smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN(Cc1cccnc1)[C@@H]1CN(c2ncccc2NC(=O)CCl)[C@@H]2CCCO[C@H]12 ZINC001164798545 721575340 /nfs/dbraw/zinc/57/53/40/721575340.db2.gz BHGHMVMMJURZNX-GGPKGHCWSA-N 0 0 415.925 2.522 20 50 HFGDRN CN(Cc1cccnc1)[C@@H]1CN(c2ncccc2NC(=O)CCl)[C@@H]2CCCO[C@@H]12 ZINC001164798550 721575072 /nfs/dbraw/zinc/57/50/72/721575072.db2.gz BHGHMVMMJURZNX-QWFCFKBJSA-N 0 0 415.925 2.522 20 50 HFGDRN CN(Cc1cccnc1)[C@@H]1CN(c2ncccc2NC(=O)CCl)[C@H]2CCCO[C@H]12 ZINC001164798549 721575032 /nfs/dbraw/zinc/57/50/32/721575032.db2.gz BHGHMVMMJURZNX-NSHGMRRFSA-N 0 0 415.925 2.522 20 50 HFGDRN CN(Cc1cccnc1)[C@@H]1CN(c2ncccc2NC(=O)CCl)[C@H]2CCCO[C@@H]12 ZINC001164798547 721575161 /nfs/dbraw/zinc/57/51/61/721575161.db2.gz BHGHMVMMJURZNX-NLWGTHIKSA-N 0 0 415.925 2.522 20 50 HFGDRN