smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name c1ccc2c(c1)[nH+]c1ccccc1c2NC[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000005875732 564033015 /nfs/dbraw/zinc/03/30/15/564033015.db2.gz FPAWCCDZRXZGTH-HTAPYJJXSA-N 2 1 345.490 5.064 40 10 EKCBMP c1ccc2c(c1)[nH+]c1ccccc1c2NC[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000005875735 564033025 /nfs/dbraw/zinc/03/30/25/564033025.db2.gz FPAWCCDZRXZGTH-VGOFRKELSA-N 2 1 345.490 5.064 40 10 EKCBMP c1ccc2c(c1)[nH+]c1ccccc1c2NC[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000017610836 564120745 /nfs/dbraw/zinc/12/07/45/564120745.db2.gz FPAWCCDZRXZGTH-JTSKRJEESA-N 2 1 345.490 5.064 40 10 EKCBMP c1ccc2c(c1)[nH+]c1ccccc1c2NC[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000017610839 564120721 /nfs/dbraw/zinc/12/07/21/564120721.db2.gz FPAWCCDZRXZGTH-VGSWGCGISA-N 2 1 345.490 5.064 40 10 EKCBMP