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 564033014 /nfs/dbraw/zinc/03/30/14/564033014.db2.gz FPAWCCDZRXZGTH-HTAPYJJXSA-N 2 0 345.490 5.064 40 10 EKCBRP c1ccc2c(c1)[nH+]c1ccccc1c2NC[C@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000005875735 564033024 /nfs/dbraw/zinc/03/30/24/564033024.db2.gz FPAWCCDZRXZGTH-VGOFRKELSA-N 2 0 345.490 5.064 40 10 EKCBRP c1ccc2c(c1)[nH+]c1ccccc1c2NC[C@@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000017610836 564120744 /nfs/dbraw/zinc/12/07/44/564120744.db2.gz FPAWCCDZRXZGTH-JTSKRJEESA-N 2 0 345.490 5.064 40 10 EKCBRP c1ccc2c(c1)[nH+]c1ccccc1c2NC[C@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000017610839 564120720 /nfs/dbraw/zinc/12/07/20/564120720.db2.gz FPAWCCDZRXZGTH-VGSWGCGISA-N 2 0 345.490 5.064 40 10 EKCBRP