smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C(CN1CC(=O)[N-]C1=O)N1CCc2n[nH]cc2C1 ZINC000217040920 373217540 /nfs/dbraw/zinc/21/75/40/373217540.db2.gz YGBZOKYHIVJPEK-UHFFFAOYSA-N -1 3 263.257 -1.154 50 70 CAIAHM Cc1nc2c(c(=O)[n-]1)CCN(C(=O)Cn1cnnn1)CC2 ZINC000217871128 373219204 /nfs/dbraw/zinc/21/92/04/373219204.db2.gz SHULVNHJWGTSAY-UHFFFAOYSA-N -1 3 289.299 -1.308 50 70 CAIAHM O=C(CN1CC(=O)[N-]C1=O)NCc1nnc2n1CCCC2 ZINC000218412503 373219757 /nfs/dbraw/zinc/21/97/57/373219757.db2.gz OPTQLBYGARLJER-UHFFFAOYSA-N -1 3 292.299 -1.218 50 70 CAIAHM