smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCN1CCCN(C(=O)[C@H]2[C@@H]3C=C[C@@]4(CN(Cc5ccc(C)c(C)c5)C(=O)[C@@H]24)O3)CC1 ZINC000216647230 568466088 /nfs/dbraw/zinc/46/60/88/568466088.db2.gz LYGNIDUYNAQGKK-FUCAVZNHSA-N 0 3 423.557 2.140 50 70 HEIAHN CCN1CCCN(C(=O)[C@@H]2[C@@H]3C=C[C@@]4(CN(Cc5ccc(C)c(C)c5)C(=O)[C@@H]24)O3)CC1 ZINC000216647292 568466077 /nfs/dbraw/zinc/46/60/77/568466077.db2.gz LYGNIDUYNAQGKK-OUMCCJGNSA-N 0 3 423.557 2.140 50 70 HEIAHN