smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H](N[C@@H]1CC2(CCCC2)Oc2ccccc21)c1ccco1 ZINC000160218897 327658185 /nfs/dbraw/zinc/65/81/85/327658185.db2.gz NLGFTFNCXTVGHT-GOEBONIOSA-N 0 0 297.398 4.767 10 70 CJIERN C[C@@H](N[C@@H]1CC2(CCCC2)Oc2ccccc21)c1ccco1 ZINC000160219028 327658143 /nfs/dbraw/zinc/65/81/43/327658143.db2.gz NLGFTFNCXTVGHT-GDBMZVCRSA-N 0 0 297.398 4.767 10 70 CJIERN Cc1ccc2ccccc2c1C(=O)c1ccc(F)cc1 ZINC000160813048 188492086 /nfs/dbraw/zinc/49/20/86/188492086.db2.gz SQKPLYYIXYNABP-UHFFFAOYSA-N 0 0 264.299 4.518 10 70 CJIERN CCc1ccc(C(=O)c2c(C)ccc3ccccc32)cc1 ZINC000160827960 188493839 /nfs/dbraw/zinc/49/38/39/188493839.db2.gz DDQXRXPZLYYRTB-UHFFFAOYSA-N 0 0 274.363 4.942 10 70 CJIERN Cc1ccc2ccccc2c1C(=O)c1ccccc1F ZINC000160829292 188493021 /nfs/dbraw/zinc/49/30/21/188493021.db2.gz POWZTKKMIMGBFA-UHFFFAOYSA-N 0 0 264.299 4.518 10 70 CJIERN