smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Oc1c(Cl)cc(Cl)cc1C[NH2+]Cc1ccc(Br)s1 ZINC000038018503 205038217 /nfs/dbraw/zinc/03/82/17/205038217.db2.gz HTZMGEHPIHSZFL-UHFFFAOYSA-N 1 2 367.095 4.813 20 10 FJCDLO C[C@H]([NH2+][C@H]1C[C@@H](CO)c2ccccc21)c1ccc(Cl)c(Cl)c1O ZINC000365293671 568434971 /nfs/dbraw/zinc/43/49/71/568434971.db2.gz UVHUVBJTFXOBPU-MMPTUQATSA-N 1 2 352.261 4.571 20 10 FJCDLO C[C@H]([NH2+][C@@H]1C[C@H](CO)c2ccccc21)c1ccc(Cl)c(Cl)c1O ZINC000365293665 568434908 /nfs/dbraw/zinc/43/49/08/568434908.db2.gz UVHUVBJTFXOBPU-LYOVBCGYSA-N 1 2 352.261 4.571 20 10 FJCDLO C[C@H]([NH2+][C@@H]1C[C@@H](CO)c2ccccc21)c1ccc(Cl)c(Cl)c1O ZINC000365293673 568434984 /nfs/dbraw/zinc/43/49/84/568434984.db2.gz UVHUVBJTFXOBPU-XMZIXOGTSA-N 1 2 352.261 4.571 20 10 FJCDLO C[C@H]([NH2+][C@H]1C[C@H](CO)c2ccccc21)c1ccc(Cl)c(Cl)c1O ZINC000365293672 568434945 /nfs/dbraw/zinc/43/49/45/568434945.db2.gz UVHUVBJTFXOBPU-USBNGQNGSA-N 1 2 352.261 4.571 20 10 FJCDLO