smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C=CCOC[C@@H](O)Cn1c(NCCN(C)C)nc2c1c(=O)[nH]c(=O)n2C ZINC000004317989 483724088 /nfs/dbraw/zinc/72/40/88/483724088.db2.gz CCTHYSHPMGJAAM-NSHDSACASA-N 0 3 366.422 -1.040 50 30 FAEAHN C=CCOC[C@H](O)Cn1c(NCCN(C)C)nc2c1c(=O)[nH]c(=O)n2C ZINC000004317990 483724337 /nfs/dbraw/zinc/72/43/37/483724337.db2.gz CCTHYSHPMGJAAM-LLVKDONJSA-N 0 3 366.422 -1.040 50 30 FAEAHN Cn1c2ncn(C[C@H](O)C/N=C/N3CCOCC3)c2c(=O)n(C)c1=O ZINC000004576291 527126546 /nfs/dbraw/zinc/12/65/46/527126546.db2.gz YBYLMWJFEFIGQR-LKBVRNOZSA-N 0 3 350.379 -1.845 50 30 biogenic,in-vitro FAEAHN Cn1c2ncn(C[C@@H](O)C/N=C/N3CCOCC3)c2c(=O)n(C)c1=O ZINC000004576292 527126239 /nfs/dbraw/zinc/12/62/39/527126239.db2.gz YBYLMWJFEFIGQR-UJFYRASASA-N 0 3 350.379 -1.845 50 30 biogenic,in-vitro FAEAHN