smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC1(C)NC(=N)NC(=[NH2+])N1CCCOc1ccc(N)cc1 ZINC000001719604 347961553 /nfs/dbraw/zinc/96/15/53/347961553.db2.gz UXPVYJZSPPVRPG-UHFFFAOYSA-N 1 3 290.371 0.719 40 10 CCCBHO CC[C@@H]1COc2nc(=O)c(C=[NH+]CCCN(C)C)c(N)n21 ZINC000104268755 349713276 /nfs/dbraw/zinc/71/32/76/349713276.db2.gz DRTZAMOCXZIZLZ-LBRMCOMOSA-N 1 3 293.371 0.396 40 10 CCCBHO CC[C@@H]1COc2nc(=O)c(C=[NH+]CCCN(C)C)c(N)n21 ZINC000104268750 349713307 /nfs/dbraw/zinc/71/33/07/349713307.db2.gz DRTZAMOCXZIZLZ-BHSHLBPJSA-N 1 3 293.371 0.396 40 10 CCCBHO