smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1cc(C=C2C(=O)NC(=O)NC2=O)ccc1OCc1cccc(F)c1 ZINC000001201916 539340152 /nfs/dbraw/zinc/34/01/52/539340152.db2.gz JDCBGLMYIQTYEP-UHFFFAOYSA-N 0 1 370.336 2.163 50 10 FECAMN CN(C)c1ccc([C@H](CNS(=O)(=O)c2cccc(F)c2)N(C)C)cc1 ZINC000005098866 204191619 /nfs/dbraw/zinc/19/16/19/204191619.db2.gz MSBPIIYKYQWCOZ-SFHVURJKSA-N 0 1 365.474 2.473 50 10 FECAMN CN(C)c1ccc([C@H](CNC(=O)C2CCCC2)N2CCN(C)CC2)cc1 ZINC000022589144 539696549 /nfs/dbraw/zinc/69/65/49/539696549.db2.gz UCTLCEVCLBKXPT-FQEVSTJZSA-N 0 1 358.530 2.348 50 10 FECAMN COc1ccc(N2CCN([C@@H]3CCCN(C(=O)c4ccc[nH]4)C3)CC2)cc1 ZINC000072135520 136142443 /nfs/dbraw/zinc/14/24/43/136142443.db2.gz VGHBETNUZNHFQQ-GOSISDBHSA-N 0 1 368.481 2.450 50 10 FECAMN COc1ccc(NC=C2C(=O)NC(=O)N(Cc3cccs3)C2=O)cc1 ZINC000101267716 543026546 /nfs/dbraw/zinc/02/65/46/543026546.db2.gz ZYKBYMVWSFCXRR-NTEUORMPSA-N 0 1 357.391 2.331 50 10 FECAMN COc1ccc(N2CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)CC2)cc1 ZINC000035507905 539983429 /nfs/dbraw/zinc/98/34/29/539983429.db2.gz YAVHPLHCAREAFI-UHFFFAOYSA-N 0 1 363.421 2.443 50 10 FECAMN COc1ccc(N2CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)CC2)cc1 ZINC000074629846 136150054 /nfs/dbraw/zinc/15/00/54/136150054.db2.gz LWHRWVJVOXAPDN-UHFFFAOYSA-N 0 1 363.421 2.443 50 10 FECAMN CC(C)(C)SCCNC=C1C(=O)NC(=O)N(Cc2ccccc2)C1=O ZINC000106310047 670810745 /nfs/dbraw/zinc/81/07/45/670810745.db2.gz XUGXRVHQOGFRRW-KAMYIIQDSA-N 0 1 361.467 2.270 50 10 FECAMN COc1ccc(/C=C2/C(=O)NC(=S)N(c3cccc(F)c3)C2=O)cc1O ZINC000015013566 539609342 /nfs/dbraw/zinc/60/93/42/539609342.db2.gz MDHSRDYBVXITEE-QPEQYQDCSA-N 0 1 372.377 2.371 50 10 FECAMN O=C(NC1CCN(c2ccc(OC(F)(F)F)cc2)CC1)[C@H]1CC1[N+](=O)[O-] ZINC000066323133 541302152 /nfs/dbraw/zinc/30/21/52/541302152.db2.gz RNEFAAMGFOLZLT-KBPBESRZSA-N 0 1 373.331 2.335 50 10 FECAMN CCN(CC)c1ccc([C@@H]2NC(=O)N=C(C)C2C(=O)OCCOC)cc1 ZINC000003902560 204114250 /nfs/dbraw/zinc/11/42/50/204114250.db2.gz BTVWTRDTYYVLSE-KRWDZBQOSA-N 0 1 361.442 2.350 50 10 FECAMN COc1ccc(OC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1 ZINC000085842853 524973589 /nfs/dbraw/zinc/97/35/89/524973589.db2.gz WEWPOVMBXFAXAC-GOSISDBHSA-N 0 1 372.465 2.266 50 10 FECAMN COc1ccc(/C=C2\C(=O)NC(=S)N(c3ccc(F)cc3)C2=O)cc1O ZINC000001149693 536597583 /nfs/dbraw/zinc/59/75/83/536597583.db2.gz OXPUWLGQWWZOBN-MDWZMJQESA-N 0 1 372.377 2.371 50 10 FECAMN O=C1NC(=S)N(c2ccc(F)cc2)C(=O)/C1=C/c1ccc2c(c1)OCO2 ZINC000001213542 132381152 /nfs/dbraw/zinc/38/11/52/132381152.db2.gz QYVDCJXFYUVUGI-NTUHNPAUSA-N 0 1 370.361 2.386 50 10 FECAMN N[C@H](C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1 ZINC000238025122 548872510 /nfs/dbraw/zinc/87/25/10/548872510.db2.gz GNYYUXOOEDCPGP-IBGZPJMESA-N 0 1 357.429 2.103 50 10 FECAMN CN(C)c1ccc([C@@H](CNS(=O)(=O)c2ccc(F)cc2)N(C)C)cc1 ZINC000005098867 204192049 /nfs/dbraw/zinc/19/20/49/204192049.db2.gz ZFELMEUJTRQIRS-GOSISDBHSA-N 0 1 365.474 2.473 50 10 FECAMN COc1cc(/C=C2\C(=O)NC(=S)N(c3ccc(F)cc3)C2=O)ccc1O ZINC000001201341 132380953 /nfs/dbraw/zinc/38/09/53/132380953.db2.gz VOCYPJOMHFBTPA-MDWZMJQESA-N 0 1 372.377 2.371 50 10 FECAMN COc1cc(/C=C2/C(=O)NC(=O)N(Cc3ccc(F)cc3)C2=O)ccc1O ZINC000015659301 539621256 /nfs/dbraw/zinc/62/12/56/539621256.db2.gz DNQKMVGMEMHWFK-ZSOIEALJSA-N 0 1 370.336 2.202 50 10 FECAMN COc1cc(C=C2C(=O)NC(=O)NC2=O)ccc1OCc1ccccc1F ZINC000004662631 204152442 /nfs/dbraw/zinc/15/24/42/204152442.db2.gz HSQWROUJNLWWMS-UHFFFAOYSA-N 0 1 370.336 2.163 50 10 FECAMN COc1ccc(CN2C(=O)NC(=O)/C(=C/c3ccc(F)cc3)C2=O)cc1 ZINC000004844219 204169206 /nfs/dbraw/zinc/16/92/06/204169206.db2.gz ULEAHZRFUXGMDE-YBEGLDIGSA-N 0 1 354.337 2.496 50 10 FECAMN CCOc1ccc2ccc(OCC)c(C=C3C(=O)NC(=O)NC3=O)c2c1 ZINC000005112902 206239297 /nfs/dbraw/zinc/23/92/97/206239297.db2.gz XRBVTFWFSLKUMH-UHFFFAOYSA-N 0 1 354.362 2.387 50 10 FECAMN COc1cc(/C=C2/C(=O)NC(=S)N(c3ccccc3)C2=O)ccc1O ZINC000001225798 132381373 /nfs/dbraw/zinc/38/13/73/132381373.db2.gz OLHYRNAWSVFKTH-LCYFTJDESA-N 0 1 354.387 2.232 50 10 FECAMN CCOC(=O)c1ccc(N2NC(=O)/C(=C/c3ccc(C=O)cc3)C2=O)cc1 ZINC000005009745 539399519 /nfs/dbraw/zinc/39/95/19/539399519.db2.gz OPDXGUBLOZRTNF-BOPFTXTBSA-N 0 1 364.357 2.137 50 10 FECAMN COc1cc(C)c(/C=C2/C(=O)NC(=O)N(C3CCCC3)C2=O)cc1OC ZINC000013546914 539587486 /nfs/dbraw/zinc/58/74/86/539587486.db2.gz MUIQLMHKYMTGGE-ZROIWOOFSA-N 0 1 358.394 2.417 50 10 FECAMN O=C1NC(=O)C(=CN=c2[nH]c3c(cc(Cl)cc3Cl)s2)C(=O)N1 ZINC000013999611 539593332 /nfs/dbraw/zinc/59/33/32/539593332.db2.gz CCXIBQRUCRTMQA-UHFFFAOYSA-N 0 1 357.178 2.265 50 10 FECAMN COc1cc(C=C2C(=O)NC(=O)N(Cc3ccc(F)cc3)C2=O)ccc1O ZINC000016996422 539638341 /nfs/dbraw/zinc/63/83/41/539638341.db2.gz DNQKMVGMEMHWFK-RIYZIHGNSA-N 0 1 370.336 2.406 50 10 FECAMN NC(=O)CN1c2ccccc2C(=O)N[C@H]1c1cc(Cl)cc(Cl)c1O ZINC000032907226 539958891 /nfs/dbraw/zinc/95/88/91/539958891.db2.gz CZUKNEADEAXSCE-OAHLLOKOSA-N 0 1 366.204 2.433 50 10 FECAMN CC(C)CNC(=O)c1coc(CN2CCN(Cc3ccccc3O)CC2)n1 ZINC000034677926 539976983 /nfs/dbraw/zinc/97/69/83/539976983.db2.gz YWMCCXAQTVFMGI-UHFFFAOYSA-N 0 1 372.469 2.084 50 10 FECAMN CCN(CC(=O)Nc1ccc(C(N)=O)cc1)Cc1ccc(N(C)C)cc1 ZINC000007362276 204295007 /nfs/dbraw/zinc/29/50/07/204295007.db2.gz BVSSVHFBELURML-UHFFFAOYSA-N 0 1 354.454 2.312 50 10 FECAMN CN(C)CCCNc1cc(N(C)C)c(N)c2c1C(=O)c1ccccc1C2=O ZINC000006664074 204260101 /nfs/dbraw/zinc/26/01/01/204260101.db2.gz XSBFUTLHHLNOQN-UHFFFAOYSA-N 0 1 366.465 2.474 50 10 FECAMN COc1ccc(N2CCN(C[C@@H](O)COCc3ccccc3)CC2)cc1 ZINC000004819455 536698298 /nfs/dbraw/zinc/69/82/98/536698298.db2.gz VENMRPDCDJMAPA-HXUWFJFHSA-N 0 1 356.466 2.395 50 10 FECAMN O=C(Oc1cccc(C=C2C(=O)NC(=O)NC2=O)c1)c1ccc(Cl)cc1 ZINC000001178278 539340270 /nfs/dbraw/zinc/34/02/70/539340270.db2.gz KSMGUZXVVKDMIW-UHFFFAOYSA-N 0 1 370.748 2.309 50 10 FECAMN COc1ccc(/C=C2\C(=O)NC(=S)N(c3cccc(F)c3)C2=O)cc1O ZINC000004689788 539390074 /nfs/dbraw/zinc/39/00/74/539390074.db2.gz MDHSRDYBVXITEE-NTUHNPAUSA-N 0 1 372.377 2.371 50 10 FECAMN C[C@@H]1C[N@@H+](Cc2c([O-])c(C(=O)N3CCOCC3)cc3ccccc32)CCO1 ZINC000024529068 539734212 /nfs/dbraw/zinc/73/42/12/539734212.db2.gz GKKTZVIAJAOIMJ-OAHLLOKOSA-N 0 1 370.449 2.239 50 10 FECAMN CN(C)c1ccc([C@@H](CNS(=O)(=O)c2cccc(F)c2)N(C)C)cc1 ZINC000005098865 207080620 /nfs/dbraw/zinc/08/06/20/207080620.db2.gz MSBPIIYKYQWCOZ-GOSISDBHSA-N 0 1 365.474 2.473 50 10 FECAMN COc1ccc(N2CCN(C(=O)CCc3nc(C)n[nH]3)CC2(C)C)cc1 ZINC000082127196 524410313 /nfs/dbraw/zinc/41/03/13/524410313.db2.gz GTGDDFRGXCTUIR-UHFFFAOYSA-N 0 1 357.458 2.182 50 10 FECAMN COc1ccc(N2CCN(C[C@@H](O)COc3ccc(F)cc3)CC2)cc1 ZINC000096247517 536698393 /nfs/dbraw/zinc/69/83/93/536698393.db2.gz FROCJPCVVLSGOK-GOSISDBHSA-N 0 1 360.429 2.396 50 10 FECAMN O=C1NC(=O)N(CCC2=CCCCC2)C(=O)C1=CNNc1ccccc1 ZINC000009348889 539501460 /nfs/dbraw/zinc/50/14/60/539501460.db2.gz RFBAOUTWWCCJEL-SSZFMOIBSA-N 0 1 354.410 2.456 50 10 FECAMN COc1ccc(/C=C2/C(=O)NC(=O)N(C3CCCC3)C2=O)c(OC)c1OC ZINC000013546924 539587435 /nfs/dbraw/zinc/58/74/35/539587435.db2.gz LEOLGDYFNZRPQO-RAXLEYEMSA-N 0 1 374.393 2.117 50 10 FECAMN CCOC(=O)c1ccc(-n2c(C)cc(/C=C3\NC(=O)NC3=O)c2C)cc1 ZINC000013616244 220079202 /nfs/dbraw/zinc/07/92/02/220079202.db2.gz CBVIOULWOANZLY-YBEGLDIGSA-N 0 1 353.378 2.451 50 10 FECAMN COc1ccc(OC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1 ZINC000085842852 524968398 /nfs/dbraw/zinc/96/83/98/524968398.db2.gz WEWPOVMBXFAXAC-SFHVURJKSA-N 0 1 372.465 2.266 50 10 FECAMN CN1CCN(c2ccc(CNS(=O)(=O)Cc3ccccc3)cc2)CC1 ZINC000004362638 539383934 /nfs/dbraw/zinc/38/39/34/539383934.db2.gz IWHWEPQDOVUNNC-UHFFFAOYSA-N 0 1 359.495 2.058 50 10 FECAMN COc1cc(/C=C2/C(=O)NC(=O)N(C3CCCCC3)C2=O)cc(OC)c1O ZINC000013773545 539591451 /nfs/dbraw/zinc/59/14/51/539591451.db2.gz MOHSTXXHCFRVMG-JYRVWZFOSA-N 0 1 374.393 2.204 50 10 FECAMN COc1ccc(N2C(=O)C(=CNc3cccc(N)c3)C(=O)NC2=S)cc1 ZINC000018206055 539647812 /nfs/dbraw/zinc/64/78/12/539647812.db2.gz ZADVNOWIKIHMGP-XNTDXEJSSA-N 0 1 368.418 2.021 50 10 FECAMN COc1cc(OC)cc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)c1 ZINC000049740632 540393263 /nfs/dbraw/zinc/39/32/63/540393263.db2.gz KTWJLPDNOXJWIK-UHFFFAOYSA-N 0 1 369.465 2.386 50 10 FECAMN COc1ccc(NC=C2C(=O)NC(=S)N(c3ccccc3)C2=O)cc1 ZINC000003005607 536655874 /nfs/dbraw/zinc/65/58/74/536655874.db2.gz APUMJPMIBLFJHG-RVDMUPIBSA-N 0 1 353.403 2.439 50 10 FECAMN Cc1ccc(N2C(=O)/C(=C\c3ccccc3O)C(=O)NC2=S)c(O)c1 ZINC000210991246 548666919 /nfs/dbraw/zinc/66/69/19/548666919.db2.gz NQBGCTUKNJVEAL-XFXZXTDPSA-N 0 1 354.387 2.238 50 10 FECAMN CC1=NC(=O)N[C@@H](c2ccc(N(C)C)cc2)C1C(=O)OC[C@@H]1CCCO1 ZINC000000853853 539335021 /nfs/dbraw/zinc/33/50/21/539335021.db2.gz WLWMCQUPJCQUJY-RDJZCZTQSA-N 0 1 359.426 2.103 50 10 biogenic FECAMN CCOC(=O)c1ccc(N2NC(=O)/C(=C/c3ccc(O)cc3)C2=O)cc1 ZINC000005009925 207071476 /nfs/dbraw/zinc/07/14/76/207071476.db2.gz NZXSGALZXYZUSH-WJDWOHSUSA-N 0 1 352.346 2.030 50 10 FECAMN COc1ccc(N2CCN(CCNc3ncnc4onc(C)c43)CC2)cc1 ZINC000020575160 524427620 /nfs/dbraw/zinc/42/76/20/524427620.db2.gz RKPVTFBYIPTABR-UHFFFAOYSA-N 0 1 368.441 2.169 50 10 FECAMN Cc1ccc(OCC(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1 ZINC000049740660 540393063 /nfs/dbraw/zinc/39/30/63/540393063.db2.gz FGNTVAMBKITEEU-UHFFFAOYSA-N 0 1 353.466 2.442 50 10 FECAMN CCOc1cc2c(cc1/C=C1/C(=O)NN(c3ccccc3)C1=O)OCO2 ZINC000004815337 207051730 /nfs/dbraw/zinc/05/17/30/207051730.db2.gz UYMHVXYDTPRKCV-ZSOIEALJSA-N 0 1 352.346 2.275 50 10 FECAMN COc1ccc(N2CCN(C[C@H](O)COCc3ccccc3)CC2)cc1 ZINC000004819454 132375028 /nfs/dbraw/zinc/37/50/28/132375028.db2.gz VENMRPDCDJMAPA-FQEVSTJZSA-N 0 1 356.466 2.395 50 10 FECAMN O=C1NC(=S)N(c2ccc(F)cc2)C(=O)C1=CNCc1ccc(F)cc1 ZINC000002892869 132384312 /nfs/dbraw/zinc/38/43/12/132384312.db2.gz JHYORHOKVUVVHM-GDNBJRDFSA-N 0 1 373.384 2.386 50 10 FECAMN CC/C(C)=C1\C(=O)NN(c2ccc(I)cc2)C1=O ZINC000000824593 539334328 /nfs/dbraw/zinc/33/43/28/539334328.db2.gz ITQYGYQVGRSENS-DHZHZOJOSA-N 0 1 356.163 2.396 50 10 FECAMN COc1cc(C=C2C(=O)NC(=O)NC2=O)ccc1OCc1ccccc1 ZINC000003208894 539361030 /nfs/dbraw/zinc/36/10/30/539361030.db2.gz IXHLBDPSFLWTFZ-UHFFFAOYSA-N 0 1 352.346 2.024 50 10 FECAMN Cc1cccc(OCC(=O)NCc2ccc(N3CCN(C)CC3)cc2)c1 ZINC000065365746 541235216 /nfs/dbraw/zinc/23/52/16/541235216.db2.gz QZDTZISQFWZMMN-UHFFFAOYSA-N 0 1 353.466 2.442 50 10 FECAMN COc1ccc(OCC(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1 ZINC000067601974 541487424 /nfs/dbraw/zinc/48/74/24/541487424.db2.gz UMOYKSHSHLPHHH-UHFFFAOYSA-N 0 1 369.465 2.142 50 10 FECAMN COc1ccccc1NC=C1C(=O)NC(=O)N(Cc2ccc(F)cc2)C1=O ZINC000100401362 209213694 /nfs/dbraw/zinc/21/36/94/209213694.db2.gz XBSOXRDESFHUQQ-UVTDQMKNSA-N 0 1 369.352 2.409 50 10 FECAMN CCOC(=O)c1ccc(N2NC(=O)/C(=C\c3cc(C)[nH]c3C)C2=O)cc1 ZINC000096234415 209142322 /nfs/dbraw/zinc/14/23/22/209142322.db2.gz KBSMRKSLCGYUDF-MHWRWJLKSA-N 0 1 353.378 2.270 50 10 FECAMN COc1ccc(N2CCN([C@H]3CCCN(C(=O)c4ccc[nH]4)C3)CC2)cc1 ZINC000072135521 136142564 /nfs/dbraw/zinc/14/25/64/136142564.db2.gz VGHBETNUZNHFQQ-SFHVURJKSA-N 0 1 368.481 2.450 50 10 FECAMN O=C(Oc1ccc(C=C2C(=O)NC(=O)NC2=O)cc1)c1ccc(Cl)cc1 ZINC000002950282 539356503 /nfs/dbraw/zinc/35/65/03/539356503.db2.gz ZQWRXWDDUSKASY-UHFFFAOYSA-N 0 1 370.748 2.309 50 10 FECAMN COc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)ccc1OC(C)=O ZINC000016667327 539636068 /nfs/dbraw/zinc/63/60/68/539636068.db2.gz JMGONLFHAQXGRJ-GDNBJRDFSA-N 0 1 352.346 2.082 50 10 FECAMN CN1C(=O)NC(=O)/C(=C\c2ccc(Oc3ccc([N+](=O)[O-])cc3)cc2)C1=O ZINC000006178497 539422780 /nfs/dbraw/zinc/42/27/80/539422780.db2.gz OAZWVCVJUCZDQR-XNTDXEJSSA-N 0 1 367.317 2.479 50 10 FECAMN CC1=NN(c2nn[nH]n2)C(=O)C1=Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000012412876 539558549 /nfs/dbraw/zinc/55/85/49/539558549.db2.gz JICSPTLUWOCIQH-JYRVWZFOSA-N 0 1 365.309 2.174 50 10 FECAMN Cc1ccc(-c2nn(-c3ccccc3)cc2C=C2C(=O)NC(=O)NC2=O)o1 ZINC000001189950 219387861 /nfs/dbraw/zinc/38/78/61/219387861.db2.gz KTMRXDRNSARYLN-UHFFFAOYSA-N 0 1 362.345 2.190 50 10 FECAMN CCC(=O)Oc1ccc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1OC ZINC000015658677 211134260 /nfs/dbraw/zinc/13/42/60/211134260.db2.gz ONWOTPSZWGMRPP-PTNGSMBKSA-N 0 1 366.373 2.472 50 10 FECAMN CN(C)c1ccc(/C=C2/C(=O)NC(=S)N(c3ccccc3F)C2=O)o1 ZINC000012363831 539556118 /nfs/dbraw/zinc/55/61/18/539556118.db2.gz DBHKABLYSCQSMV-LUAWRHEFSA-N 0 1 359.382 2.316 50 10 FECAMN COc1ccccc1/C=C1/C(=O)NC(=O)N(Cc2ccc(F)cc2)C1=O ZINC000015276807 211126101 /nfs/dbraw/zinc/12/61/01/211126101.db2.gz GPWIRYNJWOERIT-GDNBJRDFSA-N 0 1 354.337 2.496 50 10 FECAMN COC(=O)c1cccc(-n2c(C)cc(/C=C3/NC(=O)NC3=O)c2C)c1C ZINC000001143468 210324837 /nfs/dbraw/zinc/32/48/37/210324837.db2.gz USWWGAVITKLWJP-OQLLNIDSSA-N 0 1 353.378 2.369 50 10 FECAMN COc1ccc(N2CCN(C[C@H](O)COc3ccccc3OC)CC2)cc1 ZINC000020819120 524426052 /nfs/dbraw/zinc/42/60/52/524426052.db2.gz YCSQACHRPANRIW-SFHVURJKSA-N 0 1 372.465 2.266 50 10 FECAMN COC(=O)c1ccc(-n2c(C)cc(C=C3C(=O)NC(=O)NC3=O)c2C)cc1 ZINC000008997665 539495416 /nfs/dbraw/zinc/49/54/16/539495416.db2.gz AIVXBELFIBHDHX-UHFFFAOYSA-N 0 1 367.361 2.470 50 10 FECAMN CCOc1ccc(N2C(=O)/C(=C/c3cccn3C)C(=O)NC2=S)cc1 ZINC000001156555 132380488 /nfs/dbraw/zinc/38/04/88/132380488.db2.gz RPCCIFNWBDJZNG-RVDMUPIBSA-N 0 1 355.419 2.255 50 10 FECAMN COc1ccccc1/C=C1\SC(=S)N(CN2CCN(C)CC2)C1=O ZINC000334160701 210162844 /nfs/dbraw/zinc/16/28/44/210162844.db2.gz KMHWWHVJVSRVBX-PTNGSMBKSA-N 0 1 363.508 2.101 50 10 FECAMN COc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(C)C3=O)c2C)cc1 ZINC000001174855 210328926 /nfs/dbraw/zinc/32/89/26/210328926.db2.gz BPSWKRGMOOWQSO-MHWRWJLKSA-N 0 1 353.378 2.194 50 10 FECAMN CC1=NC(=O)N[C@H](c2ccc(N(C)C)cc2)C1C(=O)OCC(F)(F)F ZINC000001082106 210314943 /nfs/dbraw/zinc/31/49/43/210314943.db2.gz MZBWHKZADWPWEA-CYBMUJFWSA-N 0 1 357.332 2.486 50 10 FECAMN COc1cccc(OCC(=O)NCc2ccc(N3CCN(C)CC3)cc2)c1 ZINC000065363977 221203665 /nfs/dbraw/zinc/20/36/65/221203665.db2.gz FZZQMPFRTQMWEP-UHFFFAOYSA-N 0 1 369.465 2.142 50 10 FECAMN CCOc1ccc(N2C(=O)C(=CNN3CCCCC3)C(=O)NC2=S)cc1 ZINC000006784047 132835185 /nfs/dbraw/zinc/83/51/85/132835185.db2.gz 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