smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1cc(/C=C2/SC(=S)N(c3ccccc3Cl)C2=O)cc(OC)c1OC ZINC000027229385 569289637 /nfs/dbraw/zinc/28/96/37/569289637.db2.gz QLOPAERDVNRKBS-MHWRWJLKSA-N 0 0 421.927 4.772 20 10 HJCDRN COc1cc(/C=C2\SC(=S)N(CCc3ccccc3)C2=O)ccc1OC(F)F ZINC000020228568 521974024 /nfs/dbraw/zinc/97/40/24/521974024.db2.gz RSPFHDHHCKQDCV-ATVHPVEESA-N 0 0 421.490 4.741 20 10 HJCDRN