smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C#Cc1c(N)[nH+]ccc1Oc1ccc(NC(=O)NC(=O)Cc2ccc(F)cc2)cc1F ZINC000040979987 581094075 /nfs/dbraw/zinc/09/40/75/581094075.db2.gz LKUSYUYBQDJFNA-UHFFFAOYSA-N 1 2 422.391 3.606 1 30 HHEFLO CCO/[NH+]=C/c1c(N)ncnc1Nc1ccc2c(cnn2Cc2cccc(F)c2)c1 ZINC000029044085 581095127 /nfs/dbraw/zinc/09/51/27/581095127.db2.gz APHSPKWGAGCFBE-LUOAPIJWSA-N 1 2 405.437 3.710 1 30 HHEFLO CC(C)c1[nH+]c2ccccc2n1Cc1ccc(C(=O)N[C@@H]2CCC[C@@H]2C(=O)NO)cc1 ZINC000029038030 581091854 /nfs/dbraw/zinc/09/18/54/581091854.db2.gz XNUPVUIWOKTWNU-RBUKOAKNSA-N 1 2 420.513 3.612 1 30 HHEFLO