smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[N+](C)(C)[C@@H]1C[C@H]([N+](C)(C)C)[C@H]2c3ccccc3[C@H]21 ZINC000001619752 717088590 /nfs/dbraw/zinc/08/85/90/717088590.db2.gz RCQBRIZRKSJETF-ZYGGUILKSA-N 2 0 260.425 2.421 1 5 CEBFRP C[N+](C)(C)[C@@H]1C[C@H]([N+](C)(C)C)[C@@H]2c3ccccc3[C@H]21 ZINC000105483408 717147712 /nfs/dbraw/zinc/14/77/12/717147712.db2.gz RCQBRIZRKSJETF-YVSFHVDLSA-N 2 0 260.425 2.421 1 5 CEBFRP C[N+]1(NCC[N@@+]2(C)CCc3ccccc3C2)CCCCC1 ZINC000253979576 717169455 /nfs/dbraw/zinc/16/94/55/717169455.db2.gz ZENLQZHBAPIOBR-HXUWFJFHSA-N 2 0 289.467 2.324 1 5 CEBFRP C[N+](C)(C)[C@@H]1C[C@H]([N+](C)(C)C)[C@@H]2c3ccccc3[C@@H]21 ZINC000105483406 717147827 /nfs/dbraw/zinc/14/78/27/717147827.db2.gz RCQBRIZRKSJETF-WNKDZCFJSA-N 2 0 260.425 2.421 1 5 CEBFRP C[N+]1(NCC[N@+]2(C)CCc3ccccc3C2)CCCCC1 ZINC000254194487 717170214 /nfs/dbraw/zinc/17/02/14/717170214.db2.gz ZENLQZHBAPIOBR-FQEVSTJZSA-N 2 0 289.467 2.324 1 5 CEBFRP