smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cc(CN2CC[N@@H+](C)[C@@H](C)C2)c(C)c(C[NH+]2CCC(C)CC2)c1 ZINC000217657697 241268237 /nfs/dbraw/zinc/26/82/37/241268237.db2.gz ZMIRHZXAXZAZEX-IBGZPJMESA-N 2 1 343.559 3.671 50 70 EHIAMP Cc1cc(C[NH+]2CCC(C)CC2)c(C)c(C[N@@H+]2CCN(C)[C@@H](C)C2)c1 ZINC000217657697 241268239 /nfs/dbraw/zinc/26/82/39/241268239.db2.gz ZMIRHZXAXZAZEX-IBGZPJMESA-N 2 1 343.559 3.671 50 70 EHIAMP Cc1cc(C[NH+]2CCC(C)CC2)c(C)c(C[N@H+]2CCN(C)[C@@H](C)C2)c1 ZINC000217657697 241268243 /nfs/dbraw/zinc/26/82/43/241268243.db2.gz ZMIRHZXAXZAZEX-IBGZPJMESA-N 2 1 343.559 3.671 50 70 EHIAMP