-MNOVXSKESA-N -1 3 388.388 -1.712 20 0 GAADHM O=C(NC[C@@H]1CN(C(=O)[C@H]2CCNC2=O)CCO1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001593044529 1076225919 /nfs/dbraw/zinc/22/59/19/1076225919.db2.gz LJLRPOTYABODFE-MNOVXSKESA-N -1 3 388.388 -1.712 20 0 GAADHM O=C(NC[C@H]1CN(C(=O)[C@H]2CCNC2=O)CCO1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001593044531 1076226117 /nfs/dbraw/zinc/22/61/17/1076226117.db2.gz LJLRPOTYABODFE-QWRGUYRKSA-N -1 3 388.388 -1.712 20 0 GAADHM O=C(NC[C@H]1CN(C(=O)[C@H]2CCNC2=O)CCO1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001593044531 1076226108 /nfs/dbraw/zinc/22/61/08/1076226108.db2.gz LJLRPOTYABODFE-QWRGUYRKSA-N -1 3 388.388 -1.712 20 0 GAADHM O=C(NC[C@H]1CN(C(=O)[C@@H]2CCNC2=O)CCO1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001593044533 1076226156 /nfs/dbraw/zinc/22/61/56/1076226156.db2.gz LJLRPOTYABODFE-WDEREUQCSA-N -1 3 388.388 -1.712 20 0 GAADHM O=C(NC[C@H]1CN(C(=O)[C@@H]2CCNC2=O)CCO1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001593044533 1076226154 /nfs/dbraw/zinc/22/61/54/1076226154.db2.gz LJLRPOTYABODFE-WDEREUQCSA-N -1 3 388.388 -1.712 20 0 GAADHM O=C(NC[C@@H]1COCCO1)C(=O)N1CC(Oc2ccc(-c3nn[n-]n3)cc2)C1 ZINC001593046725 1076226002 /nfs/dbraw/zinc/22/60/02/1076226002.db2.gz LFQVRQSBRCIACX-CYBMUJFWSA-N -1 3 388.384 -1.012 20 0 GAADHM O=C(NC[C@H]1COCCO1)C(=O)N1CC(Oc2ccc(-c3nn[n-]n3)cc2)C1 ZINC001593046726 1076225974 /nfs/dbraw/zinc/22/59/74/1076225974.db2.gz LFQVRQSBRCIACX-ZDUSSCGKSA-N -1 3 388.384 -1.012 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@@H]1CCNC1=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001593048321 1076226657 /nfs/dbraw/zinc/22/66/57/1076226657.db2.gz JGXONHLWOSZOGK-GHMZBOCLSA-N -1 3 388.388 -1.712 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@@H]1CCNC1=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001593048321 1076226652 /nfs/dbraw/zinc/22/66/52/1076226652.db2.gz JGXONHLWOSZOGK-GHMZBOCLSA-N -1 3 388.388 -1.712 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@H]1CCNC1=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001593048322 1076226609 /nfs/dbraw/zinc/22/66/09/1076226609.db2.gz JGXONHLWOSZOGK-MNOVXSKESA-N -1 3 388.388 -1.712 20 0 GAADHM O=C(NC[C@@H]1COCCN1C(=O)[C@H]1CCNC1=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001593048322 1076226606 /nfs/dbraw/zinc/22/66/06/1076226606.db2.gz JGXONHLWOSZOGK-MNOVXSKESA-N -1 3 388.388 -1.712 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@H]1CCNC1=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001593048323 1076226440 /nfs/dbraw/zinc/22/64/40/1076226440.db2.gz JGXONHLWOSZOGK-QWRGUYRKSA-N -1 3 388.388 -1.712 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@H]1CCNC1=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001593048323 1076226434 /nfs/dbraw/zinc/22/64/34/1076226434.db2.gz JGXONHLWOSZOGK-QWRGUYRKSA-N -1 3 388.388 -1.712 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@@H]1CCNC1=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001593048324 1076226645 /nfs/dbraw/zinc/22/66/45/1076226645.db2.gz JGXONHLWOSZOGK-WDEREUQCSA-N -1 3 388.388 -1.712 20 0 GAADHM O=C(NC[C@H]1COCCN1C(=O)[C@@H]1CCNC1=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001593048324 1076226642 /nfs/dbraw/zinc/22/66/42/1076226642.db2.gz JGXONHLWOSZOGK-WDEREUQCSA-N -1 3 388.388 -1.712 20 0 GAADHM O=C(NC[C@H]1COCCN1)C(=O)Nc1ccccc1-n1cnc(-c2nn[n-]n2)n1 ZINC001593048716 1076226585 /nfs/dbraw/zinc/22/65/85/1076226585.db2.gz REJCUUWVDCZOEY-JTQLQIEISA-N -1 3 398.387 -1.510 20 0 GAADHM O=C(NC[C@H]1COCCN1)C(=O)Nc1ccccc1-n1cnc(-c2nnn[n-]2)n1 ZINC001593048716 1076226569 /nfs/dbraw/zinc/22/65/69/1076226569.db2.gz REJCUUWVDCZOEY-JTQLQIEISA-N -1 3 398.387 -1.510 20 0 GAADHM O=C(NC[C@@H]1COCCN1)C(=O)Nc1ccccc1-n1cnc(-c2nn[n-]n2)n1 ZINC001593048717 1076226504 /nfs/dbraw/zinc/22/65/04/1076226504.db2.gz REJCUUWVDCZOEY-SNVBAGLBSA-N -1 3 398.387 -1.510 20 0 GAADHM O=C(NC[C@@H]1COCCN1)C(=O)Nc1ccccc1-n1cnc(-c2nnn[n-]2)n1 ZINC001593048717 1076226501 /nfs/dbraw/zinc/22/65/01/1076226501.db2.gz REJCUUWVDCZOEY-SNVBAGLBSA-N -1 3 398.387 -1.510 20 0 GAADHM O=C(NCC=CCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)C(=O)NCC(F)F ZINC001593051396 1076226551 /nfs/dbraw/zinc/22/65/51/1076226551.db2.gz JMLPNTYBIPZIQY-OWOJBTEDSA-N -1 3 382.331 -1.022 20 0 GAADHM O=C(NCC=CCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)C(=O)NCC(F)F ZINC001593051396 1076226547 /nfs/dbraw/zinc/22/65/47/1076226547.db2.gz JMLPNTYBIPZIQY-OWOJBTEDSA-N -1 3 382.331 -1.022 20 0 GAADHM O=C(NCC=CCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)C(=O)NCC(F)F ZINC001593051397 1076226520 /nfs/dbraw/zinc/22/65/20/1076226520.db2.gz JMLPNTYBIPZIQY-UPHRSURJSA-N -1 3 382.331 -1.022 20 0 GAADHM O=C(NCC=CCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)C(=O)NCC(F)F ZINC001593051397 1076226517 /nfs/dbraw/zinc/22/65/17/1076226517.db2.gz JMLPNTYBIPZIQY-UPHRSURJSA-N -1 3 382.331 -1.022 20 0 GAADHM O=C(NCCCN1CCN(c2cnc(-c3nn[n-]n3)cn2)CC1)c1cnon1 ZINC001593070231 1076226908 /nfs/dbraw/zinc/22/69/08/1076226908.db2.gz FOURVHKEXMSEGJ-UHFFFAOYSA-N -1 3 385.392 -1.018 20 0 GAADHM O=C(NCCCN1CCN(c2cnc(-c3nnn[n-]3)cn2)CC1)c1cnon1 ZINC001593070231 1076226901 /nfs/dbraw/zinc/22/69/01/1076226901.db2.gz FOURVHKEXMSEGJ-UHFFFAOYSA-N -1 3 385.392 -1.018 20 0 GAADHM O=C(NCCCN1CCN(c2cncc(-c3nn[n-]n3)n2)CC1)c1cnon1 ZINC001593071038 1076227057 /nfs/dbraw/zinc/22/70/57/1076227057.db2.gz NHRYBNRXJKCATI-UHFFFAOYSA-N -1 3 385.392 -1.018 20 0 GAADHM O=C(NCCCN1CCN(c2cncc(-c3nnn[n-]3)n2)CC1)c1cnon1 ZINC001593071038 1076227051 /nfs/dbraw/zinc/22/70/51/1076227051.db2.gz NHRYBNRXJKCATI-UHFFFAOYSA-N -1 3 385.392 -1.018 20 0 GAADHM O=C(Cn1cnnn1)N(CCCNC(=O)c1cc(-c2nn[n-]n2)c[nH]1)C1CC1 ZINC001593073857 1076227551 /nfs/dbraw/zinc/22/75/51/1076227551.db2.gz WPEUCPFSEHZBRH-UHFFFAOYSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(Cn1cnnn1)N(CCCNC(=O)c1cc(-c2nnn[n-]2)c[nH]1)C1CC1 ZINC001593073857 1076227546 /nfs/dbraw/zinc/22/75/46/1076227546.db2.gz WPEUCPFSEHZBRH-UHFFFAOYSA-N -1 3 385.392 -1.008 20 0 GAADHM O=C(NCCN(CCO)C(=O)c1cc[n+]([O-])cc1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001593080493 1076227493 /nfs/dbraw/zinc/22/74/93/1076227493.db2.gz ZNUKLUGOJAOATN-UHFFFAOYSA-N -1 3 386.372 -1.307 20 0 GAADHM O=C(NCCN(CCO)C(=O)c1cc[n+]([O-])cc1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001593080493 1076227488 /nfs/dbraw/zinc/22/74/88/1076227488.db2.gz ZNUKLUGOJAOATN-UHFFFAOYSA-N -1 3 386.372 -1.307 20 0 GAADHM O=C(NCCN1C(=O)CNC1=O)C(=O)NCc1cc(-c2nn[n-]n2)ccc1F ZINC001593080914 1076227605 /nfs/dbraw/zinc/22/76/05/1076227605.db2.gz HFZOGBWXGUSIIC-UHFFFAOYSA-N -1 3 390.335 -1.710 20 0 GAADHM O=C(NCCN1C(=O)CNC1=O)C(=O)NCc1cc(-c2nnn[n-]2)ccc1F ZINC001593080914 1076227602 /nfs/dbraw/zinc/22/76/02/1076227602.db2.gz HFZOGBWXGUSIIC-UHFFFAOYSA-N -1 3 390.335 -1.710 20 0 GAADHM O=C(NCCN1C(=O)CCC1=O)C(=O)NCc1cc(-c2nn[n-]n2)ccc1F ZINC001593080977 1076227595 /nfs/dbraw/zinc/22/75/95/1076227595.db2.gz OBQQULTUULQHAY-UHFFFAOYSA-N -1 3 389.347 -1.113 20 0 GAADHM O=C(NCCN1C(=O)CCC1=O)C(=O)NCc1cc(-c2nnn[n-]2)ccc1F ZINC001593080977 1076227592 /nfs/dbraw/zinc/22/75/92/1076227592.db2.gz OBQQULTUULQHAY-UHFFFAOYSA-N -1 3 389.347 -1.113 20 0 GAADHM O=C(NCCN1C(=O)CNC1=O)C(=O)Nc1ccc(-c2nn[n-]n2)c(F)c1 ZINC001593081173 1076227320 /nfs/dbraw/zinc/22/73/20/1076227320.db2.gz ZXUXFERZZKVIHT-UHFFFAOYSA-N -1 3 376.308 -1.388 20 0 GAADHM O=C(NCCN1C(=O)CNC1=O)C(=O)Nc1ccc(-c2nnn[n-]2)c(F)c1 ZINC001593081173 1076227314 /nfs/dbraw/zinc/22/73/14/1076227314.db2.gz 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O=C(NCCNc1ccc(-c2nnn[n-]2)cn1)C(=O)NC[C@@H]1COCCO1 ZINC001593087320 1076227873 /nfs/dbraw/zinc/22/78/73/1076227873.db2.gz WDERVHKRMQHLIT-LLVKDONJSA-N -1 3 376.377 -1.679 20 0 GAADHM O=C(NCCNc1ccc(-c2nn[n-]n2)cn1)C(=O)NC[C@H]1COCCO1 ZINC001593087321 1076227910 /nfs/dbraw/zinc/22/79/10/1076227910.db2.gz WDERVHKRMQHLIT-NSHDSACASA-N -1 3 376.377 -1.679 20 0 GAADHM O=C(NCCNc1ccc(-c2nnn[n-]2)cn1)C(=O)NC[C@H]1COCCO1 ZINC001593087321 1076227904 /nfs/dbraw/zinc/22/79/04/1076227904.db2.gz WDERVHKRMQHLIT-NSHDSACASA-N -1 3 376.377 -1.679 20 0 GAADHM O=C(NCCNc1ccc(-c2nn[n-]n2)nc1)C1(n2cnnn2)CCOCC1 ZINC001593090060 1076228224 /nfs/dbraw/zinc/22/82/24/1076228224.db2.gz VDJIBWOXEOXPJN-UHFFFAOYSA-N -1 3 385.392 -1.018 20 0 GAADHM O=C(NCCNc1ccc(-c2nnn[n-]2)nc1)C1(n2cnnn2)CCOCC1 ZINC001593090060 1076228220 /nfs/dbraw/zinc/22/82/20/1076228220.db2.gz VDJIBWOXEOXPJN-UHFFFAOYSA-N -1 3 385.392 -1.018 20 0 GAADHM O=C(NCCNc1ncccc1-c1nn[n-]n1)C(=O)N1C[C@@H]2C[C@H]1C[S@@]2=O ZINC001593093019 1076228280 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JOGPZTYLJWIHNF-FVPRTTFKSA-N -1 3 399.411 -1.080 20 0 GAADHM O=C(Cn1ccccc1=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001593177754 1076231428 /nfs/dbraw/zinc/23/14/28/1076231428.db2.gz JPELVGHBGBQKIN-CHWSQXEVSA-N -1 3 398.383 -1.642 20 0 GAADHM O=C(Cn1ccccc1=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001593177754 1076231424 /nfs/dbraw/zinc/23/14/24/1076231424.db2.gz JPELVGHBGBQKIN-CHWSQXEVSA-N -1 3 398.383 -1.642 20 0 GAADHM O=C(Cn1ccccc1=O)N1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001593177755 1076231855 /nfs/dbraw/zinc/23/18/55/1076231855.db2.gz JPELVGHBGBQKIN-OLZOCXBDSA-N -1 3 398.383 -1.642 20 0 GAADHM O=C(Cn1ccccc1=O)N1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001593177755 1076231850 /nfs/dbraw/zinc/23/18/50/1076231850.db2.gz JPELVGHBGBQKIN-OLZOCXBDSA-N -1 3 398.383 -1.642 20 0 GAADHM O=C(CCc1cncnc1)N1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001593177760 1076231614 /nfs/dbraw/zinc/23/16/14/1076231614.db2.gz JSOMKIPSXZVUHK-KGLIPLIRSA-N -1 3 397.399 -1.081 20 0 GAADHM O=C(CCc1cncnc1)N1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001593177760 1076231609 /nfs/dbraw/zinc/23/16/09/1076231609.db2.gz JSOMKIPSXZVUHK-KGLIPLIRSA-N -1 3 397.399 -1.081 20 0 GAADHM O=C(CCc1cncnc1)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001593177761 1076231777 /nfs/dbraw/zinc/23/17/77/1076231777.db2.gz JSOMKIPSXZVUHK-ZIAGYGMSSA-N -1 3 397.399 -1.081 20 0 GAADHM O=C(CCc1cncnc1)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001593177761 1076231772 /nfs/dbraw/zinc/23/17/72/1076231772.db2.gz JSOMKIPSXZVUHK-ZIAGYGMSSA-N -1 3 397.399 -1.081 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O)c1cc[n+]([O-])cc1 ZINC001593177762 1076231844 /nfs/dbraw/zinc/23/18/44/1076231844.db2.gz JTZSJDXBWGEEOC-OLZOCXBDSA-N -1 3 384.356 -1.557 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O)c1cc[n+]([O-])cc1 ZINC001593177762 1076231836 /nfs/dbraw/zinc/23/18/36/1076231836.db2.gz JTZSJDXBWGEEOC-OLZOCXBDSA-N -1 3 384.356 -1.557 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O)c1cnc2n1CCC2 ZINC001593177768 1076231811 /nfs/dbraw/zinc/23/18/11/1076231811.db2.gz KKZJFZSSXAJFBA-DGCLKSJQSA-N -1 3 397.399 -1.047 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O)c1cnc2n1CCC2 ZINC001593177768 1076231804 /nfs/dbraw/zinc/23/18/04/1076231804.db2.gz KKZJFZSSXAJFBA-DGCLKSJQSA-N -1 3 397.399 -1.047 20 0 GAADHM O=C(CCc1cncnc1)N1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001593177781 1076231742 /nfs/dbraw/zinc/23/17/42/1076231742.db2.gz LXHWEKSSLJTRDR-KGLIPLIRSA-N -1 3 397.399 -1.081 20 0 GAADHM O=C(CCc1cncnc1)N1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001593177781 1076231736 /nfs/dbraw/zinc/23/17/36/1076231736.db2.gz LXHWEKSSLJTRDR-KGLIPLIRSA-N -1 3 397.399 -1.081 20 0 GAADHM O=C(CCc1cncnc1)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001593177782 1076231685 /nfs/dbraw/zinc/23/16/85/1076231685.db2.gz LXHWEKSSLJTRDR-ZIAGYGMSSA-N -1 3 397.399 -1.081 20 0 GAADHM O=C(CCc1cncnc1)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001593177782 1076231680 /nfs/dbraw/zinc/23/16/80/1076231680.db2.gz LXHWEKSSLJTRDR-ZIAGYGMSSA-N -1 3 397.399 -1.081 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O)c1cnc2n1CCC2 ZINC001593177787 1076231572 /nfs/dbraw/zinc/23/15/72/1076231572.db2.gz MKTKJSZSHMGWOX-YPMHNXCESA-N -1 3 397.399 -1.047 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O)c1cnc2n1CCC2 ZINC001593177787 1076231570 /nfs/dbraw/zinc/23/15/70/1076231570.db2.gz MKTKJSZSHMGWOX-YPMHNXCESA-N -1 3 397.399 -1.047 20 0 GAADHM O=C(COc1cccnc1)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001593177794 1076231588 /nfs/dbraw/zinc/23/15/88/1076231588.db2.gz MRLFVNUBXXRJMJ-ZIAGYGMSSA-N -1 3 398.383 -1.030 20 0 GAADHM O=C(COc1cccnc1)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001593177794 1076231586 /nfs/dbraw/zinc/23/15/86/1076231586.db2.gz MRLFVNUBXXRJMJ-ZIAGYGMSSA-N -1 3 398.383 -1.030 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc[n+]([O-])cc2)C[C@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001593177798 1076231598 /nfs/dbraw/zinc/23/15/98/1076231598.db2.gz MXOJWTZJAXVNGM-CHWSQXEVSA-N -1 3 384.356 -1.557 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc[n+]([O-])cc2)C[C@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001593177798 1076231593 /nfs/dbraw/zinc/23/15/93/1076231593.db2.gz MXOJWTZJAXVNGM-CHWSQXEVSA-N -1 3 384.356 -1.557 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc[n+]([O-])cc2)C[C@@H]1O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001593177799 1076231631 /nfs/dbraw/zinc/23/16/31/1076231631.db2.gz MXOJWTZJAXVNGM-OLZOCXBDSA-N -1 3 384.356 -1.557 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc[n+]([O-])cc2)C[C@@H]1O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001593177799 1076231625 /nfs/dbraw/zinc/23/16/25/1076231625.db2.gz MXOJWTZJAXVNGM-OLZOCXBDSA-N -1 3 384.356 -1.557 20 0 GAADHM O=C(COc1cccnc1)N1C[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001593177816 1076231665 /nfs/dbraw/zinc/23/16/65/1076231665.db2.gz OKEJZMLAZFGROC-KGLIPLIRSA-N -1 3 398.383 -1.030 20 0 GAADHM O=C(COc1cccnc1)N1C[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001593177816 1076231659 /nfs/dbraw/zinc/23/16/59/1076231659.db2.gz OKEJZMLAZFGROC-KGLIPLIRSA-N -1 3 398.383 -1.030 20 0 GAADHM O=C(C[C@@H]1CCOC1)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001593177825 1076231704 /nfs/dbraw/zinc/23/17/04/1076231704.db2.gz PHNLMUSSDCZAAT-ZWKOPEQDSA-N -1 3 375.389 -1.077 20 0 GAADHM O=C(C[C@@H]1CCOC1)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001593177825 1076231699 /nfs/dbraw/zinc/23/16/99/1076231699.db2.gz PHNLMUSSDCZAAT-ZWKOPEQDSA-N -1 3 375.389 -1.077 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1O)c1cn2c(n1)CCC2 ZINC001593177827 1076231579 /nfs/dbraw/zinc/23/15/79/1076231579.db2.gz PLOCTXFAAVRFFN-DGCLKSJQSA-N -1 3 397.399 -1.047 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1O)c1cn2c(n1)CCC2 ZINC001593177827 1076231577 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O=C(CCn1ccnc1)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001593177843 1076231827 /nfs/dbraw/zinc/23/18/27/1076231827.db2.gz QPEUWDUHEIDPJI-CHWSQXEVSA-N -1 3 385.388 -1.217 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc3n(n2)CCO3)C[C@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001593177850 1076231647 /nfs/dbraw/zinc/23/16/47/1076231647.db2.gz RDQBKAWRLRPQHR-VXGBXAGGSA-N -1 3 399.371 -1.601 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc3n(n2)CCO3)C[C@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001593177850 1076231643 /nfs/dbraw/zinc/23/16/43/1076231643.db2.gz RDQBKAWRLRPQHR-VXGBXAGGSA-N -1 3 399.371 -1.601 20 0 GAADHM O=C(CCc1ncccn1)N1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001593177853 1076231723 /nfs/dbraw/zinc/23/17/23/1076231723.db2.gz RPULUJDSIJMJQO-OLZOCXBDSA-N -1 3 397.399 -1.081 20 0 GAADHM O=C(CCc1ncccn1)N1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001593177853 1076231716 /nfs/dbraw/zinc/23/17/16/1076231716.db2.gz RPULUJDSIJMJQO-OLZOCXBDSA-N -1 3 397.399 -1.081 20 0 GAADHM O=C(Cn1ccccc1=O)N1C[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001593177861 1076231763 /nfs/dbraw/zinc/23/17/63/1076231763.db2.gz SJVVDKZRWMSAOV-OLZOCXBDSA-N -1 3 398.383 -1.642 20 0 GAADHM O=C(Cn1ccccc1=O)N1C[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001593177861 1076231755 /nfs/dbraw/zinc/23/17/55/1076231755.db2.gz SJVVDKZRWMSAOV-OLZOCXBDSA-N -1 3 398.383 -1.642 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@@H]1O)c1cnn2c1CCC2 ZINC001593177872 1076232240 /nfs/dbraw/zinc/23/22/40/1076232240.db2.gz UGXRBWJGHXFOPR-OCCSQVGLSA-N -1 3 397.399 -1.047 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@@H]1O)c1cnn2c1CCC2 ZINC001593177872 1076232236 /nfs/dbraw/zinc/23/22/36/1076232236.db2.gz UGXRBWJGHXFOPR-OCCSQVGLSA-N -1 3 397.399 -1.047 20 0 GAADHM O=C(CCc1cnccn1)N1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001593177874 1076232169 /nfs/dbraw/zinc/23/21/69/1076232169.db2.gz UIAKIHDFZSVRFZ-KGLIPLIRSA-N -1 3 397.399 -1.081 20 0 GAADHM O=C(CCc1cnccn1)N1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001593177874 1076232166 /nfs/dbraw/zinc/23/21/66/1076232166.db2.gz UIAKIHDFZSVRFZ-KGLIPLIRSA-N -1 3 397.399 -1.081 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1O)c1cc2n(n1)CCO2 ZINC001593177879 1076232267 /nfs/dbraw/zinc/23/22/67/1076232267.db2.gz UQIGJLNSIIBYJC-VXGBXAGGSA-N -1 3 399.371 -1.601 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1O)c1cc2n(n1)CCO2 ZINC001593177879 1076232263 /nfs/dbraw/zinc/23/22/63/1076232263.db2.gz UQIGJLNSIIBYJC-VXGBXAGGSA-N -1 3 399.371 -1.601 20 0 GAADHM O=C(CCc1cncnc1)N1C[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001593177882 1076232225 /nfs/dbraw/zinc/23/22/25/1076232225.db2.gz UZLAGZDKABLAEA-KGLIPLIRSA-N -1 3 397.399 -1.081 20 0 GAADHM O=C(CCc1cncnc1)N1C[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001593177882 1076232222 /nfs/dbraw/zinc/23/22/22/1076232222.db2.gz UZLAGZDKABLAEA-KGLIPLIRSA-N -1 3 397.399 -1.081 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@H]23)C[C@H]1O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001593177884 1076232159 /nfs/dbraw/zinc/23/21/59/1076232159.db2.gz VBXKJYXEFUEULH-AYLJWORCSA-N -1 3 399.411 -1.080 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@H]23)C[C@H]1O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001593177884 1076232155 /nfs/dbraw/zinc/23/21/55/1076232155.db2.gz VBXKJYXEFUEULH-AYLJWORCSA-N -1 3 399.411 -1.080 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O)c1cc[n+]([O-])cc1 ZINC001593177894 1076232255 /nfs/dbraw/zinc/23/22/55/1076232255.db2.gz VTWBXFGENPRELM-CHWSQXEVSA-N -1 3 384.356 -1.557 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O)c1cc[n+]([O-])cc1 ZINC001593177894 1076232250 /nfs/dbraw/zinc/23/22/50/1076232250.db2.gz VTWBXFGENPRELM-CHWSQXEVSA-N -1 3 384.356 -1.557 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc[n+]([O-])cc2)C[C@H]1O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001593177903 1076232055 /nfs/dbraw/zinc/23/20/55/1076232055.db2.gz WMWJAAGQKKQCEV-CHWSQXEVSA-N -1 3 384.356 -1.557 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc[n+]([O-])cc2)C[C@H]1O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001593177903 1076232051 /nfs/dbraw/zinc/23/20/51/1076232051.db2.gz WMWJAAGQKKQCEV-CHWSQXEVSA-N -1 3 384.356 -1.557 20 0 GAADHM O=C(CCc1ccncn1)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001593177908 1076232281 /nfs/dbraw/zinc/23/22/81/1076232281.db2.gz XBPRYPJZJUPJFR-ZIAGYGMSSA-N -1 3 397.399 -1.081 20 0 GAADHM O=C(CCc1ccncn1)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001593177908 1076232278 /nfs/dbraw/zinc/23/22/78/1076232278.db2.gz XBPRYPJZJUPJFR-ZIAGYGMSSA-N -1 3 397.399 -1.081 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O)C1=COCCO1 ZINC001593177909 1076232130 /nfs/dbraw/zinc/23/21/30/1076232130.db2.gz XCPNHEHWDDGLIN-GHMZBOCLSA-N -1 3 375.345 -1.616 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O)C1=COCCO1 ZINC001593177909 1076232125 /nfs/dbraw/zinc/23/21/25/1076232125.db2.gz XCPNHEHWDDGLIN-GHMZBOCLSA-N -1 3 375.345 -1.616 20 0 GAADHM O=C(CC1OCCCO1)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001593177913 1076232103 /nfs/dbraw/zinc/23/21/03/1076232103.db2.gz XQLRUAARTKLQBK-VXGBXAGGSA-N -1 3 391.388 -1.351 20 0 GAADHM O=C(CC1OCCCO1)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001593177913 1076232097 /nfs/dbraw/zinc/23/20/97/1076232097.db2.gz XQLRUAARTKLQBK-VXGBXAGGSA-N -1 3 391.388 -1.351 20 0 GAADHM O=C(Cn1ccccc1=O)N1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001593177916 1076232182 /nfs/dbraw/zinc/23/21/82/1076232182.db2.gz XXFDEKZKPGWXIO-OLZOCXBDSA-N -1 3 398.383 -1.642 20 0 GAADHM O=C(Cn1ccccc1=O)N1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001593177916 1076232178 /nfs/dbraw/zinc/23/21/78/1076232178.db2.gz XXFDEKZKPGWXIO-OLZOCXBDSA-N -1 3 398.383 -1.642 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12 ZINC001593177921 1076232140 /nfs/dbraw/zinc/23/21/40/1076232140.db2.gz YXYIHJCFOXAAET-CMVJKJGOSA-N -1 3 399.411 -1.080 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@H]12 ZINC001593177921 1076232137 /nfs/dbraw/zinc/23/21/37/1076232137.db2.gz YXYIHJCFOXAAET-CMVJKJGOSA-N -1 3 399.411 -1.080 20 0 GAADHM O=C(N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nn2)C[C@@H]1O)c1n[nH]c2c1CCC2 ZINC001593177974 1076232117 /nfs/dbraw/zinc/23/21/17/1076232117.db2.gz DKBIYCPPUYJVMQ-NEPJUHHUSA-N -1 3 382.388 -1.152 20 0 GAADHM O=C(N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nn2)C[C@H]1O)[C@H]1CCc2c[nH]nc2C1 ZINC001593178046 1076232149 /nfs/dbraw/zinc/23/21/49/1076232149.db2.gz JQGJHAFAFZTPNL-CUOATXAZSA-N -1 3 396.415 -1.149 20 0 GAADHM O=C(N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nn2)C[C@H]1O)[C@@H]1CCc2c[nH]nc2C1 ZINC001593178047 1076232037 /nfs/dbraw/zinc/23/20/37/1076232037.db2.gz JQGJHAFAFZTPNL-OWYVNGRQSA-N -1 3 396.415 -1.149 20 0 GAADHM O=C(N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O)[C@@H]1CCc2nncn2C1 ZINC001593178080 1076232469 /nfs/dbraw/zinc/23/24/69/1076232469.db2.gz MXFGADABNCYOJL-LERXQTSPSA-N -1 3 396.415 -1.219 20 0 GAADHM O=C(N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O)[C@@H]1CCc2nncn2C1 ZINC001593178080 1076232467 /nfs/dbraw/zinc/23/24/67/1076232467.db2.gz MXFGADABNCYOJL-LERXQTSPSA-N -1 3 396.415 -1.219 20 0 GAADHM O=C(N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O)[C@H]1CCc2nncn2C1 ZINC001593178081 1076232658 /nfs/dbraw/zinc/23/26/58/1076232658.db2.gz MXFGADABNCYOJL-ZLKJLUDKSA-N -1 3 396.415 -1.219 20 0 GAADHM O=C(N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O)[C@H]1CCc2nncn2C1 ZINC001593178081 1076232656 /nfs/dbraw/zinc/23/26/56/1076232656.db2.gz MXFGADABNCYOJL-ZLKJLUDKSA-N -1 3 396.415 -1.219 20 0 GAADHM O=C(N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O)c1cccn2nnnc12 ZINC001593178126 1076232639 /nfs/dbraw/zinc/23/26/39/1076232639.db2.gz PDXBQQSPKKMXJS-CHWSQXEVSA-N -1 3 393.371 -1.321 20 0 GAADHM O=C(N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O)c1cccn2nnnc12 ZINC001593178126 1076232637 /nfs/dbraw/zinc/23/26/37/1076232637.db2.gz PDXBQQSPKKMXJS-CHWSQXEVSA-N -1 3 393.371 -1.321 20 0 GAADHM O=C(N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O)c1cn2c(n1)COCC2 ZINC001593178155 1076232684 /nfs/dbraw/zinc/23/26/84/1076232684.db2.gz CDJFALKRZLJWQN-YPMHNXCESA-N -1 3 397.399 -1.032 20 0 GAADHM O=C(N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O)c1cn2c(n1)COCC2 ZINC001593178155 1076232682 /nfs/dbraw/zinc/23/26/82/1076232682.db2.gz CDJFALKRZLJWQN-YPMHNXCESA-N -1 3 397.399 -1.032 20 0 GAADHM O=C(N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O)[C@@H]1CCS(=O)(=O)N1 ZINC001593178167 1076232625 /nfs/dbraw/zinc/23/26/25/1076232625.db2.gz DGQLOXHOFIRNKX-AXFHLTTASA-N -1 3 394.417 -2.381 20 0 GAADHM O=C(N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O)[C@@H]1CCS(=O)(=O)N1 ZINC001593178167 1076232619 /nfs/dbraw/zinc/23/26/19/1076232619.db2.gz DGQLOXHOFIRNKX-AXFHLTTASA-N -1 3 394.417 -2.381 20 0 GAADHM O=C(N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1O)[C@H]1CCS(=O)(=O)N1 ZINC001593178168 1076232491 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O=C(c1cccc(-c2nnn[n-]2)c1)N1CCN([C@@H]2CS(=O)(=O)C[C@@H]2O)CC1 ZINC001593350005 1076239555 /nfs/dbraw/zinc/23/95/55/1076239555.db2.gz XUIWGFCIWQLGLW-KGLIPLIRSA-N -1 3 392.441 -1.218 20 0 GAADHM O=C(c1cccc(-c2nn[n-]n2)c1)N1CCN([C@H]2CS(=O)(=O)C[C@H]2O)CC1 ZINC001593350007 1076239324 /nfs/dbraw/zinc/23/93/24/1076239324.db2.gz XUIWGFCIWQLGLW-UONOGXRCSA-N -1 3 392.441 -1.218 20 0 GAADHM O=C(c1cccc(-c2nnn[n-]2)c1)N1CCN([C@H]2CS(=O)(=O)C[C@H]2O)CC1 ZINC001593350007 1076239319 /nfs/dbraw/zinc/23/93/19/1076239319.db2.gz XUIWGFCIWQLGLW-UONOGXRCSA-N -1 3 392.441 -1.218 20 0 GAADHM O=C(c1cccc(-c2nn[n-]n2)c1)N1CCN([C@@H]2CS(=O)(=O)C[C@H]2O)CC1 ZINC001593350009 1076239542 /nfs/dbraw/zinc/23/95/42/1076239542.db2.gz XUIWGFCIWQLGLW-ZIAGYGMSSA-N -1 3 392.441 -1.218 20 0 GAADHM O=C(c1cccc(-c2nnn[n-]2)c1)N1CCN([C@@H]2CS(=O)(=O)C[C@H]2O)CC1 ZINC001593350009 1076239536 /nfs/dbraw/zinc/23/95/36/1076239536.db2.gz XUIWGFCIWQLGLW-ZIAGYGMSSA-N -1 3 392.441 -1.218 20 0 GAADHM O=C(c1cnn(C[C@@H](O)CO)c1)N1CCN(c2cnccc2-c2nn[n-]n2)CC1 ZINC001593367783 1076239335 /nfs/dbraw/zinc/23/93/35/1076239335.db2.gz PVBDCPIUAVWLOY-CYBMUJFWSA-N -1 3 399.415 -1.226 20 0 GAADHM O=C(c1cnn(C[C@@H](O)CO)c1)N1CCN(c2cnccc2-c2nnn[n-]2)CC1 ZINC001593367783 1076239332 /nfs/dbraw/zinc/23/93/32/1076239332.db2.gz PVBDCPIUAVWLOY-CYBMUJFWSA-N -1 3 399.415 -1.226 20 0 GAADHM O=C(c1cnn(C[C@H](O)CO)c1)N1CCN(c2cnccc2-c2nn[n-]n2)CC1 ZINC001593367785 1076239375 /nfs/dbraw/zinc/23/93/75/1076239375.db2.gz PVBDCPIUAVWLOY-ZDUSSCGKSA-N -1 3 399.415 -1.226 20 0 GAADHM O=C(c1cnn(C[C@H](O)CO)c1)N1CCN(c2cnccc2-c2nnn[n-]2)CC1 ZINC001593367785 1076239372 /nfs/dbraw/zinc/23/93/72/1076239372.db2.gz PVBDCPIUAVWLOY-ZDUSSCGKSA-N -1 3 399.415 -1.226 20 0 GAADHM O=C(c1cnn(C[C@@H](O)CO)c1)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001593367834 1076239362 /nfs/dbraw/zinc/23/93/62/1076239362.db2.gz SMUXBKLSOGICFU-CYBMUJFWSA-N -1 3 399.415 -1.226 20 0 GAADHM O=C(c1cnn(C[C@@H](O)CO)c1)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001593367834 1076239357 /nfs/dbraw/zinc/23/93/57/1076239357.db2.gz SMUXBKLSOGICFU-CYBMUJFWSA-N -1 3 399.415 -1.226 20 0 GAADHM O=C(c1cnn(C[C@H](O)CO)c1)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001593367835 1076239309 /nfs/dbraw/zinc/23/93/09/1076239309.db2.gz SMUXBKLSOGICFU-ZDUSSCGKSA-N -1 3 399.415 -1.226 20 0 GAADHM O=C(c1cnn(C[C@H](O)CO)c1)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001593367835 1076239306 /nfs/dbraw/zinc/23/93/06/1076239306.db2.gz SMUXBKLSOGICFU-ZDUSSCGKSA-N -1 3 399.415 -1.226 20 0 GAADHM O=C(c1nc2n(n1)CCCN2)N1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001593371417 1076239615 /nfs/dbraw/zinc/23/96/15/1076239615.db2.gz CSUKUCNNFWRPCC-UHFFFAOYSA-N -1 3 381.404 -1.111 20 0 GAADHM O=C(c1nc2n(n1)CCCN2)N1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001593371417 1076239610 /nfs/dbraw/zinc/23/96/10/1076239610.db2.gz CSUKUCNNFWRPCC-UHFFFAOYSA-N -1 3 381.404 -1.111 20 0 GAADHM O=C(c1nc2n(n1)CCCN2)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1 ZINC001593371419 1076239504 /nfs/dbraw/zinc/23/95/04/1076239504.db2.gz CWUQNAGFYPEABN-UHFFFAOYSA-N -1 3 381.404 -1.111 20 0 GAADHM O=C(c1nc2n(n1)CCCN2)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1 ZINC001593371419 1076239497 /nfs/dbraw/zinc/23/94/97/1076239497.db2.gz CWUQNAGFYPEABN-UHFFFAOYSA-N -1 3 381.404 -1.111 20 0 GAADHM O=C([C@H]1CC(=O)N1)N1CCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001593377120 1076239918 /nfs/dbraw/zinc/23/99/18/1076239918.db2.gz AXWJPLTUFIEFKG-GFCCVEGCSA-N -1 3 391.413 -1.412 20 0 GAADHM O=C([C@H]1CC(=O)N1)N1CCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001593377120 1076239915 /nfs/dbraw/zinc/23/99/15/1076239915.db2.gz AXWJPLTUFIEFKG-GFCCVEGCSA-N -1 3 391.413 -1.412 20 0 GAADHM O=C([C@@H]1CC(=O)N1)N1CCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001593377130 1076239825 /nfs/dbraw/zinc/23/98/25/1076239825.db2.gz AXWJPLTUFIEFKG-LBPRGKRZSA-N -1 3 391.413 -1.412 20 0 GAADHM O=C([C@@H]1CC(=O)N1)N1CCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001593377130 1076239819 /nfs/dbraw/zinc/23/98/19/1076239819.db2.gz AXWJPLTUFIEFKG-LBPRGKRZSA-N -1 3 391.413 -1.412 20 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O=C(C1CC(=O)NC(=O)C1)N(CCO)CCNc1ccc(-c2nnn[n-]2)nc1 ZINC001593378190 1076240458 /nfs/dbraw/zinc/24/04/58/1076240458.db2.gz PMMMUAWIVQTRIQ-UHFFFAOYSA-N -1 3 388.388 -1.453 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)C2CC(=O)NC(=O)C2)C1)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001593378342 1076240403 /nfs/dbraw/zinc/24/04/03/1076240403.db2.gz SVSUYTDQGFVCHQ-VIFPVBQESA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)C2CC(=O)NC(=O)C2)C1)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001593378342 1076240399 /nfs/dbraw/zinc/24/03/99/1076240399.db2.gz SVSUYTDQGFVCHQ-VIFPVBQESA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)C2CC(=O)NC(=O)C2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001593378672 1076240481 /nfs/dbraw/zinc/24/04/81/1076240481.db2.gz YPXVESNHBLHWGS-JTQLQIEISA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)C2CC(=O)NC(=O)C2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001593378672 1076240479 /nfs/dbraw/zinc/24/04/79/1076240479.db2.gz YPXVESNHBLHWGS-JTQLQIEISA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)C2CC(=O)NC(=O)C2)C1)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001593378673 1076240499 /nfs/dbraw/zinc/24/04/99/1076240499.db2.gz YPXVESNHBLHWGS-SNVBAGLBSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)C2CC(=O)NC(=O)C2)C1)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001593378673 1076240497 /nfs/dbraw/zinc/24/04/97/1076240497.db2.gz YPXVESNHBLHWGS-SNVBAGLBSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C1CC(=O)NC(=O)C1)N(CCO)CCNc1ccc(-c2nn[n-]n2)cn1 ZINC001593378761 1076240454 /nfs/dbraw/zinc/24/04/54/1076240454.db2.gz ZQQGPJMERLZRDV-UHFFFAOYSA-N -1 3 388.388 -1.453 20 0 GAADHM O=C(C1CC(=O)NC(=O)C1)N(CCO)CCNc1ccc(-c2nnn[n-]2)cn1 ZINC001593378761 1076240451 /nfs/dbraw/zinc/24/04/51/1076240451.db2.gz ZQQGPJMERLZRDV-UHFFFAOYSA-N -1 3 388.388 -1.453 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)C1CC(=O)NC(=O)C1 ZINC001593380595 1076240440 /nfs/dbraw/zinc/24/04/40/1076240440.db2.gz BEQASZCDVMEXJH-JTQLQIEISA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)C1CC(=O)NC(=O)C1 ZINC001593380595 1076240438 /nfs/dbraw/zinc/24/04/38/1076240438.db2.gz BEQASZCDVMEXJH-JTQLQIEISA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(NC[C@H](O)CNc1cccc(F)c1-c1nn[n-]n1)C1CC(=O)NC(=O)C1 ZINC001593380598 1076240432 /nfs/dbraw/zinc/24/04/32/1076240432.db2.gz BEQVPYKODRLDEM-SECBINFHSA-N -1 3 391.363 -1.052 20 0 GAADHM O=C(NC[C@H](O)CNc1cccc(F)c1-c1nnn[n-]1)C1CC(=O)NC(=O)C1 ZINC001593380598 1076240428 /nfs/dbraw/zinc/24/04/28/1076240428.db2.gz BEQVPYKODRLDEM-SECBINFHSA-N -1 3 391.363 -1.052 20 0 GAADHM O=C(NC[C@@H](O)CNc1cccc(F)c1-c1nn[n-]n1)C1CC(=O)NC(=O)C1 ZINC001593380617 1076240472 /nfs/dbraw/zinc/24/04/72/1076240472.db2.gz BEQVPYKODRLDEM-VIFPVBQESA-N -1 3 391.363 -1.052 20 0 GAADHM O=C(NC[C@@H](O)CNc1cccc(F)c1-c1nnn[n-]1)C1CC(=O)NC(=O)C1 ZINC001593380617 1076240469 /nfs/dbraw/zinc/24/04/69/1076240469.db2.gz BEQVPYKODRLDEM-VIFPVBQESA-N -1 3 391.363 -1.052 20 0 GAADHM O=C(N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O)C1CC(=O)NC(=O)C1 ZINC001593380971 1076240446 /nfs/dbraw/zinc/24/04/46/1076240446.db2.gz DSBGYGGTGUQUGU-MNOVXSKESA-N -1 3 386.372 -2.020 20 0 GAADHM O=C(N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O)C1CC(=O)NC(=O)C1 ZINC001593380971 1076240444 /nfs/dbraw/zinc/24/04/44/1076240444.db2.gz DSBGYGGTGUQUGU-MNOVXSKESA-N -1 3 386.372 -2.020 20 0 GAADHM O=C(N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O)C1CC(=O)NC(=O)C1 ZINC001593380972 1076240354 /nfs/dbraw/zinc/24/03/54/1076240354.db2.gz DTYKFXOAUJYESI-MNOVXSKESA-N -1 3 386.372 -2.020 20 0 GAADHM O=C(N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O)C1CC(=O)NC(=O)C1 ZINC001593380972 1076240351 /nfs/dbraw/zinc/24/03/51/1076240351.db2.gz DTYKFXOAUJYESI-MNOVXSKESA-N -1 3 386.372 -2.020 20 0 GAADHM O=C(N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O)C1CC(=O)NC(=O)C1 ZINC001593381118 1076240391 /nfs/dbraw/zinc/24/03/91/1076240391.db2.gz GXILBGBRLUTEAI-VXGBXAGGSA-N -1 3 386.372 -2.020 20 0 GAADHM O=C(N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O)C1CC(=O)NC(=O)C1 ZINC001593381118 1076240389 /nfs/dbraw/zinc/24/03/89/1076240389.db2.gz GXILBGBRLUTEAI-VXGBXAGGSA-N -1 3 386.372 -2.020 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)C1CC(=O)NC(=O)C1 ZINC001593381680 1076240809 /nfs/dbraw/zinc/24/08/09/1076240809.db2.gz NOTKFBATFXAOMD-SECBINFHSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)C1CC(=O)NC(=O)C1 ZINC001593381680 1076240808 /nfs/dbraw/zinc/24/08/08/1076240808.db2.gz NOTKFBATFXAOMD-SECBINFHSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)C1CC(=O)NC(=O)C1 ZINC001593381681 1076240867 /nfs/dbraw/zinc/24/08/67/1076240867.db2.gz NOTKFBATFXAOMD-VIFPVBQESA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)C1CC(=O)NC(=O)C1 ZINC001593381681 1076240862 /nfs/dbraw/zinc/24/08/62/1076240862.db2.gz NOTKFBATFXAOMD-VIFPVBQESA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O)[C@@H]1CCNC(=O)C1 ZINC001593381977 1076241270 /nfs/dbraw/zinc/24/12/70/1076241270.db2.gz RCZOJGYBZVJZHH-GGZOMVNGSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O)[C@@H]1CCNC(=O)C1 ZINC001593381977 1076241262 /nfs/dbraw/zinc/24/12/62/1076241262.db2.gz RCZOJGYBZVJZHH-GGZOMVNGSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O)[C@H]1CCNC(=O)C1 ZINC001593381978 1076241345 /nfs/dbraw/zinc/24/13/45/1076241345.db2.gz RCZOJGYBZVJZHH-XXILOJSOSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O)[C@H]1CCNC(=O)C1 ZINC001593381978 1076241340 /nfs/dbraw/zinc/24/13/40/1076241340.db2.gz RCZOJGYBZVJZHH-XXILOJSOSA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N(CCO)CCNc1ccc(-c2nn[n-]n2)cn1 ZINC001593382434 1076241304 /nfs/dbraw/zinc/24/13/04/1076241304.db2.gz AOCPAPVLQWFVNA-LLVKDONJSA-N -1 3 388.388 -1.453 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N(CCO)CCNc1ccc(-c2nnn[n-]2)cn1 ZINC001593382434 1076241298 /nfs/dbraw/zinc/24/12/98/1076241298.db2.gz AOCPAPVLQWFVNA-LLVKDONJSA-N -1 3 388.388 -1.453 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N(CCO)CCNc1ccc(-c2nn[n-]n2)cn1 ZINC001593382435 1076241705 /nfs/dbraw/zinc/24/17/05/1076241705.db2.gz AOCPAPVLQWFVNA-NSHDSACASA-N -1 3 388.388 -1.453 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N(CCO)CCNc1ccc(-c2nnn[n-]2)cn1 ZINC001593382435 1076241701 /nfs/dbraw/zinc/24/17/01/1076241701.db2.gz AOCPAPVLQWFVNA-NSHDSACASA-N -1 3 388.388 -1.453 20 0 GAADHM O=C(N[C@@H]1[C@H]2CN(c3ccc(-c4nn[n-]n4)nc3)C[C@H]21)C1CC(=O)NC(=O)C1 ZINC001593382873 1076241613 /nfs/dbraw/zinc/24/16/13/1076241613.db2.gz JXEQYFTUVJUPOI-HBYGRHMLSA-N -1 3 382.384 -1.135 20 0 GAADHM O=C(N[C@@H]1[C@H]2CN(c3ccc(-c4nnn[n-]4)nc3)C[C@H]21)C1CC(=O)NC(=O)C1 ZINC001593382873 1076241609 /nfs/dbraw/zinc/24/16/09/1076241609.db2.gz JXEQYFTUVJUPOI-HBYGRHMLSA-N -1 3 382.384 -1.135 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N1CC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001593383008 1076241736 /nfs/dbraw/zinc/24/17/36/1076241736.db2.gz LLKJZPJTADPHMT-BDAKNGLRSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N1CC[C@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001593383008 1076241733 /nfs/dbraw/zinc/24/17/33/1076241733.db2.gz LLKJZPJTADPHMT-BDAKNGLRSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N1CC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001593383009 1076241601 /nfs/dbraw/zinc/24/16/01/1076241601.db2.gz LLKJZPJTADPHMT-DTWKUNHWSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N1CC[C@@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001593383009 1076241595 /nfs/dbraw/zinc/24/15/95/1076241595.db2.gz LLKJZPJTADPHMT-DTWKUNHWSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N1CC[C@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001593383011 1076241636 /nfs/dbraw/zinc/24/16/36/1076241636.db2.gz LLKJZPJTADPHMT-IUCAKERBSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N1CC[C@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001593383011 1076241632 /nfs/dbraw/zinc/24/16/32/1076241632.db2.gz LLKJZPJTADPHMT-IUCAKERBSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N1CC[C@@H]1CNC(=O)c1ccc(-c2nn[n-]n2)[nH]1 ZINC001593383013 1076241587 /nfs/dbraw/zinc/24/15/87/1076241587.db2.gz LLKJZPJTADPHMT-RKDXNWHRSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N1CC[C@@H]1CNC(=O)c1ccc(-c2nnn[n-]2)[nH]1 ZINC001593383013 1076241583 /nfs/dbraw/zinc/24/15/83/1076241583.db2.gz LLKJZPJTADPHMT-RKDXNWHRSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N1CC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001593383017 1076241625 /nfs/dbraw/zinc/24/16/25/1076241625.db2.gz LOTIUYGVCCLPPL-PSASIEDQSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N1CC[C@@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001593383017 1076241622 /nfs/dbraw/zinc/24/16/22/1076241622.db2.gz LOTIUYGVCCLPPL-PSASIEDQSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N1CC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001593383018 1076241801 /nfs/dbraw/zinc/24/18/01/1076241801.db2.gz LOTIUYGVCCLPPL-SCZZXKLOSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N1CC[C@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001593383018 1076241798 /nfs/dbraw/zinc/24/17/98/1076241798.db2.gz LOTIUYGVCCLPPL-SCZZXKLOSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N1CC[C@@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001593383019 1076241766 /nfs/dbraw/zinc/24/17/66/1076241766.db2.gz LOTIUYGVCCLPPL-WCBMZHEXSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N1CC[C@@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001593383019 1076241763 /nfs/dbraw/zinc/24/17/63/1076241763.db2.gz LOTIUYGVCCLPPL-WCBMZHEXSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N1CC[C@H]1CNC(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001593383020 1076241675 /nfs/dbraw/zinc/24/16/75/1076241675.db2.gz LOTIUYGVCCLPPL-WPRPVWTQSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N1CC[C@H]1CNC(=O)c1c[nH]c(-c2nnn[n-]2)c1 ZINC001593383020 1076241673 /nfs/dbraw/zinc/24/16/73/1076241673.db2.gz LOTIUYGVCCLPPL-WPRPVWTQSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(N[C@@H]1[C@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]21)C1CC(=O)NC(=O)C1 ZINC001593383027 1076241749 /nfs/dbraw/zinc/24/17/49/1076241749.db2.gz LYGOQENXAFTPJG-YABSGUDNSA-N -1 3 382.384 -1.135 20 0 GAADHM O=C(N[C@@H]1[C@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]21)C1CC(=O)NC(=O)C1 ZINC001593383027 1076241745 /nfs/dbraw/zinc/24/17/45/1076241745.db2.gz LYGOQENXAFTPJG-YABSGUDNSA-N -1 3 382.384 -1.135 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N(CCO)CCNc1ccc(-c2nn[n-]n2)nc1 ZINC001593383083 1076241758 /nfs/dbraw/zinc/24/17/58/1076241758.db2.gz OGSSWLJQYYSKIE-JTQLQIEISA-N -1 3 388.388 -1.453 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N(CCO)CCNc1ccc(-c2nnn[n-]2)nc1 ZINC001593383083 1076241755 /nfs/dbraw/zinc/24/17/55/1076241755.db2.gz OGSSWLJQYYSKIE-JTQLQIEISA-N -1 3 388.388 -1.453 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N(CCO)CCNc1ccc(-c2nn[n-]n2)nc1 ZINC001593383084 1076241648 /nfs/dbraw/zinc/24/16/48/1076241648.db2.gz OGSSWLJQYYSKIE-SNVBAGLBSA-N -1 3 388.388 -1.453 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N(CCO)CCNc1ccc(-c2nnn[n-]2)nc1 ZINC001593383084 1076241644 /nfs/dbraw/zinc/24/16/44/1076241644.db2.gz OGSSWLJQYYSKIE-SNVBAGLBSA-N -1 3 388.388 -1.453 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N[C@@H]1[C@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]21 ZINC001593384813 1076242214 /nfs/dbraw/zinc/24/22/14/1076242214.db2.gz GDJKFPYNKFRIEI-GJTWSCIVSA-N -1 3 382.384 -1.135 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N[C@@H]1[C@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]21 ZINC001593384813 1076242211 /nfs/dbraw/zinc/24/22/11/1076242211.db2.gz GDJKFPYNKFRIEI-GJTWSCIVSA-N -1 3 382.384 -1.135 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N[C@@H]1[C@H]2CN(c3ncccc3-c3nn[n-]n3)C[C@H]21 ZINC001593384814 1076242192 /nfs/dbraw/zinc/24/21/92/1076242192.db2.gz GDJKFPYNKFRIEI-HJUHTLPRSA-N -1 3 382.384 -1.135 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N[C@@H]1[C@H]2CN(c3ncccc3-c3nnn[n-]3)C[C@H]21 ZINC001593384814 1076242187 /nfs/dbraw/zinc/24/21/87/1076242187.db2.gz GDJKFPYNKFRIEI-HJUHTLPRSA-N -1 3 382.384 -1.135 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001593385238 1076242629 /nfs/dbraw/zinc/24/26/29/1076242629.db2.gz IAIPHWZTXKSLGO-BDAKNGLRSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001593385238 1076242627 /nfs/dbraw/zinc/24/26/27/1076242627.db2.gz IAIPHWZTXKSLGO-BDAKNGLRSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001593385241 1076242463 /nfs/dbraw/zinc/24/24/63/1076242463.db2.gz IAIPHWZTXKSLGO-DTWKUNHWSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001593385241 1076242460 /nfs/dbraw/zinc/24/24/60/1076242460.db2.gz IAIPHWZTXKSLGO-DTWKUNHWSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N[C@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001593385243 1076242533 /nfs/dbraw/zinc/24/25/33/1076242533.db2.gz IAIPHWZTXKSLGO-IUCAKERBSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N[C@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001593385243 1076242528 /nfs/dbraw/zinc/24/25/28/1076242528.db2.gz IAIPHWZTXKSLGO-IUCAKERBSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001593385245 1076242513 /nfs/dbraw/zinc/24/25/13/1076242513.db2.gz IAIPHWZTXKSLGO-RKDXNWHRSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N[C@@H]1CCN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001593385245 1076242510 /nfs/dbraw/zinc/24/25/10/1076242510.db2.gz IAIPHWZTXKSLGO-RKDXNWHRSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001593385798 1076242589 /nfs/dbraw/zinc/24/25/89/1076242589.db2.gz OBRHSDSYESDRAM-PSASIEDQSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001593385798 1076242587 /nfs/dbraw/zinc/24/25/87/1076242587.db2.gz OBRHSDSYESDRAM-PSASIEDQSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001593385799 1076242521 /nfs/dbraw/zinc/24/25/21/1076242521.db2.gz OBRHSDSYESDRAM-SCZZXKLOSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001593385799 1076242519 /nfs/dbraw/zinc/24/25/19/1076242519.db2.gz OBRHSDSYESDRAM-SCZZXKLOSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N1CC[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001593385800 1076242607 /nfs/dbraw/zinc/24/26/07/1076242607.db2.gz OBRHSDSYESDRAM-WCBMZHEXSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N1CC[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001593385800 1076242602 /nfs/dbraw/zinc/24/26/02/1076242602.db2.gz OBRHSDSYESDRAM-WCBMZHEXSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N1CC[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001593385801 1076242504 /nfs/dbraw/zinc/24/25/04/1076242504.db2.gz OBRHSDSYESDRAM-WPRPVWTQSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N1CC[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001593385801 1076242499 /nfs/dbraw/zinc/24/24/99/1076242499.db2.gz OBRHSDSYESDRAM-WPRPVWTQSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001593385804 1076242663 /nfs/dbraw/zinc/24/26/63/1076242663.db2.gz OEJZTOHMZBMHTM-SCZZXKLOSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@H]1CC(=O)NC1=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001593385804 1076242658 /nfs/dbraw/zinc/24/26/58/1076242658.db2.gz OEJZTOHMZBMHTM-SCZZXKLOSA-N -1 3 386.372 -1.422 20 0 GAADHM O=C(C[C@@H]1CC(=O)NC1=O)N1CC[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001593385805 1076242547 /nfs/dbraw/zinc/24/25/47/1076242547.db2.gz OEJZTOHMZBMHTM-WPRPVWTQSA-N -1 3 386.372 -1.422 20 0 GAADHM 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ZINC001593395443 1076244757 /nfs/dbraw/zinc/24/47/57/1076244757.db2.gz LGDGTJOHGUMBTL-YUSALJHKSA-N -1 3 388.388 -1.835 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O)[C@H]1CCCC(=O)N1 ZINC001593395443 1076244755 /nfs/dbraw/zinc/24/47/55/1076244755.db2.gz LGDGTJOHGUMBTL-YUSALJHKSA-N -1 3 388.388 -1.835 20 0 GAADHM O=C(CNS(=O)(=O)c1ccccc1-c1nn[n-]n1)OC[C@@H]1CCC(=O)N1 ZINC001593395783 1076244510 /nfs/dbraw/zinc/24/45/10/1076244510.db2.gz PWJGGIFMVXEWIB-VIFPVBQESA-N -1 3 380.386 -1.033 20 0 GAADHM O=C(CNS(=O)(=O)c1ccccc1-c1nnn[n-]1)OC[C@@H]1CCC(=O)N1 ZINC001593395783 1076244503 /nfs/dbraw/zinc/24/45/03/1076244503.db2.gz PWJGGIFMVXEWIB-VIFPVBQESA-N -1 3 380.386 -1.033 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)OC[C@@H]1CCC(=O)N1 ZINC001593395838 1076244723 /nfs/dbraw/zinc/24/47/23/1076244723.db2.gz VNXRNSWPXCATHL-JTQLQIEISA-N -1 3 380.386 -1.033 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)OC[C@@H]1CCC(=O)N1 ZINC001593395838 1076244719 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GAADHM O=C1CN(CCS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)C2(COC2)CN1 ZINC001593397363 1076245524 /nfs/dbraw/zinc/24/55/24/1076245524.db2.gz FLKAVRWQJYVPIE-UHFFFAOYSA-N -1 3 378.414 -1.159 20 0 GAADHM O=C1CN(CCS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)C2(COC2)CN1 ZINC001593397363 1076245522 /nfs/dbraw/zinc/24/55/22/1076245522.db2.gz FLKAVRWQJYVPIE-UHFFFAOYSA-N -1 3 378.414 -1.159 20 0 GAADHM O=C(CN1CC(=O)NC1=O)N1CCN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CC1 ZINC001593397390 1076245533 /nfs/dbraw/zinc/24/55/33/1076245533.db2.gz GHRBVVMLYBEMGK-UHFFFAOYSA-N -1 3 387.360 -1.969 20 0 GAADHM O=C(CN1CC(=O)NC1=O)N1CCN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CC1 ZINC001593397390 1076245529 /nfs/dbraw/zinc/24/55/29/1076245529.db2.gz GHRBVVMLYBEMGK-UHFFFAOYSA-N -1 3 387.360 -1.969 20 0 GAADHM O=C(CN1CCNC(=O)C1)N[C@@H]1C[C@H]2CC[C@@H]1N2c1ccc(-c2nn[n-]n2)nc1 ZINC001593397464 1076245690 /nfs/dbraw/zinc/24/56/90/1076245690.db2.gz KGKPBJSRYDDMRM-DFBGVHRSSA-N -1 3 397.443 -1.081 20 0 GAADHM 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ZINC001602941203 1076275329 /nfs/dbraw/zinc/27/53/29/1076275329.db2.gz SVGNCYSLZQNSMN-LBPRGKRZSA-N -1 3 376.421 -1.038 20 0 GAADHM CC(=O)NCC(=O)N(C)C[C@@H](O)CN(C)c1ccc(-c2nnn[n-]2)c(C)n1 ZINC001602941203 1076275326 /nfs/dbraw/zinc/27/53/26/1076275326.db2.gz SVGNCYSLZQNSMN-LBPRGKRZSA-N -1 3 376.421 -1.038 20 0 GAADHM CC(=O)NCC(=O)N(C)C[C@@H](O)CN(C)c1nc(C)ccc1-c1nn[n-]n1 ZINC001602941387 1076275187 /nfs/dbraw/zinc/27/51/87/1076275187.db2.gz ZLUXMOMKCLTVNO-GFCCVEGCSA-N -1 3 376.421 -1.038 20 0 GAADHM CC(=O)NCC(=O)N(C)C[C@@H](O)CN(C)c1nc(C)ccc1-c1nnn[n-]1 ZINC001602941387 1076275184 /nfs/dbraw/zinc/27/51/84/1076275184.db2.gz ZLUXMOMKCLTVNO-GFCCVEGCSA-N -1 3 376.421 -1.038 20 0 GAADHM CC(=O)NCC(=O)N(C)C[C@H](O)CN(C)c1nc(C)ccc1-c1nn[n-]n1 ZINC001602941388 1076275258 /nfs/dbraw/zinc/27/52/58/1076275258.db2.gz ZLUXMOMKCLTVNO-LBPRGKRZSA-N -1 3 376.421 -1.038 20 0 GAADHM CC(=O)NCC(=O)N(C)C[C@H](O)CN(C)c1nc(C)ccc1-c1nnn[n-]1 ZINC001602941388 1076275254 /nfs/dbraw/zinc/27/52/54/1076275254.db2.gz ZLUXMOMKCLTVNO-LBPRGKRZSA-N -1 3 376.421 -1.038 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H]1C[C@H](Nc2ncccc2-c2nn[n-]n2)C1 ZINC001602941969 1076275342 /nfs/dbraw/zinc/27/53/42/1076275342.db2.gz AOKDYOALOTVVSI-XYPYZODXSA-N -1 3 387.404 -1.427 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H]1C[C@H](Nc2ncccc2-c2nnn[n-]2)C1 ZINC001602941969 1076275338 /nfs/dbraw/zinc/27/53/38/1076275338.db2.gz AOKDYOALOTVVSI-XYPYZODXSA-N -1 3 387.404 -1.427 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)CCCNc1ccc(-c2nn[n-]n2)cn1 ZINC001602942031 1076275315 /nfs/dbraw/zinc/27/53/15/1076275315.db2.gz BRYQCUXTOHSMOP-UHFFFAOYSA-N -1 3 389.420 -1.226 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)CCCNc1ccc(-c2nnn[n-]2)cn1 ZINC001602942031 1076275311 /nfs/dbraw/zinc/27/53/11/1076275311.db2.gz BRYQCUXTOHSMOP-UHFFFAOYSA-N -1 3 389.420 -1.226 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)N(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001602942089 1076275352 /nfs/dbraw/zinc/27/53/52/1076275352.db2.gz CWYYNBKLPUSQMR-JTQLQIEISA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@H](C)N(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001602942089 1076275350 /nfs/dbraw/zinc/27/53/50/1076275350.db2.gz CWYYNBKLPUSQMR-JTQLQIEISA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)N(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001602942090 1076275284 /nfs/dbraw/zinc/27/52/84/1076275284.db2.gz CWYYNBKLPUSQMR-SNVBAGLBSA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC[C@@H](C)N(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001602942090 1076275280 /nfs/dbraw/zinc/27/52/80/1076275280.db2.gz CWYYNBKLPUSQMR-SNVBAGLBSA-N -1 3 389.420 -1.545 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCC[C@@H](C)Nc1ccc(-c2nn[n-]n2)cn1 ZINC001602942371 1076275579 /nfs/dbraw/zinc/27/55/79/1076275579.db2.gz IAWQMKQJAZWWIB-SNVBAGLBSA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCC[C@@H](C)Nc1ccc(-c2nnn[n-]2)cn1 ZINC001602942371 1076275573 /nfs/dbraw/zinc/27/55/73/1076275573.db2.gz IAWQMKQJAZWWIB-SNVBAGLBSA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)O[C@H](C)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC001602942385 1076275474 /nfs/dbraw/zinc/27/54/74/1076275474.db2.gz IPCHCNCSYFGRDP-SECBINFHSA-N -1 3 389.372 -1.011 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)O[C@H](C)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC001602942385 1076275473 /nfs/dbraw/zinc/27/54/73/1076275473.db2.gz IPCHCNCSYFGRDP-SECBINFHSA-N -1 3 389.372 -1.011 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)O[C@@H](C)C(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC001602942386 1076275525 /nfs/dbraw/zinc/27/55/25/1076275525.db2.gz IPCHCNCSYFGRDP-VIFPVBQESA-N -1 3 389.372 -1.011 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)O[C@@H](C)C(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC001602942386 1076275522 /nfs/dbraw/zinc/27/55/22/1076275522.db2.gz IPCHCNCSYFGRDP-VIFPVBQESA-N -1 3 389.372 -1.011 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CCN(c2ccsc2-c2nnn[n-]2)CC1 ZINC001602942403 1076275514 /nfs/dbraw/zinc/27/55/14/1076275514.db2.gz KCHAHHXHALAVQS-UHFFFAOYSA-N -1 3 392.445 -1.171 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCNc1ncc(-c2nn[n-]n2)cc1F ZINC001602942407 1076275671 /nfs/dbraw/zinc/27/56/71/1076275671.db2.gz KKEYGGAWGOLUDS-UHFFFAOYSA-N -1 3 379.356 -1.819 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCNc1ncc(-c2nnn[n-]2)cc1F ZINC001602942407 1076275665 /nfs/dbraw/zinc/27/56/65/1076275665.db2.gz KKEYGGAWGOLUDS-UHFFFAOYSA-N -1 3 379.356 -1.819 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)CCNc1ccc(-c2nn[n-]n2)nc1 ZINC001602942551 1076275634 /nfs/dbraw/zinc/27/56/34/1076275634.db2.gz SLGYFXXSDMHYIF-UHFFFAOYSA-N -1 3 375.393 -1.616 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N(C)CCNc1ccc(-c2nnn[n-]2)nc1 ZINC001602942551 1076275633 /nfs/dbraw/zinc/27/56/33/1076275633.db2.gz SLGYFXXSDMHYIF-UHFFFAOYSA-N -1 3 375.393 -1.616 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)CNc1ccc(-c2nn[n-]n2)c(C)n1 ZINC001602942552 1076275612 /nfs/dbraw/zinc/27/56/12/1076275612.db2.gz SPFCNLFSPFJHQQ-VIFPVBQESA-N -1 3 389.420 -1.261 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)CNc1ccc(-c2nnn[n-]2)c(C)n1 ZINC001602942552 1076275606 /nfs/dbraw/zinc/27/56/06/1076275606.db2.gz SPFCNLFSPFJHQQ-VIFPVBQESA-N -1 3 389.420 -1.261 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CC[C@@H](Oc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001602942568 1076275483 /nfs/dbraw/zinc/27/54/83/1076275483.db2.gz TWRUJXNKNVYSFZ-GFCCVEGCSA-N -1 3 388.388 -1.506 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CC[C@@H](Oc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001602942568 1076275481 /nfs/dbraw/zinc/27/54/81/1076275481.db2.gz TWRUJXNKNVYSFZ-GFCCVEGCSA-N -1 3 388.388 -1.506 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CC[C@H](Oc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001602942569 1076275565 /nfs/dbraw/zinc/27/55/65/1076275565.db2.gz TWRUJXNKNVYSFZ-LBPRGKRZSA-N -1 3 388.388 -1.506 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N1CC[C@H](Oc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001602942569 1076275559 /nfs/dbraw/zinc/27/55/59/1076275559.db2.gz TWRUJXNKNVYSFZ-LBPRGKRZSA-N -1 3 388.388 -1.506 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC/C=C\CNc1ncccc1-c1nn[n-]n1 ZINC001602942603 1076275646 /nfs/dbraw/zinc/27/56/46/1076275646.db2.gz VSMXKBKEXQYFBC-IHWYPQMZSA-N -1 3 387.404 -1.402 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC/C=C\CNc1ncccc1-c1nnn[n-]1 ZINC001602942603 1076275641 /nfs/dbraw/zinc/27/56/41/1076275641.db2.gz VSMXKBKEXQYFBC-IHWYPQMZSA-N -1 3 387.404 -1.402 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC/C=C/CNc1ncccc1-c1nn[n-]n1 ZINC001602942604 1076275597 /nfs/dbraw/zinc/27/55/97/1076275597.db2.gz VSMXKBKEXQYFBC-NSCUHMNNSA-N -1 3 387.404 -1.402 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NC/C=C/CNc1ncccc1-c1nnn[n-]1 ZINC001602942604 1076275591 /nfs/dbraw/zinc/27/55/91/1076275591.db2.gz VSMXKBKEXQYFBC-NSCUHMNNSA-N -1 3 387.404 -1.402 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)OCC(=O)Nc1cccc(-c2nn[n-]n2)c1 ZINC001602942636 1076275630 /nfs/dbraw/zinc/27/56/30/1076275630.db2.gz YBCXZAWMSDRPBA-UHFFFAOYSA-N -1 3 375.345 -1.399 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)OCC(=O)Nc1cccc(-c2nnn[n-]2)c1 ZINC001602942636 1076275629 /nfs/dbraw/zinc/27/56/29/1076275629.db2.gz YBCXZAWMSDRPBA-UHFFFAOYSA-N -1 3 375.345 -1.399 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)CCNc1ncccc1-c1nn[n-]n1 ZINC001602942656 1076275941 /nfs/dbraw/zinc/27/59/41/1076275941.db2.gz ZEOGIWTZFSMSRD-JTQLQIEISA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@@H](C)CCNc1ncccc1-c1nnn[n-]1 ZINC001602942656 1076275938 /nfs/dbraw/zinc/27/59/38/1076275938.db2.gz ZEOGIWTZFSMSRD-JTQLQIEISA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)CCNc1ncccc1-c1nn[n-]n1 ZINC001602942657 1076275865 /nfs/dbraw/zinc/27/58/65/1076275865.db2.gz ZEOGIWTZFSMSRD-SNVBAGLBSA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)N[C@H](C)CCNc1ncccc1-c1nnn[n-]1 ZINC001602942657 1076275860 /nfs/dbraw/zinc/27/58/60/1076275860.db2.gz ZEOGIWTZFSMSRD-SNVBAGLBSA-N -1 3 389.420 -1.179 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCN(C)c1ncccc1-c1nn[n-]n1 ZINC001602942663 1076275878 /nfs/dbraw/zinc/27/58/78/1076275878.db2.gz ZQSAELZVRYJATK-UHFFFAOYSA-N -1 3 375.393 -1.934 20 0 GAADHM CC(=O)NCC(=O)NCC(=O)NCCN(C)c1ncccc1-c1nnn[n-]1 ZINC001602942663 1076275876 /nfs/dbraw/zinc/27/58/76/1076275876.db2.gz ZQSAELZVRYJATK-UHFFFAOYSA-N -1 3 375.393 -1.934 20 0 GAADHM CC(=O)NC[C@@H]1CN(C(=O)C(=O)Nc2cc(C)c(-c3nn[n-]n3)cn2)CCO1 ZINC001602945505 1076275924 /nfs/dbraw/zinc/27/59/24/1076275924.db2.gz UASAPPFFABFNDW-LLVKDONJSA-N -1 3 388.388 -1.128 20 0 GAADHM CC(=O)NC[C@@H]1CN(C(=O)C(=O)Nc2cc(C)c(-c3nnn[n-]3)cn2)CCO1 ZINC001602945505 1076275918 /nfs/dbraw/zinc/27/59/18/1076275918.db2.gz UASAPPFFABFNDW-LLVKDONJSA-N -1 3 388.388 -1.128 20 0 GAADHM CC(=O)NC[C@H]1CN(C(=O)C(=O)Nc2cc(C)c(-c3nn[n-]n3)cn2)CCO1 ZINC001602945759 1076276051 /nfs/dbraw/zinc/27/60/51/1076276051.db2.gz UASAPPFFABFNDW-NSHDSACASA-N -1 3 388.388 -1.128 20 0 GAADHM CC(=O)NC[C@H]1CN(C(=O)C(=O)Nc2cc(C)c(-c3nnn[n-]3)cn2)CCO1 ZINC001602945759 1076276047 /nfs/dbraw/zinc/27/60/47/1076276047.db2.gz UASAPPFFABFNDW-NSHDSACASA-N -1 3 388.388 -1.128 20 0 GAADHM CC(=O)N[C@@H](CC(=O)N1CCN(c2ccsc2-c2nnn[n-]2)CC1)C(N)=O ZINC001602948892 1076275965 /nfs/dbraw/zinc/27/59/65/1076275965.db2.gz QDRYALZHOPLCAF-JTQLQIEISA-N -1 3 392.445 -1.043 20 0 GAADHM CC(=O)N[C@@H](CC(=O)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1)C(N)=O ZINC001602949011 1076276178 /nfs/dbraw/zinc/27/61/78/1076276178.db2.gz 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CC(C)(C(=O)NC[C@@H](O)CNc1ccc(-c2nn[n-]n2)nc1)S(C)(=O)=O ZINC001603043454 1076278213 /nfs/dbraw/zinc/27/82/13/1076278213.db2.gz QIVGHENVOWYDEQ-JTQLQIEISA-N -1 3 383.434 -1.026 20 0 GAADHM CC(C)(C(=O)NC[C@@H](O)CNc1ccc(-c2nnn[n-]2)nc1)S(C)(=O)=O ZINC001603043454 1076278209 /nfs/dbraw/zinc/27/82/09/1076278209.db2.gz QIVGHENVOWYDEQ-JTQLQIEISA-N -1 3 383.434 -1.026 20 0 GAADHM CC(C)(C(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O)S(C)(=O)=O ZINC001603044041 1076278149 /nfs/dbraw/zinc/27/81/49/1076278149.db2.gz MDESIPPKMWMVFN-MNOVXSKESA-N -1 3 395.445 -1.249 20 0 GAADHM CC(C)(C(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O)S(C)(=O)=O ZINC001603044041 1076278146 /nfs/dbraw/zinc/27/81/46/1076278146.db2.gz MDESIPPKMWMVFN-MNOVXSKESA-N -1 3 395.445 -1.249 20 0 GAADHM CC(C)(C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1O)S(C)(=O)=O ZINC001603044521 1076278096 /nfs/dbraw/zinc/27/80/96/1076278096.db2.gz SKBJCUTUVVTETC-VXGBXAGGSA-N -1 3 395.445 -1.249 20 0 GAADHM CC(C)(C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1O)S(C)(=O)=O ZINC001603044521 1076278093 /nfs/dbraw/zinc/27/80/93/1076278093.db2.gz SKBJCUTUVVTETC-VXGBXAGGSA-N -1 3 395.445 -1.249 20 0 GAADHM CC(C)(C(N)=O)N1CCN(S(=O)(=O)c2cncc(-c3nn[n-]n3)c2)CC1 ZINC001603051797 1076278558 /nfs/dbraw/zinc/27/85/58/1076278558.db2.gz XJMWOUWPWOEDKX-UHFFFAOYSA-N -1 3 380.434 -1.168 20 0 GAADHM CC(C)(C(N)=O)N1CCN(S(=O)(=O)c2cncc(-c3nnn[n-]3)c2)CC1 ZINC001603051797 1076278556 /nfs/dbraw/zinc/27/85/56/1076278556.db2.gz XJMWOUWPWOEDKX-UHFFFAOYSA-N -1 3 380.434 -1.168 20 0 GAADHM CC(C)(C)NC(=O)CN1C[C@@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)[C@@H](O)C1 ZINC001603080754 1076278823 /nfs/dbraw/zinc/27/88/23/1076278823.db2.gz GSLFECMYNUFJNN-NEPJUHHUSA-N -1 3 376.421 -1.116 20 0 GAADHM CC(C)(C)NC(=O)CN1C[C@@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)[C@@H](O)C1 ZINC001603080754 1076278818 /nfs/dbraw/zinc/27/88/18/1076278818.db2.gz GSLFECMYNUFJNN-NEPJUHHUSA-N -1 3 376.421 -1.116 20 0 GAADHM CC(C)(C)NC(=O)CN1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001603080755 1076278808 /nfs/dbraw/zinc/27/88/08/1076278808.db2.gz GSLFECMYNUFJNN-VXGBXAGGSA-N -1 3 376.421 -1.116 20 0 GAADHM CC(C)(C)NC(=O)CN1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001603080755 1076278800 /nfs/dbraw/zinc/27/88/00/1076278800.db2.gz GSLFECMYNUFJNN-VXGBXAGGSA-N -1 3 376.421 -1.116 20 0 GAADHM CC(C)(C)n1cc(-c2nnn[n-]2)c(NC(=O)C(=O)NCCN2CC[C@@H](O)C2)n1 ZINC001603128603 1076278883 /nfs/dbraw/zinc/27/88/83/1076278883.db2.gz XFPZGZHNDXSJJM-SNVBAGLBSA-N -1 3 391.436 -1.061 20 0 GAADHM CC(C)(C)n1nnc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@H]2O)n1 ZINC001603133756 1076278997 /nfs/dbraw/zinc/27/89/97/1076278997.db2.gz UYJOMFMUBOSYPK-GHMZBOCLSA-N -1 3 399.419 -1.017 20 0 GAADHM CC(C)(C)n1nnc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@H]2O)n1 ZINC001603133756 1076278992 /nfs/dbraw/zinc/27/89/92/1076278992.db2.gz UYJOMFMUBOSYPK-GHMZBOCLSA-N -1 3 399.419 -1.017 20 0 GAADHM CC(C)(CNS(=O)(=O)c1cncc(-c2nn[n-]n2)c1)NS(C)(=O)=O ZINC001603150627 1076279326 /nfs/dbraw/zinc/27/93/26/1076279326.db2.gz HOHZUDLFSOWJDL-UHFFFAOYSA-N -1 3 375.436 -1.132 20 0 GAADHM CC(C)(CNS(=O)(=O)c1cncc(-c2nnn[n-]2)c1)NS(C)(=O)=O ZINC001603150627 1076279324 /nfs/dbraw/zinc/27/93/24/1076279324.db2.gz HOHZUDLFSOWJDL-UHFFFAOYSA-N -1 3 375.436 -1.132 20 0 GAADHM CC(C)(O)CN1CCN(C(=O)Cn2cc(-c3nn[n-]n3)c(=O)[nH]c2=O)CC1 ZINC001603171113 1076279383 /nfs/dbraw/zinc/27/93/83/1076279383.db2.gz BXFCGUJKJPQNRX-UHFFFAOYSA-N -1 3 378.393 -1.956 20 0 GAADHM CC(C)(C(=O)[O-])N1CCN(CC(=O)NC(=O)N[C@@H]2CCS(=O)(=O)C2)CC1 ZINC001603263028 1076279728 /nfs/dbraw/zinc/27/97/28/1076279728.db2.gz VCEBXCDORIXSKK-LLVKDONJSA-N -1 3 390.462 -1.520 20 0 GAADHM CC(C)(C(=O)[O-])N1CCN(CC(=O)NC(=O)N[C@H]2CCS(=O)(=O)C2)CC1 ZINC001603263031 1076279801 /nfs/dbraw/zinc/27/98/01/1076279801.db2.gz VCEBXCDORIXSKK-NSHDSACASA-N -1 3 390.462 -1.520 20 0 GAADHM CC(C)CN1CCO[C@H](CNC(=O)Cn2cnc(-c3nn[n-]n3)cc2=O)C1 ZINC001603295026 1076279626 /nfs/dbraw/zinc/27/96/26/1076279626.db2.gz MGQVCACSOGXOCH-GFCCVEGCSA-N -1 3 376.421 -1.104 20 0 GAADHM CC(C)CN1CCO[C@@H](CNC(=O)Cn2cnc(-c3nn[n-]n3)cc2=O)C1 ZINC001603295027 1076279655 /nfs/dbraw/zinc/27/96/55/1076279655.db2.gz MGQVCACSOGXOCH-LBPRGKRZSA-N -1 3 376.421 -1.104 20 0 GAADHM CC(C)NS(=O)(=O)NCCN[C@@H](C(N)=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001603341790 1076280165 /nfs/dbraw/zinc/28/01/65/1076280165.db2.gz AHETWGHNTZSQBU-GFCCVEGCSA-N -1 3 382.450 -1.185 20 0 GAADHM CC(C)NS(=O)(=O)NCCN[C@H](C(N)=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001603341794 1076280467 /nfs/dbraw/zinc/28/04/67/1076280467.db2.gz AHETWGHNTZSQBU-LBPRGKRZSA-N -1 3 382.450 -1.185 20 0 GAADHM CC(C)S(=O)(=O)CC(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@H]1O ZINC001603374571 1076280499 /nfs/dbraw/zinc/28/04/99/1076280499.db2.gz BDPGSPMYSDGZQM-VXGBXAGGSA-N -1 3 395.445 -1.249 20 0 GAADHM CC(C)S(=O)(=O)CC(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@H]1O ZINC001603374571 1076280492 /nfs/dbraw/zinc/28/04/92/1076280492.db2.gz BDPGSPMYSDGZQM-VXGBXAGGSA-N -1 3 395.445 -1.249 20 0 GAADHM CC(C)S(=O)(=O)CC(=O)NC[C@H](O)CNc1ncccc1-c1nn[n-]n1 ZINC001603375170 1076280615 /nfs/dbraw/zinc/28/06/15/1076280615.db2.gz QAXBCJRUPPPRNC-JTQLQIEISA-N -1 3 383.434 -1.026 20 0 GAADHM CC(C)S(=O)(=O)CC(=O)NC[C@H](O)CNc1ncccc1-c1nnn[n-]1 ZINC001603375170 1076280611 /nfs/dbraw/zinc/28/06/11/1076280611.db2.gz QAXBCJRUPPPRNC-JTQLQIEISA-N -1 3 383.434 -1.026 20 0 GAADHM CC(C)S(=O)(=O)CC(=O)NC[C@@H](O)CNc1ncccc1-c1nn[n-]n1 ZINC001603375171 1076280512 /nfs/dbraw/zinc/28/05/12/1076280512.db2.gz QAXBCJRUPPPRNC-SNVBAGLBSA-N -1 3 383.434 -1.026 20 0 GAADHM CC(C)S(=O)(=O)CC(=O)NC[C@@H](O)CNc1ncccc1-c1nnn[n-]1 ZINC001603375171 1076280509 /nfs/dbraw/zinc/28/05/09/1076280509.db2.gz QAXBCJRUPPPRNC-SNVBAGLBSA-N -1 3 383.434 -1.026 20 0 GAADHM CC(C)c1nnnn1CC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@H]1O ZINC001603421145 1076280429 /nfs/dbraw/zinc/28/04/29/1076280429.db2.gz MYPBFYJJMFRCHS-VXGBXAGGSA-N -1 3 399.419 -1.263 20 0 GAADHM CC(C)c1nnnn1CC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@H]1O ZINC001603421145 1076280427 /nfs/dbraw/zinc/28/04/27/1076280427.db2.gz MYPBFYJJMFRCHS-VXGBXAGGSA-N -1 3 399.419 -1.263 20 0 GAADHM CC(C)c1nnnn1CC(=O)N1CC(NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001603421192 1076280576 /nfs/dbraw/zinc/28/05/76/1076280576.db2.gz OESSLRXVPUHQAL-UHFFFAOYSA-N -1 3 385.392 -1.055 20 0 GAADHM CC(C)c1nnnn1CC(=O)N1CC(NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001603421192 1076280572 /nfs/dbraw/zinc/28/05/72/1076280572.db2.gz OESSLRXVPUHQAL-UHFFFAOYSA-N -1 3 385.392 -1.055 20 0 GAADHM CC(C)c1nnnn1CC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001603421489 1076280480 /nfs/dbraw/zinc/28/04/80/1076280480.db2.gz SGQGGTMOYVHJHR-OLZOCXBDSA-N -1 3 399.419 -1.263 20 0 GAADHM CC(C)c1nnnn1CC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001603421489 1076280477 /nfs/dbraw/zinc/28/04/77/1076280477.db2.gz SGQGGTMOYVHJHR-OLZOCXBDSA-N -1 3 399.419 -1.263 20 0 GAADHM C[C@H](CN(C)c1ccc(-c2nn[n-]n2)cn1)NC(=O)CN1CCN(C)C(=O)C1 ZINC001603510588 1076282496 /nfs/dbraw/zinc/28/24/96/1076282496.db2.gz WURQHIUQNUHIOR-GFCCVEGCSA-N -1 3 387.448 -1.023 20 0 GAADHM C[C@H](CN(C)c1ccc(-c2nnn[n-]2)cn1)NC(=O)CN1CCN(C)C(=O)C1 ZINC001603510588 1076282491 /nfs/dbraw/zinc/28/24/91/1076282491.db2.gz WURQHIUQNUHIOR-GFCCVEGCSA-N -1 3 387.448 -1.023 20 0 GAADHM C[C@@H](CN(C)c1ccc(-c2nn[n-]n2)cn1)NC(=O)CN1CCN(C)C(=O)C1 ZINC001603510589 1076282528 /nfs/dbraw/zinc/28/25/28/1076282528.db2.gz WURQHIUQNUHIOR-LBPRGKRZSA-N -1 3 387.448 -1.023 20 0 GAADHM C[C@@H](CN(C)c1ccc(-c2nnn[n-]2)cn1)NC(=O)CN1CCN(C)C(=O)C1 ZINC001603510589 1076282522 /nfs/dbraw/zinc/28/25/22/1076282522.db2.gz WURQHIUQNUHIOR-LBPRGKRZSA-N -1 3 387.448 -1.023 20 0 GAADHM C[C@H](CNc1ccnc(-c2nn[n-]n2)n1)NC(=O)[C@@H](C)CN1CCOCC1 ZINC001603516655 1076282650 /nfs/dbraw/zinc/28/26/50/1076282650.db2.gz CTOJAJLVFBAUGP-NWDGAFQWSA-N -1 3 375.437 -1.037 20 0 GAADHM C[C@H](CNc1ccnc(-c2nnn[n-]2)n1)NC(=O)[C@@H](C)CN1CCOCC1 ZINC001603516655 1076282645 /nfs/dbraw/zinc/28/26/45/1076282645.db2.gz CTOJAJLVFBAUGP-NWDGAFQWSA-N -1 3 375.437 -1.037 20 0 GAADHM C[C@H](CNc1ccnc(-c2nn[n-]n2)n1)NC(=O)[C@H](C)CN1CCOCC1 ZINC001603516656 1076282439 /nfs/dbraw/zinc/28/24/39/1076282439.db2.gz CTOJAJLVFBAUGP-VXGBXAGGSA-N -1 3 375.437 -1.037 20 0 GAADHM C[C@H](CNc1ccnc(-c2nnn[n-]2)n1)NC(=O)[C@H](C)CN1CCOCC1 ZINC001603516656 1076282435 /nfs/dbraw/zinc/28/24/35/1076282435.db2.gz CTOJAJLVFBAUGP-VXGBXAGGSA-N -1 3 375.437 -1.037 20 0 GAADHM C[C@H](CN(C)c1ncc(-c2nn[n-]n2)cc1F)NC(=O)CN1C(=O)CNC1=O ZINC001603517339 1076282584 /nfs/dbraw/zinc/28/25/84/1076282584.db2.gz GOEULRLMIYXKBF-MRVPVSSYSA-N -1 3 391.367 -1.107 20 0 GAADHM C[C@H](CN(C)c1ncc(-c2nnn[n-]2)cc1F)NC(=O)CN1C(=O)CNC1=O ZINC001603517339 1076282577 /nfs/dbraw/zinc/28/25/77/1076282577.db2.gz GOEULRLMIYXKBF-MRVPVSSYSA-N -1 3 391.367 -1.107 20 0 GAADHM C[C@@H](CN(C)c1ncc(-c2nn[n-]n2)cc1F)NC(=O)CN1C(=O)CNC1=O ZINC001603517340 1076283080 /nfs/dbraw/zinc/28/30/80/1076283080.db2.gz GOEULRLMIYXKBF-QMMMGPOBSA-N -1 3 391.367 -1.107 20 0 GAADHM C[C@@H](CN(C)c1ncc(-c2nnn[n-]2)cc1F)NC(=O)CN1C(=O)CNC1=O ZINC001603517340 1076283072 /nfs/dbraw/zinc/28/30/72/1076283072.db2.gz GOEULRLMIYXKBF-QMMMGPOBSA-N -1 3 391.367 -1.107 20 0 GAADHM C[C@H](CN(C)c1ncc(-c2nn[n-]n2)cc1F)NC(=O)[C@@H]1CC(=O)NC(=O)N1 ZINC001603517502 1076282949 /nfs/dbraw/zinc/28/29/49/1076282949.db2.gz HSYLNXSLAIVPEV-XCBNKYQSSA-N -1 3 391.367 -1.060 20 0 GAADHM C[C@H](CN(C)c1ncc(-c2nnn[n-]2)cc1F)NC(=O)[C@@H]1CC(=O)NC(=O)N1 ZINC001603517502 1076282944 /nfs/dbraw/zinc/28/29/44/1076282944.db2.gz HSYLNXSLAIVPEV-XCBNKYQSSA-N -1 3 391.367 -1.060 20 0 GAADHM C[C@@H](CN(C)c1ncc(-c2nn[n-]n2)cc1F)NC(=O)[C@@H]1CC(=O)NC(=O)N1 ZINC001603517503 1076283096 /nfs/dbraw/zinc/28/30/96/1076283096.db2.gz HSYLNXSLAIVPEV-XVKPBYJWSA-N -1 3 391.367 -1.060 20 0 GAADHM C[C@@H](CN(C)c1ncc(-c2nnn[n-]2)cc1F)NC(=O)[C@@H]1CC(=O)NC(=O)N1 ZINC001603517503 1076283093 /nfs/dbraw/zinc/28/30/93/1076283093.db2.gz HSYLNXSLAIVPEV-XVKPBYJWSA-N -1 3 391.367 -1.060 20 0 GAADHM C[C@@H](CN1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1)CS(C)(=O)=O ZINC001603520494 1076283087 /nfs/dbraw/zinc/28/30/87/1076283087.db2.gz FAWXGYLTOQFKJK-BIMULSAOSA-N -1 3 397.461 -1.350 20 0 GAADHM C[C@@H](CN1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1)CS(C)(=O)=O ZINC001603520494 1076283085 /nfs/dbraw/zinc/28/30/85/1076283085.db2.gz FAWXGYLTOQFKJK-BIMULSAOSA-N -1 3 397.461 -1.350 20 0 GAADHM C[C@H](CN1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)CS(C)(=O)=O ZINC001603520495 1076283033 /nfs/dbraw/zinc/28/30/33/1076283033.db2.gz FAWXGYLTOQFKJK-OASPWFOLSA-N -1 3 397.461 -1.350 20 0 GAADHM C[C@H](CN1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)CS(C)(=O)=O ZINC001603520495 1076283030 /nfs/dbraw/zinc/28/30/30/1076283030.db2.gz FAWXGYLTOQFKJK-OASPWFOLSA-N -1 3 397.461 -1.350 20 0 GAADHM C[C@H](CN1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1)CS(C)(=O)=O ZINC001603520496 1076283129 /nfs/dbraw/zinc/28/31/29/1076283129.db2.gz FAWXGYLTOQFKJK-WQAKAFBOSA-N -1 3 397.461 -1.350 20 0 GAADHM C[C@H](CN1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1)CS(C)(=O)=O ZINC001603520496 1076283124 /nfs/dbraw/zinc/28/31/24/1076283124.db2.gz FAWXGYLTOQFKJK-WQAKAFBOSA-N -1 3 397.461 -1.350 20 0 GAADHM C[C@@H](CN1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)CS(C)(=O)=O ZINC001603520497 1076283053 /nfs/dbraw/zinc/28/30/53/1076283053.db2.gz FAWXGYLTOQFKJK-ZWKOPEQDSA-N -1 3 397.461 -1.350 20 0 GAADHM C[C@@H](CN1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)CS(C)(=O)=O ZINC001603520497 1076283050 /nfs/dbraw/zinc/28/30/50/1076283050.db2.gz FAWXGYLTOQFKJK-ZWKOPEQDSA-N -1 3 397.461 -1.350 20 0 GAADHM C[C@H](CN1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)CS(C)(=O)=O ZINC001603521144 1076283105 /nfs/dbraw/zinc/28/31/05/1076283105.db2.gz QFJGLADLUBCYEI-OASPWFOLSA-N -1 3 397.461 -1.350 20 0 GAADHM C[C@H](CN1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)CS(C)(=O)=O ZINC001603521144 1076283099 /nfs/dbraw/zinc/28/30/99/1076283099.db2.gz QFJGLADLUBCYEI-OASPWFOLSA-N -1 3 397.461 -1.350 20 0 GAADHM C[C@@H](CN1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1)CS(C)(=O)=O ZINC001603521145 1076283000 /nfs/dbraw/zinc/28/30/00/1076283000.db2.gz QFJGLADLUBCYEI-ZWKOPEQDSA-N -1 3 397.461 -1.350 20 0 GAADHM C[C@@H](CN1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1)CS(C)(=O)=O ZINC001603521145 1076282995 /nfs/dbraw/zinc/28/29/95/1076282995.db2.gz QFJGLADLUBCYEI-ZWKOPEQDSA-N -1 3 397.461 -1.350 20 0 GAADHM C[C@@H](CNC(=O)[C@H]1CCS(=O)(=O)N1)N(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001603528172 1076283516 /nfs/dbraw/zinc/28/35/16/1076283516.db2.gz LNWOUFAKVYOMQX-GXSJLCMTSA-N -1 3 380.434 -1.106 20 0 GAADHM C[C@@H](CNC(=O)[C@H]1CCS(=O)(=O)N1)N(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001603528172 1076283514 /nfs/dbraw/zinc/28/35/14/1076283514.db2.gz LNWOUFAKVYOMQX-GXSJLCMTSA-N -1 3 380.434 -1.106 20 0 GAADHM C[C@H](CNC(=O)[C@@H]1CCS(=O)(=O)N1)N(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001603528173 1076283367 /nfs/dbraw/zinc/28/33/67/1076283367.db2.gz LNWOUFAKVYOMQX-KOLCDFICSA-N -1 3 380.434 -1.106 20 0 GAADHM C[C@H](CNC(=O)[C@@H]1CCS(=O)(=O)N1)N(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001603528173 1076283362 /nfs/dbraw/zinc/28/33/62/1076283362.db2.gz LNWOUFAKVYOMQX-KOLCDFICSA-N -1 3 380.434 -1.106 20 0 GAADHM C[C@H](CNC(=O)[C@H]1CCS(=O)(=O)N1)N(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001603528174 1076283618 /nfs/dbraw/zinc/28/36/18/1076283618.db2.gz LNWOUFAKVYOMQX-MWLCHTKSSA-N -1 3 380.434 -1.106 20 0 GAADHM C[C@H](CNC(=O)[C@H]1CCS(=O)(=O)N1)N(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001603528174 1076283614 /nfs/dbraw/zinc/28/36/14/1076283614.db2.gz LNWOUFAKVYOMQX-MWLCHTKSSA-N -1 3 380.434 -1.106 20 0 GAADHM C[C@@H](CNC(=O)[C@@H]1CCS(=O)(=O)N1)N(C)c1ccc(-c2nn[n-]n2)cn1 ZINC001603528175 1076283440 /nfs/dbraw/zinc/28/34/40/1076283440.db2.gz LNWOUFAKVYOMQX-ONGXEEELSA-N -1 3 380.434 -1.106 20 0 GAADHM C[C@@H](CNC(=O)[C@@H]1CCS(=O)(=O)N1)N(C)c1ccc(-c2nnn[n-]2)cn1 ZINC001603528175 1076283436 /nfs/dbraw/zinc/28/34/36/1076283436.db2.gz LNWOUFAKVYOMQX-ONGXEEELSA-N -1 3 380.434 -1.106 20 0 GAADHM C[C@H](CNC(=O)Cn1ncn(C)c1=O)Nc1ncc(-c2nn[n-]n2)cc1F ZINC001603536156 1076284355 /nfs/dbraw/zinc/28/43/55/1076284355.db2.gz VUWAGANITBJFNK-MRVPVSSYSA-N -1 3 376.356 -1.087 20 0 GAADHM C[C@H](CNC(=O)Cn1ncn(C)c1=O)Nc1ncc(-c2nnn[n-]2)cc1F ZINC001603536156 1076284352 /nfs/dbraw/zinc/28/43/52/1076284352.db2.gz VUWAGANITBJFNK-MRVPVSSYSA-N -1 3 376.356 -1.087 20 0 GAADHM C[C@@H](CNC(=O)Cn1ncn(C)c1=O)Nc1ncc(-c2nn[n-]n2)cc1F ZINC001603536157 1076284450 /nfs/dbraw/zinc/28/44/50/1076284450.db2.gz VUWAGANITBJFNK-QMMMGPOBSA-N -1 3 376.356 -1.087 20 0 GAADHM C[C@@H](CNC(=O)Cn1ncn(C)c1=O)Nc1ncc(-c2nnn[n-]2)cc1F ZINC001603536157 1076284444 /nfs/dbraw/zinc/28/44/44/1076284444.db2.gz VUWAGANITBJFNK-QMMMGPOBSA-N -1 3 376.356 -1.087 20 0 GAADHM C[C@@H](CS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001603571786 1076284658 /nfs/dbraw/zinc/28/46/58/1076284658.db2.gz SECXCXFUHWJELE-BIMULSAOSA-N -1 3 395.445 -1.392 20 0 GAADHM C[C@@H](CS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001603571786 1076284653 /nfs/dbraw/zinc/28/46/53/1076284653.db2.gz SECXCXFUHWJELE-BIMULSAOSA-N -1 3 395.445 -1.392 20 0 GAADHM C[C@H](CS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001603571795 1076284773 /nfs/dbraw/zinc/28/47/73/1076284773.db2.gz SECXCXFUHWJELE-WQAKAFBOSA-N -1 3 395.445 -1.392 20 0 GAADHM C[C@H](CS(C)(=O)=O)C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001603571795 1076284769 /nfs/dbraw/zinc/28/47/69/1076284769.db2.gz SECXCXFUHWJELE-WQAKAFBOSA-N -1 3 395.445 -1.392 20 0 GAADHM C[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H]1CN(c2nccnc2-c2nn[n-]n2)C[C@H]1O ZINC001603588509 1076284848 /nfs/dbraw/zinc/28/48/48/1076284848.db2.gz CMIMKDBKERLNED-MVWJERBFSA-N -1 3 384.404 -1.076 20 0 GAADHM C[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H]1CN(c2nccnc2-c2nnn[n-]2)C[C@H]1O ZINC001603588509 1076284843 /nfs/dbraw/zinc/28/48/43/1076284843.db2.gz CMIMKDBKERLNED-MVWJERBFSA-N -1 3 384.404 -1.076 20 0 GAADHM C[C@H](Cc1c[nH]cn1)C(=O)N[C@@H]1CN(c2nccnc2-c2nn[n-]n2)C[C@H]1O ZINC001603588510 1076284862 /nfs/dbraw/zinc/28/48/62/1076284862.db2.gz CMIMKDBKERLNED-YUSALJHKSA-N -1 3 384.404 -1.076 20 0 GAADHM C[C@H](Cc1c[nH]cn1)C(=O)N[C@@H]1CN(c2nccnc2-c2nnn[n-]2)C[C@H]1O ZINC001603588510 1076284857 /nfs/dbraw/zinc/28/48/57/1076284857.db2.gz CMIMKDBKERLNED-YUSALJHKSA-N -1 3 384.404 -1.076 20 0 GAADHM C[C@@H](Cn1cncn1)NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001603590232 1076285169 /nfs/dbraw/zinc/28/51/69/1076285169.db2.gz CYCUMUBPPOFURY-JTQLQIEISA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@@H](Cn1cncn1)NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001603590232 1076285168 /nfs/dbraw/zinc/28/51/68/1076285168.db2.gz CYCUMUBPPOFURY-JTQLQIEISA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@H](Cn1cncn1)NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001603590237 1076285227 /nfs/dbraw/zinc/28/52/27/1076285227.db2.gz CYCUMUBPPOFURY-SNVBAGLBSA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@H](Cn1cncn1)NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001603590237 1076285225 /nfs/dbraw/zinc/28/52/25/1076285225.db2.gz CYCUMUBPPOFURY-SNVBAGLBSA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@@H](Cn1cncn1)NC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001603591002 1076285267 /nfs/dbraw/zinc/28/52/67/1076285267.db2.gz RCWBLYFSAKXWOW-JTQLQIEISA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@@H](Cn1cncn1)NC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001603591002 1076285264 /nfs/dbraw/zinc/28/52/64/1076285264.db2.gz RCWBLYFSAKXWOW-JTQLQIEISA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@H](Cn1cncn1)NC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001603591003 1076285297 /nfs/dbraw/zinc/28/52/97/1076285297.db2.gz RCWBLYFSAKXWOW-SNVBAGLBSA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@H](Cn1cncn1)NC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001603591003 1076285293 /nfs/dbraw/zinc/28/52/93/1076285293.db2.gz RCWBLYFSAKXWOW-SNVBAGLBSA-N -1 3 391.417 -1.059 20 0 GAADHM C[C@@H](Cn1cncn1)NC(=O)C(=O)NCCNc1ccc(-c2nn[n-]n2)cn1 ZINC001603591095 1076285276 /nfs/dbraw/zinc/28/52/76/1076285276.db2.gz UTVLSHDHYJGXKO-JTQLQIEISA-N -1 3 385.392 -1.414 20 0 GAADHM C[C@@H](Cn1cncn1)NC(=O)C(=O)NCCNc1ccc(-c2nnn[n-]2)cn1 ZINC001603591095 1076285273 /nfs/dbraw/zinc/28/52/73/1076285273.db2.gz UTVLSHDHYJGXKO-JTQLQIEISA-N -1 3 385.392 -1.414 20 0 GAADHM C[C@H](Cn1cncn1)NC(=O)C(=O)NCCNc1ccc(-c2nn[n-]n2)cn1 ZINC001603591096 1076285235 /nfs/dbraw/zinc/28/52/35/1076285235.db2.gz UTVLSHDHYJGXKO-SNVBAGLBSA-N -1 3 385.392 -1.414 20 0 GAADHM C[C@H](Cn1cncn1)NC(=O)C(=O)NCCNc1ccc(-c2nnn[n-]2)cn1 ZINC001603591096 1076285231 /nfs/dbraw/zinc/28/52/31/1076285231.db2.gz UTVLSHDHYJGXKO-SNVBAGLBSA-N -1 3 385.392 -1.414 20 0 GAADHM C[C@H](NC(=O)Cn1cc(-c2nn[n-]n2)c(=O)[nH]c1=O)[C@H]1CN(C)CCN1C ZINC001603617286 1076285614 /nfs/dbraw/zinc/28/56/14/1076285614.db2.gz FPPGAPOJVWQRHV-GXSJLCMTSA-N -1 3 377.409 -2.121 20 0 GAADHM C[C@H](NC(=O)Cn1cc(-c2nnn[n-]2)c(=O)[nH]c1=O)[C@H]1CN(C)CCN1C ZINC001603617286 1076285610 /nfs/dbraw/zinc/28/56/10/1076285610.db2.gz FPPGAPOJVWQRHV-GXSJLCMTSA-N -1 3 377.409 -2.121 20 0 GAADHM C[C@@H](NC(=O)Cn1cc(-c2nn[n-]n2)c(=O)[nH]c1=O)[C@@H]1CN(C)CCN1C ZINC001603617287 1076285656 /nfs/dbraw/zinc/28/56/56/1076285656.db2.gz FPPGAPOJVWQRHV-KOLCDFICSA-N -1 3 377.409 -2.121 20 0 GAADHM C[C@@H](NC(=O)Cn1cc(-c2nnn[n-]2)c(=O)[nH]c1=O)[C@@H]1CN(C)CCN1C ZINC001603617287 1076285653 /nfs/dbraw/zinc/28/56/53/1076285653.db2.gz FPPGAPOJVWQRHV-KOLCDFICSA-N -1 3 377.409 -2.121 20 0 GAADHM C[C@@H](NC(=O)Cn1cc(-c2nn[n-]n2)c(=O)[nH]c1=O)[C@H]1CN(C)CCN1C ZINC001603617288 1076285481 /nfs/dbraw/zinc/28/54/81/1076285481.db2.gz FPPGAPOJVWQRHV-MWLCHTKSSA-N -1 3 377.409 -2.121 20 0 GAADHM C[C@@H](NC(=O)Cn1cc(-c2nnn[n-]2)c(=O)[nH]c1=O)[C@H]1CN(C)CCN1C ZINC001603617288 1076285476 /nfs/dbraw/zinc/28/54/76/1076285476.db2.gz FPPGAPOJVWQRHV-MWLCHTKSSA-N -1 3 377.409 -2.121 20 0 GAADHM C[C@H](NC(=O)Cn1cc(-c2nn[n-]n2)c(=O)[nH]c1=O)[C@@H]1CN(C)CCN1C ZINC001603617289 1076285733 /nfs/dbraw/zinc/28/57/33/1076285733.db2.gz FPPGAPOJVWQRHV-ONGXEEELSA-N -1 3 377.409 -2.121 20 0 GAADHM C[C@H](NC(=O)Cn1cc(-c2nnn[n-]2)c(=O)[nH]c1=O)[C@@H]1CN(C)CCN1C ZINC001603617289 1076285727 /nfs/dbraw/zinc/28/57/27/1076285727.db2.gz FPPGAPOJVWQRHV-ONGXEEELSA-N -1 3 377.409 -2.121 20 0 GAADHM C[C@H](NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@H]1CN(C(=O)c2nc[nH]n2)CCO1 ZINC001603640072 1076286202 /nfs/dbraw/zinc/28/62/02/1076286202.db2.gz COMGFKBQBZDWOY-GZMMTYOYSA-N -1 3 386.376 -1.028 20 0 GAADHM C[C@@H](NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@@H]1CN(C(=O)c2nc[nH]n2)CCO1 ZINC001603640097 1076286209 /nfs/dbraw/zinc/28/62/09/1076286209.db2.gz COMGFKBQBZDWOY-KCJUWKMLSA-N -1 3 386.376 -1.028 20 0 GAADHM C[C@H](NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@@H]1CN(C(=O)c2nc[nH]n2)CCO1 ZINC001603640098 1076286191 /nfs/dbraw/zinc/28/61/91/1076286191.db2.gz COMGFKBQBZDWOY-KWQFWETISA-N -1 3 386.376 -1.028 20 0 GAADHM C[C@@H](NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)[C@H]1CN(C(=O)c2nc[nH]n2)CCO1 ZINC001603640099 1076285994 /nfs/dbraw/zinc/28/59/94/1076285994.db2.gz COMGFKBQBZDWOY-LDYMZIIASA-N -1 3 386.376 -1.028 20 0 GAADHM C[C@@H](NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)C1CN(C(=O)CN2CN=NC2=O)C1 ZINC001603640238 1076286128 /nfs/dbraw/zinc/28/61/28/1076286128.db2.gz GBPFLZVWUOTJTF-MRVPVSSYSA-N -1 3 386.376 -1.231 20 0 GAADHM C[C@@H](NC(=O)c1ccc(-c2nnn[n-]2)[nH]1)C1CN(C(=O)CN2CN=NC2=O)C1 ZINC001603640238 1076286124 /nfs/dbraw/zinc/28/61/24/1076286124.db2.gz GBPFLZVWUOTJTF-MRVPVSSYSA-N -1 3 386.376 -1.231 20 0 GAADHM C[C@H](NC(=O)c1ccc(-c2nn[n-]n2)[nH]1)C1CN(C(=O)CN2CN=NC2=O)C1 ZINC001603640251 1076286115 /nfs/dbraw/zinc/28/61/15/1076286115.db2.gz GBPFLZVWUOTJTF-QMMMGPOBSA-N -1 3 386.376 -1.231 20 0 GAADHM C[C@H](NC(=O)c1ccc(-c2nnn[n-]2)[nH]1)C1CN(C(=O)CN2CN=NC2=O)C1 ZINC001603640251 1076286112 /nfs/dbraw/zinc/28/61/12/1076286112.db2.gz GBPFLZVWUOTJTF-QMMMGPOBSA-N -1 3 386.376 -1.231 20 0 GAADHM C[C@@H](NCc1nnnn1C)[C@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1 ZINC001603672273 1076286233 /nfs/dbraw/zinc/28/62/33/1076286233.db2.gz QJVZFHPJSAQASX-BXKDBHETSA-N -1 3 387.408 -1.262 20 0 GAADHM C[C@@H](NCc1nnnn1C)[C@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1 ZINC001603672273 1076286229 /nfs/dbraw/zinc/28/62/29/1076286229.db2.gz QJVZFHPJSAQASX-BXKDBHETSA-N -1 3 387.408 -1.262 20 0 GAADHM C[C@H](NCc1nnnn1C)[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1 ZINC001603672374 1076286076 /nfs/dbraw/zinc/28/60/76/1076286076.db2.gz QJVZFHPJSAQASX-CABZTGNLSA-N -1 3 387.408 -1.262 20 0 GAADHM C[C@H](NCc1nnnn1C)[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1 ZINC001603672374 1076286071 /nfs/dbraw/zinc/28/60/71/1076286071.db2.gz QJVZFHPJSAQASX-CABZTGNLSA-N -1 3 387.408 -1.262 20 0 GAADHM C[C@H](NCc1nnnn1C)[C@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1 ZINC001603672375 1076286104 /nfs/dbraw/zinc/28/61/04/1076286104.db2.gz QJVZFHPJSAQASX-JOYOIKCWSA-N -1 3 387.408 -1.262 20 0 GAADHM C[C@H](NCc1nnnn1C)[C@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1 ZINC001603672375 1076286101 /nfs/dbraw/zinc/28/61/01/1076286101.db2.gz QJVZFHPJSAQASX-JOYOIKCWSA-N -1 3 387.408 -1.262 20 0 GAADHM C[C@@H](NCc1nnnn1C)[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1 ZINC001603672376 1076286048 /nfs/dbraw/zinc/28/60/48/1076286048.db2.gz QJVZFHPJSAQASX-SKDRFNHKSA-N -1 3 387.408 -1.262 20 0 GAADHM C[C@@H](NCc1nnnn1C)[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1 ZINC001603672376 1076286044 /nfs/dbraw/zinc/28/60/44/1076286044.db2.gz QJVZFHPJSAQASX-SKDRFNHKSA-N -1 3 387.408 -1.262 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N(C)[C@@H]1COC[C@H]1O ZINC001603672879 1076286181 /nfs/dbraw/zinc/28/61/81/1076286181.db2.gz WYBOJYAYXSQERG-OASPWFOLSA-N -1 3 396.429 -1.248 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N(C)[C@@H]1COC[C@H]1O ZINC001603672879 1076286174 /nfs/dbraw/zinc/28/61/74/1076286174.db2.gz WYBOJYAYXSQERG-OASPWFOLSA-N -1 3 396.429 -1.248 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N(C)[C@@H]1COC[C@H]1O ZINC001603672882 1076286090 /nfs/dbraw/zinc/28/60/90/1076286090.db2.gz WYBOJYAYXSQERG-ZWKOPEQDSA-N -1 3 396.429 -1.248 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N(C)[C@@H]1COC[C@H]1O ZINC001603672882 1076286088 /nfs/dbraw/zinc/28/60/88/1076286088.db2.gz WYBOJYAYXSQERG-ZWKOPEQDSA-N -1 3 396.429 -1.248 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N(C)CCC(N)=O ZINC001603675020 1076286024 /nfs/dbraw/zinc/28/60/24/1076286024.db2.gz BEVQJXWOAMIFNR-SECBINFHSA-N -1 3 381.418 -1.133 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N(C)CCC(N)=O ZINC001603675020 1076286023 /nfs/dbraw/zinc/28/60/23/1076286023.db2.gz BEVQJXWOAMIFNR-SECBINFHSA-N -1 3 381.418 -1.133 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N(C)CCC(N)=O ZINC001603675021 1076286034 /nfs/dbraw/zinc/28/60/34/1076286034.db2.gz BEVQJXWOAMIFNR-VIFPVBQESA-N -1 3 381.418 -1.133 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N(C)CCC(N)=O ZINC001603675021 1076286033 /nfs/dbraw/zinc/28/60/33/1076286033.db2.gz BEVQJXWOAMIFNR-VIFPVBQESA-N -1 3 381.418 -1.133 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CC(C(N)=O)C1 ZINC001603675064 1076286016 /nfs/dbraw/zinc/28/60/16/1076286016.db2.gz DMVHEJGOCPZCBE-MRVPVSSYSA-N -1 3 379.402 -1.523 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CC(C(N)=O)C1 ZINC001603675064 1076286015 /nfs/dbraw/zinc/28/60/15/1076286015.db2.gz DMVHEJGOCPZCBE-MRVPVSSYSA-N -1 3 379.402 -1.523 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1CC(C(N)=O)C1 ZINC001603675065 1076286166 /nfs/dbraw/zinc/28/61/66/1076286166.db2.gz DMVHEJGOCPZCBE-QMMMGPOBSA-N -1 3 379.402 -1.523 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1CC(C(N)=O)C1 ZINC001603675065 1076286160 /nfs/dbraw/zinc/28/61/60/1076286160.db2.gz DMVHEJGOCPZCBE-QMMMGPOBSA-N -1 3 379.402 -1.523 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1C[C@H](O)[C@@H](O)C1 ZINC001603675101 1076286615 /nfs/dbraw/zinc/28/66/15/1076286615.db2.gz FNSIPQVONHDKQA-UWJYBYFXSA-N -1 3 382.402 -1.903 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1C[C@H](O)[C@@H](O)C1 ZINC001603675101 1076286612 /nfs/dbraw/zinc/28/66/12/1076286612.db2.gz FNSIPQVONHDKQA-UWJYBYFXSA-N -1 3 382.402 -1.903 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N1C[C@H](O)[C@@H](O)C1 ZINC001603675102 1076286580 /nfs/dbraw/zinc/28/65/80/1076286580.db2.gz FNSIPQVONHDKQA-ZHAHWJHGSA-N -1 3 382.402 -1.903 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N1C[C@H](O)[C@@H](O)C1 ZINC001603675102 1076286578 /nfs/dbraw/zinc/28/65/78/1076286578.db2.gz FNSIPQVONHDKQA-ZHAHWJHGSA-N -1 3 382.402 -1.903 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@]1(CO)CCOC1 ZINC001603675229 1076286569 /nfs/dbraw/zinc/28/65/69/1076286569.db2.gz JJQUJIARPSQFPO-BMIGLBTASA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@]1(CO)CCOC1 ZINC001603675229 1076286566 /nfs/dbraw/zinc/28/65/66/1076286566.db2.gz JJQUJIARPSQFPO-BMIGLBTASA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@]1(CO)CCOC1 ZINC001603675230 1076286511 /nfs/dbraw/zinc/28/65/11/1076286511.db2.gz JJQUJIARPSQFPO-BONVTDFDSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@]1(CO)CCOC1 ZINC001603675230 1076286506 /nfs/dbraw/zinc/28/65/06/1076286506.db2.gz JJQUJIARPSQFPO-BONVTDFDSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@@]1(CO)CCOC1 ZINC001603675231 1076286601 /nfs/dbraw/zinc/28/66/01/1076286601.db2.gz JJQUJIARPSQFPO-MEBBXXQBSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@@]1(CO)CCOC1 ZINC001603675231 1076286598 /nfs/dbraw/zinc/28/65/98/1076286598.db2.gz JJQUJIARPSQFPO-MEBBXXQBSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@@]1(CO)CCOC1 ZINC001603675232 1076286473 /nfs/dbraw/zinc/28/64/73/1076286473.db2.gz JJQUJIARPSQFPO-ZUZCIYMTSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@@]1(CO)CCOC1 ZINC001603675232 1076286470 /nfs/dbraw/zinc/28/64/70/1076286470.db2.gz JJQUJIARPSQFPO-ZUZCIYMTSA-N -1 3 396.429 -1.199 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CC(C)(C(N)=O)C1 ZINC001603675237 1076286497 /nfs/dbraw/zinc/28/64/97/1076286497.db2.gz JPXSGAIFJKSKNO-SECBINFHSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CC(C)(C(N)=O)C1 ZINC001603675237 1076286493 /nfs/dbraw/zinc/28/64/93/1076286493.db2.gz JPXSGAIFJKSKNO-SECBINFHSA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1CC(C)(C(N)=O)C1 ZINC001603675238 1076286646 /nfs/dbraw/zinc/28/66/46/1076286646.db2.gz JPXSGAIFJKSKNO-VIFPVBQESA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1CC(C)(C(N)=O)C1 ZINC001603675238 1076286641 /nfs/dbraw/zinc/28/66/41/1076286641.db2.gz JPXSGAIFJKSKNO-VIFPVBQESA-N -1 3 393.429 -1.133 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1C[C@@H](O)C[C@H]1CO ZINC001603675253 1076286658 /nfs/dbraw/zinc/28/66/58/1076286658.db2.gz KGYVBIPRYWAHGO-DLOVCJGASA-N -1 3 396.429 -1.512 20 0 GAADHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1C[C@@H](O)C[C@H]1CO ZINC001603675253 1076286654 /nfs/dbraw/zinc/28/66/54/1076286654.db2.gz KGYVBIPRYWAHGO-DLOVCJGASA-N -1 3 396.429 -1.512 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N1C[C@@H](O)C[C@H]1CO ZINC001603675254 1076286632 /nfs/dbraw/zinc/28/66/32/1076286632.db2.gz KGYVBIPRYWAHGO-USWWRNFRSA-N -1 3 396.429 -1.512 20 0 GAADHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N1C[C@@H](O)C[C@H]1CO ZINC001603675254 1076286627 /nfs/dbraw/zinc/28/66/27/1076286627.db2.gz KGYVBIPRYWAHGO-USWWRNFRSA-N -1 3 396.429 -1.512 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC[C@H]1CNC(=O)C1 ZINC001603675489 1076286668 /nfs/dbraw/zinc/28/66/68/1076286668.db2.gz UXLXXKSUMUPQFX-NXEZZACHSA-N -1 3 393.429 -1.214 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NC[C@H]1CNC(=O)C1 ZINC001603675489 1076286666 /nfs/dbraw/zinc/28/66/66/1076286666.db2.gz UXLXXKSUMUPQFX-NXEZZACHSA-N -1 3 393.429 -1.214 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC[C@@H]1CNC(=O)C1 ZINC001603675490 1076286682 /nfs/dbraw/zinc/28/66/82/1076286682.db2.gz UXLXXKSUMUPQFX-UWVGGRQHSA-N -1 3 393.429 -1.214 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NC[C@@H]1CNC(=O)C1 ZINC001603675490 1076286678 /nfs/dbraw/zinc/28/66/78/1076286678.db2.gz UXLXXKSUMUPQFX-UWVGGRQHSA-N -1 3 393.429 -1.214 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC[C@H]1CNC(=O)C1 ZINC001603675491 1076286546 /nfs/dbraw/zinc/28/65/46/1076286546.db2.gz UXLXXKSUMUPQFX-VHSXEESVSA-N -1 3 393.429 -1.214 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NC[C@H]1CNC(=O)C1 ZINC001603675491 1076286543 /nfs/dbraw/zinc/28/65/43/1076286543.db2.gz UXLXXKSUMUPQFX-VHSXEESVSA-N -1 3 393.429 -1.214 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC[C@@H]1CNC(=O)C1 ZINC001603675492 1076286461 /nfs/dbraw/zinc/28/64/61/1076286461.db2.gz UXLXXKSUMUPQFX-ZJUUUORDSA-N -1 3 393.429 -1.214 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NC[C@@H]1CNC(=O)C1 ZINC001603675492 1076286457 /nfs/dbraw/zinc/28/64/57/1076286457.db2.gz UXLXXKSUMUPQFX-ZJUUUORDSA-N -1 3 393.429 -1.214 20 0 GAADHM C[C@H](NS(C)(=O)=O)C(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nn[n-]n2)nc1 ZINC001603676231 1076286532 /nfs/dbraw/zinc/28/65/32/1076286532.db2.gz BZKBGLSDSNLCAW-DLOVCJGASA-N -1 3 392.445 -1.011 20 0 GAADHM C[C@H](NS(C)(=O)=O)C(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nnn[n-]2)nc1 ZINC001603676231 1076286527 /nfs/dbraw/zinc/28/65/27/1076286527.db2.gz BZKBGLSDSNLCAW-DLOVCJGASA-N -1 3 392.445 -1.011 20 0 GAADHM C[C@@H](NS(C)(=O)=O)C(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nn[n-]n2)nc1 ZINC001603676236 1076286450 /nfs/dbraw/zinc/28/64/50/1076286450.db2.gz BZKBGLSDSNLCAW-USWWRNFRSA-N -1 3 392.445 -1.011 20 0 GAADHM C[C@@H](NS(C)(=O)=O)C(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nnn[n-]2)nc1 ZINC001603676236 1076286446 /nfs/dbraw/zinc/28/64/46/1076286446.db2.gz BZKBGLSDSNLCAW-USWWRNFRSA-N -1 3 392.445 -1.011 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@@H]1COC[C@H]1O ZINC001603676570 1076287041 /nfs/dbraw/zinc/28/70/41/1076287041.db2.gz JHWKSLDGFRKPEV-GGZOMVNGSA-N -1 3 382.402 -1.591 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@@H]1COC[C@H]1O ZINC001603676570 1076287037 /nfs/dbraw/zinc/28/70/37/1076287037.db2.gz JHWKSLDGFRKPEV-GGZOMVNGSA-N -1 3 382.402 -1.591 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@@H]1COC[C@H]1O ZINC001603676571 1076287073 /nfs/dbraw/zinc/28/70/73/1076287073.db2.gz JHWKSLDGFRKPEV-XXILOJSOSA-N -1 3 382.402 -1.591 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@@H]1COC[C@H]1O ZINC001603676571 1076287070 /nfs/dbraw/zinc/28/70/70/1076287070.db2.gz JHWKSLDGFRKPEV-XXILOJSOSA-N -1 3 382.402 -1.591 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@@H]1COCC[C@H]1O ZINC001603676647 1076286965 /nfs/dbraw/zinc/28/69/65/1076286965.db2.gz LCYOVMYBCOKUOD-OASPWFOLSA-N -1 3 396.429 -1.201 20 0 GAADHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@@H]1COCC[C@H]1O ZINC001603676647 1076286959 /nfs/dbraw/zinc/28/69/59/1076286959.db2.gz LCYOVMYBCOKUOD-OASPWFOLSA-N -1 3 396.429 -1.201 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@@H]1COCC[C@H]1O ZINC001603676660 1076286882 /nfs/dbraw/zinc/28/68/82/1076286882.db2.gz LCYOVMYBCOKUOD-ZWKOPEQDSA-N -1 3 396.429 -1.201 20 0 GAADHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@@H]1COCC[C@H]1O ZINC001603676660 1076286878 /nfs/dbraw/zinc/28/68/78/1076286878.db2.gz LCYOVMYBCOKUOD-ZWKOPEQDSA-N -1 3 396.429 -1.201 20 0 GAADHM C[C@H](NS(C)(=O)=O)C(=O)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001603677558 1076287054 /nfs/dbraw/zinc/28/70/54/1076287054.db2.gz XUOJPBZVLXCSBG-JTQLQIEISA-N -1 3 380.434 -1.152 20 0 GAADHM C[C@H](NS(C)(=O)=O)C(=O)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001603677558 1076287049 /nfs/dbraw/zinc/28/70/49/1076287049.db2.gz XUOJPBZVLXCSBG-JTQLQIEISA-N -1 3 380.434 -1.152 20 0 GAADHM C[C@@H](NS(C)(=O)=O)C(=O)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001603677559 1076286949 /nfs/dbraw/zinc/28/69/49/1076286949.db2.gz XUOJPBZVLXCSBG-SNVBAGLBSA-N -1 3 380.434 -1.152 20 0 GAADHM C[C@@H](NS(C)(=O)=O)C(=O)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001603677559 1076286944 /nfs/dbraw/zinc/28/69/44/1076286944.db2.gz XUOJPBZVLXCSBG-SNVBAGLBSA-N -1 3 380.434 -1.152 20 0 GAADHM C[C@H](Nc1ccc(-c2nn[n-]n2)cn1)[C@H]1CN(C(=O)Cn2cnnn2)CCO1 ZINC001603682467 1076287507 /nfs/dbraw/zinc/28/75/07/1076287507.db2.gz UQAMLMXKICJYDC-CMPLNLGQSA-N -1 3 385.392 -1.024 20 0 GAADHM C[C@H](Nc1ccc(-c2nnn[n-]2)cn1)[C@H]1CN(C(=O)Cn2cnnn2)CCO1 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VOZNPKTXKGIVCJ-MRXNPFEDSA-N -1 3 390.404 -1.586 20 0 GAADHM CCNC(=O)CC(=O)N1CC[C@@](O)(CNC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001604352438 1076300127 /nfs/dbraw/zinc/30/01/27/1076300127.db2.gz VOZNPKTXKGIVCJ-MRXNPFEDSA-N -1 3 390.404 -1.586 20 0 GAADHM CCNS(=O)(=O)CCNC(=O)C(=O)NCc1ccc(-c2nn[n-]n2)cc1 ZINC001604356824 1076300305 /nfs/dbraw/zinc/30/03/05/1076300305.db2.gz OOSIQQWMUFWKIX-UHFFFAOYSA-N -1 3 381.418 -1.462 20 0 GAADHM CCNS(=O)(=O)CCNC(=O)C(=O)NCc1ccc(-c2nnn[n-]2)cc1 ZINC001604356824 1076300300 /nfs/dbraw/zinc/30/03/00/1076300300.db2.gz OOSIQQWMUFWKIX-UHFFFAOYSA-N -1 3 381.418 -1.462 20 0 GAADHM CCNS(=O)(=O)CCNC(=O)C(=O)N1CCc2ccc(-c3nn[n-]n3)cc21 ZINC001604357127 1076300524 /nfs/dbraw/zinc/30/05/24/1076300524.db2.gz UNAQNWPXOWWCAD-UHFFFAOYSA-N -1 3 393.429 -1.189 20 0 GAADHM CCNS(=O)(=O)CCNC(=O)C(=O)N1CCc2ccc(-c3nnn[n-]3)cc21 ZINC001604357127 1076300523 /nfs/dbraw/zinc/30/05/23/1076300523.db2.gz UNAQNWPXOWWCAD-UHFFFAOYSA-N -1 3 393.429 -1.189 20 0 GAADHM CCOC(=O)[C@H](C)NC(=O)[C@@H](C)NS(=O)(=O)c1cncc(-c2nn[n-]n2)c1 ZINC001604361546 1076300554 /nfs/dbraw/zinc/30/05/54/1076300554.db2.gz HJQSUJGMPGMSOL-BDAKNGLRSA-N -1 3 397.417 -1.004 20 0 GAADHM CCOC(=O)[C@H](C)NC(=O)[C@@H](C)NS(=O)(=O)c1cncc(-c2nnn[n-]2)c1 ZINC001604361546 1076300549 /nfs/dbraw/zinc/30/05/49/1076300549.db2.gz HJQSUJGMPGMSOL-BDAKNGLRSA-N -1 3 397.417 -1.004 20 0 GAADHM CCOC(=O)[C@@H](C)NC(=O)[C@H](C)NS(=O)(=O)c1cncc(-c2nn[n-]n2)c1 ZINC001604361548 1076300544 /nfs/dbraw/zinc/30/05/44/1076300544.db2.gz HJQSUJGMPGMSOL-DTWKUNHWSA-N -1 3 397.417 -1.004 20 0 GAADHM CCOC(=O)[C@@H](C)NC(=O)[C@H](C)NS(=O)(=O)c1cncc(-c2nnn[n-]2)c1 ZINC001604361548 1076300543 /nfs/dbraw/zinc/30/05/43/1076300543.db2.gz HJQSUJGMPGMSOL-DTWKUNHWSA-N -1 3 397.417 -1.004 20 0 GAADHM CCOC(=O)[C@H](C)NC(=O)[C@H](C)NS(=O)(=O)c1cncc(-c2nn[n-]n2)c1 ZINC001604361551 1076300520 /nfs/dbraw/zinc/30/05/20/1076300520.db2.gz HJQSUJGMPGMSOL-IUCAKERBSA-N -1 3 397.417 -1.004 20 0 GAADHM CCOC(=O)[C@H](C)NC(=O)[C@H](C)NS(=O)(=O)c1cncc(-c2nnn[n-]2)c1 ZINC001604361551 1076300516 /nfs/dbraw/zinc/30/05/16/1076300516.db2.gz HJQSUJGMPGMSOL-IUCAKERBSA-N -1 3 397.417 -1.004 20 0 GAADHM CCOC(=O)[C@@H](C)NC(=O)[C@@H](C)NS(=O)(=O)c1cncc(-c2nn[n-]n2)c1 ZINC001604361554 1076300696 /nfs/dbraw/zinc/30/06/96/1076300696.db2.gz HJQSUJGMPGMSOL-RKDXNWHRSA-N -1 3 397.417 -1.004 20 0 GAADHM CCOC(=O)[C@@H](C)NC(=O)[C@@H](C)NS(=O)(=O)c1cncc(-c2nnn[n-]2)c1 ZINC001604361554 1076300691 /nfs/dbraw/zinc/30/06/91/1076300691.db2.gz HJQSUJGMPGMSOL-RKDXNWHRSA-N -1 3 397.417 -1.004 20 0 GAADHM CCOC(=O)CNC(=O)[C@H]1COCCN1C(=O)c1cc(-c2nn[n-]n2)cn1C ZINC001604375539 1076300668 /nfs/dbraw/zinc/30/06/68/1076300668.db2.gz GQUOBAQQYROOBE-GFCCVEGCSA-N -1 3 391.388 -1.275 20 0 GAADHM CCOC(=O)CNC(=O)[C@H]1COCCN1C(=O)c1cc(-c2nnn[n-]2)cn1C ZINC001604375539 1076300665 /nfs/dbraw/zinc/30/06/65/1076300665.db2.gz GQUOBAQQYROOBE-GFCCVEGCSA-N -1 3 391.388 -1.275 20 0 GAADHM CCOC(=O)CNC(=O)[C@@H]1COCCN1C(=O)c1cc(-c2nn[n-]n2)cn1C ZINC001604375541 1076300709 /nfs/dbraw/zinc/30/07/09/1076300709.db2.gz GQUOBAQQYROOBE-LBPRGKRZSA-N -1 3 391.388 -1.275 20 0 GAADHM CCOC(=O)CNC(=O)[C@@H]1COCCN1C(=O)c1cc(-c2nnn[n-]2)cn1C ZINC001604375541 1076300705 /nfs/dbraw/zinc/30/07/05/1076300705.db2.gz GQUOBAQQYROOBE-LBPRGKRZSA-N -1 3 391.388 -1.275 20 0 GAADHM CCOC(=O)CN(CC(N)=O)S(=O)(=O)c1ccc(-c2nn[n-]n2)cc1OC ZINC001604376023 1076300588 /nfs/dbraw/zinc/30/05/88/1076300588.db2.gz MQBVAKUSMXEKFG-UHFFFAOYSA-N -1 3 398.401 -1.086 20 0 GAADHM CCOC(=O)CN(CC(N)=O)S(=O)(=O)c1ccc(-c2nnn[n-]2)cc1OC ZINC001604376023 1076300583 /nfs/dbraw/zinc/30/05/83/1076300583.db2.gz MQBVAKUSMXEKFG-UHFFFAOYSA-N -1 3 398.401 -1.086 20 0 GAADHM CCOC(=O)c1cnn(CC(=O)N2CCC(C(N)=O)CC2)c1-c1nnn[n-]1 ZINC001604389771 1076301035 /nfs/dbraw/zinc/30/10/35/1076301035.db2.gz DYULWXKSACSAPF-UHFFFAOYSA-N -1 3 376.377 -1.036 20 0 GAADHM CCOCCNC(=O)CN1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001604429450 1076301216 /nfs/dbraw/zinc/30/12/16/1076301216.db2.gz RSELNRLKIRYEEP-CHWSQXEVSA-N -1 3 392.420 -1.878 20 0 GAADHM CCOCCNC(=O)CN1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001604429450 1076301211 /nfs/dbraw/zinc/30/12/11/1076301211.db2.gz RSELNRLKIRYEEP-CHWSQXEVSA-N -1 3 392.420 -1.878 20 0 GAADHM CCON(C)C(=O)CNC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001604437409 1076301779 /nfs/dbraw/zinc/30/17/79/1076301779.db2.gz OHRYHYIBCUMTIL-UHFFFAOYSA-N -1 3 397.417 -1.329 20 0 GAADHM CCON(C)C(=O)CNC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001604437409 1076301775 /nfs/dbraw/zinc/30/17/75/1076301775.db2.gz OHRYHYIBCUMTIL-UHFFFAOYSA-N -1 3 397.417 -1.329 20 0 GAADHM CCS(=O)(=O)CC(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@H]1O ZINC001604473631 1076302239 /nfs/dbraw/zinc/30/22/39/1076302239.db2.gz BMZQFHPUXFIECP-GHMZBOCLSA-N -1 3 381.418 -1.638 20 0 GAADHM CCS(=O)(=O)CC(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@H]1O ZINC001604473631 1076302236 /nfs/dbraw/zinc/30/22/36/1076302236.db2.gz BMZQFHPUXFIECP-GHMZBOCLSA-N -1 3 381.418 -1.638 20 0 GAADHM CCS(=O)(=O)CC(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001604473632 1076302248 /nfs/dbraw/zinc/30/22/48/1076302248.db2.gz BMZQFHPUXFIECP-MNOVXSKESA-N -1 3 381.418 -1.638 20 0 GAADHM CCS(=O)(=O)CC(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001604473632 1076302246 /nfs/dbraw/zinc/30/22/46/1076302246.db2.gz BMZQFHPUXFIECP-MNOVXSKESA-N -1 3 381.418 -1.638 20 0 GAADHM CCS(=O)(=O)CC(=O)N[C@@H]1CN(Cc2ccccc2-c2nn[n-]n2)C[C@H]1O ZINC001604474035 1076302025 /nfs/dbraw/zinc/30/20/25/1076302025.db2.gz GJJJNDYBRZIDFF-ZIAGYGMSSA-N -1 3 394.457 -1.037 20 0 GAADHM CCS(=O)(=O)CC(=O)N[C@@H]1CN(Cc2cccc(-c3nn[n-]n3)c2)C[C@@H]1O ZINC001604474050 1076302072 /nfs/dbraw/zinc/30/20/72/1076302072.db2.gz HABWHVAIUFYAMT-KGLIPLIRSA-N -1 3 394.457 -1.037 20 0 GAADHM CCS(=O)(=O)NCCNC(=O)C(=O)NCc1ccc(-c2nn[n-]n2)cc1 ZINC001604474357 1076302646 /nfs/dbraw/zinc/30/26/46/1076302646.db2.gz CBUBJGZTLALTNI-UHFFFAOYSA-N -1 3 381.418 -1.462 20 0 GAADHM CCS(=O)(=O)NCCNC(=O)C(=O)NCc1ccc(-c2nnn[n-]2)cc1 ZINC001604474357 1076302640 /nfs/dbraw/zinc/30/26/40/1076302640.db2.gz CBUBJGZTLALTNI-UHFFFAOYSA-N -1 3 381.418 -1.462 20 0 GAADHM CCS(=O)(=O)NCCNC(=O)NCCNc1ncccc1-c1nn[n-]n1 ZINC001604474434 1076302578 /nfs/dbraw/zinc/30/25/78/1076302578.db2.gz DDDQCTQZXSOFOT-UHFFFAOYSA-N -1 3 383.438 -1.088 20 0 GAADHM CCS(=O)(=O)NCCNC(=O)NCCNc1ncccc1-c1nnn[n-]1 ZINC001604474434 1076302573 /nfs/dbraw/zinc/30/25/73/1076302573.db2.gz DDDQCTQZXSOFOT-UHFFFAOYSA-N -1 3 383.438 -1.088 20 0 GAADHM CCS(=O)(=O)NCCNS(=O)(=O)c1cnc(C)c(-c2nn[n-]n2)c1 ZINC001604474460 1076302461 /nfs/dbraw/zinc/30/24/61/1076302461.db2.gz DMWWTRMTKOJVEK-UHFFFAOYSA-N -1 3 375.436 -1.212 20 0 GAADHM CCS(=O)(=O)NCCNS(=O)(=O)c1cnc(C)c(-c2nnn[n-]2)c1 ZINC001604474460 1076302452 /nfs/dbraw/zinc/30/24/52/1076302452.db2.gz DMWWTRMTKOJVEK-UHFFFAOYSA-N -1 3 375.436 -1.212 20 0 GAADHM CCS(=O)(=O)NCCCNS(=O)(=O)c1cncc(-c2nn[n-]n2)c1 ZINC001604474492 1076302511 /nfs/dbraw/zinc/30/25/11/1076302511.db2.gz GAVPJSQQNRGPMW-UHFFFAOYSA-N -1 3 375.436 -1.131 20 0 GAADHM CCS(=O)(=O)NCCCNS(=O)(=O)c1cncc(-c2nnn[n-]2)c1 ZINC001604474492 1076302508 /nfs/dbraw/zinc/30/25/08/1076302508.db2.gz GAVPJSQQNRGPMW-UHFFFAOYSA-N -1 3 375.436 -1.131 20 0 GAADHM CCS(=O)(=O)CC(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001604474598 1076302628 /nfs/dbraw/zinc/30/26/28/1076302628.db2.gz NBIXUJCFHKCHSP-GHMZBOCLSA-N -1 3 399.408 -1.499 20 0 GAADHM CCS(=O)(=O)CC(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001604474598 1076302620 /nfs/dbraw/zinc/30/26/20/1076302620.db2.gz NBIXUJCFHKCHSP-GHMZBOCLSA-N -1 3 399.408 -1.499 20 0 GAADHM CCS(=O)(=O)CC(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001604474601 1076302438 /nfs/dbraw/zinc/30/24/38/1076302438.db2.gz NBIXUJCFHKCHSP-MNOVXSKESA-N -1 3 399.408 -1.499 20 0 GAADHM CCS(=O)(=O)CC(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001604474601 1076302434 /nfs/dbraw/zinc/30/24/34/1076302434.db2.gz NBIXUJCFHKCHSP-MNOVXSKESA-N -1 3 399.408 -1.499 20 0 GAADHM CCS(=O)(=O)NCCN1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001604474784 1076303065 /nfs/dbraw/zinc/30/30/65/1076303065.db2.gz IIEAZZPWSIFORJ-NEPJUHHUSA-N -1 3 398.449 -2.091 20 0 GAADHM CCS(=O)(=O)NCCN1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001604474784 1076303062 /nfs/dbraw/zinc/30/30/62/1076303062.db2.gz IIEAZZPWSIFORJ-NEPJUHHUSA-N -1 3 398.449 -2.091 20 0 GAADHM CCS(=O)(=O)NCC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nn[n-]n2)nc1 ZINC001604474834 1076302875 /nfs/dbraw/zinc/30/28/75/1076302875.db2.gz MIVWBWMDDCODER-RYUDHWBXSA-N -1 3 392.445 -1.010 20 0 GAADHM CCS(=O)(=O)NCC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nnn[n-]2)nc1 ZINC001604474834 1076302873 /nfs/dbraw/zinc/30/28/73/1076302873.db2.gz MIVWBWMDDCODER-RYUDHWBXSA-N -1 3 392.445 -1.010 20 0 GAADHM CCS(=O)(=O)NCCNC(=O)NCCNc1ccc(-c2nn[n-]n2)cn1 ZINC001604474910 1076303079 /nfs/dbraw/zinc/30/30/79/1076303079.db2.gz QLYKYUJQSGTYEX-UHFFFAOYSA-N -1 3 383.438 -1.088 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CNS(=O)(=O)CCC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001604893822 1076328461 /nfs/dbraw/zinc/32/84/61/1076328461.db2.gz WNDGRZJRHXIQGV-MNOVXSKESA-N -1 3 396.433 -2.133 20 0 GAADHM CNS(=O)(=O)CCC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001604893822 1076328454 /nfs/dbraw/zinc/32/84/54/1076328454.db2.gz WNDGRZJRHXIQGV-MNOVXSKESA-N -1 3 396.433 -2.133 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(Cc2cccc(-c3nn[n-]n3)c2)C[C@H]1O ZINC001604893827 1076328372 /nfs/dbraw/zinc/32/83/72/1076328372.db2.gz WRRZXMZZNYASSP-CHWSQXEVSA-N -1 3 395.445 -1.923 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(Cc2cccc(-c3nn[n-]n3)c2)C[C@@H]1O ZINC001604893828 1076328506 /nfs/dbraw/zinc/32/85/06/1076328506.db2.gz WRRZXMZZNYASSP-OLZOCXBDSA-N -1 3 395.445 -1.923 20 0 GAADHM CNS(=O)(=O)CCC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nn[n-]n2)nc1 ZINC001604893852 1076328421 /nfs/dbraw/zinc/32/84/21/1076328421.db2.gz XFQUJYSTZXIQFM-RYUDHWBXSA-N -1 3 392.445 -1.010 20 0 GAADHM CNS(=O)(=O)CCC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc(-c2nnn[n-]2)nc1 ZINC001604893852 1076328416 /nfs/dbraw/zinc/32/84/16/1076328416.db2.gz XFQUJYSTZXIQFM-RYUDHWBXSA-N -1 3 392.445 -1.010 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@H]1OC ZINC001604893871 1076328570 /nfs/dbraw/zinc/32/85/70/1076328570.db2.gz YCRSJDNLZOWTFC-VXGBXAGGSA-N -1 3 396.433 -1.869 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@H]1OC ZINC001604893871 1076328566 /nfs/dbraw/zinc/32/85/66/1076328566.db2.gz YCRSJDNLZOWTFC-VXGBXAGGSA-N -1 3 396.433 -1.869 20 0 GAADHM CNS(=O)(=O)CCCNC(=O)CNC(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001604893882 1076328882 /nfs/dbraw/zinc/32/88/82/1076328882.db2.gz YFYBVPBVGGCURF-UHFFFAOYSA-N -1 3 381.418 -1.348 20 0 GAADHM CNS(=O)(=O)CCCNC(=O)CNC(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001604893882 1076328877 /nfs/dbraw/zinc/32/88/77/1076328877.db2.gz YFYBVPBVGGCURF-UHFFFAOYSA-N -1 3 381.418 -1.348 20 0 GAADHM CNS(=O)(=O)CC(=O)NCCCN(C)c1ncc(-c2nn[n-]n2)cc1F ZINC001604893913 1076328778 /nfs/dbraw/zinc/32/87/78/1076328778.db2.gz YYVNIRMBLGDOSV-UHFFFAOYSA-N -1 3 386.413 -1.108 20 0 GAADHM CNS(=O)(=O)CC(=O)NCCCN(C)c1ncc(-c2nnn[n-]2)cc1F ZINC001604893913 1076328771 /nfs/dbraw/zinc/32/87/71/1076328771.db2.gz YYVNIRMBLGDOSV-UHFFFAOYSA-N -1 3 386.413 -1.108 20 0 GAADHM CNS(=O)(=O)CC(=O)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)cc2)C[C@H]1O ZINC001604893945 1076329009 /nfs/dbraw/zinc/32/90/09/1076329009.db2.gz ZLHPNSPPQZMMKW-CHWSQXEVSA-N -1 3 395.445 -1.923 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC=CCNc1ccc(-c2nn[n-]n2)nc1 ZINC001604896398 1076328841 /nfs/dbraw/zinc/32/88/41/1076328841.db2.gz ACSIVOPUWINEIV-IHWYPQMZSA-N -1 3 381.422 -1.600 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC=CCNc1ccc(-c2nnn[n-]2)nc1 ZINC001604896398 1076328833 /nfs/dbraw/zinc/32/88/33/1076328833.db2.gz ACSIVOPUWINEIV-IHWYPQMZSA-N -1 3 381.422 -1.600 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC=CCNc1ccc(-c2nn[n-]n2)nc1 ZINC001604896408 1076328904 /nfs/dbraw/zinc/32/89/04/1076328904.db2.gz ACSIVOPUWINEIV-NSCUHMNNSA-N -1 3 381.422 -1.600 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC=CCNc1ccc(-c2nnn[n-]2)nc1 ZINC001604896408 1076328898 /nfs/dbraw/zinc/32/88/98/1076328898.db2.gz ACSIVOPUWINEIV-NSCUHMNNSA-N -1 3 381.422 -1.600 20 0 GAADHM CNS(=O)(=O)N1CCN(c2nc3c(cc2-c2nn[n-]n2)COCC3)CC1 ZINC001604896417 1076328759 /nfs/dbraw/zinc/32/87/59/1076328759.db2.gz AIRANGGNXMRLNR-UHFFFAOYSA-N -1 3 380.434 -1.079 20 0 GAADHM CNS(=O)(=O)N1CCN(c2nc3c(cc2-c2nnn[n-]2)COCC3)CC1 ZINC001604896417 1076328754 /nfs/dbraw/zinc/32/87/54/1076328754.db2.gz AIRANGGNXMRLNR-UHFFFAOYSA-N -1 3 380.434 -1.079 20 0 GAADHM CNS(=O)(=O)CCNC(=O)C(=O)N[C@@H]1CCc2cc(-c3nn[n-]n3)ccc21 ZINC001604896530 1076329022 /nfs/dbraw/zinc/32/90/22/1076329022.db2.gz CDKCLSKPIFECPD-GFCCVEGCSA-N -1 3 393.429 -1.364 20 0 GAADHM CNS(=O)(=O)CCNC(=O)C(=O)N[C@@H]1CCc2cc(-c3nnn[n-]3)ccc21 ZINC001604896530 1076329019 /nfs/dbraw/zinc/32/90/19/1076329019.db2.gz CDKCLSKPIFECPD-GFCCVEGCSA-N -1 3 393.429 -1.364 20 0 GAADHM CNS(=O)(=O)CCNC(=O)C(=O)N[C@H]1CCc2cc(-c3nn[n-]n3)ccc21 ZINC001604896532 1076328963 /nfs/dbraw/zinc/32/89/63/1076328963.db2.gz CDKCLSKPIFECPD-LBPRGKRZSA-N -1 3 393.429 -1.364 20 0 GAADHM CNS(=O)(=O)CCNC(=O)C(=O)N[C@H]1CCc2cc(-c3nnn[n-]3)ccc21 ZINC001604896532 1076328957 /nfs/dbraw/zinc/32/89/57/1076328957.db2.gz CDKCLSKPIFECPD-LBPRGKRZSA-N -1 3 393.429 -1.364 20 0 GAADHM CNS(=O)(=O)CCNC(=O)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001604896543 1076329032 /nfs/dbraw/zinc/32/90/32/1076329032.db2.gz COGRUISSWMTSIM-UHFFFAOYSA-N -1 3 395.449 -1.358 20 0 GAADHM CNS(=O)(=O)CCNC(=O)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001604896543 1076329030 /nfs/dbraw/zinc/32/90/30/1076329030.db2.gz COGRUISSWMTSIM-UHFFFAOYSA-N -1 3 395.449 -1.358 20 0 GAADHM CNS(=O)(=O)CCNC(=O)C(=O)Nc1cc(-c2nn[n-]n2)ccc1OC ZINC001604896593 1076328727 /nfs/dbraw/zinc/32/87/27/1076328727.db2.gz DBCHGUUBDUBGQQ-UHFFFAOYSA-N -1 3 383.390 -1.521 20 0 GAADHM CNS(=O)(=O)CCNC(=O)C(=O)Nc1cc(-c2nnn[n-]2)ccc1OC ZINC001604896593 1076328722 /nfs/dbraw/zinc/32/87/22/1076328722.db2.gz DBCHGUUBDUBGQQ-UHFFFAOYSA-N -1 3 383.390 -1.521 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1C[C@@H](Nc2ccc(-c3nn[n-]n3)cn2)C1 ZINC001604896621 1076328862 /nfs/dbraw/zinc/32/88/62/1076328862.db2.gz DPEBDQZODCHZKP-AOOOYVTPSA-N -1 3 381.422 -1.625 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1C[C@@H](Nc2ccc(-c3nnn[n-]3)cn2)C1 ZINC001604896621 1076328855 /nfs/dbraw/zinc/32/88/55/1076328855.db2.gz DPEBDQZODCHZKP-AOOOYVTPSA-N -1 3 381.422 -1.625 20 0 GAADHM CNS(=O)(=O)N1CCN(S(=O)(=O)c2ccccc2-c2nn[n-]n2)CC1 ZINC001604896642 1076328795 /nfs/dbraw/zinc/32/87/95/1076328795.db2.gz FRUZZBFKMWSUFE-UHFFFAOYSA-N -1 3 387.447 -1.363 20 0 GAADHM CNS(=O)(=O)N1CCN(S(=O)(=O)c2ccccc2-c2nnn[n-]2)CC1 ZINC001604896642 1076328790 /nfs/dbraw/zinc/32/87/90/1076328790.db2.gz FRUZZBFKMWSUFE-UHFFFAOYSA-N -1 3 387.447 -1.363 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)Nc1ccc(-c2nn[n-]n2)c(C)n1 ZINC001604896667 1076329452 /nfs/dbraw/zinc/32/94/52/1076329452.db2.gz GWUGRKDYPJQNRE-MRVPVSSYSA-N -1 3 383.438 -1.459 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)Nc1ccc(-c2nnn[n-]2)c(C)n1 ZINC001604896667 1076329448 /nfs/dbraw/zinc/32/94/48/1076329448.db2.gz GWUGRKDYPJQNRE-MRVPVSSYSA-N -1 3 383.438 -1.459 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)Nc1ccc(-c2nn[n-]n2)c(C)n1 ZINC001604896668 1076329440 /nfs/dbraw/zinc/32/94/40/1076329440.db2.gz GWUGRKDYPJQNRE-QMMMGPOBSA-N -1 3 383.438 -1.459 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)Nc1ccc(-c2nnn[n-]2)c(C)n1 ZINC001604896668 1076329436 /nfs/dbraw/zinc/32/94/36/1076329436.db2.gz GWUGRKDYPJQNRE-QMMMGPOBSA-N -1 3 383.438 -1.459 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001604896670 1076329306 /nfs/dbraw/zinc/32/93/06/1076329306.db2.gz GZUCSABMFNOTMJ-UHFFFAOYSA-N -1 3 381.422 -2.036 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001604896670 1076329299 /nfs/dbraw/zinc/32/92/99/1076329299.db2.gz GZUCSABMFNOTMJ-UHFFFAOYSA-N -1 3 381.422 -2.036 20 0 GAADHM CNS(=O)(=O)N1CCN(C(=O)Nc2cnc(OC)c(-c3nnn[n-]3)c2)CC1 ZINC001604897040 1076329389 /nfs/dbraw/zinc/32/93/89/1076329389.db2.gz JRQTYODUOMDSIK-UHFFFAOYSA-N -1 3 397.421 -1.116 20 0 GAADHM CNS(=O)(=O)CCNC(=O)C(=O)N[C@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC001604897145 1076329325 /nfs/dbraw/zinc/32/93/25/1076329325.db2.gz KXBKXQUNXAYKHQ-SECBINFHSA-N -1 3 381.418 -1.291 20 0 GAADHM CNS(=O)(=O)CCNC(=O)C(=O)N[C@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC001604897145 1076329317 /nfs/dbraw/zinc/32/93/17/1076329317.db2.gz KXBKXQUNXAYKHQ-SECBINFHSA-N -1 3 381.418 -1.291 20 0 GAADHM CNS(=O)(=O)CCNC(=O)C(=O)N[C@@H](C)c1cccc(-c2nn[n-]n2)c1 ZINC001604897147 1076329212 /nfs/dbraw/zinc/32/92/12/1076329212.db2.gz KXBKXQUNXAYKHQ-VIFPVBQESA-N -1 3 381.418 -1.291 20 0 GAADHM CNS(=O)(=O)CCNC(=O)C(=O)N[C@@H](C)c1cccc(-c2nnn[n-]2)c1 ZINC001604897147 1076329204 /nfs/dbraw/zinc/32/92/04/1076329204.db2.gz KXBKXQUNXAYKHQ-VIFPVBQESA-N -1 3 381.418 -1.291 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCO[C@@H](c2cccc(-c3nn[n-]n3)c2)C1 ZINC001604897247 1076329197 /nfs/dbraw/zinc/32/91/97/1076329197.db2.gz LQMIEIKUGAJENA-GFCCVEGCSA-N -1 3 381.418 -1.180 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCO[C@@H](c2cccc(-c3nnn[n-]3)c2)C1 ZINC001604897247 1076329192 /nfs/dbraw/zinc/32/91/92/1076329192.db2.gz LQMIEIKUGAJENA-GFCCVEGCSA-N -1 3 381.418 -1.180 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCO[C@H](c2cccc(-c3nn[n-]n3)c2)C1 ZINC001604897494 1076329407 /nfs/dbraw/zinc/32/94/07/1076329407.db2.gz LQMIEIKUGAJENA-LBPRGKRZSA-N -1 3 381.418 -1.180 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCO[C@H](c2cccc(-c3nnn[n-]3)c2)C1 ZINC001604897494 1076329401 /nfs/dbraw/zinc/32/94/01/1076329401.db2.gz LQMIEIKUGAJENA-LBPRGKRZSA-N -1 3 381.418 -1.180 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCCNc1ccc(-c2nn[n-]n2)c(C)n1 ZINC001604897569 1076329426 /nfs/dbraw/zinc/32/94/26/1076329426.db2.gz OBOLKPALVVMOIO-UHFFFAOYSA-N -1 3 383.438 -1.458 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCCCNc1ccc(-c2nnn[n-]2)c(C)n1 ZINC001604897569 1076329420 /nfs/dbraw/zinc/32/94/20/1076329420.db2.gz OBOLKPALVVMOIO-UHFFFAOYSA-N -1 3 383.438 -1.458 20 0 GAADHM CNS(=O)(=O)N1CCN(C[C@@H](O)COc2ccccc2-c2nn[n-]n2)CC1 ZINC001604897586 1076329370 /nfs/dbraw/zinc/32/93/70/1076329370.db2.gz OZIOMQNLFRQPJE-GFCCVEGCSA-N -1 3 397.461 -1.312 20 0 GAADHM CNS(=O)(=O)N1CCN(C[C@@H](O)COc2ccccc2-c2nnn[n-]2)CC1 ZINC001604897586 1076329365 /nfs/dbraw/zinc/32/93/65/1076329365.db2.gz OZIOMQNLFRQPJE-GFCCVEGCSA-N -1 3 397.461 -1.312 20 0 GAADHM CNS(=O)(=O)N1CCN(C[C@H](O)COc2ccccc2-c2nn[n-]n2)CC1 ZINC001604897587 1076329263 /nfs/dbraw/zinc/32/92/63/1076329263.db2.gz OZIOMQNLFRQPJE-LBPRGKRZSA-N -1 3 397.461 -1.312 20 0 GAADHM CNS(=O)(=O)N1CCN(C[C@H](O)COc2ccccc2-c2nnn[n-]2)CC1 ZINC001604897587 1076329257 /nfs/dbraw/zinc/32/92/57/1076329257.db2.gz OZIOMQNLFRQPJE-LBPRGKRZSA-N -1 3 397.461 -1.312 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)C[C@@H](C)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001604897590 1076329150 /nfs/dbraw/zinc/32/91/50/1076329150.db2.gz PCKGFZDRFYXWNP-SECBINFHSA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)C[C@@H](C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001604897590 1076329147 /nfs/dbraw/zinc/32/91/47/1076329147.db2.gz PCKGFZDRFYXWNP-SECBINFHSA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)C[C@H](C)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001604897591 1076329238 /nfs/dbraw/zinc/32/92/38/1076329238.db2.gz PCKGFZDRFYXWNP-VIFPVBQESA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)C[C@H](C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001604897591 1076329234 /nfs/dbraw/zinc/32/92/34/1076329234.db2.gz PCKGFZDRFYXWNP-VIFPVBQESA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)[C@H](C)CNc1ncccc1-c1nn[n-]n1 ZINC001604897697 1076329347 /nfs/dbraw/zinc/32/93/47/1076329347.db2.gz RJXSBXCZUJBYGU-SECBINFHSA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)[C@H](C)CNc1ncccc1-c1nnn[n-]1 ZINC001604897697 1076329342 /nfs/dbraw/zinc/32/93/42/1076329342.db2.gz RJXSBXCZUJBYGU-SECBINFHSA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)[C@@H](C)CNc1ncccc1-c1nn[n-]n1 ZINC001604897700 1076329138 /nfs/dbraw/zinc/32/91/38/1076329138.db2.gz RJXSBXCZUJBYGU-VIFPVBQESA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)[C@@H](C)CNc1ncccc1-c1nnn[n-]1 ZINC001604897700 1076329133 /nfs/dbraw/zinc/32/91/33/1076329133.db2.gz RJXSBXCZUJBYGU-VIFPVBQESA-N -1 3 383.438 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H](C)CNc1snc(C)c1-c1nnn[n-]1 ZINC001604897713 1076329168 /nfs/dbraw/zinc/32/91/68/1076329168.db2.gz RRDKKQVHZNHETN-ZCFIWIBFSA-N -1 3 389.467 -1.398 20 0 GAADHM CNS(=O)(=O)CCNC(=O)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1 ZINC001604897716 1076329847 /nfs/dbraw/zinc/32/98/47/1076329847.db2.gz RSYFESJPYARKLW-UHFFFAOYSA-N -1 3 395.449 -1.358 20 0 GAADHM CNS(=O)(=O)CCNC(=O)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1 ZINC001604897716 1076329841 /nfs/dbraw/zinc/32/98/41/1076329841.db2.gz RSYFESJPYARKLW-UHFFFAOYSA-N -1 3 395.449 -1.358 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC[C@@H](C)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001604897854 1076329747 /nfs/dbraw/zinc/32/97/47/1076329747.db2.gz STCIFVFJRATHKW-SECBINFHSA-N -1 3 383.438 -1.378 20 0 GAADHM CNS(=O)(=O)NCC(=O)NCC[C@@H](C)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001604897854 1076329742 /nfs/dbraw/zinc/32/97/42/1076329742.db2.gz STCIFVFJRATHKW-SECBINFHSA-N -1 3 383.438 -1.378 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)CNc1ncccc1-c1nn[n-]n1 ZINC001604897871 1076329688 /nfs/dbraw/zinc/32/96/88/1076329688.db2.gz UAFXUCUFFZRVSY-SECBINFHSA-N -1 3 383.438 -1.520 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@@H](C)CNc1ncccc1-c1nnn[n-]1 ZINC001604897871 1076329684 /nfs/dbraw/zinc/32/96/84/1076329684.db2.gz UAFXUCUFFZRVSY-SECBINFHSA-N -1 3 383.438 -1.520 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)CNc1ncccc1-c1nn[n-]n1 ZINC001604897875 1076329605 /nfs/dbraw/zinc/32/96/05/1076329605.db2.gz UAFXUCUFFZRVSY-VIFPVBQESA-N -1 3 383.438 -1.520 20 0 GAADHM CNS(=O)(=O)NCC(=O)NC[C@H](C)CNc1ncccc1-c1nnn[n-]1 ZINC001604897875 1076329602 /nfs/dbraw/zinc/32/96/02/1076329602.db2.gz UAFXUCUFFZRVSY-VIFPVBQESA-N -1 3 383.438 -1.520 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1C[C@@H](C)[C@H](Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001604897888 1076329815 /nfs/dbraw/zinc/32/98/15/1076329815.db2.gz UNMPRGRKHLHXSO-BXKDBHETSA-N -1 3 395.449 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1C[C@@H](C)[C@H](Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001604897888 1076329809 /nfs/dbraw/zinc/32/98/09/1076329809.db2.gz UNMPRGRKHLHXSO-BXKDBHETSA-N -1 3 395.449 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)CCCNc1ccc(-c2nn[n-]n2)cn1 ZINC001604897909 1076329716 /nfs/dbraw/zinc/32/97/16/1076329716.db2.gz VYJXGLSSNZHSTC-UHFFFAOYSA-N -1 3 383.438 -1.424 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)CCCNc1ccc(-c2nnn[n-]2)cn1 ZINC001604897909 1076329711 /nfs/dbraw/zinc/32/97/11/1076329711.db2.gz VYJXGLSSNZHSTC-UHFFFAOYSA-N -1 3 383.438 -1.424 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1C[C@@H](C)[C@H](Nc2ncccc2-c2nn[n-]n2)C1 ZINC001604897910 1076329701 /nfs/dbraw/zinc/32/97/01/1076329701.db2.gz VYWOFJYYUJZZBZ-MWLCHTKSSA-N -1 3 395.449 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1C[C@@H](C)[C@H](Nc2ncccc2-c2nnn[n-]2)C1 ZINC001604897910 1076329696 /nfs/dbraw/zinc/32/96/96/1076329696.db2.gz VYWOFJYYUJZZBZ-MWLCHTKSSA-N -1 3 395.449 -1.426 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nn[n-]n3)nc2)[C@@H]1C ZINC001604897937 1076329732 /nfs/dbraw/zinc/32/97/32/1076329732.db2.gz XLFBRUXXQHZFJC-KOLCDFICSA-N -1 3 395.449 -1.601 20 0 GAADHM CNS(=O)(=O)NCC(=O)N[C@H]1CCN(c2ccc(-c3nnn[n-]3)nc2)[C@@H]1C ZINC001604897937 1076329726 /nfs/dbraw/zinc/32/97/26/1076329726.db2.gz XLFBRUXXQHZFJC-KOLCDFICSA-N -1 3 395.449 -1.601 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)CCNc1nc(C)ccc1-c1nn[n-]n1 ZINC001604897938 1076329618 /nfs/dbraw/zinc/32/96/18/1076329618.db2.gz XMBDWCCWZLGCPA-UHFFFAOYSA-N -1 3 383.438 -1.506 20 0 GAADHM CNS(=O)(=O)NCC(=O)N(C)CCNc1nc(C)ccc1-c1nnn[n-]1 ZINC001604897938 1076329614 /nfs/dbraw/zinc/32/96/14/1076329614.db2.gz XMBDWCCWZLGCPA-UHFFFAOYSA-N -1 3 383.438 -1.506 20 0 GAADHM CNS(=O)(=O)N1CCN(C(=O)NCc2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001604897944 1076329830 /nfs/dbraw/zinc/32/98/30/1076329830.db2.gz YFLNLWNWDNFYOA-UHFFFAOYSA-N -1 3 381.422 -1.447 20 0 GAADHM CNS(=O)(=O)N1CCN(C(=O)NCc2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001604897944 1076329825 /nfs/dbraw/zinc/32/98/25/1076329825.db2.gz YFLNLWNWDNFYOA-UHFFFAOYSA-N -1 3 381.422 -1.447 20 0 GAADHM CNS(=O)(=O)NCC(=O)N1CCN(c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001604897960 1076329573 /nfs/dbraw/zinc/32/95/73/1076329573.db2.gz ZFFMHRJIDLDKDQ-UHFFFAOYSA-N -1 3 380.434 -1.431 20 0 GAADHM CNS(=O)(=O)CCNC(=O)C(=O)NCc1ccc(OC)c(-c2nn[n-]n2)c1 ZINC001604897961 1076329674 /nfs/dbraw/zinc/32/96/74/1076329674.db2.gz ZFGZVGRJJZKFKS-UHFFFAOYSA-N -1 3 397.417 -1.843 20 0 GAADHM CNS(=O)(=O)CCNC(=O)C(=O)NCc1ccc(OC)c(-c2nnn[n-]2)c1 ZINC001604897961 1076329671 /nfs/dbraw/zinc/32/96/71/1076329671.db2.gz ZFGZVGRJJZKFKS-UHFFFAOYSA-N -1 3 397.417 -1.843 20 0 GAADHM COC(=O)C(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c1ccccc1-c1nn[n-]n1 ZINC001604900561 1076329784 /nfs/dbraw/zinc/32/97/84/1076329784.db2.gz RYSMEOBYHUZSLQ-MRVPVSSYSA-N -1 3 397.369 -1.181 20 0 GAADHM COC(=O)C(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c1ccccc1-c1nnn[n-]1 ZINC001604900561 1076329778 /nfs/dbraw/zinc/32/97/78/1076329778.db2.gz RYSMEOBYHUZSLQ-MRVPVSSYSA-N -1 3 397.369 -1.181 20 0 GAADHM COC(=O)C(=O)[C@H](C)OC(=O)CNS(=O)(=O)c1ccccc1-c1nn[n-]n1 ZINC001604900562 1076329628 /nfs/dbraw/zinc/32/96/28/1076329628.db2.gz RYSMEOBYHUZSLQ-QMMMGPOBSA-N -1 3 397.369 -1.181 20 0 GAADHM COC(=O)C(=O)[C@H](C)OC(=O)CNS(=O)(=O)c1ccccc1-c1nnn[n-]1 ZINC001604900562 1076329626 /nfs/dbraw/zinc/32/96/26/1076329626.db2.gz RYSMEOBYHUZSLQ-QMMMGPOBSA-N -1 3 397.369 -1.181 20 0 GAADHM COC(=O)[C@H](CC1OCCO1)NS(=O)(=O)c1cncc(-c2nn[n-]n2)c1 ZINC001604904889 1076330246 /nfs/dbraw/zinc/33/02/46/1076330246.db2.gz PFIHYXXNRKHWGA-JTQLQIEISA-N -1 3 384.374 -1.155 20 0 GAADHM COC(=O)[C@H](CC1OCCO1)NS(=O)(=O)c1cncc(-c2nnn[n-]2)c1 ZINC001604904889 1076330242 /nfs/dbraw/zinc/33/02/42/1076330242.db2.gz PFIHYXXNRKHWGA-JTQLQIEISA-N -1 3 384.374 -1.155 20 0 GAADHM COC(=O)[C@@H](CC1OCCO1)NS(=O)(=O)c1cncc(-c2nn[n-]n2)c1 ZINC001604904890 1076330000 /nfs/dbraw/zinc/33/00/00/1076330000.db2.gz 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ZINC001604927771 1076330598 /nfs/dbraw/zinc/33/05/98/1076330598.db2.gz WFHLKMHXPFAHAS-CYBMUJFWSA-N -1 3 387.400 -1.202 20 0 GAADHM COC(=O)[C@H]1CN(C)C(=O)CN1CC(=O)NCc1cccc(-c2nnn[n-]2)c1 ZINC001604927771 1076330594 /nfs/dbraw/zinc/33/05/94/1076330594.db2.gz WFHLKMHXPFAHAS-CYBMUJFWSA-N -1 3 387.400 -1.202 20 0 GAADHM COC(=O)[C@@H]1CN(C)C(=O)CN1CC(=O)NCc1cccc(-c2nn[n-]n2)c1 ZINC001604927772 1076330458 /nfs/dbraw/zinc/33/04/58/1076330458.db2.gz WFHLKMHXPFAHAS-ZDUSSCGKSA-N -1 3 387.400 -1.202 20 0 GAADHM COC(=O)[C@@H]1CN(C)C(=O)CN1CC(=O)NCc1cccc(-c2nnn[n-]2)c1 ZINC001604927772 1076330453 /nfs/dbraw/zinc/33/04/53/1076330453.db2.gz WFHLKMHXPFAHAS-ZDUSSCGKSA-N -1 3 387.400 -1.202 20 0 GAADHM COC(=O)C[C@H]1C(=O)NCCN1S(=O)(=O)c1ccccc1-c1nn[n-]n1 ZINC001604930778 1076330477 /nfs/dbraw/zinc/33/04/77/1076330477.db2.gz RPUNLBLFSLNSNE-JTQLQIEISA-N -1 3 380.386 -1.081 20 0 GAADHM COC(=O)C[C@H]1C(=O)NCCN1S(=O)(=O)c1ccccc1-c1nnn[n-]1 ZINC001604930778 1076330474 /nfs/dbraw/zinc/33/04/74/1076330474.db2.gz RPUNLBLFSLNSNE-JTQLQIEISA-N -1 3 380.386 -1.081 20 0 GAADHM COC(=O)C[C@@H]1C(=O)NCCN1S(=O)(=O)c1ccccc1-c1nn[n-]n1 ZINC001604930779 1076330635 /nfs/dbraw/zinc/33/06/35/1076330635.db2.gz RPUNLBLFSLNSNE-SNVBAGLBSA-N -1 3 380.386 -1.081 20 0 GAADHM COC(=O)C[C@@H]1C(=O)NCCN1S(=O)(=O)c1ccccc1-c1nnn[n-]1 ZINC001604930779 1076330631 /nfs/dbraw/zinc/33/06/31/1076330631.db2.gz RPUNLBLFSLNSNE-SNVBAGLBSA-N -1 3 380.386 -1.081 20 0 GAADHM COC(=O)C[C@H]1C(=O)NCCN1S(=O)(=O)c1cncc(-c2nn[n-]n2)c1 ZINC001604931289 1076330666 /nfs/dbraw/zinc/33/06/66/1076330666.db2.gz ZDIXMQXEFLOFMV-JTQLQIEISA-N -1 3 381.374 -1.686 20 0 GAADHM COC(=O)C[C@H]1C(=O)NCCN1S(=O)(=O)c1cncc(-c2nnn[n-]2)c1 ZINC001604931289 1076330662 /nfs/dbraw/zinc/33/06/62/1076330662.db2.gz ZDIXMQXEFLOFMV-JTQLQIEISA-N -1 3 381.374 -1.686 20 0 GAADHM COC(=O)C[C@@H]1C(=O)NCCN1S(=O)(=O)c1cncc(-c2nn[n-]n2)c1 ZINC001604931295 1076330617 /nfs/dbraw/zinc/33/06/17/1076330617.db2.gz ZDIXMQXEFLOFMV-SNVBAGLBSA-N -1 3 381.374 -1.686 20 0 GAADHM COC(=O)C[C@@H]1C(=O)NCCN1S(=O)(=O)c1cncc(-c2nnn[n-]2)c1 ZINC001604931295 1076330611 /nfs/dbraw/zinc/33/06/11/1076330611.db2.gz ZDIXMQXEFLOFMV-SNVBAGLBSA-N -1 3 381.374 -1.686 20 0 GAADHM COC(=O)CCNC(=O)CCNC(=O)CNc1ccc(-c2nn[n-]n2)cn1 ZINC001604938798 1076331007 /nfs/dbraw/zinc/33/10/07/1076331007.db2.gz VGYIKQOCSSEBMT-UHFFFAOYSA-N -1 3 376.377 -1.141 20 0 GAADHM COC(=O)CCNC(=O)CCNC(=O)CNc1ccc(-c2nnn[n-]2)cn1 ZINC001604938798 1076331000 /nfs/dbraw/zinc/33/10/00/1076331000.db2.gz VGYIKQOCSSEBMT-UHFFFAOYSA-N -1 3 376.377 -1.141 20 0 GAADHM COC(=O)CNC(=O)CNS(=O)(=O)Cc1ccc(F)cc1-c1nn[n-]n1 ZINC001604939631 1076331024 /nfs/dbraw/zinc/33/10/24/1076331024.db2.gz GEGPRTGHWADEHT-UHFFFAOYSA-N -1 3 386.365 -1.286 20 0 GAADHM COC(=O)CNC(=O)CNS(=O)(=O)Cc1ccc(F)cc1-c1nnn[n-]1 ZINC001604939631 1076331018 /nfs/dbraw/zinc/33/10/18/1076331018.db2.gz GEGPRTGHWADEHT-UHFFFAOYSA-N -1 3 386.365 -1.286 20 0 GAADHM COC(=O)CN(CC(=O)OC)S(=O)(=O)c1cnc(C)c(-c2nn[n-]n2)c1 ZINC001604940107 1076330841 /nfs/dbraw/zinc/33/08/41/1076330841.db2.gz RMEBUHWWRHLSEX-UHFFFAOYSA-N -1 3 384.374 -1.093 20 0 GAADHM COC(=O)CN(CC(=O)OC)S(=O)(=O)c1cnc(C)c(-c2nnn[n-]2)c1 ZINC001604940107 1076330837 /nfs/dbraw/zinc/33/08/37/1076330837.db2.gz RMEBUHWWRHLSEX-UHFFFAOYSA-N -1 3 384.374 -1.093 20 0 GAADHM COC(=O)CNC(=O)[C@@H](C)N1CCN(c2c(-c3nn[n-]n3)c(C)nn2C)CC1 ZINC001604940110 1076331046 /nfs/dbraw/zinc/33/10/46/1076331046.db2.gz RUYWTRFPDHKAGT-LLVKDONJSA-N -1 3 391.436 -1.292 20 0 GAADHM COC(=O)CNC(=O)[C@@H](C)N1CCN(c2c(-c3nnn[n-]3)c(C)nn2C)CC1 ZINC001604940110 1076331041 /nfs/dbraw/zinc/33/10/41/1076331041.db2.gz RUYWTRFPDHKAGT-LLVKDONJSA-N -1 3 391.436 -1.292 20 0 GAADHM COC(=O)CNC(=O)[C@H](C)N1CCN(c2c(-c3nn[n-]n3)c(C)nn2C)CC1 ZINC001604940111 1076330986 /nfs/dbraw/zinc/33/09/86/1076330986.db2.gz RUYWTRFPDHKAGT-NSHDSACASA-N -1 3 391.436 -1.292 20 0 GAADHM COC(=O)CNC(=O)[C@H](C)N1CCN(c2c(-c3nnn[n-]3)c(C)nn2C)CC1 ZINC001604940111 1076330980 /nfs/dbraw/zinc/33/09/80/1076330980.db2.gz RUYWTRFPDHKAGT-NSHDSACASA-N -1 3 391.436 -1.292 20 0 GAADHM COC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001604940234 1076331225 /nfs/dbraw/zinc/33/12/25/1076331225.db2.gz VIXREDYECOVDGF-UHFFFAOYSA-N -1 3 375.345 -1.998 20 0 GAADHM COC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001604940234 1076331224 /nfs/dbraw/zinc/33/12/24/1076331224.db2.gz VIXREDYECOVDGF-UHFFFAOYSA-N -1 3 375.345 -1.998 20 0 GAADHM COC(=O)COCCNC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001604941392 1076331519 /nfs/dbraw/zinc/33/15/19/1076331519.db2.gz XWTIKCIILHVGEO-UHFFFAOYSA-N -1 3 398.401 -1.549 20 0 GAADHM COC(=O)COCCNC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001604941392 1076331513 /nfs/dbraw/zinc/33/15/13/1076331513.db2.gz XWTIKCIILHVGEO-UHFFFAOYSA-N -1 3 398.401 -1.549 20 0 GAADHM COC(=O)N(C)CCNC(=O)C(=O)NCCNc1ncccc1-c1nn[n-]n1 ZINC001604944435 1076331369 /nfs/dbraw/zinc/33/13/69/1076331369.db2.gz HGUKBYVXPMHYDH-UHFFFAOYSA-N -1 3 391.392 -1.396 20 0 GAADHM COC(=O)N(C)CCNC(=O)C(=O)NCCNc1ncccc1-c1nnn[n-]1 ZINC001604944435 1076331366 /nfs/dbraw/zinc/33/13/66/1076331366.db2.gz HGUKBYVXPMHYDH-UHFFFAOYSA-N -1 3 391.392 -1.396 20 0 GAADHM COC(=O)N(C)CCNC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001604945638 1076331501 /nfs/dbraw/zinc/33/15/01/1076331501.db2.gz YVMHNLMXLRERAH-UHFFFAOYSA-N -1 3 397.417 -1.041 20 0 GAADHM COC(=O)N(C)CCNC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001604945638 1076331495 /nfs/dbraw/zinc/33/14/95/1076331495.db2.gz YVMHNLMXLRERAH-UHFFFAOYSA-N -1 3 397.417 -1.041 20 0 GAADHM COC(=O)NC1CN(C(=O)C(=O)NCCNc2ncccc2-c2nn[n-]n2)C1 ZINC001604950803 1076331484 /nfs/dbraw/zinc/33/14/84/1076331484.db2.gz UKYGAAMESDYMIZ-UHFFFAOYSA-N -1 3 389.376 -1.643 20 0 GAADHM COC(=O)NC1CN(C(=O)C(=O)NCCNc2ncccc2-c2nnn[n-]2)C1 ZINC001604950803 1076331478 /nfs/dbraw/zinc/33/14/78/1076331478.db2.gz UKYGAAMESDYMIZ-UHFFFAOYSA-N -1 3 389.376 -1.643 20 0 GAADHM COC(=O)NCC(=O)NC[C@@]1(O)CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001604952855 1076331303 /nfs/dbraw/zinc/33/13/03/1076331303.db2.gz PPRUZCWSUACRJA-HNNXBMFYSA-N -1 3 376.377 -1.325 20 0 GAADHM COC(=O)NCC(=O)NC[C@@]1(O)CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001604952855 1076331298 /nfs/dbraw/zinc/33/12/98/1076331298.db2.gz PPRUZCWSUACRJA-HNNXBMFYSA-N -1 3 376.377 -1.325 20 0 GAADHM COC(=O)NCC(=O)NC[C@]1(O)CCN(c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001604952862 1076331440 /nfs/dbraw/zinc/33/14/40/1076331440.db2.gz PPRUZCWSUACRJA-OAHLLOKOSA-N -1 3 376.377 -1.325 20 0 GAADHM COC(=O)NCC(=O)NC[C@]1(O)CCN(c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001604952862 1076331432 /nfs/dbraw/zinc/33/14/32/1076331432.db2.gz PPRUZCWSUACRJA-OAHLLOKOSA-N -1 3 376.377 -1.325 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001604953308 1076331389 /nfs/dbraw/zinc/33/13/89/1076331389.db2.gz UNNAJOMYDYYUGV-NXEZZACHSA-N -1 3 380.340 -1.578 20 0 GAADHM COC(=O)NCC(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001604953308 1076331384 /nfs/dbraw/zinc/33/13/84/1076331384.db2.gz UNNAJOMYDYYUGV-NXEZZACHSA-N -1 3 380.340 -1.578 20 0 GAADHM COC(=O)[C@@H]1CN(C(=O)C(=O)Nc2ccc(-c3nn[n-]n3)cn2)C[C@H](C)O1 ZINC001604958072 1076331941 /nfs/dbraw/zinc/33/19/41/1076331941.db2.gz UNCIHUDFQKYFJT-WPRPVWTQSA-N -1 3 375.345 -1.011 20 0 GAADHM COC(=O)[C@@H]1CN(C(=O)C(=O)Nc2ccc(-c3nnn[n-]3)cn2)C[C@H](C)O1 ZINC001604958072 1076331939 /nfs/dbraw/zinc/33/19/39/1076331939.db2.gz UNCIHUDFQKYFJT-WPRPVWTQSA-N -1 3 375.345 -1.011 20 0 GAADHM COC(=O)[C@H](C)NC(=O)[C@H](C)NS(=O)(=O)c1cncc(-c2nn[n-]n2)c1 ZINC001604962224 1076331835 /nfs/dbraw/zinc/33/18/35/1076331835.db2.gz WQYUKTBSFFDGJE-YUMQZZPRSA-N -1 3 383.390 -1.394 20 0 GAADHM COC(=O)[C@H](C)NC(=O)[C@H](C)NS(=O)(=O)c1cncc(-c2nnn[n-]2)c1 ZINC001604962224 1076331829 /nfs/dbraw/zinc/33/18/29/1076331829.db2.gz WQYUKTBSFFDGJE-YUMQZZPRSA-N -1 3 383.390 -1.394 20 0 GAADHM COC(=O)c1cc(-c2nn[n-]n2)ccc1S(=O)(=O)NCc1nnn(C)n1 ZINC001604963744 1076331639 /nfs/dbraw/zinc/33/16/39/1076331639.db2.gz NQQWVBRBSWMKBP-UHFFFAOYSA-N -1 3 379.362 -1.345 20 0 GAADHM COC(=O)c1cc(-c2nnn[n-]2)ccc1S(=O)(=O)NCc1nnn(C)n1 ZINC001604963744 1076331633 /nfs/dbraw/zinc/33/16/33/1076331633.db2.gz NQQWVBRBSWMKBP-UHFFFAOYSA-N -1 3 379.362 -1.345 20 0 GAADHM COC(=O)c1cc(-c2nn[n-]n2)ccc1S(=O)(=O)NCC(=O)N(C)OC ZINC001604963934 1076331700 /nfs/dbraw/zinc/33/17/00/1076331700.db2.gz CZNDHDMAFSKYSG-UHFFFAOYSA-N -1 3 384.374 -1.049 20 0 GAADHM COC(=O)c1cc(-c2nnn[n-]2)ccc1S(=O)(=O)NCC(=O)N(C)OC ZINC001604963934 1076331696 /nfs/dbraw/zinc/33/16/96/1076331696.db2.gz CZNDHDMAFSKYSG-UHFFFAOYSA-N -1 3 384.374 -1.049 20 0 GAADHM COC(=O)c1cc(-c2nn[n-]n2)ccc1S(=O)(=O)N1C[C@H](O)C[C@H](O)C1 ZINC001604964137 1076331735 /nfs/dbraw/zinc/33/17/35/1076331735.db2.gz ICUZFNFQUUAFBT-AOOOYVTPSA-N -1 3 383.386 -1.231 20 0 GAADHM COC(=O)c1cc(-c2nnn[n-]2)ccc1S(=O)(=O)N1C[C@H](O)C[C@H](O)C1 ZINC001604964137 1076331729 /nfs/dbraw/zinc/33/17/29/1076331729.db2.gz ICUZFNFQUUAFBT-AOOOYVTPSA-N -1 3 383.386 -1.231 20 0 GAADHM COC(=O)c1cc(-c2nn[n-]n2)ccc1S(=O)(=O)N1C[C@@H](O)[C@H](CO)C1 ZINC001604964181 1076331682 /nfs/dbraw/zinc/33/16/82/1076331682.db2.gz IQMUWWVALGTLHS-GXSJLCMTSA-N -1 3 383.386 -1.373 20 0 GAADHM COC(=O)c1cc(-c2nnn[n-]2)ccc1S(=O)(=O)N1C[C@@H](O)[C@H](CO)C1 ZINC001604964181 1076331678 /nfs/dbraw/zinc/33/16/78/1076331678.db2.gz IQMUWWVALGTLHS-GXSJLCMTSA-N -1 3 383.386 -1.373 20 0 GAADHM COC(=O)c1cc(-c2nn[n-]n2)ccc1S(=O)(=O)N1C[C@H](O)[C@@H](CO)C1 ZINC001604964182 1076331819 /nfs/dbraw/zinc/33/18/19/1076331819.db2.gz IQMUWWVALGTLHS-KOLCDFICSA-N -1 3 383.386 -1.373 20 0 GAADHM COC(=O)c1cc(-c2nnn[n-]2)ccc1S(=O)(=O)N1C[C@H](O)[C@@H](CO)C1 ZINC001604964182 1076331811 /nfs/dbraw/zinc/33/18/11/1076331811.db2.gz IQMUWWVALGTLHS-KOLCDFICSA-N -1 3 383.386 -1.373 20 0 GAADHM COC(=O)c1cc(-c2nn[n-]n2)ccc1S(=O)(=O)N1C[C@H](CO)[C@H](O)C1 ZINC001604964183 1076331715 /nfs/dbraw/zinc/33/17/15/1076331715.db2.gz IQMUWWVALGTLHS-MWLCHTKSSA-N -1 3 383.386 -1.373 20 0 GAADHM COC(=O)c1cc(-c2nnn[n-]2)ccc1S(=O)(=O)N1C[C@H](CO)[C@H](O)C1 ZINC001604964183 1076331712 /nfs/dbraw/zinc/33/17/12/1076331712.db2.gz IQMUWWVALGTLHS-MWLCHTKSSA-N -1 3 383.386 -1.373 20 0 GAADHM COC(=O)c1cc(-c2nn[n-]n2)ccc1S(=O)(=O)N1C[C@H](O)[C@H](CO)C1 ZINC001604964184 1076331889 /nfs/dbraw/zinc/33/18/89/1076331889.db2.gz IQMUWWVALGTLHS-ONGXEEELSA-N -1 3 383.386 -1.373 20 0 GAADHM COC(=O)c1cc(-c2nnn[n-]2)ccc1S(=O)(=O)N1C[C@H](O)[C@H](CO)C1 ZINC001604964184 1076331884 /nfs/dbraw/zinc/33/18/84/1076331884.db2.gz IQMUWWVALGTLHS-ONGXEEELSA-N -1 3 383.386 -1.373 20 0 GAADHM COC(=O)c1cc(-c2nn[n-]n2)ccc1S(=O)(=O)N1CCN(C)C[C@@H]1CO ZINC001604964347 1076331916 /nfs/dbraw/zinc/33/19/16/1076331916.db2.gz LWJMWOZWMJASOT-LLVKDONJSA-N -1 3 396.429 -1.050 20 0 GAADHM COC(=O)c1cc(-c2nnn[n-]2)ccc1S(=O)(=O)N1CCN(C)C[C@@H]1CO ZINC001604964347 1076331912 /nfs/dbraw/zinc/33/19/12/1076331912.db2.gz LWJMWOZWMJASOT-LLVKDONJSA-N -1 3 396.429 -1.050 20 0 GAADHM COC(=O)c1cc(-c2nn[n-]n2)ccc1S(=O)(=O)N1CCN(C)C[C@H]1CO ZINC001604964348 1076331873 /nfs/dbraw/zinc/33/18/73/1076331873.db2.gz 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COC[C@@H](CCO)NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001605053479 1076333936 /nfs/dbraw/zinc/33/39/36/1076333936.db2.gz YJXOUVSUJMXCSF-LLVKDONJSA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@@H](CCO)NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001605053479 1076333929 /nfs/dbraw/zinc/33/39/29/1076333929.db2.gz YJXOUVSUJMXCSF-LLVKDONJSA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@H](CCO)NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001605053481 1076334082 /nfs/dbraw/zinc/33/40/82/1076334082.db2.gz YJXOUVSUJMXCSF-NSHDSACASA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@H](CCO)NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001605053481 1076334076 /nfs/dbraw/zinc/33/40/76/1076334076.db2.gz YJXOUVSUJMXCSF-NSHDSACASA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@@H](CNC(=O)C(=O)NCCNc1ccc(-c2nn[n-]n2)cn1)OC ZINC001605054739 1076333813 /nfs/dbraw/zinc/33/38/13/1076333813.db2.gz BXIFSPJUZGVBFE-LLVKDONJSA-N -1 3 378.393 -1.433 20 0 GAADHM COC[C@@H](CNC(=O)C(=O)NCCNc1ccc(-c2nnn[n-]2)cn1)OC ZINC001605054739 1076333809 /nfs/dbraw/zinc/33/38/09/1076333809.db2.gz BXIFSPJUZGVBFE-LLVKDONJSA-N -1 3 378.393 -1.433 20 0 GAADHM COC[C@H](CNC(=O)C(=O)NCCNc1ccc(-c2nn[n-]n2)cn1)OC ZINC001605054740 1076334316 /nfs/dbraw/zinc/33/43/16/1076334316.db2.gz BXIFSPJUZGVBFE-NSHDSACASA-N -1 3 378.393 -1.433 20 0 GAADHM COC[C@H](CNC(=O)C(=O)NCCNc1ccc(-c2nnn[n-]2)cn1)OC ZINC001605054740 1076334314 /nfs/dbraw/zinc/33/43/14/1076334314.db2.gz BXIFSPJUZGVBFE-NSHDSACASA-N -1 3 378.393 -1.433 20 0 GAADHM COC[C@@H](CO)NC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001605055009 1076334290 /nfs/dbraw/zinc/33/42/90/1076334290.db2.gz FLFFLESRFWMHIT-GXSJLCMTSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@@H](CO)NC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001605055009 1076334286 /nfs/dbraw/zinc/33/42/86/1076334286.db2.gz FLFFLESRFWMHIT-GXSJLCMTSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@H](CO)NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001605055010 1076334330 /nfs/dbraw/zinc/33/43/30/1076334330.db2.gz FLFFLESRFWMHIT-KOLCDFICSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@H](CO)NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001605055010 1076334326 /nfs/dbraw/zinc/33/43/26/1076334326.db2.gz FLFFLESRFWMHIT-KOLCDFICSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@@H](CO)NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001605055011 1076334383 /nfs/dbraw/zinc/33/43/83/1076334383.db2.gz FLFFLESRFWMHIT-MWLCHTKSSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@@H](CO)NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001605055011 1076334379 /nfs/dbraw/zinc/33/43/79/1076334379.db2.gz FLFFLESRFWMHIT-MWLCHTKSSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@H](CO)NC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001605055012 1076334495 /nfs/dbraw/zinc/33/44/95/1076334495.db2.gz FLFFLESRFWMHIT-ONGXEEELSA-N -1 3 384.418 -1.343 20 0 GAADHM COC[C@H](CO)NC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001605055012 1076334489 /nfs/dbraw/zinc/33/44/89/1076334489.db2.gz FLFFLESRFWMHIT-ONGXEEELSA-N -1 3 384.418 -1.343 20 0 GAADHM COCC(COC)NC(=O)CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC001605055850 1076334305 /nfs/dbraw/zinc/33/43/05/1076334305.db2.gz LCJGPXPBFDVTBE-UHFFFAOYSA-N -1 3 384.418 -1.077 20 0 GAADHM COCC(COC)NC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001605055850 1076334301 /nfs/dbraw/zinc/33/43/01/1076334301.db2.gz LCJGPXPBFDVTBE-UHFFFAOYSA-N -1 3 384.418 -1.077 20 0 GAADHM COC[C@H](O)CCNC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001605059110 1076334399 /nfs/dbraw/zinc/33/43/99/1076334399.db2.gz KACCBOZVSVVYOQ-LLVKDONJSA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@H](O)CCNC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001605059110 1076334393 /nfs/dbraw/zinc/33/43/93/1076334393.db2.gz KACCBOZVSVVYOQ-LLVKDONJSA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@@H](O)CCNC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001605059113 1076334227 /nfs/dbraw/zinc/33/42/27/1076334227.db2.gz KACCBOZVSVVYOQ-NSHDSACASA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@@H](O)CCNC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001605059113 1076334221 /nfs/dbraw/zinc/33/42/21/1076334221.db2.gz KACCBOZVSVVYOQ-NSHDSACASA-N -1 3 384.418 -1.341 20 0 GAADHM COC[C@H](OC)C(=O)NC[C@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001605060181 1076334814 /nfs/dbraw/zinc/33/48/14/1076334814.db2.gz PVBXIPYBMQXDAU-BLLLJJGKSA-N -1 3 377.405 -1.020 20 0 GAADHM COC[C@H](OC)C(=O)NC[C@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001605060181 1076334811 /nfs/dbraw/zinc/33/48/11/1076334811.db2.gz PVBXIPYBMQXDAU-BLLLJJGKSA-N -1 3 377.405 -1.020 20 0 GAADHM COC[C@H](OC)C(=O)NC[C@@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001605060183 1076334662 /nfs/dbraw/zinc/33/46/62/1076334662.db2.gz PVBXIPYBMQXDAU-LRDDRELGSA-N -1 3 377.405 -1.020 20 0 GAADHM COC[C@H](OC)C(=O)NC[C@@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001605060183 1076334654 /nfs/dbraw/zinc/33/46/54/1076334654.db2.gz PVBXIPYBMQXDAU-LRDDRELGSA-N -1 3 377.405 -1.020 20 0 GAADHM COC[C@@H](OC)C(=O)NC[C@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001605060185 1076334767 /nfs/dbraw/zinc/33/47/67/1076334767.db2.gz PVBXIPYBMQXDAU-MLGOLLRUSA-N -1 3 377.405 -1.020 20 0 GAADHM COC[C@@H](OC)C(=O)NC[C@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001605060185 1076334761 /nfs/dbraw/zinc/33/47/61/1076334761.db2.gz PVBXIPYBMQXDAU-MLGOLLRUSA-N -1 3 377.405 -1.020 20 0 GAADHM COC[C@@H](OC)C(=O)NC[C@@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001605060187 1076334700 /nfs/dbraw/zinc/33/47/00/1076334700.db2.gz PVBXIPYBMQXDAU-WBMJQRKESA-N -1 3 377.405 -1.020 20 0 GAADHM COC[C@@H](OC)C(=O)NC[C@@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001605060187 1076334694 /nfs/dbraw/zinc/33/46/94/1076334694.db2.gz PVBXIPYBMQXDAU-WBMJQRKESA-N -1 3 377.405 -1.020 20 0 GAADHM COCC1(O)CN(C(=O)[C@H](C)NS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)C1 ZINC001605067425 1076334624 /nfs/dbraw/zinc/33/46/24/1076334624.db2.gz CYAOWMXUMOICOJ-JTQLQIEISA-N -1 3 396.429 -1.247 20 0 GAADHM COCC1(O)CN(C(=O)[C@H](C)NS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)C1 ZINC001605067425 1076334616 /nfs/dbraw/zinc/33/46/16/1076334616.db2.gz CYAOWMXUMOICOJ-JTQLQIEISA-N -1 3 396.429 -1.247 20 0 GAADHM COCC1(O)CN(C(=O)[C@@H](C)NS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)C1 ZINC001605067426 1076334911 /nfs/dbraw/zinc/33/49/11/1076334911.db2.gz CYAOWMXUMOICOJ-SNVBAGLBSA-N -1 3 396.429 -1.247 20 0 GAADHM COCC1(O)CN(C(=O)[C@@H](C)NS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)C1 ZINC001605067426 1076334904 /nfs/dbraw/zinc/33/49/04/1076334904.db2.gz CYAOWMXUMOICOJ-SNVBAGLBSA-N -1 3 396.429 -1.247 20 0 GAADHM COCC1(O)CN(C(=O)[C@H](C)NS(=O)(=O)c2cccc(-c3nn[n-]n3)c2)C1 ZINC001605067753 1076334642 /nfs/dbraw/zinc/33/46/42/1076334642.db2.gz KYDJRDLWKVDVFN-JTQLQIEISA-N -1 3 396.429 -1.247 20 0 GAADHM COCC1(O)CN(C(=O)[C@H](C)NS(=O)(=O)c2cccc(-c3nnn[n-]3)c2)C1 ZINC001605067753 1076334637 /nfs/dbraw/zinc/33/46/37/1076334637.db2.gz KYDJRDLWKVDVFN-JTQLQIEISA-N -1 3 396.429 -1.247 20 0 GAADHM COCC1(O)CN(C(=O)[C@@H](C)NS(=O)(=O)c2cccc(-c3nn[n-]n3)c2)C1 ZINC001605067754 1076335238 /nfs/dbraw/zinc/33/52/38/1076335238.db2.gz KYDJRDLWKVDVFN-SNVBAGLBSA-N -1 3 396.429 -1.247 20 0 GAADHM COCC1(O)CN(C(=O)[C@@H](C)NS(=O)(=O)c2cccc(-c3nnn[n-]3)c2)C1 ZINC001605067754 1076335231 /nfs/dbraw/zinc/33/52/31/1076335231.db2.gz KYDJRDLWKVDVFN-SNVBAGLBSA-N -1 3 396.429 -1.247 20 0 GAADHM COCC[C@H](CO)NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001605079961 1076335111 /nfs/dbraw/zinc/33/51/11/1076335111.db2.gz SYEUICBKBRKNDV-LLVKDONJSA-N -1 3 384.418 -1.341 20 0 GAADHM COCC[C@H](CO)NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001605079961 1076335108 /nfs/dbraw/zinc/33/51/08/1076335108.db2.gz SYEUICBKBRKNDV-LLVKDONJSA-N -1 3 384.418 -1.341 20 0 GAADHM COCC[C@@H](CO)NC(=O)CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC001605079962 1076335134 /nfs/dbraw/zinc/33/51/34/1076335134.db2.gz SYEUICBKBRKNDV-NSHDSACASA-N -1 3 384.418 -1.341 20 0 GAADHM COCC[C@@H](CO)NC(=O)CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC001605079962 1076335131 /nfs/dbraw/zinc/33/51/31/1076335131.db2.gz SYEUICBKBRKNDV-NSHDSACASA-N -1 3 384.418 -1.341 20 0 GAADHM COCCCNC(=O)CN1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001605088950 1076335051 /nfs/dbraw/zinc/33/50/51/1076335051.db2.gz GESLTXZATSGRQL-OLZOCXBDSA-N -1 3 392.420 -1.878 20 0 GAADHM COCCCNC(=O)CN1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001605088950 1076335045 /nfs/dbraw/zinc/33/50/45/1076335045.db2.gz GESLTXZATSGRQL-OLZOCXBDSA-N -1 3 392.420 -1.878 20 0 GAADHM COCCCNC(=O)C(=O)N1CCN(c2c(-c3nn[n-]n3)c(C)nn2C)CC1 ZINC001605089310 1076335543 /nfs/dbraw/zinc/33/55/43/1076335543.db2.gz SWVRUOQTBDZWNU-UHFFFAOYSA-N -1 3 391.436 -1.290 20 0 GAADHM COCCCNC(=O)C(=O)N1CCN(c2c(-c3nnn[n-]3)c(C)nn2C)CC1 ZINC001605089310 1076335538 /nfs/dbraw/zinc/33/55/38/1076335538.db2.gz SWVRUOQTBDZWNU-UHFFFAOYSA-N -1 3 391.436 -1.290 20 0 GAADHM COCCCOCC(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001605091480 1076335663 /nfs/dbraw/zinc/33/56/63/1076335663.db2.gz BHTZUMOZSFUUJC-OLZOCXBDSA-N -1 3 377.405 -1.020 20 0 GAADHM COCCCOCC(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001605091480 1076335659 /nfs/dbraw/zinc/33/56/59/1076335659.db2.gz BHTZUMOZSFUUJC-OLZOCXBDSA-N -1 3 377.405 -1.020 20 0 GAADHM COCCN(C)S(=O)(=O)N1CCN(c2c(-c3nn[n-]n3)c(C)nn2C)CC1 ZINC001605095109 1076335573 /nfs/dbraw/zinc/33/55/73/1076335573.db2.gz WJGRRSSKGVPDJY-UHFFFAOYSA-N -1 3 399.481 -1.146 20 0 GAADHM COCCN(C)S(=O)(=O)N1CCN(c2c(-c3nnn[n-]3)c(C)nn2C)CC1 ZINC001605095109 1076335570 /nfs/dbraw/zinc/33/55/70/1076335570.db2.gz WJGRRSSKGVPDJY-UHFFFAOYSA-N -1 3 399.481 -1.146 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CN(C)C(=O)N1)c1ccc(-c2nn[n-]n2)nc1 ZINC001605097106 1076335915 /nfs/dbraw/zinc/33/59/15/1076335915.db2.gz IZVATNFUZJOAMH-CYBMUJFWSA-N -1 3 389.420 -1.146 20 0 GAADHM COCCN(CCNC(=O)[C@H]1CN(C)C(=O)N1)c1ccc(-c2nnn[n-]2)nc1 ZINC001605097106 1076335909 /nfs/dbraw/zinc/33/59/09/1076335909.db2.gz IZVATNFUZJOAMH-CYBMUJFWSA-N -1 3 389.420 -1.146 20 0 GAADHM COCCN(CCNC(=O)[C@@H]1CN(C)C(=O)N1)c1ccc(-c2nn[n-]n2)nc1 ZINC001605097107 1076336015 /nfs/dbraw/zinc/33/60/15/1076336015.db2.gz IZVATNFUZJOAMH-ZDUSSCGKSA-N -1 3 389.420 -1.146 20 0 GAADHM 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ZINC001605323353 1076340840 /nfs/dbraw/zinc/34/08/40/1076340840.db2.gz AUTOVVARFYCTMC-KSSFIOAISA-N -1 3 382.461 -1.025 20 0 GAADHM CCCN1CC[C@@H](NC(=O)C(=O)N2CCN([C@]3(C(=O)[O-])CCOC3)CC2)C1 ZINC001605323354 1076340908 /nfs/dbraw/zinc/34/09/08/1076340908.db2.gz AUTOVVARFYCTMC-RDTXWAMCSA-N -1 3 382.461 -1.025 20 0 GAADHM COc1ncc(NC(=O)CNS(=O)(=O)c2cn(C)cn2)cc1-c1nnn[n-]1 ZINC001605346904 1076341001 /nfs/dbraw/zinc/34/10/01/1076341001.db2.gz FWWJXXUCIPRPGC-UHFFFAOYSA-N -1 3 393.389 -1.079 20 0 GAADHM COc1ncc(NC(=O)CNS(=O)(=O)c2cnn(C)c2)cc1-c1nnn[n-]1 ZINC001605347488 1076340947 /nfs/dbraw/zinc/34/09/47/1076340947.db2.gz JTFSFSSFLBFYGT-UHFFFAOYSA-N -1 3 393.389 -1.079 20 0 GAADHM COc1nccc(CN2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001605349307 1076341252 /nfs/dbraw/zinc/34/12/52/1076341252.db2.gz BBDZSUFAHXUPKO-CHWSQXEVSA-N -1 3 385.388 -1.032 20 0 GAADHM COc1nccc(CN2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001605349307 1076341248 /nfs/dbraw/zinc/34/12/48/1076341248.db2.gz BBDZSUFAHXUPKO-CHWSQXEVSA-N -1 3 385.388 -1.032 20 0 GAADHM COc1nccc(CN2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nn[n-]n4)c3)C2)n1 ZINC001605349443 1076341442 /nfs/dbraw/zinc/34/14/42/1076341442.db2.gz KQYJJUGOZFRYSF-CHWSQXEVSA-N -1 3 385.388 -1.032 20 0 GAADHM COc1nccc(CN2C[C@@H](O)[C@H](NC(=O)c3c[nH]c(-c4nnn[n-]4)c3)C2)n1 ZINC001605349443 1076341437 /nfs/dbraw/zinc/34/14/37/1076341437.db2.gz KQYJJUGOZFRYSF-CHWSQXEVSA-N -1 3 385.388 -1.032 20 0 GAADHM COc1nn(C)cc1C(=O)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)cn2)C[C@@H]1O ZINC001605350842 1076341411 /nfs/dbraw/zinc/34/14/11/1076341411.db2.gz RFJOHLBLYQMOJE-NEPJUHHUSA-N -1 3 385.388 -1.017 20 0 GAADHM COc1nn(C)cc1C(=O)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)cn2)C[C@@H]1O ZINC001605350842 1076341407 /nfs/dbraw/zinc/34/14/07/1076341407.db2.gz RFJOHLBLYQMOJE-NEPJUHHUSA-N -1 3 385.388 -1.017 20 0 GAADHM CS(=O)(=O)CC(=O)N1CC[C@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@H]21 ZINC001605352403 1076341285 /nfs/dbraw/zinc/34/12/85/1076341285.db2.gz BVVWBBIUWJRDTJ-JOYOIKCWSA-N -1 3 393.429 -1.088 20 0 GAADHM CS(=O)(=O)CC(=O)N1CC[C@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@H]21 ZINC001605352403 1076341278 /nfs/dbraw/zinc/34/12/78/1076341278.db2.gz BVVWBBIUWJRDTJ-JOYOIKCWSA-N -1 3 393.429 -1.088 20 0 GAADHM CS(=O)(=O)CC(=O)NC[C@@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001605352405 1076341455 /nfs/dbraw/zinc/34/14/55/1076341455.db2.gz BXGPCKPUVCPMAC-AWEZNQCLSA-N -1 3 381.418 -1.636 20 0 GAADHM CS(=O)(=O)CC(=O)NC[C@@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001605352405 1076341450 /nfs/dbraw/zinc/34/14/50/1076341450.db2.gz BXGPCKPUVCPMAC-AWEZNQCLSA-N -1 3 381.418 -1.636 20 0 GAADHM CS(=O)(=O)CC(=O)NC[C@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001605352406 1076341424 /nfs/dbraw/zinc/34/14/24/1076341424.db2.gz BXGPCKPUVCPMAC-CQSZACIVSA-N -1 3 381.418 -1.636 20 0 GAADHM CS(=O)(=O)CC(=O)NC[C@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001605352406 1076341419 /nfs/dbraw/zinc/34/14/19/1076341419.db2.gz BXGPCKPUVCPMAC-CQSZACIVSA-N -1 3 381.418 -1.636 20 0 GAADHM CS(=O)(=O)CC(=O)N[C@@H]1[C@H]2CN(c3ncc(-c4nn[n-]n4)cc3F)C[C@H]21 ZINC001605352431 1076341266 /nfs/dbraw/zinc/34/12/66/1076341266.db2.gz CSPFLIISWGAVJG-GDGBQDQQSA-N -1 3 381.393 -1.004 20 0 GAADHM CS(=O)(=O)CC(=O)N[C@@H]1[C@H]2CN(c3ncc(-c4nnn[n-]4)cc3F)C[C@H]21 ZINC001605352431 1076341262 /nfs/dbraw/zinc/34/12/62/1076341262.db2.gz CSPFLIISWGAVJG-GDGBQDQQSA-N -1 3 381.393 -1.004 20 0 GAADHM CS(=O)(=O)CC(=O)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001605352433 1076341726 /nfs/dbraw/zinc/34/17/26/1076341726.db2.gz DDCRKZMZWWYTLK-OLZOCXBDSA-N -1 3 398.420 -1.288 20 0 GAADHM CS(=O)(=O)CC1(C(=O)NCCNc2ccc(-c3nn[n-]n3)cn2)COC1 ZINC001605352457 1076341758 /nfs/dbraw/zinc/34/17/58/1076341758.db2.gz FMIKIBQVYUAUCN-UHFFFAOYSA-N -1 3 381.418 -1.149 20 0 GAADHM CS(=O)(=O)CC1(C(=O)NCCNc2ccc(-c3nnn[n-]3)cn2)COC1 ZINC001605352457 1076341753 /nfs/dbraw/zinc/34/17/53/1076341753.db2.gz FMIKIBQVYUAUCN-UHFFFAOYSA-N -1 3 381.418 -1.149 20 0 GAADHM CS(=O)(=O)CC(=O)N[C@@H]1CN(Cc2cccc(-c3nn[n-]n3)c2)C[C@@H]1O ZINC001605352459 1076341782 /nfs/dbraw/zinc/34/17/82/1076341782.db2.gz FXWQGVUOZKLHPW-OLZOCXBDSA-N -1 3 380.430 -1.427 20 0 GAADHM CS(=O)(=O)CC(=O)N[C@@H]1CN(Cc2ccccc2-c2nn[n-]n2)C[C@H]1O ZINC001605352470 1076341619 /nfs/dbraw/zinc/34/16/19/1076341619.db2.gz GFNRDSPYRWTUNG-CHWSQXEVSA-N -1 3 380.430 -1.427 20 0 GAADHM CS(=O)(=O)C[C@@H](O)CNS(=O)(=O)Cc1cc(-c2nn[n-]n2)ccc1F ZINC001605352709 1076341813 /nfs/dbraw/zinc/34/18/13/1076341813.db2.gz IKZDYMAHKDLQNJ-JTQLQIEISA-N -1 3 393.422 -1.169 20 0 GAADHM CS(=O)(=O)C[C@H](O)CNS(=O)(=O)Cc1cc(-c2nn[n-]n2)ccc1F ZINC001605352710 1076341770 /nfs/dbraw/zinc/34/17/70/1076341770.db2.gz IKZDYMAHKDLQNJ-SNVBAGLBSA-N -1 3 393.422 -1.169 20 0 GAADHM CS(=O)(=O)CC(=O)N1CCO[C@H](CNc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001605352734 1076341853 /nfs/dbraw/zinc/34/18/53/1076341853.db2.gz JRZPOCUJOONIJA-LLVKDONJSA-N -1 3 381.418 -1.054 20 0 GAADHM CS(=O)(=O)CC(=O)N1CCO[C@H](CNc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001605352734 1076341849 /nfs/dbraw/zinc/34/18/49/1076341849.db2.gz JRZPOCUJOONIJA-LLVKDONJSA-N -1 3 381.418 -1.054 20 0 GAADHM CS(=O)(=O)CC(=O)N1CCO[C@@H](CNc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001605352735 1076341834 /nfs/dbraw/zinc/34/18/34/1076341834.db2.gz JRZPOCUJOONIJA-NSHDSACASA-N -1 3 381.418 -1.054 20 0 GAADHM CS(=O)(=O)CC(=O)N1CCO[C@@H](CNc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001605352735 1076341830 /nfs/dbraw/zinc/34/18/30/1076341830.db2.gz JRZPOCUJOONIJA-NSHDSACASA-N -1 3 381.418 -1.054 20 0 GAADHM CS(=O)(=O)CC(=O)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)s2)C[C@H]1O ZINC001605353059 1076341603 /nfs/dbraw/zinc/34/16/03/1076341603.db2.gz PUTXLPNGUCLCSD-NXEZZACHSA-N -1 3 386.459 -1.366 20 0 GAADHM CS(=O)(=O)CC(=O)N[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C[C@H]1O ZINC001605353068 1076341743 /nfs/dbraw/zinc/34/17/43/1076341743.db2.gz QDXFQZJRVPITPM-GHMZBOCLSA-N -1 3 381.418 -1.638 20 0 GAADHM CS(=O)(=O)CC(=O)N[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C[C@H]1O ZINC001605353068 1076341737 /nfs/dbraw/zinc/34/17/37/1076341737.db2.gz QDXFQZJRVPITPM-GHMZBOCLSA-N -1 3 381.418 -1.638 20 0 GAADHM CS(=O)(=O)CC(=O)N[C@@H]1CCN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001605353069 1076341645 /nfs/dbraw/zinc/34/16/45/1076341645.db2.gz QDXFQZJRVPITPM-MNOVXSKESA-N -1 3 381.418 -1.638 20 0 GAADHM CS(=O)(=O)CC(=O)N[C@@H]1CCN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001605353069 1076341637 /nfs/dbraw/zinc/34/16/37/1076341637.db2.gz QDXFQZJRVPITPM-MNOVXSKESA-N -1 3 381.418 -1.638 20 0 GAADHM CS(=O)(=O)CC(=O)N[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001605353070 1076341698 /nfs/dbraw/zinc/34/16/98/1076341698.db2.gz QDXFQZJRVPITPM-QWRGUYRKSA-N -1 3 381.418 -1.638 20 0 GAADHM CS(=O)(=O)CC(=O)N[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001605353070 1076341694 /nfs/dbraw/zinc/34/16/94/1076341694.db2.gz QDXFQZJRVPITPM-QWRGUYRKSA-N -1 3 381.418 -1.638 20 0 GAADHM CS(=O)(=O)CC(=O)N[C@H]1CCN(c2ncccc2-c2nn[n-]n2)C[C@H]1O ZINC001605353138 1076341663 /nfs/dbraw/zinc/34/16/63/1076341663.db2.gz QDXFQZJRVPITPM-WDEREUQCSA-N -1 3 381.418 -1.638 20 0 GAADHM CS(=O)(=O)CC(=O)N[C@H]1CCN(c2ncccc2-c2nnn[n-]2)C[C@H]1O ZINC001605353138 1076341658 /nfs/dbraw/zinc/34/16/58/1076341658.db2.gz QDXFQZJRVPITPM-WDEREUQCSA-N -1 3 381.418 -1.638 20 0 GAADHM CS(=O)(=O)CC(=O)N[C@@H]1CN(Cc2ccc(-c3nn[n-]n3)c(F)c2)C[C@H]1O ZINC001605353144 1076341801 /nfs/dbraw/zinc/34/18/01/1076341801.db2.gz RHMDSFQPRHBEHH-CHWSQXEVSA-N -1 3 398.420 -1.288 20 0 GAADHM CS(=O)(=O)CC(=O)N[C@@H]1CN(Cc2ccc(-c3nnn[n-]3)c(F)c2)C[C@H]1O ZINC001605353144 1076341795 /nfs/dbraw/zinc/34/17/95/1076341795.db2.gz RHMDSFQPRHBEHH-CHWSQXEVSA-N -1 3 398.420 -1.288 20 0 GAADHM CS(=O)(=O)C[C@H](O)CNS(=O)(=O)c1cc(F)cc(-c2nn[n-]n2)c1 ZINC001605353155 1076341682 /nfs/dbraw/zinc/34/16/82/1076341682.db2.gz RNSNFFDJJPOVQX-SECBINFHSA-N -1 3 379.395 -1.310 20 0 GAADHM CS(=O)(=O)C[C@H](O)CNS(=O)(=O)c1cc(F)cc(-c2nnn[n-]2)c1 ZINC001605353155 1076341676 /nfs/dbraw/zinc/34/16/76/1076341676.db2.gz RNSNFFDJJPOVQX-SECBINFHSA-N -1 3 379.395 -1.310 20 0 GAADHM CS(=O)(=O)C[C@@H](O)CNS(=O)(=O)c1cc(F)cc(-c2nn[n-]n2)c1 ZINC001605353156 1076341944 /nfs/dbraw/zinc/34/19/44/1076341944.db2.gz RNSNFFDJJPOVQX-VIFPVBQESA-N -1 3 379.395 -1.310 20 0 GAADHM CS(=O)(=O)C[C@@H](O)CNS(=O)(=O)c1cc(F)cc(-c2nnn[n-]2)c1 ZINC001605353156 1076341941 /nfs/dbraw/zinc/34/19/41/1076341941.db2.gz RNSNFFDJJPOVQX-VIFPVBQESA-N -1 3 379.395 -1.310 20 0 GAADHM CS(=O)(=O)CC(=O)NC[C@H]1CN(c2ncccc2-c2nn[n-]n2)CCO1 ZINC001605353218 1076341984 /nfs/dbraw/zinc/34/19/84/1076341984.db2.gz VAJXEKKEPNBLOK-JTQLQIEISA-N -1 3 381.418 -1.372 20 0 GAADHM CS(=O)(=O)CC(=O)NC[C@H]1CN(c2ncccc2-c2nnn[n-]2)CCO1 ZINC001605353218 1076341981 /nfs/dbraw/zinc/34/19/81/1076341981.db2.gz VAJXEKKEPNBLOK-JTQLQIEISA-N -1 3 381.418 -1.372 20 0 GAADHM CS(=O)(=O)CC(=O)NC[C@@H]1CN(c2ncccc2-c2nn[n-]n2)CCO1 ZINC001605353219 1076342023 /nfs/dbraw/zinc/34/20/23/1076342023.db2.gz VAJXEKKEPNBLOK-SNVBAGLBSA-N -1 3 381.418 -1.372 20 0 GAADHM CS(=O)(=O)CC(=O)NC[C@@H]1CN(c2ncccc2-c2nnn[n-]2)CCO1 ZINC001605353219 1076342019 /nfs/dbraw/zinc/34/20/19/1076342019.db2.gz VAJXEKKEPNBLOK-SNVBAGLBSA-N -1 3 381.418 -1.372 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@H]1O ZINC001605353576 1076342079 /nfs/dbraw/zinc/34/20/79/1076342079.db2.gz MTDQRGHFTAMYFC-GHMZBOCLSA-N -1 3 381.418 -1.638 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@H]1O ZINC001605353576 1076342073 /nfs/dbraw/zinc/34/20/73/1076342073.db2.gz MTDQRGHFTAMYFC-GHMZBOCLSA-N -1 3 381.418 -1.638 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@@H]1O ZINC001605353577 1076342178 /nfs/dbraw/zinc/34/21/78/1076342178.db2.gz MTDQRGHFTAMYFC-MNOVXSKESA-N -1 3 381.418 -1.638 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@@H]1O ZINC001605353577 1076342173 /nfs/dbraw/zinc/34/21/73/1076342173.db2.gz MTDQRGHFTAMYFC-MNOVXSKESA-N -1 3 381.418 -1.638 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@H]1O ZINC001605353703 1076342159 /nfs/dbraw/zinc/34/21/59/1076342159.db2.gz RQOGDNHSSUMOOV-GHMZBOCLSA-N -1 3 399.408 -1.499 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@H]1O ZINC001605353703 1076342153 /nfs/dbraw/zinc/34/21/53/1076342153.db2.gz RQOGDNHSSUMOOV-GHMZBOCLSA-N -1 3 399.408 -1.499 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CN(c2ncc(-c3nn[n-]n3)cc2F)C[C@@H]1O ZINC001605353729 1076342110 /nfs/dbraw/zinc/34/21/10/1076342110.db2.gz RQOGDNHSSUMOOV-MNOVXSKESA-N -1 3 399.408 -1.499 20 0 GAADHM CS(=O)(=O)CCC(=O)N[C@@H]1CN(c2ncc(-c3nnn[n-]3)cc2F)C[C@@H]1O ZINC001605353729 1076342104 /nfs/dbraw/zinc/34/21/04/1076342104.db2.gz RQOGDNHSSUMOOV-MNOVXSKESA-N -1 3 399.408 -1.499 20 0 GAADHM CS(=O)(=O)CCCN1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nn[n-]n3)c[nH]2)C1 ZINC001605353878 1076342556 /nfs/dbraw/zinc/34/25/56/1076342556.db2.gz DLNAJGNTFFJTEP-VXGBXAGGSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCCN1C[C@@H](O)[C@H](NC(=O)c2cc(-c3nnn[n-]3)c[nH]2)C1 ZINC001605353878 1076342551 /nfs/dbraw/zinc/34/25/51/1076342551.db2.gz DLNAJGNTFFJTEP-VXGBXAGGSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCOCCNC(=O)C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC001605354171 1076342505 /nfs/dbraw/zinc/34/25/05/1076342505.db2.gz KVNQAGXXTIQLCS-UHFFFAOYSA-N -1 3 382.402 -1.017 20 0 GAADHM CS(=O)(=O)CCOCCNC(=O)C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC001605354171 1076342498 /nfs/dbraw/zinc/34/24/98/1076342498.db2.gz KVNQAGXXTIQLCS-UHFFFAOYSA-N -1 3 382.402 -1.017 20 0 GAADHM CS(=O)(=O)CCCN1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001605354213 1076342462 /nfs/dbraw/zinc/34/24/62/1076342462.db2.gz LFUKZGQCMLFGFJ-VXGBXAGGSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCCN1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001605354213 1076342456 /nfs/dbraw/zinc/34/24/56/1076342456.db2.gz LFUKZGQCMLFGFJ-VXGBXAGGSA-N -1 3 383.434 -1.596 20 0 GAADHM CS(=O)(=O)CCCC(=O)NC[C@H](O)CNc1ncccc1-c1nn[n-]n1 ZINC001605354216 1076342335 /nfs/dbraw/zinc/34/23/35/1076342335.db2.gz LGEVSZRMEIWETR-JTQLQIEISA-N -1 3 383.434 -1.025 20 0 GAADHM CS(=O)(=O)CCCC(=O)NC[C@H](O)CNc1ncccc1-c1nnn[n-]1 ZINC001605354216 1076342328 /nfs/dbraw/zinc/34/23/28/1076342328.db2.gz LGEVSZRMEIWETR-JTQLQIEISA-N -1 3 383.434 -1.025 20 0 GAADHM CS(=O)(=O)CCCC(=O)NC[C@@H](O)CNc1ncccc1-c1nn[n-]n1 ZINC001605354223 1076342384 /nfs/dbraw/zinc/34/23/84/1076342384.db2.gz LGEVSZRMEIWETR-SNVBAGLBSA-N -1 3 383.434 -1.025 20 0 GAADHM CS(=O)(=O)CCCC(=O)NC[C@@H](O)CNc1ncccc1-c1nnn[n-]1 ZINC001605354223 1076342379 /nfs/dbraw/zinc/34/23/79/1076342379.db2.gz LGEVSZRMEIWETR-SNVBAGLBSA-N -1 3 383.434 -1.025 20 0 GAADHM CS(=O)(=O)N1CC(CNC(=O)NCCNc2ncccc2-c2nn[n-]n2)C1 ZINC001605356520 1076342297 /nfs/dbraw/zinc/34/22/97/1076342297.db2.gz FRPLQYBVYSWXGJ-UHFFFAOYSA-N -1 3 395.449 -1.136 20 0 GAADHM CS(=O)(=O)N1CC(CNC(=O)NCCNc2ncccc2-c2nnn[n-]2)C1 ZINC001605356520 1076342291 /nfs/dbraw/zinc/34/22/91/1076342291.db2.gz FRPLQYBVYSWXGJ-UHFFFAOYSA-N -1 3 395.449 -1.136 20 0 GAADHM CS(=O)(=O)N1CCN(C(=O)C(=O)NCc2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001605356615 1076342424 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Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@](O)(CNC(=O)[C@H]3CCNC3=O)C2)n1 ZINC001605766271 1076351953 /nfs/dbraw/zinc/35/19/53/1076351953.db2.gz WEAJYJVNLREUGX-YVEFUNNKSA-N -1 3 386.416 -1.236 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@](O)(CNC(=O)[C@H]3CCNC3=O)C2)n1 ZINC001605766271 1076351951 /nfs/dbraw/zinc/35/19/51/1076351951.db2.gz WEAJYJVNLREUGX-YVEFUNNKSA-N -1 3 386.416 -1.236 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@](O)(CNC(=O)C3(C(N)=O)CC3)C2)n1 ZINC001605766316 1076352048 /nfs/dbraw/zinc/35/20/48/1076352048.db2.gz XQDRYDBUDRNAJC-INIZCTEOSA-N -1 3 386.416 -1.107 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@](O)(CNC(=O)C3(C(N)=O)CC3)C2)n1 ZINC001605766316 1076352045 /nfs/dbraw/zinc/35/20/45/1076352045.db2.gz XQDRYDBUDRNAJC-INIZCTEOSA-N -1 3 386.416 -1.107 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CC[C@@](O)(CNC(=O)C3(C(N)=O)CC3)C2)n1 ZINC001605766317 1076351894 /nfs/dbraw/zinc/35/18/94/1076351894.db2.gz XQDRYDBUDRNAJC-MRXNPFEDSA-N -1 3 386.416 -1.107 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CC[C@@](O)(CNC(=O)C3(C(N)=O)CC3)C2)n1 ZINC001605766317 1076351890 /nfs/dbraw/zinc/35/18/90/1076351890.db2.gz XQDRYDBUDRNAJC-MRXNPFEDSA-N -1 3 386.416 -1.107 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)CNC(=O)C3CC3)C2)n1 ZINC001605767538 1076351911 /nfs/dbraw/zinc/35/19/11/1076351911.db2.gz MGDHSZZQUPETQL-CHWSQXEVSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)CNC(=O)C3CC3)C2)n1 ZINC001605767538 1076351906 /nfs/dbraw/zinc/35/19/06/1076351906.db2.gz MGDHSZZQUPETQL-CHWSQXEVSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCC(=O)N3C)C2)n1 ZINC001605767942 1076351944 /nfs/dbraw/zinc/35/19/44/1076351944.db2.gz SPBQUMLYUUWKNR-FRRDWIJNSA-N -1 3 386.416 -1.143 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCC(=O)N3C)C2)n1 ZINC001605767942 1076351938 /nfs/dbraw/zinc/35/19/38/1076351938.db2.gz SPBQUMLYUUWKNR-FRRDWIJNSA-N -1 3 386.416 -1.143 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)CCn3ccnn3)C2)n1 ZINC001605768078 1076351826 /nfs/dbraw/zinc/35/18/26/1076351826.db2.gz VYTJXRYGKFUZKO-CHWSQXEVSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)CCn3ccnn3)C2)n1 ZINC001605768078 1076351821 /nfs/dbraw/zinc/35/18/21/1076351821.db2.gz VYTJXRYGKFUZKO-CHWSQXEVSA-N -1 3 384.404 -1.082 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCOC[C@@H]2CNC(=O)[C@H]2CNC(=O)N2)n1 ZINC001605768237 1076351992 /nfs/dbraw/zinc/35/19/92/1076351992.db2.gz TXYIKWYZQWCENA-CMPLNLGQSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCOC[C@@H]2CNC(=O)[C@H]2CNC(=O)N2)n1 ZINC001605768237 1076351985 /nfs/dbraw/zinc/35/19/85/1076351985.db2.gz TXYIKWYZQWCENA-CMPLNLGQSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCOC[C@@H]2CNC(=O)[C@@H]2CNC(=O)N2)n1 ZINC001605768241 1076352281 /nfs/dbraw/zinc/35/22/81/1076352281.db2.gz TXYIKWYZQWCENA-JQWIXIFHSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCOC[C@@H]2CNC(=O)[C@@H]2CNC(=O)N2)n1 ZINC001605768241 1076352275 /nfs/dbraw/zinc/35/22/75/1076352275.db2.gz TXYIKWYZQWCENA-JQWIXIFHSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCOC[C@H]2CNC(=O)[C@@H]2CNC(=O)N2)n1 ZINC001605768242 1076352453 /nfs/dbraw/zinc/35/24/53/1076352453.db2.gz TXYIKWYZQWCENA-PWSUYJOCSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCOC[C@H]2CNC(=O)[C@@H]2CNC(=O)N2)n1 ZINC001605768242 1076352447 /nfs/dbraw/zinc/35/24/47/1076352447.db2.gz TXYIKWYZQWCENA-PWSUYJOCSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCOC[C@H]2CNC(=O)[C@H]2CNC(=O)N2)n1 ZINC001605768243 1076352355 /nfs/dbraw/zinc/35/23/55/1076352355.db2.gz TXYIKWYZQWCENA-ZYHUDNBSSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCOC[C@H]2CNC(=O)[C@H]2CNC(=O)N2)n1 ZINC001605768243 1076352351 /nfs/dbraw/zinc/35/23/51/1076352351.db2.gz TXYIKWYZQWCENA-ZYHUDNBSSA-N -1 3 387.404 -1.427 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCOC[C@H]2CNC(=O)CCNC(N)=O)n1 ZINC001605768262 1076352169 /nfs/dbraw/zinc/35/21/69/1076352169.db2.gz VHUJPBAVGIKZPE-LLVKDONJSA-N -1 3 389.420 -1.050 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCOC[C@H]2CNC(=O)CCNC(N)=O)n1 ZINC001605768262 1076352165 /nfs/dbraw/zinc/35/21/65/1076352165.db2.gz VHUJPBAVGIKZPE-LLVKDONJSA-N -1 3 389.420 -1.050 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2CCOC[C@@H]2CNC(=O)CCNC(N)=O)n1 ZINC001605768263 1076352217 /nfs/dbraw/zinc/35/22/17/1076352217.db2.gz VHUJPBAVGIKZPE-NSHDSACASA-N -1 3 389.420 -1.050 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2CCOC[C@@H]2CNC(=O)CCNC(N)=O)n1 ZINC001605768263 1076352212 /nfs/dbraw/zinc/35/22/12/1076352212.db2.gz VHUJPBAVGIKZPE-NSHDSACASA-N -1 3 389.420 -1.050 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@H]3CCN(C)C3=O)[C@@H](O)C2)n1 ZINC001605769718 1076352315 /nfs/dbraw/zinc/35/23/15/1076352315.db2.gz FSTZWBOGJDVFQH-UPJWGTAASA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@H]3CCN(C)C3=O)[C@@H](O)C2)n1 ZINC001605769718 1076352312 /nfs/dbraw/zinc/35/23/12/1076352312.db2.gz FSTZWBOGJDVFQH-UPJWGTAASA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@@H]3CCN(C)C3=O)[C@@H](O)C2)n1 ZINC001605769719 1076352482 /nfs/dbraw/zinc/35/24/82/1076352482.db2.gz FSTZWBOGJDVFQH-XQQFMLRXSA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@@H]3CCN(C)C3=O)[C@@H](O)C2)n1 ZINC001605769719 1076352475 /nfs/dbraw/zinc/35/24/75/1076352475.db2.gz FSTZWBOGJDVFQH-XQQFMLRXSA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@@H]3CCCNC3=O)[C@@H](O)C2)n1 ZINC001605769903 1076352300 /nfs/dbraw/zinc/35/23/00/1076352300.db2.gz IEFKGXGDNANBNE-UPJWGTAASA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@@H]3CCCNC3=O)[C@@H](O)C2)n1 ZINC001605769903 1076352294 /nfs/dbraw/zinc/35/22/94/1076352294.db2.gz IEFKGXGDNANBNE-UPJWGTAASA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@H]3CCCNC3=O)[C@@H](O)C2)n1 ZINC001605769904 1076352195 /nfs/dbraw/zinc/35/21/95/1076352195.db2.gz IEFKGXGDNANBNE-XQQFMLRXSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@H]3CCCNC3=O)[C@@H](O)C2)n1 ZINC001605769904 1076352188 /nfs/dbraw/zinc/35/21/88/1076352188.db2.gz IEFKGXGDNANBNE-XQQFMLRXSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](O)[C@H](NC(=O)c3cnn(C)c3N)C2)n1 ZINC001605770192 1076352467 /nfs/dbraw/zinc/35/24/67/1076352467.db2.gz SGLPKYDZJDDTIJ-VXGBXAGGSA-N -1 3 384.404 -1.135 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](O)[C@H](NC(=O)c3cnn(C)c3N)C2)n1 ZINC001605770192 1076352463 /nfs/dbraw/zinc/35/24/63/1076352463.db2.gz SGLPKYDZJDDTIJ-VXGBXAGGSA-N -1 3 384.404 -1.135 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@H]3CN(C)CCO3)[C@@H](O)C2)n1 ZINC001605770307 1076352244 /nfs/dbraw/zinc/35/22/44/1076352244.db2.gz TXOVJGALSDEWHP-HZSPNIEDSA-N -1 3 388.432 -1.434 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@H]3CN(C)CCO3)[C@@H](O)C2)n1 ZINC001605770307 1076352234 /nfs/dbraw/zinc/35/22/34/1076352234.db2.gz TXOVJGALSDEWHP-HZSPNIEDSA-N -1 3 388.432 -1.434 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N2C[C@@H](NC(=O)[C@@H]3CN(C)CCO3)[C@@H](O)C2)n1 ZINC001605770313 1076352436 /nfs/dbraw/zinc/35/24/36/1076352436.db2.gz TXOVJGALSDEWHP-RDBSUJKOSA-N -1 3 388.432 -1.434 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N2C[C@@H](NC(=O)[C@@H]3CN(C)CCO3)[C@@H](O)C2)n1 ZINC001605770313 1076352429 /nfs/dbraw/zinc/35/24/29/1076352429.db2.gz TXOVJGALSDEWHP-RDBSUJKOSA-N -1 3 388.432 -1.434 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@H](CO)CNC(=O)c2cc(=O)n(C)cn2)n1 ZINC001605773683 1076352262 /nfs/dbraw/zinc/35/22/62/1076352262.db2.gz LTEUIKPDYRWPOK-JTQLQIEISA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@H](CO)CNC(=O)c2cc(=O)n(C)cn2)n1 ZINC001605773683 1076352258 /nfs/dbraw/zinc/35/22/58/1076352258.db2.gz LTEUIKPDYRWPOK-JTQLQIEISA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(N[C@@H](CO)CNC(=O)c2cc(=O)n(C)cn2)n1 ZINC001605773685 1076352370 /nfs/dbraw/zinc/35/23/70/1076352370.db2.gz LTEUIKPDYRWPOK-SNVBAGLBSA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(N[C@@H](CO)CNC(=O)c2cc(=O)n(C)cn2)n1 ZINC001605773685 1076352365 /nfs/dbraw/zinc/35/23/65/1076352365.db2.gz LTEUIKPDYRWPOK-SNVBAGLBSA-N -1 3 385.388 -1.133 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@@H]2CN(C(=O)Cn3cnnn3)CCO2)n1 ZINC001605779663 1076352155 /nfs/dbraw/zinc/35/21/55/1076352155.db2.gz PUGXNAMJYKDIKR-LLVKDONJSA-N -1 3 385.392 -1.104 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@@H]2CN(C(=O)Cn3cnnn3)CCO2)n1 ZINC001605779663 1076352150 /nfs/dbraw/zinc/35/21/50/1076352150.db2.gz PUGXNAMJYKDIKR-LLVKDONJSA-N -1 3 385.392 -1.104 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NC[C@H]2CN(C(=O)Cn3cnnn3)CCO2)n1 ZINC001605779664 1076352497 /nfs/dbraw/zinc/35/24/97/1076352497.db2.gz PUGXNAMJYKDIKR-NSHDSACASA-N -1 3 385.392 -1.104 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NC[C@H]2CN(C(=O)Cn3cnnn3)CCO2)n1 ZINC001605779664 1076352492 /nfs/dbraw/zinc/35/24/92/1076352492.db2.gz PUGXNAMJYKDIKR-NSHDSACASA-N -1 3 385.392 -1.104 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NCCN(CCO)C(=O)[C@H]2COC(=O)N2)n1 ZINC001605783266 1076352335 /nfs/dbraw/zinc/35/23/35/1076352335.db2.gz DHQWWCUYIKKHCQ-LLVKDONJSA-N -1 3 376.377 -1.089 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NCCN(CCO)C(=O)[C@H]2COC(=O)N2)n1 ZINC001605783266 1076352329 /nfs/dbraw/zinc/35/23/29/1076352329.db2.gz DHQWWCUYIKKHCQ-LLVKDONJSA-N -1 3 376.377 -1.089 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)c(NCCN(CCO)C(=O)[C@@H]2COC(=O)N2)n1 ZINC001605783268 1076352384 /nfs/dbraw/zinc/35/23/84/1076352384.db2.gz DHQWWCUYIKKHCQ-NSHDSACASA-N -1 3 376.377 -1.089 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)c(NCCN(CCO)C(=O)[C@@H]2COC(=O)N2)n1 ZINC001605783268 1076352381 /nfs/dbraw/zinc/35/23/81/1076352381.db2.gz DHQWWCUYIKKHCQ-NSHDSACASA-N -1 3 376.377 -1.089 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)C(=O)N1CCN2C(=O)NC(=O)[C@H]2C1 ZINC001605796508 1076352839 /nfs/dbraw/zinc/35/28/39/1076352839.db2.gz SHRPYWGJLJERDE-LLVKDONJSA-N -1 3 384.356 -1.124 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)cc1NC(=O)C(=O)N1CCN2C(=O)NC(=O)[C@@H]2C1 ZINC001605796509 1076352682 /nfs/dbraw/zinc/35/26/82/1076352682.db2.gz SHRPYWGJLJERDE-NSHDSACASA-N -1 3 384.356 -1.124 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)cc1S(=O)(=O)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001605801964 1076352642 /nfs/dbraw/zinc/35/26/42/1076352642.db2.gz OPBZTZQJQYWQDG-LLVKDONJSA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)cc1S(=O)(=O)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001605801964 1076352639 /nfs/dbraw/zinc/35/26/39/1076352639.db2.gz OPBZTZQJQYWQDG-LLVKDONJSA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1ccc(-c2nn[n-]n2)cc1S(=O)(=O)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001605801965 1076352711 /nfs/dbraw/zinc/35/27/11/1076352711.db2.gz OPBZTZQJQYWQDG-NSHDSACASA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1ccc(-c2nnn[n-]2)cc1S(=O)(=O)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001605801965 1076352705 /nfs/dbraw/zinc/35/27/05/1076352705.db2.gz OPBZTZQJQYWQDG-NSHDSACASA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1ccc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@@H]2O)nn1 ZINC001605821347 1076352770 /nfs/dbraw/zinc/35/27/70/1076352770.db2.gz KLPSONMNBKFVDH-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(C(=O)N[C@@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@@H]2O)nn1 ZINC001605821347 1076352765 /nfs/dbraw/zinc/35/27/65/1076352765.db2.gz KLPSONMNBKFVDH-OLZOCXBDSA-N -1 3 383.372 -1.091 20 0 GAADHM Cc1ccc(S(=O)(=O)NCCOCCS(N)(=O)=O)c(-c2nn[n-]n2)c1 ZINC001605882004 1076352807 /nfs/dbraw/zinc/35/28/07/1076352807.db2.gz NABSJCBVKKKSIP-UHFFFAOYSA-N -1 3 390.447 -1.241 20 0 GAADHM Cc1ccc(S(=O)(=O)NCCOCCS(N)(=O)=O)c(-c2nnn[n-]2)c1 ZINC001605882004 1076352802 /nfs/dbraw/zinc/35/28/02/1076352802.db2.gz NABSJCBVKKKSIP-UHFFFAOYSA-N -1 3 390.447 -1.241 20 0 GAADHM Cc1ccc(S(=O)(=O)N2CCN3[C@@H](CNS3(=O)=O)C2)c(-c2nn[n-]n2)c1 ZINC001605882451 1076352963 /nfs/dbraw/zinc/35/29/63/1076352963.db2.gz SJDDPMRRZOFZGW-JTQLQIEISA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1ccc(S(=O)(=O)N2CCN3[C@@H](CNS3(=O)=O)C2)c(-c2nnn[n-]2)c1 ZINC001605882451 1076352957 /nfs/dbraw/zinc/35/29/57/1076352957.db2.gz SJDDPMRRZOFZGW-JTQLQIEISA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1ccc(S(=O)(=O)N2CCN3[C@H](CNS3(=O)=O)C2)c(-c2nn[n-]n2)c1 ZINC001605882452 1076353016 /nfs/dbraw/zinc/35/30/16/1076353016.db2.gz SJDDPMRRZOFZGW-SNVBAGLBSA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1ccc(S(=O)(=O)N2CCN3[C@H](CNS3(=O)=O)C2)c(-c2nnn[n-]2)c1 ZINC001605882452 1076353009 /nfs/dbraw/zinc/35/30/09/1076353009.db2.gz SJDDPMRRZOFZGW-SNVBAGLBSA-N -1 3 399.458 -1.302 20 0 GAADHM Cc1ccc(S(=O)(=O)NCCNS(=O)(=O)N(C)C)c(-c2nn[n-]n2)c1 ZINC001605882745 1076353112 /nfs/dbraw/zinc/35/31/12/1076353112.db2.gz YOUMJTLGXSJFGY-UHFFFAOYSA-N -1 3 389.463 -1.151 20 0 GAADHM Cc1ccc(S(=O)(=O)NCCNS(=O)(=O)N(C)C)c(-c2nnn[n-]2)c1 ZINC001605882745 1076353106 /nfs/dbraw/zinc/35/31/06/1076353106.db2.gz YOUMJTLGXSJFGY-UHFFFAOYSA-N -1 3 389.463 -1.151 20 0 GAADHM Cc1cccc(-c2nn[n-]n2)c1S(=O)(=O)N1CCN(CC(N)=O)C(=O)C1 ZINC001605895410 1076353092 /nfs/dbraw/zinc/35/30/92/1076353092.db2.gz IDRVNDDBFXHUKI-UHFFFAOYSA-N -1 3 379.402 -1.507 20 0 GAADHM Cc1cccc(-c2nnn[n-]2)c1S(=O)(=O)N1CCN(CC(N)=O)C(=O)C1 ZINC001605895410 1076353087 /nfs/dbraw/zinc/35/30/87/1076353087.db2.gz IDRVNDDBFXHUKI-UHFFFAOYSA-N -1 3 379.402 -1.507 20 0 GAADHM Cc1cccc(NC(=O)C(=O)N2CCN(CC(N)=O)C(=O)C2)c1-c1nn[n-]n1 ZINC001605918693 1076352992 /nfs/dbraw/zinc/35/29/92/1076352992.db2.gz LPWMPYRXPYIOMI-UHFFFAOYSA-N -1 3 386.372 -1.730 20 0 GAADHM Cc1cccc(NC(=O)C(=O)N2CCN(CC(N)=O)C(=O)C2)c1-c1nnn[n-]1 ZINC001605918693 1076352985 /nfs/dbraw/zinc/35/29/85/1076352985.db2.gz LPWMPYRXPYIOMI-UHFFFAOYSA-N -1 3 386.372 -1.730 20 0 GAADHM Cc1cccc(NC(=O)C(=O)N2CCN3C(=O)NC(=O)[C@@H]3C2)c1-c1nn[n-]n1 ZINC001605918813 1076353148 /nfs/dbraw/zinc/35/31/48/1076353148.db2.gz ONCIQPSTYHQIJE-JTQLQIEISA-N -1 3 384.356 -1.124 20 0 GAADHM Cc1cccc(NC(=O)C(=O)N2CCN3C(=O)NC(=O)[C@@H]3C2)c1-c1nnn[n-]1 ZINC001605918813 1076353143 /nfs/dbraw/zinc/35/31/43/1076353143.db2.gz ONCIQPSTYHQIJE-JTQLQIEISA-N -1 3 384.356 -1.124 20 0 GAADHM Cc1cccc(NC(=O)C(=O)N2CCN3C(=O)NC(=O)[C@H]3C2)c1-c1nn[n-]n1 ZINC001605918814 1076353033 /nfs/dbraw/zinc/35/30/33/1076353033.db2.gz ONCIQPSTYHQIJE-SNVBAGLBSA-N -1 3 384.356 -1.124 20 0 GAADHM Cc1cccc(NC(=O)C(=O)N2CCN3C(=O)NC(=O)[C@H]3C2)c1-c1nnn[n-]1 ZINC001605918814 1076353028 /nfs/dbraw/zinc/35/30/28/1076353028.db2.gz ONCIQPSTYHQIJE-SNVBAGLBSA-N -1 3 384.356 -1.124 20 0 GAADHM Cc1cccc(NC(=O)C(=O)N2CCN3C(=O)C(=O)NC[C@H]3C2)c1-c1nn[n-]n1 ZINC001605919164 1076353166 /nfs/dbraw/zinc/35/31/66/1076353166.db2.gz UZEQJINNQCSWPP-JTQLQIEISA-N -1 3 398.383 -1.717 20 0 GAADHM Cc1cccc(NC(=O)C(=O)N2CCN3C(=O)C(=O)NC[C@H]3C2)c1-c1nnn[n-]1 ZINC001605919164 1076353161 /nfs/dbraw/zinc/35/31/61/1076353161.db2.gz UZEQJINNQCSWPP-JTQLQIEISA-N -1 3 398.383 -1.717 20 0 GAADHM Cc1cccc(NC(=O)C(=O)N2CCN3C(=O)C(=O)NC[C@@H]3C2)c1-c1nn[n-]n1 ZINC001605919167 1076353131 /nfs/dbraw/zinc/35/31/31/1076353131.db2.gz UZEQJINNQCSWPP-SNVBAGLBSA-N -1 3 398.383 -1.717 20 0 GAADHM Cc1cccc(NC(=O)C(=O)N2CCN3C(=O)C(=O)NC[C@@H]3C2)c1-c1nnn[n-]1 ZINC001605919167 1076353124 /nfs/dbraw/zinc/35/31/24/1076353124.db2.gz UZEQJINNQCSWPP-SNVBAGLBSA-N -1 3 398.383 -1.717 20 0 GAADHM Cc1cccc(S(=O)(=O)NCCOCCS(N)(=O)=O)c1-c1nn[n-]n1 ZINC001605926613 1076352944 /nfs/dbraw/zinc/35/29/44/1076352944.db2.gz WAAWOIHOCUWEME-UHFFFAOYSA-N -1 3 390.447 -1.241 20 0 GAADHM Cc1cccc(S(=O)(=O)NCCOCCS(N)(=O)=O)c1-c1nnn[n-]1 ZINC001605926613 1076352940 /nfs/dbraw/zinc/35/29/40/1076352940.db2.gz WAAWOIHOCUWEME-UHFFFAOYSA-N -1 3 390.447 -1.241 20 0 GAADHM Cc1ccn(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)n1 ZINC001605948444 1076353293 /nfs/dbraw/zinc/35/32/93/1076353293.db2.gz JWQZEYKIQXHRPK-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccn(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)n1 ZINC001605948444 1076353290 /nfs/dbraw/zinc/35/32/90/1076353290.db2.gz JWQZEYKIQXHRPK-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccnn1CC(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C[C@H]1O ZINC001605962596 1076353311 /nfs/dbraw/zinc/35/33/11/1076353311.db2.gz FKKDDVVYFRBFTD-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1ccnn1CC(=O)N[C@@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C[C@H]1O ZINC001605962596 1076353305 /nfs/dbraw/zinc/35/33/05/1076353305.db2.gz FKKDDVVYFRBFTD-CHWSQXEVSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1cn(C)nc1C(=O)N1C[C@@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)[C@@H](O)C1 ZINC001605968749 1076353890 /nfs/dbraw/zinc/35/38/90/1076353890.db2.gz FJNMQUAGIZUPFL-NEPJUHHUSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cn(C)nc1C(=O)N1C[C@@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)[C@@H](O)C1 ZINC001605968749 1076353886 /nfs/dbraw/zinc/35/38/86/1076353886.db2.gz FJNMQUAGIZUPFL-NEPJUHHUSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cn(C)nc1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nn[n-]n3)[nH]2)C1 ZINC001605968750 1076353662 /nfs/dbraw/zinc/35/36/62/1076353662.db2.gz FJNMQUAGIZUPFL-VXGBXAGGSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cn(C)nc1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(-c3nnn[n-]3)[nH]2)C1 ZINC001605968750 1076353656 /nfs/dbraw/zinc/35/36/56/1076353656.db2.gz FJNMQUAGIZUPFL-VXGBXAGGSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cn(C)nc1C(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@@H]1O ZINC001605969581 1076353705 /nfs/dbraw/zinc/35/37/05/1076353705.db2.gz OPVKOSKQNDLODZ-NEPJUHHUSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cn(C)nc1C(=O)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@@H]1O ZINC001605969581 1076353699 /nfs/dbraw/zinc/35/36/99/1076353699.db2.gz OPVKOSKQNDLODZ-NEPJUHHUSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cnn(C)c1C(=O)N1C[C@@H](NC(=O)c2c[nH]c(-c3nn[n-]n3)c2)[C@@H](O)C1 ZINC001605987918 1076353769 /nfs/dbraw/zinc/35/37/69/1076353769.db2.gz ZJIHFHHRFQAADY-NEPJUHHUSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cnn(C)c1C(=O)N1C[C@@H](NC(=O)c2c[nH]c(-c3nnn[n-]3)c2)[C@@H](O)C1 ZINC001605987918 1076353763 /nfs/dbraw/zinc/35/37/63/1076353763.db2.gz ZJIHFHHRFQAADY-NEPJUHHUSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cnn(C)c1C(=O)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O ZINC001605989203 1076353879 /nfs/dbraw/zinc/35/38/79/1076353879.db2.gz FMDHXVUMNDQFEZ-NEPJUHHUSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cnn(C)c1C(=O)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O ZINC001605989203 1076353875 /nfs/dbraw/zinc/35/38/75/1076353875.db2.gz FMDHXVUMNDQFEZ-NEPJUHHUSA-N -1 3 385.388 -1.148 20 0 GAADHM Cc1cnn(CC(=O)N[C@@H]2CN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C[C@@H]2O)c1 ZINC001605989317 1076353913 /nfs/dbraw/zinc/35/39/13/1076353913.db2.gz ADVNLEIHAFYSJC-OLZOCXBDSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1cnn(CC(=O)N[C@@H]2CN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C[C@@H]2O)c1 ZINC001605989317 1076353910 /nfs/dbraw/zinc/35/39/10/1076353910.db2.gz ADVNLEIHAFYSJC-OLZOCXBDSA-N -1 3 385.388 -1.299 20 0 GAADHM Cc1nnc(CC(=O)NC[C@H]2COCCN2c2cnc(-c3nnn[n-]3)cn2)[nH]1 ZINC001606010479 1076354230 /nfs/dbraw/zinc/35/42/30/1076354230.db2.gz CLNMQUXTPMIDEP-JTQLQIEISA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nnc(CC(=O)NC[C@@H]2COCCN2c2cnc(-c3nnn[n-]3)cn2)[nH]1 ZINC001606010480 1076354248 /nfs/dbraw/zinc/35/42/48/1076354248.db2.gz CLNMQUXTPMIDEP-SNVBAGLBSA-N -1 3 385.392 -1.353 20 0 GAADHM Cc1nn[nH]c1C(=O)NC[C@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1 ZINC001606015302 1076354487 /nfs/dbraw/zinc/35/44/87/1076354487.db2.gz KQTVQDQNPYFZII-JTQLQIEISA-N -1 3 386.376 -1.108 20 0 GAADHM Cc1nn[nH]c1C(=O)NC[C@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1 ZINC001606015302 1076354480 /nfs/dbraw/zinc/35/44/80/1076354480.db2.gz KQTVQDQNPYFZII-JTQLQIEISA-N -1 3 386.376 -1.108 20 0 GAADHM Cc1nn[nH]c1C(=O)NC[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)CCO1 ZINC001606015303 1076354431 /nfs/dbraw/zinc/35/44/31/1076354431.db2.gz KQTVQDQNPYFZII-SNVBAGLBSA-N -1 3 386.376 -1.108 20 0 GAADHM Cc1nn[nH]c1C(=O)NC[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)CCO1 ZINC001606015303 1076354425 /nfs/dbraw/zinc/35/44/25/1076354425.db2.gz KQTVQDQNPYFZII-SNVBAGLBSA-N -1 3 386.376 -1.108 20 0 GAADHM Cc1nn[nH]c1C(=O)NC[C@H]1COCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001606015492 1076354584 /nfs/dbraw/zinc/35/45/84/1076354584.db2.gz UCJYGXWPDQHAAR-JTQLQIEISA-N -1 3 386.376 -1.108 20 0 GAADHM Cc1nn[nH]c1C(=O)NC[C@@H]1COCCN1C(=O)c1c[nH]c(-c2nn[n-]n2)c1 ZINC001606015493 1076354461 /nfs/dbraw/zinc/35/44/61/1076354461.db2.gz UCJYGXWPDQHAAR-SNVBAGLBSA-N -1 3 386.376 -1.108 20 0 GAADHM Cc1nc(-c2nn[n-]n2)c(N2CCN(C(=O)CN3C[C@H](O)C[C@H]3CO)CC2)o1 ZINC001606020016 1076354628 /nfs/dbraw/zinc/35/46/28/1076354628.db2.gz RSZZJUACHPMEOH-NWDGAFQWSA-N -1 3 392.420 -1.761 20 0 GAADHM Cc1nc(-c2nnn[n-]2)c(N2CCN(C(=O)CN3C[C@H](O)C[C@H]3CO)CC2)o1 ZINC001606020016 1076354624 /nfs/dbraw/zinc/35/46/24/1076354624.db2.gz RSZZJUACHPMEOH-NWDGAFQWSA-N -1 3 392.420 -1.761 20 0 GAADHM Cc1nc(-c2nn[n-]n2)c(N2CCN(C(=O)CN(C)CCC(N)=O)CC2)o1 ZINC001606020307 1076354542 /nfs/dbraw/zinc/35/45/42/1076354542.db2.gz VDISTWZSRWDRLD-UHFFFAOYSA-N -1 3 377.409 -1.381 20 0 GAADHM Cc1nc(-c2nnn[n-]2)c(N2CCN(C(=O)CN(C)CCC(N)=O)CC2)o1 ZINC001606020307 1076354539 /nfs/dbraw/zinc/35/45/39/1076354539.db2.gz VDISTWZSRWDRLD-UHFFFAOYSA-N -1 3 377.409 -1.381 20 0 GAADHM CN(C)CCN1CCN(C(=O)C(=O)N2CCC3(C[C@@H]3C(=O)[O-])CC2)CC1=O ZINC001606027096 1076354636 /nfs/dbraw/zinc/35/46/36/1076354636.db2.gz FEZMSNVRMLQJTA-CYBMUJFWSA-N -1 3 380.445 -1.068 20 0 GAADHM CN(C)CCN1CCN(C(=O)C(=O)N2CCC3(C[C@H]3C(=O)[O-])CC2)CC1=O ZINC001606027097 1076354528 /nfs/dbraw/zinc/35/45/28/1076354528.db2.gz FEZMSNVRMLQJTA-ZDUSSCGKSA-N -1 3 380.445 -1.068 20 0 GAADHM Cc1nc(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)cn3)C[C@@H]2O)c(=O)[nH]c1C ZINC001606030972 1076354500 /nfs/dbraw/zinc/35/45/00/1076354500.db2.gz YDENWMQEXGNNNW-NEPJUHHUSA-N -1 3 397.399 -1.059 20 0 GAADHM Cc1nc(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)cn3)C[C@@H]2O)c(=O)[nH]c1C ZINC001606030972 1076354497 /nfs/dbraw/zinc/35/44/97/1076354497.db2.gz YDENWMQEXGNNNW-NEPJUHHUSA-N -1 3 397.399 -1.059 20 0 GAADHM Cc1nc(C)n(CCN2C[C@@H](NC(=O)c3cc(-c4nn[n-]n4)c[nH]3)[C@@H](O)C2)n1 ZINC001606038618 1076354927 /nfs/dbraw/zinc/35/49/27/1076354927.db2.gz JEERNZCBGSDAON-KGLIPLIRSA-N -1 3 386.420 -1.122 20 0 GAADHM Cc1nc(C)n(CCN2C[C@@H](NC(=O)c3cc(-c4nnn[n-]4)c[nH]3)[C@@H](O)C2)n1 ZINC001606038618 1076354922 /nfs/dbraw/zinc/35/49/22/1076354922.db2.gz JEERNZCBGSDAON-KGLIPLIRSA-N -1 3 386.420 -1.122 20 0 GAADHM Cc1nc(C)n(CCN2C[C@@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)[C@@H](O)C2)n1 ZINC001606038664 1076354874 /nfs/dbraw/zinc/35/48/74/1076354874.db2.gz LELCHSMASLLVTR-KGLIPLIRSA-N -1 3 386.420 -1.122 20 0 GAADHM Cc1nnc(CN2CCN(C(=O)C(=O)Nc3ccc(-c4nn[n-]n4)cn3)CC2)[nH]1 ZINC001606041998 1076355245 /nfs/dbraw/zinc/35/52/45/1076355245.db2.gz DMIKHKMOPGILIY-UHFFFAOYSA-N -1 3 397.403 -1.029 20 0 GAADHM Cc1nc(N(C)C[C@@H](O)CN(C)C(=O)Cn2ncnn2)ccc1-c1nn[n-]n1 ZINC001606044683 1076355159 /nfs/dbraw/zinc/35/51/59/1076355159.db2.gz HGENMWHGXADJSS-LLVKDONJSA-N -1 3 387.408 -1.488 20 0 GAADHM Cc1nc(N(C)C[C@@H](O)CN(C)C(=O)Cn2ncnn2)ccc1-c1nnn[n-]1 ZINC001606044683 1076355156 /nfs/dbraw/zinc/35/51/56/1076355156.db2.gz HGENMWHGXADJSS-LLVKDONJSA-N -1 3 387.408 -1.488 20 0 GAADHM Cc1nc(N(C)C[C@H](O)CN(C)C(=O)Cn2ncnn2)ccc1-c1nn[n-]n1 ZINC001606044689 1076355281 /nfs/dbraw/zinc/35/52/81/1076355281.db2.gz HGENMWHGXADJSS-NSHDSACASA-N -1 3 387.408 -1.488 20 0 GAADHM Cc1nc(N(C)C[C@H](O)CN(C)C(=O)Cn2ncnn2)ccc1-c1nnn[n-]1 ZINC001606044689 1076355277 /nfs/dbraw/zinc/35/52/77/1076355277.db2.gz HGENMWHGXADJSS-NSHDSACASA-N -1 3 387.408 -1.488 20 0 GAADHM Cc1nc(N(C)C)nc(N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nn[n-]n4)[nH]3)C2)n1 ZINC001606045738 1076355262 /nfs/dbraw/zinc/35/52/62/1076355262.db2.gz ZFNJLQGQPPHYEG-VXGBXAGGSA-N -1 3 399.419 -1.266 20 0 GAADHM Cc1nc(N(C)C)nc(N2C[C@@H](O)[C@H](NC(=O)c3ccc(-c4nnn[n-]4)[nH]3)C2)n1 ZINC001606045738 1076355256 /nfs/dbraw/zinc/35/52/56/1076355256.db2.gz ZFNJLQGQPPHYEG-VXGBXAGGSA-N -1 3 399.419 -1.266 20 0 GAADHM Cc1nc(N2CC[C@@H](N3CCN(C(=O)C(N)=O)CC3)C2)ccc1-c1nn[n-]n1 ZINC001606049109 1076355311 /nfs/dbraw/zinc/35/53/11/1076355311.db2.gz LJBSIMOZDKUUDE-GFCCVEGCSA-N -1 3 385.432 -1.222 20 0 GAADHM Cc1nc(N2CC[C@@H](N3CCN(C(=O)C(N)=O)CC3)C2)ccc1-c1nnn[n-]1 ZINC001606049109 1076355307 /nfs/dbraw/zinc/35/53/07/1076355307.db2.gz LJBSIMOZDKUUDE-GFCCVEGCSA-N -1 3 385.432 -1.222 20 0 GAADHM Cc1nc(N2CC[C@H](N3CCN(C(=O)C(N)=O)CC3)C2)ccc1-c1nn[n-]n1 ZINC001606049110 1076355173 /nfs/dbraw/zinc/35/51/73/1076355173.db2.gz LJBSIMOZDKUUDE-LBPRGKRZSA-N -1 3 385.432 -1.222 20 0 GAADHM Cc1nc(N2CC[C@H](N3CCN(C(=O)C(N)=O)CC3)C2)ccc1-c1nnn[n-]1 ZINC001606049110 1076355168 /nfs/dbraw/zinc/35/51/68/1076355168.db2.gz LJBSIMOZDKUUDE-LBPRGKRZSA-N -1 3 385.432 -1.222 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)Cn3ncnn3)C2)ccc1-c1nn[n-]n1 ZINC001606049791 1076355075 /nfs/dbraw/zinc/35/50/75/1076355075.db2.gz AEIMSIYCOLOQGJ-HNNXBMFYSA-N -1 3 385.392 -1.686 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)Cn3ncnn3)C2)ccc1-c1nnn[n-]1 ZINC001606049791 1076355071 /nfs/dbraw/zinc/35/50/71/1076355071.db2.gz AEIMSIYCOLOQGJ-HNNXBMFYSA-N -1 3 385.392 -1.686 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)Cn3ncnn3)C2)ccc1-c1nn[n-]n1 ZINC001606049792 1076355300 /nfs/dbraw/zinc/35/53/00/1076355300.db2.gz AEIMSIYCOLOQGJ-OAHLLOKOSA-N -1 3 385.392 -1.686 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)Cn3ncnn3)C2)ccc1-c1nnn[n-]1 ZINC001606049792 1076355291 /nfs/dbraw/zinc/35/52/91/1076355291.db2.gz AEIMSIYCOLOQGJ-OAHLLOKOSA-N -1 3 385.392 -1.686 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)[C@@H]3CCNC3=O)C2)ccc1-c1nn[n-]n1 ZINC001606052773 1076355086 /nfs/dbraw/zinc/35/50/86/1076355086.db2.gz ZNNTXOYRMLHODW-PXAZEXFGSA-N -1 3 386.416 -1.236 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)[C@@H]3CCNC3=O)C2)ccc1-c1nnn[n-]1 ZINC001606052773 1076355082 /nfs/dbraw/zinc/35/50/82/1076355082.db2.gz ZNNTXOYRMLHODW-PXAZEXFGSA-N -1 3 386.416 -1.236 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)[C@H]3CCNC3=O)C2)ccc1-c1nn[n-]n1 ZINC001606052774 1076355060 /nfs/dbraw/zinc/35/50/60/1076355060.db2.gz ZNNTXOYRMLHODW-SJCJKPOMSA-N -1 3 386.416 -1.236 20 0 GAADHM Cc1nc(N2CC[C@](O)(CNC(=O)[C@H]3CCNC3=O)C2)ccc1-c1nnn[n-]1 ZINC001606052774 1076355056 /nfs/dbraw/zinc/35/50/56/1076355056.db2.gz ZNNTXOYRMLHODW-SJCJKPOMSA-N -1 3 386.416 -1.236 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)[C@@H]3CCNC3=O)C2)ccc1-c1nn[n-]n1 ZINC001606052775 1076355146 /nfs/dbraw/zinc/35/51/46/1076355146.db2.gz ZNNTXOYRMLHODW-SJKOYZFVSA-N -1 3 386.416 -1.236 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)[C@@H]3CCNC3=O)C2)ccc1-c1nnn[n-]1 ZINC001606052775 1076355143 /nfs/dbraw/zinc/35/51/43/1076355143.db2.gz ZNNTXOYRMLHODW-SJKOYZFVSA-N -1 3 386.416 -1.236 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)[C@H]3CCNC3=O)C2)ccc1-c1nn[n-]n1 ZINC001606052776 1076355336 /nfs/dbraw/zinc/35/53/36/1076355336.db2.gz ZNNTXOYRMLHODW-YVEFUNNKSA-N -1 3 386.416 -1.236 20 0 GAADHM Cc1nc(N2CC[C@@](O)(CNC(=O)[C@H]3CCNC3=O)C2)ccc1-c1nnn[n-]1 ZINC001606052776 1076355330 /nfs/dbraw/zinc/35/53/30/1076355330.db2.gz ZNNTXOYRMLHODW-YVEFUNNKSA-N -1 3 386.416 -1.236 20 0 GAADHM Cc1nc(N2CCOC[C@@H]2CNC(=O)[C@H](C)NC(N)=O)ccc1-c1nn[n-]n1 ZINC001606054142 1076355323 /nfs/dbraw/zinc/35/53/23/1076355323.db2.gz BDFPJUJZGPFYGQ-QWRGUYRKSA-N -1 3 389.420 -1.052 20 0 GAADHM Cc1nc(N2CCOC[C@@H]2CNC(=O)[C@H](C)NC(N)=O)ccc1-c1nnn[n-]1 ZINC001606054142 1076355315 /nfs/dbraw/zinc/35/53/15/1076355315.db2.gz BDFPJUJZGPFYGQ-QWRGUYRKSA-N -1 3 389.420 -1.052 20 0 GAADHM Cc1nc(N2CCOC[C@H]2CNC(=O)[C@H](C)NC(N)=O)ccc1-c1nn[n-]n1 ZINC001606054143 1076355188 /nfs/dbraw/zinc/35/51/88/1076355188.db2.gz BDFPJUJZGPFYGQ-WDEREUQCSA-N -1 3 389.420 -1.052 20 0 GAADHM Cc1nc(N2CCOC[C@H]2CNC(=O)[C@H](C)NC(N)=O)ccc1-c1nnn[n-]1 ZINC001606054143 1076355181 /nfs/dbraw/zinc/35/51/81/1076355181.db2.gz BDFPJUJZGPFYGQ-WDEREUQCSA-N -1 3 389.420 -1.052 20 0 GAADHM Cc1nc(N2CCN(CCNC(=O)[C@H]3C[C@H]3C(N)=O)CC2)ccc1-c1nn[n-]n1 ZINC001606054154 1076355213 /nfs/dbraw/zinc/35/52/13/1076355213.db2.gz BRFMMUYVTQPKKI-KGLIPLIRSA-N -1 3 399.459 -1.070 20 0 GAADHM Cc1nc(N2CCN(CCNC(=O)[C@H]3C[C@H]3C(N)=O)CC2)ccc1-c1nnn[n-]1 ZINC001606054154 1076355205 /nfs/dbraw/zinc/35/52/05/1076355205.db2.gz BRFMMUYVTQPKKI-KGLIPLIRSA-N -1 3 399.459 -1.070 20 0 GAADHM Cc1nc(N2CCOC[C@H]2CNC(=O)Cn2cnnn2)ccc1-c1nn[n-]n1 ZINC001606054182 1076355102 /nfs/dbraw/zinc/35/51/02/1076355102.db2.gz DBXPRJGNJXHUMG-LLVKDONJSA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1nc(N2CCOC[C@H]2CNC(=O)Cn2cnnn2)ccc1-c1nnn[n-]1 ZINC001606054182 1076355097 /nfs/dbraw/zinc/35/50/97/1076355097.db2.gz DBXPRJGNJXHUMG-LLVKDONJSA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1nc(N2CCOC[C@@H]2CNC(=O)Cn2cnnn2)ccc1-c1nn[n-]n1 ZINC001606054183 1076355488 /nfs/dbraw/zinc/35/54/88/1076355488.db2.gz DBXPRJGNJXHUMG-NSHDSACASA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1nc(N2CCOC[C@@H]2CNC(=O)Cn2cnnn2)ccc1-c1nnn[n-]1 ZINC001606054183 1076355484 /nfs/dbraw/zinc/35/54/84/1076355484.db2.gz DBXPRJGNJXHUMG-NSHDSACASA-N -1 3 385.392 -1.422 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)c3cn(C)c(=O)n3C)C2)ccc1-c1nn[n-]n1 ZINC001606056411 1076355677 /nfs/dbraw/zinc/35/56/77/1076355677.db2.gz BCHDMRDXKQCCJC-DGCLKSJQSA-N -1 3 399.415 -1.413 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)c3cn(C)c(=O)n3C)C2)ccc1-c1nnn[n-]1 ZINC001606056411 1076355672 /nfs/dbraw/zinc/35/56/72/1076355672.db2.gz BCHDMRDXKQCCJC-DGCLKSJQSA-N -1 3 399.415 -1.413 20 0 GAADHM Cc1c(C(=O)N[C@@H]2CN(c3ccc(-c4nn[n-]n4)c(C)n3)C[C@H]2O)nnn1C ZINC001606056415 1076355590 /nfs/dbraw/zinc/35/55/90/1076355590.db2.gz BJAXQFPYDXZQEO-VXGBXAGGSA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1c(C(=O)N[C@@H]2CN(c3ccc(-c4nnn[n-]4)c(C)n3)C[C@H]2O)nnn1C ZINC001606056415 1076355585 /nfs/dbraw/zinc/35/55/85/1076355585.db2.gz BJAXQFPYDXZQEO-VXGBXAGGSA-N -1 3 384.404 -1.013 20 0 GAADHM Cc1nc(N2C[C@@H](NC(=O)C(=O)NCC3CC3)[C@@H](O)C2)ccc1-c1nn[n-]n1 ZINC001606056496 1076355759 /nfs/dbraw/zinc/35/57/59/1076355759.db2.gz GOHAGCGRMSFKMV-OLZOCXBDSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](NC(=O)C(=O)NCC3CC3)[C@@H](O)C2)ccc1-c1nnn[n-]1 ZINC001606056496 1076355756 /nfs/dbraw/zinc/35/57/56/1076355756.db2.gz GOHAGCGRMSFKMV-OLZOCXBDSA-N -1 3 386.416 -1.238 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)C3CS(=O)(=O)C3)C2)ccc1-c1nn[n-]n1 ZINC001606056519 1076355610 /nfs/dbraw/zinc/35/56/10/1076355610.db2.gz HHTSFOXWOIDXRM-VXGBXAGGSA-N -1 3 393.429 -1.720 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)C3CS(=O)(=O)C3)C2)ccc1-c1nnn[n-]1 ZINC001606056519 1076355603 /nfs/dbraw/zinc/35/56/03/1076355603.db2.gz HHTSFOXWOIDXRM-VXGBXAGGSA-N -1 3 393.429 -1.720 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCN(C)C3=O)C2)ccc1-c1nn[n-]n1 ZINC001606056655 1076355472 /nfs/dbraw/zinc/35/54/72/1076355472.db2.gz PYEGDKYZHNEGPT-JHJVBQTASA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@H]3CCN(C)C3=O)C2)ccc1-c1nnn[n-]1 ZINC001606056655 1076355469 /nfs/dbraw/zinc/35/54/69/1076355469.db2.gz PYEGDKYZHNEGPT-JHJVBQTASA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCN(C)C3=O)C2)ccc1-c1nn[n-]n1 ZINC001606056656 1076355642 /nfs/dbraw/zinc/35/56/42/1076355642.db2.gz PYEGDKYZHNEGPT-YNEHKIRRSA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1nc(N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCN(C)C3=O)C2)ccc1-c1nnn[n-]1 ZINC001606056656 1076355637 /nfs/dbraw/zinc/35/56/37/1076355637.db2.gz PYEGDKYZHNEGPT-YNEHKIRRSA-N -1 3 386.416 -1.286 20 0 GAADHM Cc1nc(N2C[C@@H](NC(=O)CN3CCCC3=O)[C@@H](O)C2)ccc1-c1nn[n-]n1 ZINC001606056778 1076355503 /nfs/dbraw/zinc/35/55/03/1076355503.db2.gz XXYXLUWPELJGTJ-OLZOCXBDSA-N -1 3 386.416 -1.142 20 0 GAADHM Cc1nc(N2C[C@@H](NC(=O)CN3CCCC3=O)[C@@H](O)C2)ccc1-c1nnn[n-]1 ZINC001606056778 1076355499 /nfs/dbraw/zinc/35/54/99/1076355499.db2.gz XXYXLUWPELJGTJ-OLZOCXBDSA-N -1 3 386.416 -1.142 20 0 GAADHM Cc1nc(NC(=O)C(=O)N2CC(NS(C)(=O)=O)C2)ccc1-c1nn[n-]n1 ZINC001606057025 1076355717 /nfs/dbraw/zinc/35/57/17/1076355717.db2.gz AJWKDOXIMYLJCE-UHFFFAOYSA-N -1 3 380.390 -1.731 20 0 GAADHM Cc1nc(NC(=O)C(=O)N2CC(NS(C)(=O)=O)C2)ccc1-c1nnn[n-]1 ZINC001606057025 1076355715 /nfs/dbraw/zinc/35/57/15/1076355715.db2.gz AJWKDOXIMYLJCE-UHFFFAOYSA-N -1 3 380.390 -1.731 20 0 GAADHM Cc1nc(N2C[C@@H](NC(=O)c3cnn(C)c3N)[C@@H](O)C2)ccc1-c1nn[n-]n1 ZINC001606057405 1076355538 /nfs/dbraw/zinc/35/55/38/1076355538.db2.gz IOBMPBALHJGDQR-NEPJUHHUSA-N -1 3 384.404 -1.135 20 0 GAADHM Cc1nc(N2C[C@@H](NC(=O)c3cnn(C)c3N)[C@@H](O)C2)ccc1-c1nnn[n-]1 ZINC001606057405 1076355533 /nfs/dbraw/zinc/35/55/33/1076355533.db2.gz IOBMPBALHJGDQR-NEPJUHHUSA-N -1 3 384.404 -1.135 20 0 GAADHM Cc1nc(NC(=O)CN2CCN(C)C(=O)C2)n(-c2ccc(-c3nn[n-]n3)cc2)n1 ZINC001606058094 1076355518 /nfs/dbraw/zinc/35/55/18/1076355518.db2.gz PHHQFCYIVVOPEX-UHFFFAOYSA-N -1 3 396.415 -1.110 20 0 GAADHM Cc1nc(NC(=O)C(=O)N2CCN(c3nncn3C)CC2)ccc1-c1nn[n-]n1 ZINC001606058227 1076355748 /nfs/dbraw/zinc/35/57/48/1076355748.db2.gz WGMVTFSDTKUGRD-UHFFFAOYSA-N -1 3 397.403 -1.014 20 0 GAADHM Cc1nc(NC(=O)C(=O)N2CCN(c3nncn3C)CC2)ccc1-c1nnn[n-]1 ZINC001606058227 1076355745 /nfs/dbraw/zinc/35/57/45/1076355745.db2.gz WGMVTFSDTKUGRD-UHFFFAOYSA-N -1 3 397.403 -1.014 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)C2CS(=O)(=O)C2)ccc1-c1nn[n-]n1 ZINC001606066748 1076355556 /nfs/dbraw/zinc/35/55/56/1076355556.db2.gz FZSNQMCQVHYWJV-JTQLQIEISA-N -1 3 381.418 -1.496 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)C2CS(=O)(=O)C2)ccc1-c1nnn[n-]1 ZINC001606066748 1076355551 /nfs/dbraw/zinc/35/55/51/1076355551.db2.gz FZSNQMCQVHYWJV-JTQLQIEISA-N -1 3 381.418 -1.496 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)C2CS(=O)(=O)C2)ccc1-c1nn[n-]n1 ZINC001606066749 1076355574 /nfs/dbraw/zinc/35/55/74/1076355574.db2.gz FZSNQMCQVHYWJV-SNVBAGLBSA-N -1 3 381.418 -1.496 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)C2CS(=O)(=O)C2)ccc1-c1nnn[n-]1 ZINC001606066749 1076355567 /nfs/dbraw/zinc/35/55/67/1076355567.db2.gz FZSNQMCQVHYWJV-SNVBAGLBSA-N -1 3 381.418 -1.496 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)CCS(C)(=O)=O)ccc1-c1nn[n-]n1 ZINC001606067058 1076355727 /nfs/dbraw/zinc/35/57/27/1076355727.db2.gz JZQNTONREPOAHG-JTQLQIEISA-N -1 3 383.434 -1.106 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)CCS(C)(=O)=O)ccc1-c1nnn[n-]1 ZINC001606067058 1076355724 /nfs/dbraw/zinc/35/57/24/1076355724.db2.gz JZQNTONREPOAHG-JTQLQIEISA-N -1 3 383.434 -1.106 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)CCS(C)(=O)=O)ccc1-c1nn[n-]n1 ZINC001606067059 1076355707 /nfs/dbraw/zinc/35/57/07/1076355707.db2.gz JZQNTONREPOAHG-SNVBAGLBSA-N -1 3 383.434 -1.106 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)CCS(C)(=O)=O)ccc1-c1nnn[n-]1 ZINC001606067059 1076355703 /nfs/dbraw/zinc/35/57/03/1076355703.db2.gz JZQNTONREPOAHG-SNVBAGLBSA-N -1 3 383.434 -1.106 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)CN2CCOCC2)ccc1-c1nn[n-]n1 ZINC001606067952 1076355737 /nfs/dbraw/zinc/35/57/37/1076355737.db2.gz SXLRYKWZLMHGKJ-GFCCVEGCSA-N -1 3 376.421 -1.209 20 0 GAADHM Cc1nc(NC[C@@H](O)CNC(=O)CN2CCOCC2)ccc1-c1nnn[n-]1 ZINC001606067952 1076355734 /nfs/dbraw/zinc/35/57/34/1076355734.db2.gz SXLRYKWZLMHGKJ-GFCCVEGCSA-N -1 3 376.421 -1.209 20 0 GAADHM Cc1nc(NC[C@H](O)CNC(=O)CN2CCOCC2)ccc1-c1nn[n-]n1 ZINC001606067959 1076355693 /nfs/dbraw/zinc/35/56/93/1076355693.db2.gz SXLRYKWZLMHGKJ-LBPRGKRZSA-N -1 3 376.421 -1.209 20 0 GAADHM 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ZINC001606399058 1076367179 /nfs/dbraw/zinc/36/71/79/1076367179.db2.gz KPPUXSPXOITVLH-DJFWLOJKSA-N -1 3 384.400 -1.011 20 0 GAADHM NC(=O)C(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001606399059 1076367169 /nfs/dbraw/zinc/36/71/69/1076367169.db2.gz KPPUXSPXOITVLH-MGAJZRQESA-N -1 3 384.400 -1.011 20 0 GAADHM NC(=O)C(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001606399059 1076367166 /nfs/dbraw/zinc/36/71/66/1076367166.db2.gz KPPUXSPXOITVLH-MGAJZRQESA-N -1 3 384.400 -1.011 20 0 GAADHM NC(=O)C(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cc(-c2nn[n-]n2)c[nH]1 ZINC001606399060 1076367212 /nfs/dbraw/zinc/36/72/12/1076367212.db2.gz KPPUXSPXOITVLH-UKKREREHSA-N -1 3 384.400 -1.011 20 0 GAADHM NC(=O)C(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cc(-c2nnn[n-]2)c[nH]1 ZINC001606399060 1076367207 /nfs/dbraw/zinc/36/72/07/1076367207.db2.gz KPPUXSPXOITVLH-UKKREREHSA-N -1 3 384.400 -1.011 20 0 GAADHM 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1076367466 /nfs/dbraw/zinc/36/74/66/1076367466.db2.gz LJMYCWKXIAOWIC-YVNDNENWSA-N -1 3 384.400 -1.011 20 0 GAADHM NC(=O)C(=O)N1CCC(F)(F)[C@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001606399274 1076367555 /nfs/dbraw/zinc/36/75/55/1076367555.db2.gz SYQXJXBDEGXYJO-MRVPVSSYSA-N -1 3 382.331 -1.106 20 0 GAADHM NC(=O)C(=O)N1CCC(F)(F)[C@H](CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001606399274 1076367551 /nfs/dbraw/zinc/36/75/51/1076367551.db2.gz SYQXJXBDEGXYJO-MRVPVSSYSA-N -1 3 382.331 -1.106 20 0 GAADHM NC(=O)C(=O)N1CCC(F)(F)[C@@H](CNC(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1 ZINC001606399275 1076367440 /nfs/dbraw/zinc/36/74/40/1076367440.db2.gz SYQXJXBDEGXYJO-QMMMGPOBSA-N -1 3 382.331 -1.106 20 0 GAADHM NC(=O)C(=O)N1CCC(F)(F)[C@@H](CNC(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1 ZINC001606399275 1076367437 /nfs/dbraw/zinc/36/74/37/1076367437.db2.gz SYQXJXBDEGXYJO-QMMMGPOBSA-N -1 3 382.331 -1.106 20 0 GAADHM NC(=O)C(=O)N1CC[C@@H](N2CCN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)CC2)C1 ZINC001606399368 1076367483 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/nfs/dbraw/zinc/36/75/38/1076367538.db2.gz AVRALHREBXYWOT-MRVPVSSYSA-N -1 3 382.331 -1.106 20 0 GAADHM NC(=O)C(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)CCC1(F)F ZINC001606399536 1076367943 /nfs/dbraw/zinc/36/79/43/1076367943.db2.gz AVRALHREBXYWOT-QMMMGPOBSA-N -1 3 382.331 -1.106 20 0 GAADHM NC(=O)C(=O)NC[C@H]1CN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)CCC1(F)F ZINC001606399536 1076367942 /nfs/dbraw/zinc/36/79/42/1076367942.db2.gz AVRALHREBXYWOT-QMMMGPOBSA-N -1 3 382.331 -1.106 20 0 GAADHM NC(=O)C(=O)N1CCN(C2CN(Cc3ccc(-c4nn[n-]n4)cc3F)C2)CC1 ZINC001606399537 1076367951 /nfs/dbraw/zinc/36/79/51/1076367951.db2.gz AYDQTEWUPLYFGQ-UHFFFAOYSA-N -1 3 388.407 -1.181 20 0 GAADHM NC(=O)C(=O)N1CCN(C2CN(Cc3ccc(-c4nnn[n-]4)cc3F)C2)CC1 ZINC001606399537 1076367950 /nfs/dbraw/zinc/36/79/50/1076367950.db2.gz AYDQTEWUPLYFGQ-UHFFFAOYSA-N -1 3 388.407 -1.181 20 0 GAADHM NC(=O)C(=O)NC[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCC1(F)F ZINC001606399589 1076367947 /nfs/dbraw/zinc/36/79/47/1076367947.db2.gz CFKDKRZJNDLKPS-SSDOTTSWSA-N -1 3 382.331 -1.106 20 0 GAADHM NC(=O)C(=O)NC[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCC1(F)F ZINC001606399589 1076367945 /nfs/dbraw/zinc/36/79/45/1076367945.db2.gz CFKDKRZJNDLKPS-SSDOTTSWSA-N -1 3 382.331 -1.106 20 0 GAADHM NC(=O)C(=O)NC[C@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)CCC1(F)F ZINC001606399590 1076367957 /nfs/dbraw/zinc/36/79/57/1076367957.db2.gz CFKDKRZJNDLKPS-ZETCQYMHSA-N -1 3 382.331 -1.106 20 0 GAADHM NC(=O)C(=O)NC[C@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)CCC1(F)F ZINC001606399590 1076367956 /nfs/dbraw/zinc/36/79/56/1076367956.db2.gz CFKDKRZJNDLKPS-ZETCQYMHSA-N -1 3 382.331 -1.106 20 0 GAADHM NC(=O)C(=O)N1CCN([C@@H]2CCN(C(=O)c3cc(-c4nn[n-]n4)c[nH]3)C2)CC1 ZINC001606399774 1076367972 /nfs/dbraw/zinc/36/79/72/1076367972.db2.gz FRKITDGOYYWASU-LLVKDONJSA-N -1 3 387.404 -1.961 20 0 GAADHM NC(=O)C(=O)N1CCN([C@@H]2CCN(C(=O)c3cc(-c4nnn[n-]4)c[nH]3)C2)CC1 ZINC001606399774 1076367971 /nfs/dbraw/zinc/36/79/71/1076367971.db2.gz FRKITDGOYYWASU-LLVKDONJSA-N -1 3 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NS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)N2Cc3ccc(-c4nn[n-]n4)cc3C2)C1 ZINC001606440104 1076371430 /nfs/dbraw/zinc/37/14/30/1076371430.db2.gz HCBPTZLKYDEQBD-GFCCVEGCSA-N -1 3 391.413 -1.402 20 0 GAADHM NS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)N2Cc3ccc(-c4nnn[n-]4)cc3C2)C1 ZINC001606440104 1076371428 /nfs/dbraw/zinc/37/14/28/1076371428.db2.gz HCBPTZLKYDEQBD-GFCCVEGCSA-N -1 3 391.413 -1.402 20 0 GAADHM NS(=O)(=O)[C@H]1CCN(C(=O)C(=O)N2Cc3ccc(-c4nn[n-]n4)cc3C2)C1 ZINC001606440105 1076371390 /nfs/dbraw/zinc/37/13/90/1076371390.db2.gz HCBPTZLKYDEQBD-LBPRGKRZSA-N -1 3 391.413 -1.402 20 0 GAADHM NS(=O)(=O)[C@H]1CCN(C(=O)C(=O)N2Cc3ccc(-c4nnn[n-]4)cc3C2)C1 ZINC001606440105 1076371384 /nfs/dbraw/zinc/37/13/84/1076371384.db2.gz HCBPTZLKYDEQBD-LBPRGKRZSA-N -1 3 391.413 -1.402 20 0 GAADHM NS(=O)(=O)[C@H]1CCN(CCS(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001606440145 1076371312 /nfs/dbraw/zinc/37/13/12/1076371312.db2.gz JIYMAHSXTASWFQ-JTQLQIEISA-N -1 3 387.447 -1.602 20 0 GAADHM NS(=O)(=O)[C@H]1CCN(CCS(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001606440145 1076371310 /nfs/dbraw/zinc/37/13/10/1076371310.db2.gz JIYMAHSXTASWFQ-JTQLQIEISA-N -1 3 387.447 -1.602 20 0 GAADHM NS(=O)(=O)[C@@H]1CCN(CCS(=O)(=O)c2ccc(-c3nn[n-]n3)cn2)C1 ZINC001606440146 1076371287 /nfs/dbraw/zinc/37/12/87/1076371287.db2.gz JIYMAHSXTASWFQ-SNVBAGLBSA-N -1 3 387.447 -1.602 20 0 GAADHM NS(=O)(=O)[C@@H]1CCN(CCS(=O)(=O)c2ccc(-c3nnn[n-]3)cn2)C1 ZINC001606440146 1076371285 /nfs/dbraw/zinc/37/12/85/1076371285.db2.gz JIYMAHSXTASWFQ-SNVBAGLBSA-N -1 3 387.447 -1.602 20 0 GAADHM NS(=O)(=O)[C@H]1CCN(C(=O)C(=O)N2Cc3cccc(-c4nn[n-]n4)c3C2)C1 ZINC001606440404 1076371359 /nfs/dbraw/zinc/37/13/59/1076371359.db2.gz KXYGAOKANZYFOR-JTQLQIEISA-N -1 3 391.413 -1.402 20 0 GAADHM NS(=O)(=O)[C@H]1CCN(C(=O)C(=O)N2Cc3cccc(-c4nnn[n-]4)c3C2)C1 ZINC001606440404 1076371354 /nfs/dbraw/zinc/37/13/54/1076371354.db2.gz KXYGAOKANZYFOR-JTQLQIEISA-N -1 3 391.413 -1.402 20 0 GAADHM NS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)N2Cc3cccc(-c4nn[n-]n4)c3C2)C1 ZINC001606440406 1076371728 /nfs/dbraw/zinc/37/17/28/1076371728.db2.gz KXYGAOKANZYFOR-SNVBAGLBSA-N -1 3 391.413 -1.402 20 0 GAADHM NS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)N2Cc3cccc(-c4nnn[n-]4)c3C2)C1 ZINC001606440406 1076371724 /nfs/dbraw/zinc/37/17/24/1076371724.db2.gz KXYGAOKANZYFOR-SNVBAGLBSA-N -1 3 391.413 -1.402 20 0 GAADHM NS(=O)(=O)C1(C(=O)N2CCN(c3cc(-c4nn[n-]n4)ccn3)CC2)CC1 ZINC001606441155 1076371812 /nfs/dbraw/zinc/37/18/12/1076371812.db2.gz UKUNTBLXFSNMMO-UHFFFAOYSA-N -1 3 378.418 -1.269 20 0 GAADHM NS(=O)(=O)C1(C(=O)N2CCN(c3cc(-c4nnn[n-]4)ccn3)CC2)CC1 ZINC001606441155 1076371810 /nfs/dbraw/zinc/37/18/10/1076371810.db2.gz UKUNTBLXFSNMMO-UHFFFAOYSA-N -1 3 378.418 -1.269 20 0 GAADHM NS(=O)(=O)CCOCCNC(=O)c1ncc(-c2nn[n-]n2)cc1Cl ZINC001606442074 1076371800 /nfs/dbraw/zinc/37/18/00/1076371800.db2.gz AKXUJEWHBTVLCJ-UHFFFAOYSA-N -1 3 375.798 -1.050 20 0 GAADHM NS(=O)(=O)CCOCCNC(=O)c1ncc(-c2nnn[n-]2)cc1Cl ZINC001606442074 1076371797 /nfs/dbraw/zinc/37/17/97/1076371797.db2.gz AKXUJEWHBTVLCJ-UHFFFAOYSA-N -1 3 375.798 -1.050 20 0 GAADHM NS(=O)(=O)CCOCCNS(=O)(=O)c1ccc(F)c(-c2nn[n-]n2)c1 ZINC001606442514 1076371838 /nfs/dbraw/zinc/37/18/38/1076371838.db2.gz LUPRSOSVJBSCMV-UHFFFAOYSA-N -1 3 394.410 -1.411 20 0 GAADHM NS(=O)(=O)CCOCCNS(=O)(=O)c1ccc(F)c(-c2nnn[n-]2)c1 ZINC001606442514 1076371837 /nfs/dbraw/zinc/37/18/37/1076371837.db2.gz LUPRSOSVJBSCMV-UHFFFAOYSA-N -1 3 394.410 -1.411 20 0 GAADHM NS(=O)(=O)CCCNC(=O)N1CCN(c2cnccc2-c2nn[n-]n2)CC1 ZINC001606442694 1076371741 /nfs/dbraw/zinc/37/17/41/1076371741.db2.gz PYUZUBQLKWMVLM-UHFFFAOYSA-N -1 3 395.449 -1.228 20 0 GAADHM NS(=O)(=O)CCCNC(=O)N1CCN(c2cnccc2-c2nnn[n-]2)CC1 ZINC001606442694 1076371738 /nfs/dbraw/zinc/37/17/38/1076371738.db2.gz PYUZUBQLKWMVLM-UHFFFAOYSA-N -1 3 395.449 -1.228 20 0 GAADHM NS(=O)(=O)C1CN(S(=O)(=O)Cc2ccc(F)cc2-c2nn[n-]n2)C1 ZINC001606442735 1076371849 /nfs/dbraw/zinc/37/18/49/1076371849.db2.gz SCJVZEMPKAYNLK-UHFFFAOYSA-N -1 3 376.395 -1.192 20 0 GAADHM NS(=O)(=O)C1CN(S(=O)(=O)Cc2ccc(F)cc2-c2nnn[n-]2)C1 ZINC001606442735 1076371847 /nfs/dbraw/zinc/37/18/47/1076371847.db2.gz SCJVZEMPKAYNLK-UHFFFAOYSA-N -1 3 376.395 -1.192 20 0 GAADHM NS(=O)(=O)C1CN(S(=O)(=O)Cc2cc(-c3nn[n-]n3)ccc2F)C1 ZINC001606442882 1076371715 /nfs/dbraw/zinc/37/17/15/1076371715.db2.gz ZYSWBAPUAMRKHY-UHFFFAOYSA-N -1 3 376.395 -1.192 20 0 GAADHM NS(=O)(=O)C1CN(S(=O)(=O)Cc2cc(-c3nnn[n-]3)ccc2F)C1 ZINC001606442882 1076371713 /nfs/dbraw/zinc/37/17/13/1076371713.db2.gz ZYSWBAPUAMRKHY-UHFFFAOYSA-N -1 3 376.395 -1.192 20 0 GAADHM NS(=O)(=O)N1CCC(NS(=O)(=O)c2cccc(-c3nn[n-]n3)c2)CC1 ZINC001606443897 1076371830 /nfs/dbraw/zinc/37/18/30/1076371830.db2.gz QDMCZPQUMJKOLM-UHFFFAOYSA-N -1 3 387.447 -1.187 20 0 GAADHM NS(=O)(=O)N1CCC(NS(=O)(=O)c2cccc(-c3nnn[n-]3)c2)CC1 ZINC001606443897 1076371827 /nfs/dbraw/zinc/37/18/27/1076371827.db2.gz QDMCZPQUMJKOLM-UHFFFAOYSA-N -1 3 387.447 -1.187 20 0 GAADHM NS(=O)(=O)N1CCN(CC(=O)NCc2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001606444022 1076371751 /nfs/dbraw/zinc/37/17/51/1076371751.db2.gz SBFVAWCYGJGMKR-UHFFFAOYSA-N -1 3 380.434 -1.696 20 0 GAADHM NS(=O)(=O)N1CCN(CC(=O)NCc2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001606444022 1076371748 /nfs/dbraw/zinc/37/17/48/1076371748.db2.gz SBFVAWCYGJGMKR-UHFFFAOYSA-N -1 3 380.434 -1.696 20 0 GAADHM NS(=O)(=O)c1cnn(CC(=O)N[C@@H]2Cc3ccc(-c4nn[n-]n4)cc3C2)c1 ZINC001606444039 1076371834 /nfs/dbraw/zinc/37/18/34/1076371834.db2.gz RHMYFHGVURRCBN-GFCCVEGCSA-N -1 3 388.413 -1.006 20 0 GAADHM NS(=O)(=O)c1cnn(CC(=O)N[C@H]2Cc3ccc(-c4nn[n-]n4)cc3C2)c1 ZINC001606444044 1076371779 /nfs/dbraw/zinc/37/17/79/1076371779.db2.gz RHMYFHGVURRCBN-LBPRGKRZSA-N -1 3 388.413 -1.006 20 0 GAADHM Nc1c(-c2nn[n-]n2)cnn1CCOC(=O)Cn1nc2n(c1=O)CCCCC2 ZINC001606449507 1076372155 /nfs/dbraw/zinc/37/21/55/1076372155.db2.gz MGZLLSPHCOBMNP-UHFFFAOYSA-N -1 3 388.392 -1.027 20 0 GAADHM Nc1c(-c2nnn[n-]2)cnn1CCOC(=O)Cn1nc2n(c1=O)CCCCC2 ZINC001606449507 1076372153 /nfs/dbraw/zinc/37/21/53/1076372153.db2.gz MGZLLSPHCOBMNP-UHFFFAOYSA-N -1 3 388.392 -1.027 20 0 GAADHM Nc1sc2c(c1-c1nn[n-]n1)CCN(C(=O)[C@@H]1CS(=O)(=O)CC(=O)N1)C2 ZINC001606456137 1076372179 /nfs/dbraw/zinc/37/21/79/1076372179.db2.gz FIFGBQSEAKBEAG-ZETCQYMHSA-N -1 3 397.442 -1.692 20 0 GAADHM Nc1sc2c(c1-c1nnn[n-]1)CCN(C(=O)[C@@H]1CS(=O)(=O)CC(=O)N1)C2 ZINC001606456137 1076372175 /nfs/dbraw/zinc/37/21/75/1076372175.db2.gz FIFGBQSEAKBEAG-ZETCQYMHSA-N -1 3 397.442 -1.692 20 0 GAADHM Nc1ncn(CC(=O)N[C@@H]2CCN(Cc3ccc(-c4nn[n-]n4)cc3)C2=O)n1 ZINC001606456383 1076372087 /nfs/dbraw/zinc/37/20/87/1076372087.db2.gz OUGMWAXOKRVRFS-GFCCVEGCSA-N -1 3 382.388 -1.042 20 0 GAADHM Nc1ncn(CC(=O)N[C@@H]2CCN(Cc3ccc(-c4nnn[n-]4)cc3)C2=O)n1 ZINC001606456383 1076372083 /nfs/dbraw/zinc/37/20/83/1076372083.db2.gz OUGMWAXOKRVRFS-GFCCVEGCSA-N -1 3 382.388 -1.042 20 0 GAADHM Nc1ncn(CC(=O)N[C@H]2CCN(Cc3ccc(-c4nn[n-]n4)cc3)C2=O)n1 ZINC001606456384 1076372127 /nfs/dbraw/zinc/37/21/27/1076372127.db2.gz OUGMWAXOKRVRFS-LBPRGKRZSA-N -1 3 382.388 -1.042 20 0 GAADHM Nc1ncn(CC(=O)N[C@H]2CCN(Cc3ccc(-c4nnn[n-]4)cc3)C2=O)n1 ZINC001606456384 1076372122 /nfs/dbraw/zinc/37/21/22/1076372122.db2.gz OUGMWAXOKRVRFS-LBPRGKRZSA-N -1 3 382.388 -1.042 20 0 GAADHM O=C(C(=O)N1CCC[C@@H](O)C1)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001606457130 1076372205 /nfs/dbraw/zinc/37/22/05/1076372205.db2.gz JKZFINGIBBBNHF-GFCCVEGCSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCC[C@@H](O)C1)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001606457130 1076372201 /nfs/dbraw/zinc/37/22/01/1076372201.db2.gz JKZFINGIBBBNHF-GFCCVEGCSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1)N(CCO)C1CC1 ZINC001606457237 1076372143 /nfs/dbraw/zinc/37/21/43/1076372143.db2.gz NMNAXFVJXTWLCJ-UHFFFAOYSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1)N(CCO)C1CC1 ZINC001606457237 1076372138 /nfs/dbraw/zinc/37/21/38/1076372138.db2.gz NMNAXFVJXTWLCJ-UHFFFAOYSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCC[C@@H](O)C1)N1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001606459636 1076372441 /nfs/dbraw/zinc/37/24/41/1076372441.db2.gz BJRMPRANDFZLGH-CYBMUJFWSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCC[C@@H](O)C1)N1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001606459636 1076372439 /nfs/dbraw/zinc/37/24/39/1076372439.db2.gz BJRMPRANDFZLGH-CYBMUJFWSA-N -1 3 386.416 -1.106 20 0 GAADHM O=C(C(=O)N1CCN2C(=O)NC[C@@H]2C1)N1CCc2ccc(-c3nn[n-]n3)cc21 ZINC001606460088 1076372425 /nfs/dbraw/zinc/37/24/25/1076372425.db2.gz ILUNZVDAIJTQLT-GFCCVEGCSA-N -1 3 382.384 -1.008 20 0 GAADHM O=C(C(=O)N1CCN2C(=O)NC[C@@H]2C1)N1CCc2ccc(-c3nnn[n-]3)cc21 ZINC001606460088 1076372422 /nfs/dbraw/zinc/37/24/22/1076372422.db2.gz ILUNZVDAIJTQLT-GFCCVEGCSA-N -1 3 382.384 -1.008 20 0 GAADHM O=C(C(=O)N1CCN2C(=O)NC[C@H]2C1)N1CCc2ccc(-c3nn[n-]n3)cc21 ZINC001606460090 1076372502 /nfs/dbraw/zinc/37/25/02/1076372502.db2.gz ILUNZVDAIJTQLT-LBPRGKRZSA-N -1 3 382.384 -1.008 20 0 GAADHM O=C(C(=O)N1CCN2C(=O)NC[C@H]2C1)N1CCc2ccc(-c3nnn[n-]3)cc21 ZINC001606460090 1076372500 /nfs/dbraw/zinc/37/25/00/1076372500.db2.gz ILUNZVDAIJTQLT-LBPRGKRZSA-N -1 3 382.384 -1.008 20 0 GAADHM O=C(C(=O)N1CCN(Cc2ccncc2-c2nn[n-]n2)CC1)N1CCOCC1 ZINC001606460488 1076372408 /nfs/dbraw/zinc/37/24/08/1076372408.db2.gz PELGJQIFSGABDH-UHFFFAOYSA-N -1 3 386.416 -1.235 20 0 GAADHM O=C(C(=O)N1CCN(Cc2ccncc2-c2nnn[n-]2)CC1)N1CCOCC1 ZINC001606460488 1076372404 /nfs/dbraw/zinc/37/24/04/1076372404.db2.gz PELGJQIFSGABDH-UHFFFAOYSA-N -1 3 386.416 -1.235 20 0 GAADHM O=C(C(=O)N1CCN(Cc2ccc(-c3nn[n-]n3)cn2)CC1)N1CCOCC1 ZINC001606460887 1076372382 /nfs/dbraw/zinc/37/23/82/1076372382.db2.gz SGTOVYXPCTVOMI-UHFFFAOYSA-N -1 3 386.416 -1.235 20 0 GAADHM O=C(C(=O)N1CCN(Cc2ccc(-c3nnn[n-]3)cn2)CC1)N1CCOCC1 ZINC001606460887 1076372378 /nfs/dbraw/zinc/37/23/78/1076372378.db2.gz SGTOVYXPCTVOMI-UHFFFAOYSA-N -1 3 386.416 -1.235 20 0 GAADHM O=C(C1=C[C@@H](O)[C@@H](O)[C@H](O)C1)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1 ZINC001606461982 1076372916 /nfs/dbraw/zinc/37/29/16/1076372916.db2.gz AEPBJDKCBYENQP-UMVBOHGHSA-N -1 3 387.400 -1.677 20 0 GAADHM O=C(C1=C[C@@H](O)[C@@H](O)[C@H](O)C1)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1 ZINC001606461982 1076372909 /nfs/dbraw/zinc/37/29/09/1076372909.db2.gz AEPBJDKCBYENQP-UMVBOHGHSA-N -1 3 387.400 -1.677 20 0 GAADHM O=C(C1=NN(CCO)C(=O)CC1)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1 ZINC001606462053 1076372900 /nfs/dbraw/zinc/37/29/00/1076372900.db2.gz CGKOKTDRBCMYMD-UHFFFAOYSA-N -1 3 399.415 -1.119 20 0 GAADHM O=C(C1=NN(CCO)C(=O)CC1)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1 ZINC001606462053 1076372896 /nfs/dbraw/zinc/37/28/96/1076372896.db2.gz CGKOKTDRBCMYMD-UHFFFAOYSA-N -1 3 399.415 -1.119 20 0 GAADHM O=C(C1=NN(CCO)C(=O)CC1)N1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001606462179 1076372983 /nfs/dbraw/zinc/37/29/83/1076372983.db2.gz DKSJWJYHEMCSOJ-UHFFFAOYSA-N -1 3 399.415 -1.119 20 0 GAADHM O=C(C1=NN(CCO)C(=O)CC1)N1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001606462179 1076372978 /nfs/dbraw/zinc/37/29/78/1076372978.db2.gz DKSJWJYHEMCSOJ-UHFFFAOYSA-N -1 3 399.415 -1.119 20 0 GAADHM O=C(C1=C[C@@H](O)[C@@H](O)[C@H](O)C1)N1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001606462676 1076372956 /nfs/dbraw/zinc/37/29/56/1076372956.db2.gz MGAVXFUPNUPZFL-RBSFLKMASA-N -1 3 387.400 -1.677 20 0 GAADHM O=C(C1=C[C@@H](O)[C@@H](O)[C@H](O)C1)N1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001606462676 1076372950 /nfs/dbraw/zinc/37/29/50/1076372950.db2.gz MGAVXFUPNUPZFL-RBSFLKMASA-N -1 3 387.400 -1.677 20 0 GAADHM O=C(C1=C[C@@H](O)[C@@H](O)[C@H](O)C1)N1CCN(c2ccsc2-c2nnn[n-]2)CC1 ZINC001606462884 1076372848 /nfs/dbraw/zinc/37/28/48/1076372848.db2.gz PYGNMJOOPWCORW-JHJVBQTASA-N -1 3 392.441 -1.010 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CCN(c2cnccc2-c2nn[n-]n2)CC1 ZINC001606474896 1076372878 /nfs/dbraw/zinc/37/28/78/1076372878.db2.gz CJKMMRCAJLEDCN-LLVKDONJSA-N -1 3 378.418 -1.398 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CCN(c2cnccc2-c2nnn[n-]2)CC1 ZINC001606474896 1076372874 /nfs/dbraw/zinc/37/28/74/1076372874.db2.gz CJKMMRCAJLEDCN-LLVKDONJSA-N -1 3 378.418 -1.398 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CCN(c2cnccc2-c2nn[n-]n2)CC1 ZINC001606474897 1076373036 /nfs/dbraw/zinc/37/30/36/1076373036.db2.gz CJKMMRCAJLEDCN-NSHDSACASA-N -1 3 378.418 -1.398 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CCN(c2cnccc2-c2nnn[n-]2)CC1 ZINC001606474897 1076373028 /nfs/dbraw/zinc/37/30/28/1076373028.db2.gz CJKMMRCAJLEDCN-NSHDSACASA-N -1 3 378.418 -1.398 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CCCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001606475081 1076372811 /nfs/dbraw/zinc/37/28/11/1076372811.db2.gz IKKVLIPSSSHKMO-CYBMUJFWSA-N -1 3 392.445 -1.008 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CCCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001606475081 1076372807 /nfs/dbraw/zinc/37/28/07/1076372807.db2.gz IKKVLIPSSSHKMO-CYBMUJFWSA-N -1 3 392.445 -1.008 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CCCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001606475082 1076372941 /nfs/dbraw/zinc/37/29/41/1076372941.db2.gz IKKVLIPSSSHKMO-ZDUSSCGKSA-N -1 3 392.445 -1.008 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CCCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001606475082 1076372936 /nfs/dbraw/zinc/37/29/36/1076372936.db2.gz IKKVLIPSSSHKMO-ZDUSSCGKSA-N -1 3 392.445 -1.008 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CC[C@H](Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001606475090 1076372782 /nfs/dbraw/zinc/37/27/82/1076372782.db2.gz IPRIBNBIWTXFAV-CMPLNLGQSA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CC[C@H](Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001606475090 1076372777 /nfs/dbraw/zinc/37/27/77/1076372777.db2.gz IPRIBNBIWTXFAV-CMPLNLGQSA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CC[C@H](Nc2ccc(-c3nn[n-]n3)nc2)C1 ZINC001606475091 1076372970 /nfs/dbraw/zinc/37/29/70/1076372970.db2.gz IPRIBNBIWTXFAV-JQWIXIFHSA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CC[C@H](Nc2ccc(-c3nnn[n-]3)nc2)C1 ZINC001606475091 1076372965 /nfs/dbraw/zinc/37/29/65/1076372965.db2.gz IPRIBNBIWTXFAV-JQWIXIFHSA-N -1 3 378.418 -1.034 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001606475192 1076372862 /nfs/dbraw/zinc/37/28/62/1076372862.db2.gz MPTNGTZGKRYSBY-GFCCVEGCSA-N -1 3 378.418 -1.398 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001606475192 1076372857 /nfs/dbraw/zinc/37/28/57/1076372857.db2.gz MPTNGTZGKRYSBY-GFCCVEGCSA-N -1 3 378.418 -1.398 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CCN(c2ccc(-c3nn[n-]n3)nc2)CC1 ZINC001606475193 1076372822 /nfs/dbraw/zinc/37/28/22/1076372822.db2.gz MPTNGTZGKRYSBY-LBPRGKRZSA-N -1 3 378.418 -1.398 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1CCN(c2ccc(-c3nnn[n-]3)nc2)CC1 ZINC001606475193 1076372818 /nfs/dbraw/zinc/37/28/18/1076372818.db2.gz MPTNGTZGKRYSBY-LBPRGKRZSA-N -1 3 378.418 -1.398 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1C[C@@H]2C[C@H]1CN2c1ncccc1-c1nn[n-]n1 ZINC001606475832 1076373016 /nfs/dbraw/zinc/37/30/16/1076373016.db2.gz BBGZZVREQBTFDO-JBLDHEPKSA-N -1 3 390.429 -1.257 20 0 GAADHM O=C([C@H]1CCS(=O)(=O)N1)N1C[C@@H]2C[C@H]1CN2c1ncccc1-c1nnn[n-]1 ZINC001606475832 1076373011 /nfs/dbraw/zinc/37/30/11/1076373011.db2.gz BBGZZVREQBTFDO-JBLDHEPKSA-N -1 3 390.429 -1.257 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1C[C@@H]2C[C@H]1CN2c1ncccc1-c1nn[n-]n1 ZINC001606475833 1076373308 /nfs/dbraw/zinc/37/33/08/1076373308.db2.gz BBGZZVREQBTFDO-NHCYSSNCSA-N -1 3 390.429 -1.257 20 0 GAADHM O=C([C@@H]1CCS(=O)(=O)N1)N1C[C@@H]2C[C@H]1CN2c1ncccc1-c1nnn[n-]1 ZINC001606475833 1076373307 /nfs/dbraw/zinc/37/33/07/1076373307.db2.gz BBGZZVREQBTFDO-NHCYSSNCSA-N -1 3 390.429 -1.257 20 0 GAADHM O=C(C[C@@H]1CCOC1)N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O ZINC001606503544 1076373691 /nfs/dbraw/zinc/37/36/91/1076373691.db2.gz PGMNYRBZNKSRTC-ZWKOPEQDSA-N -1 3 375.389 -1.077 20 0 GAADHM O=C(C[C@@H]1CCOC1)N[C@@H]1CN(C(=O)c2ccc(-c3nnn[n-]3)[nH]2)C[C@H]1O ZINC001606503544 1076373686 /nfs/dbraw/zinc/37/36/86/1076373686.db2.gz PGMNYRBZNKSRTC-ZWKOPEQDSA-N -1 3 375.389 -1.077 20 0 GAADHM O=C(C[C@@H]1CCNC1=O)NC[C@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001606503903 1076373737 /nfs/dbraw/zinc/37/37/37/1076373737.db2.gz LNYZHLWCBHLXIB-APPDUMDISA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(C[C@@H]1CCNC1=O)NC[C@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001606503903 1076373733 /nfs/dbraw/zinc/37/37/33/1076373733.db2.gz LNYZHLWCBHLXIB-APPDUMDISA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(C[C@H]1CCNC1=O)NC[C@@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001606503904 1076373617 /nfs/dbraw/zinc/37/36/17/1076373617.db2.gz LNYZHLWCBHLXIB-DIFFPNOSSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(C[C@H]1CCNC1=O)NC[C@@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001606503904 1076373611 /nfs/dbraw/zinc/37/36/11/1076373611.db2.gz LNYZHLWCBHLXIB-DIFFPNOSSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(C[C@@H]1CCNC1=O)NC[C@@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001606503905 1076373640 /nfs/dbraw/zinc/37/36/40/1076373640.db2.gz LNYZHLWCBHLXIB-GTNSWQLSSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(C[C@@H]1CCNC1=O)NC[C@@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001606503905 1076373635 /nfs/dbraw/zinc/37/36/35/1076373635.db2.gz LNYZHLWCBHLXIB-GTNSWQLSSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(C[C@H]1CCNC1=O)NC[C@]1(O)CCN(c2ncccc2-c2nn[n-]n2)C1 ZINC001606503906 1076373785 /nfs/dbraw/zinc/37/37/85/1076373785.db2.gz LNYZHLWCBHLXIB-PIGZYNQJSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(C[C@H]1CCNC1=O)NC[C@]1(O)CCN(c2ncccc2-c2nnn[n-]2)C1 ZINC001606503906 1076373781 /nfs/dbraw/zinc/37/37/81/1076373781.db2.gz LNYZHLWCBHLXIB-PIGZYNQJSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(CC1CS(=O)(=O)C1)NC[C@@H](CO)Nc1ncccc1-c1nn[n-]n1 ZINC001606507402 1076374424 /nfs/dbraw/zinc/37/44/24/1076374424.db2.gz PTOGUYCWRHHSKS-JTQLQIEISA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(CC1CS(=O)(=O)C1)NC[C@@H](CO)Nc1ncccc1-c1nnn[n-]1 ZINC001606507402 1076374422 /nfs/dbraw/zinc/37/44/22/1076374422.db2.gz PTOGUYCWRHHSKS-JTQLQIEISA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(CC1CS(=O)(=O)C1)NC[C@H](CO)Nc1ncccc1-c1nn[n-]n1 ZINC001606507405 1076374462 /nfs/dbraw/zinc/37/44/62/1076374462.db2.gz PTOGUYCWRHHSKS-SNVBAGLBSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(CC1CS(=O)(=O)C1)NC[C@H](CO)Nc1ncccc1-c1nnn[n-]1 ZINC001606507405 1076374458 /nfs/dbraw/zinc/37/44/58/1076374458.db2.gz PTOGUYCWRHHSKS-SNVBAGLBSA-N -1 3 381.418 -1.415 20 0 GAADHM O=C(CC1CS(=O)(=O)C1)N[C@@H]1CN(c2ncccc2-c2nn[n-]n2)C[C@H]1O ZINC001606507904 1076374370 /nfs/dbraw/zinc/37/43/70/1076374370.db2.gz PUTGQOMGZKSSBI-VXGBXAGGSA-N -1 3 393.429 -1.638 20 0 GAADHM O=C(CC1CS(=O)(=O)C1)N[C@@H]1CN(c2ncccc2-c2nnn[n-]2)C[C@H]1O ZINC001606507904 1076374368 /nfs/dbraw/zinc/37/43/68/1076374368.db2.gz PUTGQOMGZKSSBI-VXGBXAGGSA-N -1 3 393.429 -1.638 20 0 GAADHM O=C(CC1OCCCO1)N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@H]1O ZINC001606507968 1076374374 /nfs/dbraw/zinc/37/43/74/1076374374.db2.gz SJBNUWGTHSFRRO-VXGBXAGGSA-N -1 3 391.388 -1.351 20 0 GAADHM O=C(CC1OCCCO1)N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@H]1O ZINC001606507968 1076374373 /nfs/dbraw/zinc/37/43/73/1076374373.db2.gz SJBNUWGTHSFRRO-VXGBXAGGSA-N -1 3 391.388 -1.351 20 0 GAADHM O=C(CC1CS(=O)(=O)C1)N[C@@H]1CN(c2ccc(-c3nn[n-]n3)nc2)C[C@@H]1O ZINC001606508023 1076374345 /nfs/dbraw/zinc/37/43/45/1076374345.db2.gz WIEJAGBISILYCW-OLZOCXBDSA-N -1 3 393.429 -1.638 20 0 GAADHM O=C(CC1CS(=O)(=O)C1)N[C@@H]1CN(c2ccc(-c3nnn[n-]3)nc2)C[C@@H]1O ZINC001606508023 1076374344 /nfs/dbraw/zinc/37/43/44/1076374344.db2.gz WIEJAGBISILYCW-OLZOCXBDSA-N -1 3 393.429 -1.638 20 0 GAADHM O=C(CCN1C(=O)CCC1=O)NC[C@H](CO)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001606518015 1076374964 /nfs/dbraw/zinc/37/49/64/1076374964.db2.gz BEXYNAHOYOTKKN-LLVKDONJSA-N -1 3 388.388 -1.310 20 0 GAADHM O=C(CCN1C(=O)CCC1=O)NC[C@H](CO)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001606518015 1076374961 /nfs/dbraw/zinc/37/49/61/1076374961.db2.gz BEXYNAHOYOTKKN-LLVKDONJSA-N -1 3 388.388 -1.310 20 0 GAADHM O=C(CCN1C(=O)CCC1=O)NC[C@@H](CO)Nc1ccc(-c2nn[n-]n2)nc1 ZINC001606518016 1076374849 /nfs/dbraw/zinc/37/48/49/1076374849.db2.gz BEXYNAHOYOTKKN-NSHDSACASA-N -1 3 388.388 -1.310 20 0 GAADHM O=C(CCN1C(=O)CCC1=O)NC[C@@H](CO)Nc1ccc(-c2nnn[n-]2)nc1 ZINC001606518016 1076374845 /nfs/dbraw/zinc/37/48/45/1076374845.db2.gz 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O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)NCCCn1ccnn1 ZINC001606554368 1076379410 /nfs/dbraw/zinc/37/94/10/1076379410.db2.gz JJHKNFSHAHKPRL-UHFFFAOYSA-N -1 3 391.417 -1.057 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)N[C@@]1(CCO)CCOC1 ZINC001606554399 1076379575 /nfs/dbraw/zinc/37/95/75/1076379575.db2.gz KNPUCOUKCBZXPM-HNNXBMFYSA-N -1 3 396.429 -1.197 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)N[C@@]1(CCO)CCOC1 ZINC001606554399 1076379573 /nfs/dbraw/zinc/37/95/73/1076379573.db2.gz KNPUCOUKCBZXPM-HNNXBMFYSA-N -1 3 396.429 -1.197 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)N[C@]1(CCO)CCOC1 ZINC001606554400 1076379514 /nfs/dbraw/zinc/37/95/14/1076379514.db2.gz KNPUCOUKCBZXPM-OAHLLOKOSA-N -1 3 396.429 -1.197 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)N[C@]1(CCO)CCOC1 ZINC001606554400 1076379511 /nfs/dbraw/zinc/37/95/11/1076379511.db2.gz KNPUCOUKCBZXPM-OAHLLOKOSA-N -1 3 396.429 -1.197 20 0 GAADHM O=C(CNCCS(=O)(=O)c1ccc(-c2nn[n-]n2)cn1)N1CCOCC1 ZINC001606554448 1076379556 /nfs/dbraw/zinc/37/95/56/1076379556.db2.gz MQYSJMRAFFNKEM-UHFFFAOYSA-N -1 3 381.418 -1.516 20 0 GAADHM O=C(CNCCS(=O)(=O)c1ccc(-c2nnn[n-]2)cn1)N1CCOCC1 ZINC001606554448 1076379555 /nfs/dbraw/zinc/37/95/55/1076379555.db2.gz MQYSJMRAFFNKEM-UHFFFAOYSA-N -1 3 381.418 -1.516 20 0 GAADHM O=C(CNS(=O)(=O)c1ccccc1-c1nn[n-]n1)OC[C@H]1CNC(=O)O1 ZINC001606554475 1076379566 /nfs/dbraw/zinc/37/95/66/1076379566.db2.gz OLUKQNQECFWWOT-MRVPVSSYSA-N -1 3 382.358 -1.203 20 0 GAADHM O=C(CNS(=O)(=O)c1ccccc1-c1nnn[n-]1)OC[C@H]1CNC(=O)O1 ZINC001606554475 1076379565 /nfs/dbraw/zinc/37/95/65/1076379565.db2.gz OLUKQNQECFWWOT-MRVPVSSYSA-N -1 3 382.358 -1.203 20 0 GAADHM O=C(CNS(=O)(=O)c1ccccc1-c1nn[n-]n1)OC[C@@H]1CNC(=O)O1 ZINC001606554476 1076379433 /nfs/dbraw/zinc/37/94/33/1076379433.db2.gz OLUKQNQECFWWOT-QMMMGPOBSA-N -1 3 382.358 -1.203 20 0 GAADHM O=C(CNS(=O)(=O)c1ccccc1-c1nnn[n-]1)OC[C@@H]1CNC(=O)O1 ZINC001606554476 1076379430 /nfs/dbraw/zinc/37/94/30/1076379430.db2.gz OLUKQNQECFWWOT-QMMMGPOBSA-N -1 3 382.358 -1.203 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)N1CCn2nncc2C1 ZINC001606554618 1076379523 /nfs/dbraw/zinc/37/95/23/1076379523.db2.gz PYFULCFZCOXKPY-UHFFFAOYSA-N -1 3 389.401 -1.221 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)N1CCn2nncc2C1 ZINC001606554618 1076379520 /nfs/dbraw/zinc/37/95/20/1076379520.db2.gz PYFULCFZCOXKPY-UHFFFAOYSA-N -1 3 389.401 -1.221 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)N1C[C@@H](O)[C@H](CO)C1 ZINC001606554621 1076379562 /nfs/dbraw/zinc/37/95/62/1076379562.db2.gz QBIVUFCASSQCOD-CMPLNLGQSA-N -1 3 382.402 -2.043 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)N1C[C@@H](O)[C@H](CO)C1 ZINC001606554621 1076379560 /nfs/dbraw/zinc/37/95/60/1076379560.db2.gz QBIVUFCASSQCOD-CMPLNLGQSA-N -1 3 382.402 -2.043 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)N1C[C@H](O)[C@H](CO)C1 ZINC001606554622 1076379537 /nfs/dbraw/zinc/37/95/37/1076379537.db2.gz QBIVUFCASSQCOD-JQWIXIFHSA-N -1 3 382.402 -2.043 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)N1C[C@H](O)[C@H](CO)C1 ZINC001606554622 1076379532 /nfs/dbraw/zinc/37/95/32/1076379532.db2.gz QBIVUFCASSQCOD-JQWIXIFHSA-N -1 3 382.402 -2.043 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)N1C[C@H](O)[C@@H](CO)C1 ZINC001606554623 1076379462 /nfs/dbraw/zinc/37/94/62/1076379462.db2.gz QBIVUFCASSQCOD-PWSUYJOCSA-N -1 3 382.402 -2.043 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)N1C[C@H](O)[C@@H](CO)C1 ZINC001606554623 1076379457 /nfs/dbraw/zinc/37/94/57/1076379457.db2.gz QBIVUFCASSQCOD-PWSUYJOCSA-N -1 3 382.402 -2.043 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)N1C[C@H](CO)[C@H](O)C1 ZINC001606554624 1076379974 /nfs/dbraw/zinc/37/99/74/1076379974.db2.gz QBIVUFCASSQCOD-ZYHUDNBSSA-N -1 3 382.402 -2.043 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)N1C[C@H](CO)[C@H](O)C1 ZINC001606554624 1076379971 /nfs/dbraw/zinc/37/99/71/1076379971.db2.gz QBIVUFCASSQCOD-ZYHUDNBSSA-N -1 3 382.402 -2.043 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)OCCn1cncn1 ZINC001606554639 1076379917 /nfs/dbraw/zinc/37/99/17/1076379917.db2.gz QSZUIVKAAZFXFW-UHFFFAOYSA-N -1 3 378.374 -1.020 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)OCCn1cncn1 ZINC001606554639 1076379913 /nfs/dbraw/zinc/37/99/13/1076379913.db2.gz QSZUIVKAAZFXFW-UHFFFAOYSA-N -1 3 378.374 -1.020 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)N1CCn2ncnc2C1 ZINC001606554642 1076379997 /nfs/dbraw/zinc/37/99/97/1076379997.db2.gz QXTYCHYDYMUQJX-UHFFFAOYSA-N -1 3 389.401 -1.221 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)N1CCn2ncnc2C1 ZINC001606554642 1076379994 /nfs/dbraw/zinc/37/99/94/1076379994.db2.gz QXTYCHYDYMUQJX-UHFFFAOYSA-N -1 3 389.401 -1.221 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)N[C@@H](CO)[C@H]1CCOC1 ZINC001606554667 1076379951 /nfs/dbraw/zinc/37/99/51/1076379951.db2.gz SEEFCZMEPIJKKG-AAEUAGOBSA-N -1 3 396.429 -1.341 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)N[C@@H](CO)[C@H]1CCOC1 ZINC001606554667 1076379948 /nfs/dbraw/zinc/37/99/48/1076379948.db2.gz SEEFCZMEPIJKKG-AAEUAGOBSA-N -1 3 396.429 -1.341 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)N[C@H](CO)[C@@H]1CCOC1 ZINC001606554668 1076379941 /nfs/dbraw/zinc/37/99/41/1076379941.db2.gz SEEFCZMEPIJKKG-DGCLKSJQSA-N -1 3 396.429 -1.341 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)N[C@H](CO)[C@@H]1CCOC1 ZINC001606554668 1076379938 /nfs/dbraw/zinc/37/99/38/1076379938.db2.gz SEEFCZMEPIJKKG-DGCLKSJQSA-N -1 3 396.429 -1.341 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)N[C@H](CO)[C@H]1CCOC1 ZINC001606554669 1076379780 /nfs/dbraw/zinc/37/97/80/1076379780.db2.gz SEEFCZMEPIJKKG-WCQYABFASA-N -1 3 396.429 -1.341 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)N[C@H](CO)[C@H]1CCOC1 ZINC001606554669 1076379773 /nfs/dbraw/zinc/37/97/73/1076379773.db2.gz SEEFCZMEPIJKKG-WCQYABFASA-N -1 3 396.429 -1.341 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)N[C@@H](CO)[C@@H]1CCOC1 ZINC001606554670 1076379984 /nfs/dbraw/zinc/37/99/84/1076379984.db2.gz SEEFCZMEPIJKKG-YPMHNXCESA-N -1 3 396.429 -1.341 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)N[C@@H](CO)[C@@H]1CCOC1 ZINC001606554670 1076379981 /nfs/dbraw/zinc/37/99/81/1076379981.db2.gz SEEFCZMEPIJKKG-YPMHNXCESA-N -1 3 396.429 -1.341 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)NCCN1CCOCC1 ZINC001606554705 1076379842 /nfs/dbraw/zinc/37/98/42/1076379842.db2.gz UOWTXAPHKPEMRG-UHFFFAOYSA-N -1 3 395.445 -1.407 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)NCCN1CCOCC1 ZINC001606554705 1076379838 /nfs/dbraw/zinc/37/98/38/1076379838.db2.gz UOWTXAPHKPEMRG-UHFFFAOYSA-N -1 3 395.445 -1.407 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)NC[C@@H]1CCC(=O)N1 ZINC001606554805 1076379903 /nfs/dbraw/zinc/37/99/03/1076379903.db2.gz UVBBFJZROMYSKQ-JTQLQIEISA-N -1 3 379.402 -1.460 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)NC[C@@H]1CCC(=O)N1 ZINC001606554805 1076379897 /nfs/dbraw/zinc/37/98/97/1076379897.db2.gz UVBBFJZROMYSKQ-JTQLQIEISA-N -1 3 379.402 -1.460 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)NCC[C@]1(O)CCOC1 ZINC001606554820 1076379824 /nfs/dbraw/zinc/37/98/24/1076379824.db2.gz VHXONIUBHDCZTP-HNNXBMFYSA-N -1 3 396.429 -1.197 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)NCC[C@]1(O)CCOC1 ZINC001606554820 1076379821 /nfs/dbraw/zinc/37/98/21/1076379821.db2.gz VHXONIUBHDCZTP-HNNXBMFYSA-N -1 3 396.429 -1.197 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)NCC[C@@]1(O)CCOC1 ZINC001606554821 1076379762 /nfs/dbraw/zinc/37/97/62/1076379762.db2.gz VHXONIUBHDCZTP-OAHLLOKOSA-N -1 3 396.429 -1.197 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)NCC[C@@]1(O)CCOC1 ZINC001606554821 1076379758 /nfs/dbraw/zinc/37/97/58/1076379758.db2.gz VHXONIUBHDCZTP-OAHLLOKOSA-N -1 3 396.429 -1.197 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)NC[C@H]1CCCNC1=O ZINC001606554882 1076379890 /nfs/dbraw/zinc/37/98/90/1076379890.db2.gz XNTAWTHUTIBJRL-LLVKDONJSA-N -1 3 393.429 -1.213 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)NC[C@H]1CCCNC1=O ZINC001606554882 1076379887 /nfs/dbraw/zinc/37/98/87/1076379887.db2.gz XNTAWTHUTIBJRL-LLVKDONJSA-N -1 3 393.429 -1.213 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)NC[C@@H]1CCCNC1=O ZINC001606554888 1076379964 /nfs/dbraw/zinc/37/99/64/1076379964.db2.gz XNTAWTHUTIBJRL-NSHDSACASA-N -1 3 393.429 -1.213 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)NC[C@@H]1CCCNC1=O ZINC001606554888 1076379959 /nfs/dbraw/zinc/37/99/59/1076379959.db2.gz XNTAWTHUTIBJRL-NSHDSACASA-N -1 3 393.429 -1.213 20 0 GAADHM O=C(CNc1ccc(-c2nn[n-]n2)cn1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001606557722 1076379805 /nfs/dbraw/zinc/37/98/05/1076379805.db2.gz UCJDTRZSOMBDKJ-JTQLQIEISA-N -1 3 379.406 -1.966 20 0 GAADHM O=C(CNc1ccc(-c2nnn[n-]2)cn1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001606557722 1076379800 /nfs/dbraw/zinc/37/98/00/1076379800.db2.gz UCJDTRZSOMBDKJ-JTQLQIEISA-N -1 3 379.406 -1.966 20 0 GAADHM O=C(CNc1ccc(-c2nn[n-]n2)cn1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001606557723 1076379990 /nfs/dbraw/zinc/37/99/90/1076379990.db2.gz 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MIAHVUJBJCYERE-SJCJKPOMSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ccc(-c3nn[n-]n3)cn2)C1)[C@@H]1CCCNC1=O ZINC001607051744 1076401954 /nfs/dbraw/zinc/40/19/54/1076401954.db2.gz MIAHVUJBJCYERE-SJKOYZFVSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ccc(-c3nnn[n-]3)cn2)C1)[C@@H]1CCCNC1=O ZINC001607051744 1076401950 /nfs/dbraw/zinc/40/19/50/1076401950.db2.gz MIAHVUJBJCYERE-SJKOYZFVSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ccc(-c3nn[n-]n3)cn2)C1)[C@H]1CCCNC1=O ZINC001607051748 1076401835 /nfs/dbraw/zinc/40/18/35/1076401835.db2.gz MIAHVUJBJCYERE-YVEFUNNKSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(NC[C@]1(O)CCN(c2ccc(-c3nnn[n-]3)cn2)C1)[C@H]1CCCNC1=O ZINC001607051748 1076401831 /nfs/dbraw/zinc/40/18/31/1076401831.db2.gz MIAHVUJBJCYERE-YVEFUNNKSA-N -1 3 386.416 -1.155 20 0 GAADHM O=C(NCCN(CCO)C(=O)c1cc(-c2nn[n-]n2)c[nH]1)[C@@H]1CCCNC1=O ZINC001607051770 1076401932 /nfs/dbraw/zinc/40/19/32/1076401932.db2.gz MOQZNTMCUCNDFV-LLVKDONJSA-N -1 3 390.404 -1.728 20 0 GAADHM O=C(NCCN(CCO)C(=O)c1cc(-c2nnn[n-]2)c[nH]1)[C@@H]1CCCNC1=O ZINC001607051770 1076401930 /nfs/dbraw/zinc/40/19/30/1076401930.db2.gz MOQZNTMCUCNDFV-LLVKDONJSA-N -1 3 390.404 -1.728 20 0 GAADHM O=C(NCCN(CCO)C(=O)c1cc(-c2nn[n-]n2)c[nH]1)[C@H]1CCCNC1=O ZINC001607051772 1076401890 /nfs/dbraw/zinc/40/18/90/1076401890.db2.gz MOQZNTMCUCNDFV-NSHDSACASA-N -1 3 390.404 -1.728 20 0 GAADHM O=C(NCCN(CCO)C(=O)c1cc(-c2nnn[n-]2)c[nH]1)[C@H]1CCCNC1=O ZINC001607051772 1076401886 /nfs/dbraw/zinc/40/18/86/1076401886.db2.gz MOQZNTMCUCNDFV-NSHDSACASA-N -1 3 390.404 -1.728 20 0 GAADHM O=C(N[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]21)[C@@H]1CCCNC1=O ZINC001607051946 1076402111 /nfs/dbraw/zinc/40/21/11/1076402111.db2.gz OKEDPIHLEBRCCJ-DCQANWLSSA-N -1 3 384.400 -1.092 20 0 GAADHM O=C(N[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]21)[C@@H]1CCCNC1=O ZINC001607051946 1076402105 /nfs/dbraw/zinc/40/21/05/1076402105.db2.gz OKEDPIHLEBRCCJ-DCQANWLSSA-N -1 3 384.400 -1.092 20 0 GAADHM O=C(N[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nn[n-]n4)c3)C[C@H]21)[C@H]1CCCNC1=O ZINC001607051948 1076402099 /nfs/dbraw/zinc/40/20/99/1076402099.db2.gz OKEDPIHLEBRCCJ-MEWQQHAOSA-N -1 3 384.400 -1.092 20 0 GAADHM O=C(N[C@@H]1[C@H]2CN(C(=O)c3c[nH]c(-c4nnn[n-]4)c3)C[C@H]21)[C@H]1CCCNC1=O ZINC001607051948 1076402097 /nfs/dbraw/zinc/40/20/97/1076402097.db2.gz OKEDPIHLEBRCCJ-MEWQQHAOSA-N -1 3 384.400 -1.092 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)N1CC2(C1)CNC(=O)O2 ZINC001607052697 1076402173 /nfs/dbraw/zinc/40/21/73/1076402173.db2.gz KKDDTDGSMWCJSK-UHFFFAOYSA-N -1 3 393.385 -1.534 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)N1CC2(C1)CNC(=O)O2 ZINC001607052697 1076402171 /nfs/dbraw/zinc/40/21/71/1076402171.db2.gz KKDDTDGSMWCJSK-UHFFFAOYSA-N -1 3 393.385 -1.534 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2ccc(-c3nn[n-]n3)[nH]2)C[C@H]1O)[C@@H]1CCCNC1=O ZINC001607052843 1076402155 /nfs/dbraw/zinc/40/21/55/1076402155.db2.gz VMLLAZBUBFQVDW-GGZOMVNGSA-N -1 3 388.388 -1.978 20 0 GAADHM 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O=C(N[C@@H]1CN(C(=O)c2cc(-c3nn[n-]n3)c[nH]2)C[C@@H]1O)[C@H]1CCCNC1=O ZINC001607053021 1076402478 /nfs/dbraw/zinc/40/24/78/1076402478.db2.gz WTUYLQOBXRHXCC-WCQGTBRESA-N -1 3 388.388 -1.978 20 0 GAADHM O=C(N[C@@H]1CN(C(=O)c2cc(-c3nnn[n-]3)c[nH]2)C[C@@H]1O)[C@H]1CCCNC1=O ZINC001607053021 1076402476 /nfs/dbraw/zinc/40/24/76/1076402476.db2.gz WTUYLQOBXRHXCC-WCQGTBRESA-N -1 3 388.388 -1.978 20 0 GAADHM O=C1NC[C@@H]2CN(S(=O)(=O)c3cncc(-c4nn[n-]n4)c3)CCN2C1=O ZINC001607053028 1076402517 /nfs/dbraw/zinc/40/25/17/1076402517.db2.gz LLVXLHFMYJKYMY-SECBINFHSA-N -1 3 378.374 -2.407 20 0 GAADHM O=C1NC[C@@H]2CN(S(=O)(=O)c3cncc(-c4nnn[n-]4)c3)CCN2C1=O ZINC001607053028 1076402514 /nfs/dbraw/zinc/40/25/14/1076402514.db2.gz LLVXLHFMYJKYMY-SECBINFHSA-N -1 3 378.374 -2.407 20 0 GAADHM O=C1NC[C@H]2CN(S(=O)(=O)c3cncc(-c4nn[n-]n4)c3)CCN2C1=O ZINC001607053031 1076402463 /nfs/dbraw/zinc/40/24/63/1076402463.db2.gz LLVXLHFMYJKYMY-VIFPVBQESA-N -1 3 378.374 -2.407 20 0 GAADHM O=C1NC[C@H]2CN(S(=O)(=O)c3cncc(-c4nnn[n-]4)c3)CCN2C1=O ZINC001607053031 1076402461 /nfs/dbraw/zinc/40/24/61/1076402461.db2.gz LLVXLHFMYJKYMY-VIFPVBQESA-N -1 3 378.374 -2.407 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@@H]1CCNC1=O ZINC001607053040 1076402487 /nfs/dbraw/zinc/40/24/87/1076402487.db2.gz LMPDOWLSGSWHSF-HWPZZCPQSA-N -1 3 388.388 -1.976 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@@H]1CCNC1=O ZINC001607053040 1076402484 /nfs/dbraw/zinc/40/24/84/1076402484.db2.gz LMPDOWLSGSWHSF-HWPZZCPQSA-N -1 3 388.388 -1.976 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@H]1CCNC1=O ZINC001607053041 1076402432 /nfs/dbraw/zinc/40/24/32/1076402432.db2.gz LMPDOWLSGSWHSF-MGPLVRAMSA-N -1 3 388.388 -1.976 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@H]1CCNC1=O ZINC001607053041 1076402431 /nfs/dbraw/zinc/40/24/31/1076402431.db2.gz LMPDOWLSGSWHSF-MGPLVRAMSA-N -1 3 388.388 -1.976 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@H]1CCNC1=O ZINC001607053042 1076402415 /nfs/dbraw/zinc/40/24/15/1076402415.db2.gz LMPDOWLSGSWHSF-QFYYESIMSA-N -1 3 388.388 -1.976 20 0 GAADHM O=C(NC[C@@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@H]1CCNC1=O ZINC001607053042 1076402413 /nfs/dbraw/zinc/40/24/13/1076402413.db2.gz LMPDOWLSGSWHSF-QFYYESIMSA-N -1 3 388.388 -1.976 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nn[n-]n3)c2)C1)[C@@H]1CCNC1=O ZINC001607053043 1076402471 /nfs/dbraw/zinc/40/24/71/1076402471.db2.gz LMPDOWLSGSWHSF-QLJPJBMISA-N -1 3 388.388 -1.976 20 0 GAADHM O=C(NC[C@]1(O)CCN(C(=O)c2c[nH]c(-c3nnn[n-]3)c2)C1)[C@@H]1CCNC1=O ZINC001607053043 1076402467 /nfs/dbraw/zinc/40/24/67/1076402467.db2.gz LMPDOWLSGSWHSF-QLJPJBMISA-N -1 3 388.388 -1.976 20 0 GAADHM O=C(NCCN(CCO)C(=O)c1cc(-c2nn[n-]n2)c[nH]1)[C@H]1CCNC1=O ZINC001607053378 1076402501 /nfs/dbraw/zinc/40/25/01/1076402501.db2.gz NPNAWQMAHUFRQS-JTQLQIEISA-N -1 3 376.377 -2.118 20 0 GAADHM 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Cn1cnnc1CCNC(=O)CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC001609481427 1076421765 /nfs/dbraw/zinc/42/17/65/1076421765.db2.gz SSJYRBAQDKEOMP-UHFFFAOYSA-N -1 3 391.417 -1.368 20 0 GAADHM Cn1nnc(CNC(=O)C(=O)NCc2ccc(-c3nn[n-]n3)c(Cl)c2)n1 ZINC001609482947 1076421902 /nfs/dbraw/zinc/42/19/02/1076421902.db2.gz AISSQKKTYSOIFQ-UHFFFAOYSA-N -1 3 376.768 -1.024 20 0 GAADHM Cn1nnc(CNC(=O)C(=O)NCc2ccc(-c3nnn[n-]3)c(Cl)c2)n1 ZINC001609482947 1076421898 /nfs/dbraw/zinc/42/18/98/1076421898.db2.gz AISSQKKTYSOIFQ-UHFFFAOYSA-N -1 3 376.768 -1.024 20 0 GAADHM Cn1nnc(CNC(=O)C(=O)N2CCN(c3ncccc3-c3nn[n-]n3)CC2)n1 ZINC001609483167 1076421940 /nfs/dbraw/zinc/42/19/40/1076421940.db2.gz MVHVGXIFUFCWQC-UHFFFAOYSA-N -1 3 398.391 -2.250 20 0 GAADHM Cn1nnc(CNC(=O)C(=O)N2CCN(c3ncccc3-c3nnn[n-]3)CC2)n1 ZINC001609483167 1076421937 /nfs/dbraw/zinc/42/19/37/1076421937.db2.gz MVHVGXIFUFCWQC-UHFFFAOYSA-N -1 3 398.391 -2.250 20 0 GAADHM Cn1nnc(CNC(=O)C(=O)N2CC(Oc3ccc(-c4nn[n-]n4)cc3)C2)n1 ZINC001609483179 1076421795 /nfs/dbraw/zinc/42/17/95/1076421795.db2.gz NPBTUGCZKDRREC-UHFFFAOYSA-N -1 3 384.360 -1.704 20 0 GAADHM Cn1nncc1S(=O)(=O)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001609483583 1076421857 /nfs/dbraw/zinc/42/18/57/1076421857.db2.gz KTPRGGMDPHJAIX-UHFFFAOYSA-N -1 3 376.406 -1.099 20 0 GAADHM Cn1nncc1S(=O)(=O)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001609483583 1076421852 /nfs/dbraw/zinc/42/18/52/1076421852.db2.gz KTPRGGMDPHJAIX-UHFFFAOYSA-N -1 3 376.406 -1.099 20 0 GAADHM Cn1nncc1NC(=O)C(=O)N1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1 ZINC001609483690 1076421829 /nfs/dbraw/zinc/42/18/29/1076421829.db2.gz QRIXRPUPNGVWIE-UHFFFAOYSA-N -1 3 383.376 -1.323 20 0 GAADHM Cn1nncc1NC(=O)C(=O)N1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1 ZINC001609483690 1076421826 /nfs/dbraw/zinc/42/18/26/1076421826.db2.gz QRIXRPUPNGVWIE-UHFFFAOYSA-N -1 3 383.376 -1.323 20 0 GAADHM NC(=O)C1CCN(C(=O)CNS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001609501924 1076422389 /nfs/dbraw/zinc/42/23/89/1076422389.db2.gz AKZVFOHYPJRRQW-UHFFFAOYSA-N -1 3 393.429 -1.131 20 0 GAADHM NC(=O)C1CCN(C(=O)CNS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001609501924 1076422388 /nfs/dbraw/zinc/42/23/88/1076422388.db2.gz AKZVFOHYPJRRQW-UHFFFAOYSA-N -1 3 393.429 -1.131 20 0 GAADHM NC(=O)C[C@@H]1CCN(C(=O)CNS(=O)(=O)c2cccc(-c3nn[n-]n3)c2)C1 ZINC001609502056 1076422428 /nfs/dbraw/zinc/42/24/28/1076422428.db2.gz AXGPIOSDCJWJHR-JTQLQIEISA-N -1 3 393.429 -1.131 20 0 GAADHM NC(=O)C[C@@H]1CCN(C(=O)CNS(=O)(=O)c2cccc(-c3nnn[n-]3)c2)C1 ZINC001609502056 1076422426 /nfs/dbraw/zinc/42/24/26/1076422426.db2.gz AXGPIOSDCJWJHR-JTQLQIEISA-N -1 3 393.429 -1.131 20 0 GAADHM NC(=O)C[C@H]1CCN(C(=O)CNS(=O)(=O)c2cccc(-c3nn[n-]n3)c2)C1 ZINC001609502057 1076422403 /nfs/dbraw/zinc/42/24/03/1076422403.db2.gz AXGPIOSDCJWJHR-SNVBAGLBSA-N -1 3 393.429 -1.131 20 0 GAADHM NC(=O)C[C@H]1CCN(C(=O)CNS(=O)(=O)c2cccc(-c3nnn[n-]3)c2)C1 ZINC001609502057 1076422401 /nfs/dbraw/zinc/42/24/01/1076422401.db2.gz AXGPIOSDCJWJHR-SNVBAGLBSA-N -1 3 393.429 -1.131 20 0 GAADHM NC(=O)[C@H]1CN(C(=O)C(=O)N[C@@H]2CCc3cc(-c4nn[n-]n4)ccc32)CCO1 ZINC001609502229 1076422393 /nfs/dbraw/zinc/42/23/93/1076422393.db2.gz GTXJWNGXNYASJA-CHWSQXEVSA-N -1 3 385.384 -1.317 20 0 GAADHM NC(=O)[C@H]1CN(C(=O)C(=O)N[C@@H]2CCc3cc(-c4nnn[n-]4)ccc32)CCO1 ZINC001609502229 1076422391 /nfs/dbraw/zinc/42/23/91/1076422391.db2.gz GTXJWNGXNYASJA-CHWSQXEVSA-N -1 3 385.384 -1.317 20 0 GAADHM NC(=O)[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCc3cc(-c4nn[n-]n4)ccc32)CCO1 ZINC001609502230 1076422443 /nfs/dbraw/zinc/42/24/43/1076422443.db2.gz GTXJWNGXNYASJA-OLZOCXBDSA-N -1 3 385.384 -1.317 20 0 GAADHM NC(=O)[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCc3cc(-c4nnn[n-]4)ccc32)CCO1 ZINC001609502230 1076422441 /nfs/dbraw/zinc/42/24/41/1076422441.db2.gz GTXJWNGXNYASJA-OLZOCXBDSA-N -1 3 385.384 -1.317 20 0 GAADHM NC(=O)[C@H]1CN(C(=O)C(=O)N[C@H]2CCc3cc(-c4nn[n-]n4)ccc32)CCO1 ZINC001609502231 1076422398 /nfs/dbraw/zinc/42/23/98/1076422398.db2.gz GTXJWNGXNYASJA-QWHCGFSZSA-N -1 3 385.384 -1.317 20 0 GAADHM NC(=O)[C@H]1CN(C(=O)C(=O)N[C@H]2CCc3cc(-c4nnn[n-]4)ccc32)CCO1 ZINC001609502231 1076422396 /nfs/dbraw/zinc/42/23/96/1076422396.db2.gz GTXJWNGXNYASJA-QWHCGFSZSA-N -1 3 385.384 -1.317 20 0 GAADHM NC(=O)[C@@H]1CN(C(=O)C(=O)N[C@H]2CCc3cc(-c4nn[n-]n4)ccc32)CCO1 ZINC001609502232 1076422422 /nfs/dbraw/zinc/42/24/22/1076422422.db2.gz GTXJWNGXNYASJA-STQMWFEESA-N -1 3 385.384 -1.317 20 0 GAADHM NC(=O)[C@@H]1CN(C(=O)C(=O)N[C@H]2CCc3cc(-c4nnn[n-]4)ccc32)CCO1 ZINC001609502232 1076422420 /nfs/dbraw/zinc/42/24/20/1076422420.db2.gz GTXJWNGXNYASJA-STQMWFEESA-N -1 3 385.384 -1.317 20 0 GAADHM NC(=O)[C@H]1CN(C(=O)C(=O)NCc2ccc(-c3nn[n-]n3)cc2F)CCO1 ZINC001609502320 1076422344 /nfs/dbraw/zinc/42/23/44/1076422344.db2.gz KQUKXLZAHHUHRE-LLVKDONJSA-N -1 3 377.336 -1.665 20 0 GAADHM NC(=O)[C@H]1CN(C(=O)C(=O)NCc2ccc(-c3nnn[n-]3)cc2F)CCO1 ZINC001609502320 1076422338 /nfs/dbraw/zinc/42/23/38/1076422338.db2.gz KQUKXLZAHHUHRE-LLVKDONJSA-N -1 3 377.336 -1.665 20 0 GAADHM NC(=O)[C@@H]1CN(C(=O)C(=O)NCc2ccc(-c3nn[n-]n3)cc2F)CCO1 ZINC001609502321 1076422411 /nfs/dbraw/zinc/42/24/11/1076422411.db2.gz KQUKXLZAHHUHRE-NSHDSACASA-N -1 3 377.336 -1.665 20 0 GAADHM NC(=O)[C@@H]1CN(C(=O)C(=O)NCc2ccc(-c3nnn[n-]3)cc2F)CCO1 ZINC001609502321 1076422410 /nfs/dbraw/zinc/42/24/10/1076422410.db2.gz KQUKXLZAHHUHRE-NSHDSACASA-N -1 3 377.336 -1.665 20 0 GAADHM NC(=O)[C@H]1CC[C@@H](CNC(=O)C(=O)NCc2ccc(-c3nn[n-]n3)cc2F)O1 ZINC001609502518 1076422386 /nfs/dbraw/zinc/42/23/86/1076422386.db2.gz NHVRPRLTXHZEBF-CMPLNLGQSA-N -1 3 391.363 -1.229 20 0 GAADHM NC(=O)[C@H]1CC[C@@H](CNC(=O)C(=O)NCc2ccc(-c3nnn[n-]3)cc2F)O1 ZINC001609502518 1076422385 /nfs/dbraw/zinc/42/23/85/1076422385.db2.gz NHVRPRLTXHZEBF-CMPLNLGQSA-N -1 3 391.363 -1.229 20 0 GAADHM NC(=O)[C@@H]1CC[C@@H](CNC(=O)C(=O)NCc2ccc(-c3nn[n-]n3)cc2F)O1 ZINC001609502524 1076422438 /nfs/dbraw/zinc/42/24/38/1076422438.db2.gz NHVRPRLTXHZEBF-JQWIXIFHSA-N -1 3 391.363 -1.229 20 0 GAADHM NC(=O)[C@@H]1CC[C@@H](CNC(=O)C(=O)NCc2ccc(-c3nnn[n-]3)cc2F)O1 ZINC001609502524 1076422437 /nfs/dbraw/zinc/42/24/37/1076422437.db2.gz NHVRPRLTXHZEBF-JQWIXIFHSA-N -1 3 391.363 -1.229 20 0 GAADHM NC(=O)[C@@H]1CC[C@H](CNC(=O)C(=O)NCc2ccc(-c3nn[n-]n3)cc2F)O1 ZINC001609502525 1076422432 /nfs/dbraw/zinc/42/24/32/1076422432.db2.gz NHVRPRLTXHZEBF-PWSUYJOCSA-N -1 3 391.363 -1.229 20 0 GAADHM NC(=O)[C@@H]1CC[C@H](CNC(=O)C(=O)NCc2ccc(-c3nnn[n-]3)cc2F)O1 ZINC001609502525 1076422431 /nfs/dbraw/zinc/42/24/31/1076422431.db2.gz NHVRPRLTXHZEBF-PWSUYJOCSA-N -1 3 391.363 -1.229 20 0 GAADHM NC(=O)[C@H]1CC[C@H](CNC(=O)C(=O)NCc2ccc(-c3nn[n-]n3)cc2F)O1 ZINC001609502526 1076422417 /nfs/dbraw/zinc/42/24/17/1076422417.db2.gz NHVRPRLTXHZEBF-ZYHUDNBSSA-N -1 3 391.363 -1.229 20 0 GAADHM NC(=O)[C@H]1CC[C@H](CNC(=O)C(=O)NCc2ccc(-c3nnn[n-]3)cc2F)O1 ZINC001609502526 1076422415 /nfs/dbraw/zinc/42/24/15/1076422415.db2.gz NHVRPRLTXHZEBF-ZYHUDNBSSA-N -1 3 391.363 -1.229 20 0 GAADHM NC(=O)[C@@H]1CCCN(C(=O)CNS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)C1 ZINC001609502609 1076422408 /nfs/dbraw/zinc/42/24/08/1076422408.db2.gz PDURUGYMNNVHLG-LLVKDONJSA-N -1 3 393.429 -1.131 20 0 GAADHM NC(=O)[C@@H]1CCCN(C(=O)CNS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)C1 ZINC001609502609 1076422406 /nfs/dbraw/zinc/42/24/06/1076422406.db2.gz PDURUGYMNNVHLG-LLVKDONJSA-N -1 3 393.429 -1.131 20 0 GAADHM NC(=O)[C@H]1CCCN(C(=O)CNS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)C1 ZINC001609502610 1076422378 /nfs/dbraw/zinc/42/23/78/1076422378.db2.gz PDURUGYMNNVHLG-NSHDSACASA-N -1 3 393.429 -1.131 20 0 GAADHM NC(=O)[C@H]1CCCN(C(=O)CNS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)C1 ZINC001609502610 1076422376 /nfs/dbraw/zinc/42/23/76/1076422376.db2.gz PDURUGYMNNVHLG-NSHDSACASA-N -1 3 393.429 -1.131 20 0 GAADHM NC(=O)[C@H]1CN(C(=O)C(=O)NCc2ccc(-c3nn[n-]n3)c(Cl)c2)CCO1 ZINC001609502819 1076422383 /nfs/dbraw/zinc/42/23/83/1076422383.db2.gz WPPNPWBGIJFTRF-LLVKDONJSA-N -1 3 393.791 -1.151 20 0 GAADHM NC(=O)[C@H]1CN(C(=O)C(=O)NCc2ccc(-c3nnn[n-]3)c(Cl)c2)CCO1 ZINC001609502819 1076422382 /nfs/dbraw/zinc/42/23/82/1076422382.db2.gz WPPNPWBGIJFTRF-LLVKDONJSA-N -1 3 393.791 -1.151 20 0 GAADHM NC(=O)[C@@H]1CN(C(=O)C(=O)NCc2ccc(-c3nn[n-]n3)c(Cl)c2)CCO1 ZINC001609502820 1076422359 /nfs/dbraw/zinc/42/23/59/1076422359.db2.gz WPPNPWBGIJFTRF-NSHDSACASA-N -1 3 393.791 -1.151 20 0 GAADHM NC(=O)[C@@H]1CN(C(=O)C(=O)NCc2ccc(-c3nnn[n-]3)c(Cl)c2)CCO1 ZINC001609502820 1076422356 /nfs/dbraw/zinc/42/23/56/1076422356.db2.gz WPPNPWBGIJFTRF-NSHDSACASA-N -1 3 393.791 -1.151 20 0 GAADHM NC(=O)C1(O)CCN(CCS(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001609502947 1076422370 /nfs/dbraw/zinc/42/23/70/1076422370.db2.gz VFACMDQLRGXBSS-UHFFFAOYSA-N -1 3 380.430 -1.047 20 0 GAADHM NC(=O)C1(O)CCN(CCS(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001609502947 1076422367 /nfs/dbraw/zinc/42/23/67/1076422367.db2.gz VFACMDQLRGXBSS-UHFFFAOYSA-N -1 3 380.430 -1.047 20 0 GAADHM NC(=O)[C@@H]1CC[C@@H](CNC(=O)C(=O)N2CCc3ccc(-c4nn[n-]n4)cc32)O1 ZINC001609502990 1076422827 /nfs/dbraw/zinc/42/28/27/1076422827.db2.gz XMMNWZKRPBMPNO-AAEUAGOBSA-N -1 3 385.384 -1.095 20 0 GAADHM NC(=O)[C@@H]1CC[C@@H](CNC(=O)C(=O)N2CCc3ccc(-c4nnn[n-]4)cc32)O1 ZINC001609502990 1076422825 /nfs/dbraw/zinc/42/28/25/1076422825.db2.gz XMMNWZKRPBMPNO-AAEUAGOBSA-N -1 3 385.384 -1.095 20 0 GAADHM NC(=O)[C@H]1CC[C@H](CNC(=O)C(=O)N2CCc3ccc(-c4nn[n-]n4)cc32)O1 ZINC001609502991 1076422715 /nfs/dbraw/zinc/42/27/15/1076422715.db2.gz XMMNWZKRPBMPNO-DGCLKSJQSA-N -1 3 385.384 -1.095 20 0 GAADHM NC(=O)[C@H]1CC[C@H](CNC(=O)C(=O)N2CCc3ccc(-c4nnn[n-]4)cc32)O1 ZINC001609502991 1076422711 /nfs/dbraw/zinc/42/27/11/1076422711.db2.gz XMMNWZKRPBMPNO-DGCLKSJQSA-N -1 3 385.384 -1.095 20 0 GAADHM NC(=O)[C@H]1CC[C@@H](CNC(=O)C(=O)N2CCc3ccc(-c4nn[n-]n4)cc32)O1 ZINC001609502992 1076422809 /nfs/dbraw/zinc/42/28/09/1076422809.db2.gz XMMNWZKRPBMPNO-WCQYABFASA-N -1 3 385.384 -1.095 20 0 GAADHM NC(=O)[C@H]1CC[C@@H](CNC(=O)C(=O)N2CCc3ccc(-c4nnn[n-]4)cc32)O1 ZINC001609502992 1076422806 /nfs/dbraw/zinc/42/28/06/1076422806.db2.gz XMMNWZKRPBMPNO-WCQYABFASA-N -1 3 385.384 -1.095 20 0 GAADHM NC(=O)[C@@H]1CC[C@H](CNC(=O)C(=O)N2CCc3ccc(-c4nn[n-]n4)cc32)O1 ZINC001609502993 1076422870 /nfs/dbraw/zinc/42/28/70/1076422870.db2.gz XMMNWZKRPBMPNO-YPMHNXCESA-N -1 3 385.384 -1.095 20 0 GAADHM NC(=O)[C@@H]1CC[C@H](CNC(=O)C(=O)N2CCc3ccc(-c4nnn[n-]4)cc32)O1 ZINC001609502993 1076422865 /nfs/dbraw/zinc/42/28/65/1076422865.db2.gz XMMNWZKRPBMPNO-YPMHNXCESA-N -1 3 385.384 -1.095 20 0 GAADHM NC(=O)CN1CCN(S(=O)(=O)c2ccc(Cl)cc2-c2nnn[n-]2)CC1=O ZINC001609503499 1076422801 /nfs/dbraw/zinc/42/28/01/1076422801.db2.gz HXJPDSALCLBPDY-UHFFFAOYSA-N -1 3 399.820 -1.162 20 0 GAADHM NC(=O)CNC(=O)C1CCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2)CC1 ZINC001609503642 1076422879 /nfs/dbraw/zinc/42/28/79/1076422879.db2.gz MVYLKHQOBRERCP-UHFFFAOYSA-N -1 3 393.429 -1.131 20 0 GAADHM NC(=O)CNC(=O)C1CCN(S(=O)(=O)c2ccc(-c3nnn[n-]3)cc2)CC1 ZINC001609503642 1076422876 /nfs/dbraw/zinc/42/28/76/1076422876.db2.gz 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NC(=O)CN1CCN(S(=O)(=O)c2cc(-c3nnn[n-]3)ccc2Cl)CC1=O ZINC001609503774 1076422751 /nfs/dbraw/zinc/42/27/51/1076422751.db2.gz ONFGCNMEWAOGCR-UHFFFAOYSA-N -1 3 399.820 -1.162 20 0 GAADHM NC(=O)CN1CCN(C[C@@H](O)COc2ccc(-c3nn[n-]n3)cc2)CC1=O ZINC001609503778 1076422742 /nfs/dbraw/zinc/42/27/42/1076422742.db2.gz OXIQWQBAIKFKCG-GFCCVEGCSA-N -1 3 375.389 -1.764 20 0 GAADHM NC(=O)CN1CCN(C[C@H](O)COc2ccc(-c3nn[n-]n3)cc2)CC1=O ZINC001609503779 1076422840 /nfs/dbraw/zinc/42/28/40/1076422840.db2.gz OXIQWQBAIKFKCG-LBPRGKRZSA-N -1 3 375.389 -1.764 20 0 GAADHM NC(=O)CCS(=O)(=O)CCN1CCN(c2cc(-c3nn[n-]n3)ccn2)CC1 ZINC001609503810 1076422733 /nfs/dbraw/zinc/42/27/33/1076422733.db2.gz RSZANPDOBATVOP-UHFFFAOYSA-N -1 3 394.461 -1.326 20 0 GAADHM NC(=O)CCS(=O)(=O)CCN1CCN(c2cc(-c3nnn[n-]3)ccn2)CC1 ZINC001609503810 1076422729 /nfs/dbraw/zinc/42/27/29/1076422729.db2.gz RSZANPDOBATVOP-UHFFFAOYSA-N -1 3 394.461 -1.326 20 0 GAADHM NC(=O)CN1CCN(S(=O)(=O)c2ccc(-c3nn[n-]n3)cc2Cl)CC1=O ZINC001609503906 1076422793 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O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)N1CCC[C@@](O)(CO)C1 ZINC001609527594 1076424080 /nfs/dbraw/zinc/42/40/80/1076424080.db2.gz KTLRIGLHVXMSIC-HNNXBMFYSA-N -1 3 396.429 -1.509 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)N1CCC[C@](O)(CO)C1 ZINC001609527595 1076424133 /nfs/dbraw/zinc/42/41/33/1076424133.db2.gz KTLRIGLHVXMSIC-OAHLLOKOSA-N -1 3 396.429 -1.509 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)N1CCC[C@](O)(CO)C1 ZINC001609527595 1076424131 /nfs/dbraw/zinc/42/41/31/1076424131.db2.gz KTLRIGLHVXMSIC-OAHLLOKOSA-N -1 3 396.429 -1.509 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)N1CCN(CCO)CC1 ZINC001609527654 1076424046 /nfs/dbraw/zinc/42/40/46/1076424046.db2.gz ODDCGTYOWFCPGL-UHFFFAOYSA-N -1 3 395.445 -1.719 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)N1CCN(CCO)CC1 ZINC001609527654 1076424043 /nfs/dbraw/zinc/42/40/43/1076424043.db2.gz ODDCGTYOWFCPGL-UHFFFAOYSA-N -1 3 395.445 -1.719 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)OCC1(CO)COC1 ZINC001609527660 1076424075 /nfs/dbraw/zinc/42/40/75/1076424075.db2.gz ONHTVBPNSLLSDJ-UHFFFAOYSA-N -1 3 383.386 -1.303 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)OCC1(CO)COC1 ZINC001609527660 1076424074 /nfs/dbraw/zinc/42/40/74/1076424074.db2.gz ONHTVBPNSLLSDJ-UHFFFAOYSA-N -1 3 383.386 -1.303 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)N[C@@H]1CCCCNC1=O ZINC001609527680 1076424102 /nfs/dbraw/zinc/42/41/02/1076424102.db2.gz PPDCNCPAIWNYGI-GFCCVEGCSA-N -1 3 393.429 -1.070 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)N[C@@H]1CCCCNC1=O ZINC001609527680 1076424100 /nfs/dbraw/zinc/42/41/00/1076424100.db2.gz PPDCNCPAIWNYGI-GFCCVEGCSA-N -1 3 393.429 -1.070 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)N[C@H]1CCCCNC1=O ZINC001609527681 1076424115 /nfs/dbraw/zinc/42/41/15/1076424115.db2.gz PPDCNCPAIWNYGI-LBPRGKRZSA-N -1 3 393.429 -1.070 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)N[C@H]1CCCCNC1=O ZINC001609527681 1076424113 /nfs/dbraw/zinc/42/41/13/1076424113.db2.gz 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396.429 -1.653 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)N1CC[C@@H](CO)[C@H](O)C1 ZINC001609527690 1076424067 /nfs/dbraw/zinc/42/40/67/1076424067.db2.gz PXXYITQNRYUKST-WCQYABFASA-N -1 3 396.429 -1.653 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)N1CC[C@H](CO)[C@@H](O)C1 ZINC001609527691 1076424510 /nfs/dbraw/zinc/42/45/10/1076424510.db2.gz PXXYITQNRYUKST-YPMHNXCESA-N -1 3 396.429 -1.653 20 0 GAADHM O=C(CNS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)N1CC[C@H](CO)[C@@H](O)C1 ZINC001609527691 1076424507 /nfs/dbraw/zinc/42/45/07/1076424507.db2.gz PXXYITQNRYUKST-YPMHNXCESA-N -1 3 396.429 -1.653 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)N1CC(n2cncn2)C1 ZINC001609527736 1076424498 /nfs/dbraw/zinc/42/44/98/1076424498.db2.gz SSKZQEYEPUBOHT-UHFFFAOYSA-N -1 3 389.401 -1.180 20 0 GAADHM O=C(CNS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)N1CC(n2cncn2)C1 ZINC001609527736 1076424494 /nfs/dbraw/zinc/42/44/94/1076424494.db2.gz SSKZQEYEPUBOHT-UHFFFAOYSA-N -1 3 389.401 -1.180 20 0 GAADHM O=C(CNc1ccc(-c2nn[n-]n2)cc1)N1CCN(C(=O)Cn2cnnn2)CC1 ZINC001609527956 1076424573 /nfs/dbraw/zinc/42/45/73/1076424573.db2.gz GFBAZEMYMKOIGF-UHFFFAOYSA-N -1 3 397.403 -1.364 20 0 GAADHM O=C(CO)N1CCN(S(=O)(=O)Cc2ccc(F)cc2-c2nn[n-]n2)CC1 ZINC001609528544 1076424466 /nfs/dbraw/zinc/42/44/66/1076424466.db2.gz AETWRKYMSIDAMK-UHFFFAOYSA-N -1 3 384.393 -1.028 20 0 GAADHM O=C(CO)N1CCN(S(=O)(=O)Cc2ccc(F)cc2-c2nnn[n-]2)CC1 ZINC001609528544 1076424465 /nfs/dbraw/zinc/42/44/65/1076424465.db2.gz AETWRKYMSIDAMK-UHFFFAOYSA-N -1 3 384.393 -1.028 20 0 GAADHM O=C(CO)N1CCN(S(=O)(=O)Cc2ccc(-c3nn[n-]n3)cc2F)CC1 ZINC001609528908 1076424521 /nfs/dbraw/zinc/42/45/21/1076424521.db2.gz ZSZHXCKNLXBBPT-UHFFFAOYSA-N -1 3 384.393 -1.028 20 0 GAADHM O=C(CO)N1CCN(S(=O)(=O)Cc2ccc(-c3nnn[n-]3)cc2F)CC1 ZINC001609528908 1076424518 /nfs/dbraw/zinc/42/45/18/1076424518.db2.gz ZSZHXCKNLXBBPT-UHFFFAOYSA-N -1 3 384.393 -1.028 20 0 GAADHM O=C(COC(=O)CN1CCC(=O)NC1=O)NCc1ccc(-c2nn[n-]n2)cc1 ZINC001609529121 1076424541 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399.411 -1.011 20 0 GAADHM O=C(N[C@@H]1CCOC1)C(=O)N[C@@H]1CCN(Cc2ccc(-c3nn[n-]n3)cc2)C1=O ZINC001609541890 1076425046 /nfs/dbraw/zinc/42/50/46/1076425046.db2.gz GRGKSIOZEMLDNN-ZIAGYGMSSA-N -1 3 399.411 -1.011 20 0 GAADHM O=C(N[C@@H]1CCOC1)C(=O)N[C@@H]1CCN(Cc2ccc(-c3nnn[n-]3)cc2)C1=O ZINC001609541890 1076425040 /nfs/dbraw/zinc/42/50/40/1076425040.db2.gz GRGKSIOZEMLDNN-ZIAGYGMSSA-N -1 3 399.411 -1.011 20 0 GAADHM O=C(N[C@H]1CCN(Cc2ccc(-c3nn[n-]n3)cc2)C1=O)C(=O)N1CC(CO)C1 ZINC001609542390 1076424938 /nfs/dbraw/zinc/42/49/38/1076424938.db2.gz UCANHXYJKRXSJD-AWEZNQCLSA-N -1 3 399.411 -1.466 20 0 GAADHM O=C(N[C@H]1CCN(Cc2ccc(-c3nnn[n-]3)cc2)C1=O)C(=O)N1CC(CO)C1 ZINC001609542390 1076424937 /nfs/dbraw/zinc/42/49/37/1076424937.db2.gz UCANHXYJKRXSJD-AWEZNQCLSA-N -1 3 399.411 -1.466 20 0 GAADHM O=C(N[C@@H]1CCN(Cc2ccc(-c3nn[n-]n3)cc2)C1=O)C(=O)N1CC(CO)C1 ZINC001609542391 1076424881 /nfs/dbraw/zinc/42/48/81/1076424881.db2.gz UCANHXYJKRXSJD-CQSZACIVSA-N -1 3 399.411 -1.466 20 0 GAADHM O=C(N[C@@H]1CCN(Cc2ccc(-c3nnn[n-]3)cc2)C1=O)C(=O)N1CC(CO)C1 ZINC001609542391 1076424878 /nfs/dbraw/zinc/42/48/78/1076424878.db2.gz UCANHXYJKRXSJD-CQSZACIVSA-N -1 3 399.411 -1.466 20 0 GAADHM O=C(N[C@@H]1CS(=O)(=O)C[C@H]1N1CCOCC1)c1cc(-c2nn[n-]n2)ccn1 ZINC001609544449 1076424977 /nfs/dbraw/zinc/42/49/77/1076424977.db2.gz ROMMJBHPOFRTGF-CHWSQXEVSA-N -1 3 393.429 -1.511 20 0 GAADHM O=C(N[C@@H]1CS(=O)(=O)C[C@H]1N1CCOCC1)c1cc(-c2nnn[n-]2)ccn1 ZINC001609544449 1076424974 /nfs/dbraw/zinc/42/49/74/1076424974.db2.gz ROMMJBHPOFRTGF-CHWSQXEVSA-N -1 3 393.429 -1.511 20 0 GAADHM O=C(N[C@@H]1CS(=O)(=O)C[C@@H]1N1CCOCC1)c1cc(-c2nn[n-]n2)ccn1 ZINC001609544450 1076424924 /nfs/dbraw/zinc/42/49/24/1076424924.db2.gz ROMMJBHPOFRTGF-OLZOCXBDSA-N -1 3 393.429 -1.511 20 0 GAADHM O=C(N[C@@H]1CS(=O)(=O)C[C@@H]1N1CCOCC1)c1cc(-c2nnn[n-]2)ccn1 ZINC001609544450 1076424921 /nfs/dbraw/zinc/42/49/21/1076424921.db2.gz ROMMJBHPOFRTGF-OLZOCXBDSA-N -1 3 393.429 -1.511 20 0 GAADHM O=C(N[C@H]1CS(=O)(=O)C[C@H]1N1CCOCC1)c1cc(-c2nn[n-]n2)ccn1 ZINC001609544451 1076424904 /nfs/dbraw/zinc/42/49/04/1076424904.db2.gz ROMMJBHPOFRTGF-QWHCGFSZSA-N -1 3 393.429 -1.511 20 0 GAADHM O=C(N[C@H]1CS(=O)(=O)C[C@H]1N1CCOCC1)c1cc(-c2nnn[n-]2)ccn1 ZINC001609544451 1076424902 /nfs/dbraw/zinc/42/49/02/1076424902.db2.gz ROMMJBHPOFRTGF-QWHCGFSZSA-N -1 3 393.429 -1.511 20 0 GAADHM O=C(N[C@H]1CS(=O)(=O)C[C@@H]1N1CCOCC1)c1cc(-c2nn[n-]n2)ccn1 ZINC001609544452 1076425004 /nfs/dbraw/zinc/42/50/04/1076425004.db2.gz ROMMJBHPOFRTGF-STQMWFEESA-N -1 3 393.429 -1.511 20 0 GAADHM O=C(N[C@H]1CS(=O)(=O)C[C@@H]1N1CCOCC1)c1cc(-c2nnn[n-]2)ccn1 ZINC001609544452 1076425003 /nfs/dbraw/zinc/42/50/03/1076425003.db2.gz ROMMJBHPOFRTGF-STQMWFEESA-N -1 3 393.429 -1.511 20 0 GAADHM O=C(NCCN1C(=O)CNC1=O)C(=O)N1CCc2ccc(-c3nn[n-]n3)cc21 ZINC001609548173 1076425023 /nfs/dbraw/zinc/42/50/23/1076425023.db2.gz BQZCRVVRAWCKRJ-UHFFFAOYSA-N -1 3 384.356 -1.576 20 0 GAADHM O=C(NCCN1C(=O)CNC1=O)C(=O)N1CCc2ccc(-c3nnn[n-]3)cc21 ZINC001609548173 1076425021 /nfs/dbraw/zinc/42/50/21/1076425021.db2.gz BQZCRVVRAWCKRJ-UHFFFAOYSA-N -1 3 384.356 -1.576 20 0 GAADHM O=C(NCCN1C(=O)CNC1=O)[C@@H]1CC(=O)N(c2ccc(-c3nn[n-]n3)cc2)C1 ZINC001609548231 1076425033 /nfs/dbraw/zinc/42/50/33/1076425033.db2.gz FYYWQNDRCOOKBP-LLVKDONJSA-N -1 3 398.383 -1.112 20 0 GAADHM O=C(NCCN1C(=O)CNC1=O)[C@@H]1CC(=O)N(c2ccc(-c3nnn[n-]3)cc2)C1 ZINC001609548231 1076425030 /nfs/dbraw/zinc/42/50/30/1076425030.db2.gz FYYWQNDRCOOKBP-LLVKDONJSA-N -1 3 398.383 -1.112 20 0 GAADHM O=C(NCCN1C(=O)CNC1=O)[C@H]1CC(=O)N(c2ccc(-c3nn[n-]n3)cc2)C1 ZINC001609548232 1076424995 /nfs/dbraw/zinc/42/49/95/1076424995.db2.gz FYYWQNDRCOOKBP-NSHDSACASA-N -1 3 398.383 -1.112 20 0 GAADHM O=C(NCCN1C(=O)CNC1=O)[C@H]1CC(=O)N(c2ccc(-c3nnn[n-]3)cc2)C1 ZINC001609548232 1076424992 /nfs/dbraw/zinc/42/49/92/1076424992.db2.gz FYYWQNDRCOOKBP-NSHDSACASA-N -1 3 398.383 -1.112 20 0 GAADHM O=C(NCCN1C(=O)CNC1=O)C(=O)Nc1ccc(F)cc1-c1nn[n-]n1 ZINC001609548461 1076425443 /nfs/dbraw/zinc/42/54/43/1076425443.db2.gz OKRHYVKWJWZFJQ-UHFFFAOYSA-N -1 3 376.308 -1.388 20 0 GAADHM O=C(NCCN1C(=O)CNC1=O)C(=O)Nc1ccc(F)cc1-c1nnn[n-]1 ZINC001609548461 1076425439 /nfs/dbraw/zinc/42/54/39/1076425439.db2.gz OKRHYVKWJWZFJQ-UHFFFAOYSA-N -1 3 376.308 -1.388 20 0 GAADHM O=C(NCCNC(=O)C1CC1)C(=O)NCCNc1ncccc1-c1nn[n-]n1 ZINC001609548671 1076425358 /nfs/dbraw/zinc/42/53/58/1076425358.db2.gz WITDSDWDIFBYPH-UHFFFAOYSA-N -1 3 387.404 -1.568 20 0 GAADHM O=C(NCCNC(=O)C1CC1)C(=O)NCCNc1ncccc1-c1nnn[n-]1 ZINC001609548671 1076425354 /nfs/dbraw/zinc/42/53/54/1076425354.db2.gz WITDSDWDIFBYPH-UHFFFAOYSA-N -1 3 387.404 -1.568 20 0 GAADHM O=C(NCCN1C(=O)CNC1=O)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC001609548761 1076425477 /nfs/dbraw/zinc/42/54/77/1076425477.db2.gz ZKFGFPFDGPDEOU-UHFFFAOYSA-N -1 3 376.308 -1.388 20 0 GAADHM O=C(NCCN1C(=O)CNC1=O)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC001609548761 1076425475 /nfs/dbraw/zinc/42/54/75/1076425475.db2.gz ZKFGFPFDGPDEOU-UHFFFAOYSA-N -1 3 376.308 -1.388 20 0 GAADHM O=C(CNC(=O)C(=O)NCCNc1ncccc1-c1nn[n-]n1)N1CCCC1 ZINC001609549273 1076425392 /nfs/dbraw/zinc/42/53/92/1076425392.db2.gz POOFESVOFIHNCU-UHFFFAOYSA-N -1 3 387.404 -1.472 20 0 GAADHM O=C(CNC(=O)C(=O)NCCNc1ncccc1-c1nnn[n-]1)N1CCCC1 ZINC001609549273 1076425389 /nfs/dbraw/zinc/42/53/89/1076425389.db2.gz POOFESVOFIHNCU-UHFFFAOYSA-N -1 3 387.404 -1.472 20 0 GAADHM O=C(NCCNc1ncccc1-c1nn[n-]n1)C(=O)N1CC[C@@H](n2cncn2)C1 ZINC001609549377 1076425487 /nfs/dbraw/zinc/42/54/87/1076425487.db2.gz UWWLJUWGXXPPMO-LLVKDONJSA-N -1 3 397.403 -1.145 20 0 GAADHM O=C(NCCNc1ncccc1-c1nnn[n-]1)C(=O)N1CC[C@@H](n2cncn2)C1 ZINC001609549377 1076425485 /nfs/dbraw/zinc/42/54/85/1076425485.db2.gz UWWLJUWGXXPPMO-LLVKDONJSA-N -1 3 397.403 -1.145 20 0 GAADHM O=C(NCCNc1ncccc1-c1nn[n-]n1)C(=O)N1CC[C@H](n2cncn2)C1 ZINC001609549378 1076425451 /nfs/dbraw/zinc/42/54/51/1076425451.db2.gz UWWLJUWGXXPPMO-NSHDSACASA-N -1 3 397.403 -1.145 20 0 GAADHM O=C(NCCNc1ncccc1-c1nnn[n-]1)C(=O)N1CC[C@H](n2cncn2)C1 ZINC001609549378 1076425449 /nfs/dbraw/zinc/42/54/49/1076425449.db2.gz UWWLJUWGXXPPMO-NSHDSACASA-N -1 3 397.403 -1.145 20 0 GAADHM O=C(NCCn1cccn1)C(=O)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001609551306 1076425334 /nfs/dbraw/zinc/42/53/34/1076425334.db2.gz GFCIYECLVRVBBJ-UHFFFAOYSA-N -1 3 396.415 -1.077 20 0 GAADHM O=C(NCCn1cccn1)C(=O)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001609551306 1076425329 /nfs/dbraw/zinc/42/53/29/1076425329.db2.gz GFCIYECLVRVBBJ-UHFFFAOYSA-N -1 3 396.415 -1.077 20 0 GAADHM O=C(NCCn1cnc(-c2nn[n-]n2)n1)N1CCN(C[C@H]2CCOC2)CC1 ZINC001609551982 1076425528 /nfs/dbraw/zinc/42/55/28/1076425528.db2.gz SUAPDPIWVJHJQT-GFCCVEGCSA-N -1 3 376.425 -1.178 20 0 GAADHM O=C(NCCn1cnc(-c2nnn[n-]2)n1)N1CCN(C[C@H]2CCOC2)CC1 ZINC001609551982 1076425523 /nfs/dbraw/zinc/42/55/23/1076425523.db2.gz SUAPDPIWVJHJQT-GFCCVEGCSA-N -1 3 376.425 -1.178 20 0 GAADHM O=C(NCCn1cnc(-c2nn[n-]n2)n1)N1CCN(C[C@@H]2CCOC2)CC1 ZINC001609551983 1076425348 /nfs/dbraw/zinc/42/53/48/1076425348.db2.gz SUAPDPIWVJHJQT-LBPRGKRZSA-N -1 3 376.425 -1.178 20 0 GAADHM O=C(NCCn1cnc(-c2nnn[n-]2)n1)N1CCN(C[C@@H]2CCOC2)CC1 ZINC001609551983 1076425345 /nfs/dbraw/zinc/42/53/45/1076425345.db2.gz SUAPDPIWVJHJQT-LBPRGKRZSA-N -1 3 376.425 -1.178 20 0 GAADHM O=C(NCc1cc[nH]n1)C(=O)N1CCN(c2ccc(-c3nn[n-]n3)cn2)CC1 ZINC001609552534 1076425411 /nfs/dbraw/zinc/42/54/11/1076425411.db2.gz KDWBFZHAOCKFHT-UHFFFAOYSA-N -1 3 382.388 -1.050 20 0 GAADHM O=C(NCc1cc[nH]n1)C(=O)N1CCN(c2ccc(-c3nnn[n-]3)cn2)CC1 ZINC001609552534 1076425408 /nfs/dbraw/zinc/42/54/08/1076425408.db2.gz KDWBFZHAOCKFHT-UHFFFAOYSA-N -1 3 382.388 -1.050 20 0 GAADHM O=C(NCCn1cncn1)C(=O)N1CCN(c2ncccc2-c2nn[n-]n2)CC1 ZINC001609552580 1076425510 /nfs/dbraw/zinc/42/55/10/1076425510.db2.gz PINWLSAHKGXJLF-UHFFFAOYSA-N -1 3 397.403 -1.682 20 0 GAADHM O=C(NCCn1cncn1)C(=O)N1CCN(c2ncccc2-c2nnn[n-]2)CC1 ZINC001609552580 1076425507 /nfs/dbraw/zinc/42/55/07/1076425507.db2.gz PINWLSAHKGXJLF-UHFFFAOYSA-N -1 3 397.403 -1.682 20 0 GAADHM O=C(Nc1ccc(-c2nn[n-]n2)c(F)c1)C(=O)N1CCN2C(=O)NC(=O)[C@@H]2C1 ZINC001609562365 1076425370 /nfs/dbraw/zinc/42/53/70/1076425370.db2.gz IHKKKEGLTJLUIE-JTQLQIEISA-N -1 3 388.319 -1.293 20 0 GAADHM O=C(Nc1ccc(-c2nnn[n-]2)c(F)c1)C(=O)N1CCN2C(=O)NC(=O)[C@@H]2C1 ZINC001609562365 1076425366 /nfs/dbraw/zinc/42/53/66/1076425366.db2.gz IHKKKEGLTJLUIE-JTQLQIEISA-N -1 3 388.319 -1.293 20 0 GAADHM O=C(Nc1ccc(-c2nn[n-]n2)c(F)c1)C(=O)N1CCN2C(=O)NC(=O)[C@H]2C1 ZINC001609562366 1076425433 /nfs/dbraw/zinc/42/54/33/1076425433.db2.gz IHKKKEGLTJLUIE-SNVBAGLBSA-N -1 3 388.319 -1.293 20 0 GAADHM O=C(Nc1ccc(-c2nnn[n-]2)c(F)c1)C(=O)N1CCN2C(=O)NC(=O)[C@H]2C1 ZINC001609562366 1076425431 /nfs/dbraw/zinc/42/54/31/1076425431.db2.gz IHKKKEGLTJLUIE-SNVBAGLBSA-N -1 3 388.319 -1.293 20 0 GAADHM O=C(Nc1ccc(-c2nn[n-]n2)cn1)C(=O)N1CCN2C(=O)C(=O)NC[C@@H]2C1 ZINC001609563694 1076425462 /nfs/dbraw/zinc/42/54/62/1076425462.db2.gz FNQHCFDBAKGQKE-SECBINFHSA-N -1 3 385.344 -2.631 20 0 GAADHM 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