smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name NC[C@@H](O)C[NH2+]CCCCCCCC[NH2+]C[C@@H](O)CN ZINC000013650060 351338017 /nfs/dbraw/zinc/33/80/17/351338017.db2.gz VYACBFOHRYDHRR-OKILXGFUSA-N 2 3 290.452 -0.855 10 0 CBAEHP NC[C@H](O)C[NH2+]CCCCCCCC[NH2+]C[C@@H](O)CN ZINC000013650058 351337176 /nfs/dbraw/zinc/33/71/76/351337176.db2.gz VYACBFOHRYDHRR-KBPBESRZSA-N 2 3 290.452 -0.855 10 0 CBAEHP NC[C@@H](O)C[NH2+]CCCCCCCC[NH2+]C[C@H](O)CN ZINC000013650059 351338131 /nfs/dbraw/zinc/33/81/31/351338131.db2.gz VYACBFOHRYDHRR-ZIAGYGMSSA-N 2 3 290.452 -0.855 10 0 CBAEHP