smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCC[NH+](CCCC)CCC[NH2+]Cc1c(OC)ccc2ccccc21 ZINC000013733713 211054696 /nfs/dbraw/zinc/05/46/96/211054696.db2.gz ZXXJBYFVWIDOFG-UHFFFAOYSA-N 2 1 356.554 5.230 10 0 FKAEMP CCCC[NH+](CCCC)CCC[NH2+]Cc1c(OCC)ccc2ccccc21 ZINC000013733716 220090834 /nfs/dbraw/zinc/09/08/34/220090834.db2.gz AXRRSJXDLBTQIL-UHFFFAOYSA-N 2 1 370.581 5.620 10 0 FKAEMP CCCC[NH+](CCCC)CCC[NH2+]Cc1ccc(-c2ccc(F)cc2)o1 ZINC000013733826 211053790 /nfs/dbraw/zinc/05/37/90/211053790.db2.gz QUOHQQRSRWWKMK-UHFFFAOYSA-N 2 1 360.517 5.468 10 0 FKAEMP CN[C@@]1(c2cc(-c3ccccc3)[o+]c(-c3ccccc3)c2)C=CC([NH2+]C)=CC1 ZINC000100312995 222241897 /nfs/dbraw/zinc/24/18/97/222241897.db2.gz GTUSQBXBAVTEPW-VWLOTQADSA-N 2 1 369.488 5.373 10 0 FKAEMP