smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[N+](CC)(CC)Cc1cccc(C[N+](CC)(CC)CC)c1 ZINC000006707852 181375771 /nfs/dbraw/zinc/37/57/71/181375771.db2.gz VKTYWJVKTQGECG-UHFFFAOYSA-N 2 0 306.538 4.440 10 5 DIBERP C[N+]1(CC[N@H+](Cc2ccccc2)C2CCCCC2)CCCCC1 ZINC000033878379 717122899 /nfs/dbraw/zinc/12/28/99/717122899.db2.gz TYGXHMPKLSPQSW-UHFFFAOYSA-N 2 0 315.525 4.452 10 5 DIBERP