smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN(C)C1CCC(NC2=CC(=O)C(NC3CCC([NH+](C)C)CC3)=CC2=O)CC1 ZINC000001614483 206386904 /nfs/dbraw/zinc/38/69/04/206386904.db2.gz YEWDZHSIZNEQGG-UHFFFAOYSA-N 1 3 388.556 1.831 40 30 GDEBHO CN(C)CCCNC1=C(Cl)C(=O)C(NCCC[NH+](C)C)=C(Cl)C1=O ZINC000001726019 209337317 /nfs/dbraw/zinc/33/73/17/209337317.db2.gz AORHTVYEVDVVNM-UHFFFAOYSA-N 1 3 377.316 1.122 40 30 GDEBHO