smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[NH2+]CC[NH2+]Cc1ccc(C)c(C)c1 ZINC000161297404 170115949 /nfs/dbraw/zinc/11/59/49/170115949.db2.gz CLRQTIIAHJGHRG-UHFFFAOYSA-N 2 2 206.333 2.003 20 70 BEIDLP CC[C@H]1CCC[N@H+](CCn2cc[nH+]c2)C1 ZINC000159722294 384351157 /nfs/dbraw/zinc/35/11/57/384351157.db2.gz UGZDMSKAZIVUNB-LBPRGKRZSA-N 2 2 207.321 2.005 20 70 BEIDLP CC[C@H]1CCC[N@@H+](CCn2cc[nH+]c2)C1 ZINC000159722294 384351164 /nfs/dbraw/zinc/35/11/64/384351164.db2.gz UGZDMSKAZIVUNB-LBPRGKRZSA-N 2 2 207.321 2.005 20 70 BEIDLP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1cnccn1 ZINC000161063402 384461620 /nfs/dbraw/zinc/46/16/20/384461620.db2.gz QQDSBLFLJQPERH-XQQFMLRXSA-N 2 2 248.374 2.000 20 70 BEIDLP CC[N@@H+]1CCCC[C@@H]1C[NH2+][C@@H](C)C(C)C ZINC000161170750 384864736 /nfs/dbraw/zinc/86/47/36/384864736.db2.gz NGSGKWJZYLBGOK-QWHCGFSZSA-N 2 2 212.381 2.495 20 70 BEIDLP CC[N@H+]1CCCC[C@@H]1C[NH2+][C@@H](C)C(C)C ZINC000161170750 384864742 /nfs/dbraw/zinc/86/47/42/384864742.db2.gz NGSGKWJZYLBGOK-QWHCGFSZSA-N 2 2 212.381 2.495 20 70 BEIDLP CC[N@H+](CCn1cc[nH+]c1)C1CCCC1 ZINC000159750945 384355221 /nfs/dbraw/zinc/35/52/21/384355221.db2.gz RNOXKMGIEGXYGJ-UHFFFAOYSA-N 2 2 207.321 2.148 20 70 BEIDLP CC[N@@H+](CCn1cc[nH+]c1)C1CCCC1 ZINC000159750945 384355224 /nfs/dbraw/zinc/35/52/24/384355224.db2.gz RNOXKMGIEGXYGJ-UHFFFAOYSA-N 2 2 207.321 2.148 20 70 BEIDLP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)c1cscn1 ZINC000161178345 384884434 /nfs/dbraw/zinc/88/44/34/384884434.db2.gz YBSZRLQZLWKSLI-ZJUUUORDSA-N 2 2 227.377 2.134 20 70 BEIDLP C[NH2+]CC[NH2+]Cc1ccc(C(C)C)cc1 ZINC000161266165 173356248 /nfs/dbraw/zinc/35/62/48/173356248.db2.gz BEWMOOUPJWEKPJ-UHFFFAOYSA-N 2 2 206.333 2.119 20 70 BEIDLP C[N@H+](CCn1cc[nH+]c1)CC1CCCC1 ZINC000161503681 384498097 /nfs/dbraw/zinc/49/80/97/384498097.db2.gz BYEIJEVWVLMZLT-UHFFFAOYSA-N 2 2 207.321 2.005 20 70 BEIDLP C[N@@H+](CCn1cc[nH+]c1)CC1CCCC1 ZINC000161503681 384498101 /nfs/dbraw/zinc/49/81/01/384498101.db2.gz BYEIJEVWVLMZLT-UHFFFAOYSA-N 2 2 207.321 2.005 20 70 BEIDLP C[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)c1cscn1 ZINC000161178455 384882278 /nfs/dbraw/zinc/88/22/78/384882278.db2.gz YBSZRLQZLWKSLI-VHSXEESVSA-N 2 2 227.377 2.134 20 70 BEIDLP CC[NH2+]CC[NH2+]Cc1ccc(CC)s1 ZINC000161298313 387185627 /nfs/dbraw/zinc/18/56/27/387185627.db2.gz DVBRVNDMRSLQDR-UHFFFAOYSA-N 2 2 212.362 2.010 20 70 BEIDLP CCC[NH2+]CC[NH2+]Cc1ccc(CC)s1 ZINC000161341339 343204808 /nfs/dbraw/zinc/20/48/08/343204808.db2.gz KWRMXWUJLXSLFD-UHFFFAOYSA-N 2 2 226.389 2.400 20 70 BEIDLP c1[nH+]c2c(n1CC[NH+]1CCCCC1)CCCC2 ZINC000160723123 349313180 /nfs/dbraw/zinc/31/31/80/349313180.db2.gz FOBJYJZWHSIXHS-UHFFFAOYSA-N 2 2 233.359 2.248 20 70 BEIDLP c1cn(CC[N@@H+]2CC[C@H](c3ccccc3)C2)c[nH+]1 ZINC000159783767 384354395 /nfs/dbraw/zinc/35/43/95/384354395.db2.gz KECQYCBUTQAQNZ-HNNXBMFYSA-N 2 2 241.338 2.373 20 70 BEIDLP c1cn(CC[N@H+]2CC[C@H](c3ccccc3)C2)c[nH+]1 ZINC000159783767 384354401 /nfs/dbraw/zinc/35/44/01/384354401.db2.gz KECQYCBUTQAQNZ-HNNXBMFYSA-N 2 2 241.338 2.373 20 70 BEIDLP c1cn(CC[N@@H+]2CC[C@@H](c3ccccc3)C2)c[nH+]1 ZINC000159783621 384356402 /nfs/dbraw/zinc/35/64/02/384356402.db2.gz KECQYCBUTQAQNZ-OAHLLOKOSA-N 2 2 241.338 2.373 20 70 BEIDLP c1cn(CC[N@H+]2CC[C@@H](c3ccccc3)C2)c[nH+]1 ZINC000159783621 384356409 /nfs/dbraw/zinc/35/64/09/384356409.db2.gz KECQYCBUTQAQNZ-OAHLLOKOSA-N 2 2 241.338 2.373 20 70 BEIDLP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)c1cscn1 ZINC000161178573 176626221 /nfs/dbraw/zinc/62/62/21/176626221.db2.gz YBSZRLQZLWKSLI-NXEZZACHSA-N 2 2 227.377 2.134 20 70 BEIDLP CC[NH2+]CC[NH2+]Cc1cc(C)ccc1C ZINC000161287141 170115754 /nfs/dbraw/zinc/11/57/54/170115754.db2.gz XXJLXUACZXBKPK-UHFFFAOYSA-N 2 2 206.333 2.003 20 70 BEIDLP CC[NH2+]CC[NH2+]Cc1ccc(Cl)cc1 ZINC000161286571 170115845 /nfs/dbraw/zinc/11/58/45/170115845.db2.gz BFJJZKWAHSNYJI-UHFFFAOYSA-N 2 2 212.724 2.039 20 70 BEIDLP C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1cnccn1 ZINC000161063638 384461456 /nfs/dbraw/zinc/46/14/56/384461456.db2.gz QQDSBLFLJQPERH-AVGNSLFASA-N 2 2 248.374 2.000 20 70 BEIDLP Cc1ccc(C[N@H+](C)C[C@@H]2CCC[NH+](C)C2)o1 ZINC000161289836 384478891 /nfs/dbraw/zinc/47/88/91/384478891.db2.gz BUWVMTGGUTXDLX-CYBMUJFWSA-N 2 2 236.359 2.362 20 70 BEIDLP Cc1ccc(C[N@@H+](C)C[C@@H]2CCC[NH+](C)C2)o1 ZINC000161289836 384478896 /nfs/dbraw/zinc/47/88/96/384478896.db2.gz BUWVMTGGUTXDLX-CYBMUJFWSA-N 2 2 236.359 2.362 20 70 BEIDLP Cc1ccc(C[NH+](C)C[C@@H]2CCC[N@H+](C)C2)o1 ZINC000161289836 384478900 /nfs/dbraw/zinc/47/89/00/384478900.db2.gz BUWVMTGGUTXDLX-CYBMUJFWSA-N 2 2 236.359 2.362 20 70 BEIDLP Cc1ccc(C[NH+](C)C[C@@H]2CCC[N@@H+](C)C2)o1 ZINC000161289836 384478904 /nfs/dbraw/zinc/47/89/04/384478904.db2.gz BUWVMTGGUTXDLX-CYBMUJFWSA-N 2 2 236.359 2.362 20 70 BEIDLP CC[NH2+]CC[NH2+]Cc1cc(C)cc(C)c1 ZINC000161312737 170115224 /nfs/dbraw/zinc/11/52/24/170115224.db2.gz KSPINNAMTSTTDE-UHFFFAOYSA-N 2 2 206.333 2.003 20 70 BEIDLP C[NH2+]CC[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC000161257677 173355909 /nfs/dbraw/zinc/35/59/09/173355909.db2.gz LAXPMLOXWGKFEP-UHFFFAOYSA-N 2 2 233.142 2.302 20 70 BEIDLP Cc1cc(N[C@@H]2CC[N@@H+]3CCCC[C@@H]23)nc(C)[nH+]1 ZINC000217362767 178182432 /nfs/dbraw/zinc/18/24/32/178182432.db2.gz XVCYZSTXYMINCH-OLZOCXBDSA-N 2 2 246.358 2.132 20 70 BEIDLP Cc1cc(N[C@@H]2CC[N@H+]3CCCC[C@@H]23)nc(C)[nH+]1 ZINC000217362767 178182437 /nfs/dbraw/zinc/18/24/37/178182437.db2.gz XVCYZSTXYMINCH-OLZOCXBDSA-N 2 2 246.358 2.132 20 70 BEIDLP CC[C@@H]1CCC[N@H+](CCn2cc[nH+]c2)C1 ZINC000159722171 346428829 /nfs/dbraw/zinc/42/88/29/346428829.db2.gz UGZDMSKAZIVUNB-GFCCVEGCSA-N 2 2 207.321 2.005 20 70 BEIDLP CC[C@@H]1CCC[N@@H+](CCn2cc[nH+]c2)C1 ZINC000159722171 346428831 /nfs/dbraw/zinc/42/88/31/346428831.db2.gz UGZDMSKAZIVUNB-GFCCVEGCSA-N 2 2 207.321 2.005 20 70 BEIDLP C[N@@H+](CCc1ccccc1)CCn1cc[nH+]c1 ZINC000161421056 384488746 /nfs/dbraw/zinc/48/87/46/384488746.db2.gz ZQQWEBPVSNEXGG-UHFFFAOYSA-N 2 2 229.327 2.058 20 70 BEIDLP C[N@H+](CCc1ccccc1)CCn1cc[nH+]c1 ZINC000161421056 384488754 /nfs/dbraw/zinc/48/87/54/384488754.db2.gz ZQQWEBPVSNEXGG-UHFFFAOYSA-N 2 2 229.327 2.058 20 70 BEIDLP CC(C)(C)[NH2+]CC[NH2+]CCc1cccs1 ZINC000161441422 386031730 /nfs/dbraw/zinc/03/17/30/386031730.db2.gz NRWHUKXWLULGEX-UHFFFAOYSA-N 2 2 226.389 2.268 20 70 BEIDLP CC[NH2+]CC[NH2+]Cc1ccc(C)c(Cl)c1 ZINC000161308270 170115604 /nfs/dbraw/zinc/11/56/04/170115604.db2.gz XLFAGTURCWZVHJ-UHFFFAOYSA-N 2 2 226.751 2.348 20 70 BEIDLP Cc1cc(N[C@H]2CC[N@@H+]3CCCC[C@@H]23)nc(C)[nH+]1 ZINC000217362835 178190970 /nfs/dbraw/zinc/19/09/70/178190970.db2.gz XVCYZSTXYMINCH-STQMWFEESA-N 2 2 246.358 2.132 20 70 BEIDLP Cc1cc(N[C@H]2CC[N@H+]3CCCC[C@@H]23)nc(C)[nH+]1 ZINC000217362835 178190973 /nfs/dbraw/zinc/19/09/73/178190973.db2.gz XVCYZSTXYMINCH-STQMWFEESA-N 2 2 246.358 2.132 20 70 BEIDLP CCC[NH2+]CC[NH2+]Cc1cccc(Cl)c1 ZINC000161342972 169259761 /nfs/dbraw/zinc/25/97/61/169259761.db2.gz RHAFZGFCAFXDHE-UHFFFAOYSA-N 2 2 226.751 2.429 20 70 BEIDLP Cc1ccc(C[N@H+](C)C[C@H]2CCC[NH+](C)C2)o1 ZINC000161289966 384480477 /nfs/dbraw/zinc/48/04/77/384480477.db2.gz BUWVMTGGUTXDLX-ZDUSSCGKSA-N 2 2 236.359 2.362 20 70 BEIDLP Cc1ccc(C[N@@H+](C)C[C@H]2CCC[NH+](C)C2)o1 ZINC000161289966 384480480 /nfs/dbraw/zinc/48/04/80/384480480.db2.gz BUWVMTGGUTXDLX-ZDUSSCGKSA-N 2 2 236.359 2.362 20 70 BEIDLP Cc1ccc(C[NH+](C)C[C@H]2CCC[N@H+](C)C2)o1 ZINC000161289966 384480483 /nfs/dbraw/zinc/48/04/83/384480483.db2.gz BUWVMTGGUTXDLX-ZDUSSCGKSA-N 2 2 236.359 2.362 20 70 BEIDLP Cc1ccc(C[NH+](C)C[C@H]2CCC[N@@H+](C)C2)o1 ZINC000161289966 384480485 /nfs/dbraw/zinc/48/04/85/384480485.db2.gz BUWVMTGGUTXDLX-ZDUSSCGKSA-N 2 2 236.359 2.362 20 70 BEIDLP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)c1cscn1 ZINC000161178232 384885177 /nfs/dbraw/zinc/88/51/77/384885177.db2.gz YBSZRLQZLWKSLI-UWVGGRQHSA-N 2 2 227.377 2.134 20 70 BEIDLP CC[NH2+]CC[NH2+]Cc1cccc(C)c1C ZINC000161287283 170115662 /nfs/dbraw/zinc/11/56/62/170115662.db2.gz WRQPHTMKZSPDNP-UHFFFAOYSA-N 2 2 206.333 2.003 20 70 BEIDLP CC[N@@H+]1CCCC[C@H]1C[NH2+][C@@H](COC)C(C)C ZINC000161199061 346479587 /nfs/dbraw/zinc/47/95/87/346479587.db2.gz FEWPJTRIXNVPAI-KBPBESRZSA-N 2 2 242.407 2.121 20 70 BEIDLP CC[N@H+]1CCCC[C@H]1C[NH2+][C@@H](COC)C(C)C ZINC000161199061 346479592 /nfs/dbraw/zinc/47/95/92/346479592.db2.gz FEWPJTRIXNVPAI-KBPBESRZSA-N 2 2 242.407 2.121 20 70 BEIDLP CC[N@@H+]1CCCC[C@@H]1C[NH2+][C@@H](COC)C(C)C ZINC000161198933 349409606 /nfs/dbraw/zinc/40/96/06/349409606.db2.gz FEWPJTRIXNVPAI-KGLIPLIRSA-N 2 2 242.407 2.121 20 70 BEIDLP CC[N@H+]1CCCC[C@@H]1C[NH2+][C@@H](COC)C(C)C ZINC000161198933 349409609 /nfs/dbraw/zinc/40/96/09/349409609.db2.gz FEWPJTRIXNVPAI-KGLIPLIRSA-N 2 2 242.407 2.121 20 70 BEIDLP C[N@@H+](CCc1ccc(F)cc1)CCn1cc[nH+]c1 ZINC000161452655 384491142 /nfs/dbraw/zinc/49/11/42/384491142.db2.gz LNUZRXFNNLZQAY-UHFFFAOYSA-N 2 2 247.317 2.197 20 70 BEIDLP C[N@H+](CCc1ccc(F)cc1)CCn1cc[nH+]c1 ZINC000161452655 384491150 /nfs/dbraw/zinc/49/11/50/384491150.db2.gz LNUZRXFNNLZQAY-UHFFFAOYSA-N 2 2 247.317 2.197 20 70 BEIDLP CCC[NH2+]CC[NH2+]Cc1ccccc1C ZINC000161358515 169259336 /nfs/dbraw/zinc/25/93/36/169259336.db2.gz JUJUIIGTPBFTSR-UHFFFAOYSA-N 2 2 206.333 2.084 20 70 BEIDLP C[N@H+](CC[C@H]1CCC[NH+]1C)Cc1ccco1 ZINC000161292242 384480850 /nfs/dbraw/zinc/48/08/50/384480850.db2.gz YAVBXJOWCZIJRT-GFCCVEGCSA-N 2 2 222.332 2.196 20 70 BEIDLP C[N@@H+](CC[C@H]1CCC[NH+]1C)Cc1ccco1 ZINC000161292242 384480857 /nfs/dbraw/zinc/48/08/57/384480857.db2.gz YAVBXJOWCZIJRT-GFCCVEGCSA-N 2 2 222.332 2.196 20 70 BEIDLP C[NH+](CC[C@H]1CCC[N@@H+]1C)Cc1ccco1 ZINC000161292242 384480861 /nfs/dbraw/zinc/48/08/61/384480861.db2.gz YAVBXJOWCZIJRT-GFCCVEGCSA-N 2 2 222.332 2.196 20 70 BEIDLP C[NH+](CC[C@H]1CCC[N@H+]1C)Cc1ccco1 ZINC000161292242 384480866 /nfs/dbraw/zinc/48/08/66/384480866.db2.gz YAVBXJOWCZIJRT-GFCCVEGCSA-N 2 2 222.332 2.196 20 70 BEIDLP C[C@H](c1ccco1)[N@H+](C)CCn1cc[nH+]c1 ZINC000161500324 177047873 /nfs/dbraw/zinc/04/78/73/177047873.db2.gz WNUYPMSACGBIKE-LLVKDONJSA-N 2 2 219.288 2.169 20 70 BEIDLP C[C@H](c1ccco1)[N@@H+](C)CCn1cc[nH+]c1 ZINC000161500324 177047875 /nfs/dbraw/zinc/04/78/75/177047875.db2.gz WNUYPMSACGBIKE-LLVKDONJSA-N 2 2 219.288 2.169 20 70 BEIDLP CCC[NH2+]CC[NH2+]Cc1ccc(Cl)cc1 ZINC000161332634 169259186 /nfs/dbraw/zinc/25/91/86/169259186.db2.gz MPZVJDOGNICWDL-UHFFFAOYSA-N 2 2 226.751 2.429 20 70 BEIDLP C[C@@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1cnccn1 ZINC000161063520 384460327 /nfs/dbraw/zinc/46/03/27/384460327.db2.gz QQDSBLFLJQPERH-UPJWGTAASA-N 2 2 248.374 2.000 20 70 BEIDLP CC[NH2+]CC[NH2+]Cc1ccc(F)c(Cl)c1 ZINC000161311302 170115879 /nfs/dbraw/zinc/11/58/79/170115879.db2.gz OJZISNUMCZNQRK-UHFFFAOYSA-N 2 2 230.714 2.178 20 70 BEIDLP C[C@@H](c1ccco1)[N@H+](C)CCn1cc[nH+]c1 ZINC000161500218 176031128 /nfs/dbraw/zinc/03/11/28/176031128.db2.gz WNUYPMSACGBIKE-NSHDSACASA-N 2 2 219.288 2.169 20 70 BEIDLP C[C@@H](c1ccco1)[N@@H+](C)CCn1cc[nH+]c1 ZINC000161500218 176031129 /nfs/dbraw/zinc/03/11/29/176031129.db2.gz WNUYPMSACGBIKE-NSHDSACASA-N 2 2 219.288 2.169 20 70 BEIDLP CCC[NH2+]CC[NH2+]Cc1cccc(C)c1 ZINC000161363933 169258990 /nfs/dbraw/zinc/25/89/90/169258990.db2.gz RUUSDXIAJTVLCX-UHFFFAOYSA-N 2 2 206.333 2.084 20 70 BEIDLP C[C@@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1cnccn1 ZINC000161063759 384461812 /nfs/dbraw/zinc/46/18/12/384461812.db2.gz QQDSBLFLJQPERH-AGIUHOORSA-N 2 2 248.374 2.000 20 70 BEIDLP CC[N@@H+]1CCCC[C@H]1C[NH2+][C@@H](C)C(C)C ZINC000161170856 384865680 /nfs/dbraw/zinc/86/56/80/384865680.db2.gz NGSGKWJZYLBGOK-STQMWFEESA-N 2 2 212.381 2.495 20 70 BEIDLP CC[N@H+]1CCCC[C@H]1C[NH2+][C@@H](C)C(C)C ZINC000161170856 384865687 /nfs/dbraw/zinc/86/56/87/384865687.db2.gz NGSGKWJZYLBGOK-STQMWFEESA-N 2 2 212.381 2.495 20 70 BEIDLP CC[NH2+]CC[NH2+]Cc1ccc(Cl)c(C)c1 ZINC000161292511 170115779 /nfs/dbraw/zinc/11/57/79/170115779.db2.gz FELJJHRUQIJJBB-UHFFFAOYSA-N 2 2 226.751 2.348 20 70 BEIDLP CC[NH2+]CC[NH2+]Cc1ccc(C)cc1C ZINC000161313167 170115568 /nfs/dbraw/zinc/11/55/68/170115568.db2.gz IJOMXTSUKOVBKG-UHFFFAOYSA-N 2 2 206.333 2.003 20 70 BEIDLP C[N@H+](CC[C@@H]1CCC[NH+]1C)Cc1ccco1 ZINC000161292344 384478817 /nfs/dbraw/zinc/47/88/17/384478817.db2.gz YAVBXJOWCZIJRT-LBPRGKRZSA-N 2 2 222.332 2.196 20 70 BEIDLP C[N@@H+](CC[C@@H]1CCC[NH+]1C)Cc1ccco1 ZINC000161292344 384478824 /nfs/dbraw/zinc/47/88/24/384478824.db2.gz YAVBXJOWCZIJRT-LBPRGKRZSA-N 2 2 222.332 2.196 20 70 BEIDLP C[NH+](CC[C@@H]1CCC[N@@H+]1C)Cc1ccco1 ZINC000161292344 384478827 /nfs/dbraw/zinc/47/88/27/384478827.db2.gz YAVBXJOWCZIJRT-LBPRGKRZSA-N 2 2 222.332 2.196 20 70 BEIDLP C[NH+](CC[C@@H]1CCC[N@H+]1C)Cc1ccco1 ZINC000161292344 384478833 /nfs/dbraw/zinc/47/88/33/384478833.db2.gz YAVBXJOWCZIJRT-LBPRGKRZSA-N 2 2 222.332 2.196 20 70 BEIDLP CC[NH2+]CC[NH2+]Cc1ccc(SC)cc1 ZINC000161289628 170115558 /nfs/dbraw/zinc/11/55/58/170115558.db2.gz ZRAHMSONTHYXAI-UHFFFAOYSA-N 2 2 224.373 2.108 20 70 BEIDLP C[NH2+]CC[NH2+]Cc1csc2ccccc12 ZINC000161253777 173355995 /nfs/dbraw/zinc/35/59/95/173355995.db2.gz GRHNKSKPHLSGRG-UHFFFAOYSA-N 2 2 220.341 2.210 20 70 BEIDLP C[N@H+](CCC[NH+]1CCCCC1)Cc1cccnc1 ZINC000161455379 349453150 /nfs/dbraw/zinc/45/31/50/349453150.db2.gz ZFIGIOQADWVVMQ-UHFFFAOYSA-N 2 2 247.386 2.389 20 70 BEIDLP C[N@@H+](CCC[NH+]1CCCCC1)Cc1cccnc1 ZINC000161455379 349453154 /nfs/dbraw/zinc/45/31/54/349453154.db2.gz ZFIGIOQADWVVMQ-UHFFFAOYSA-N 2 2 247.386 2.389 20 70 BEIDLP c1cn(CC[N@H+](C2CC2)C2CCCC2)c[nH+]1 ZINC000161378189 387196567 /nfs/dbraw/zinc/19/65/67/387196567.db2.gz BIVOFOLAPWDSTM-UHFFFAOYSA-N 2 2 219.332 2.290 20 70 BEIDLP c1cn(CC[N@@H+](C2CC2)C2CCCC2)c[nH+]1 ZINC000161378189 387196574 /nfs/dbraw/zinc/19/65/74/387196574.db2.gz BIVOFOLAPWDSTM-UHFFFAOYSA-N 2 2 219.332 2.290 20 70 BEIDLP