smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CO[NH+]=C(N)CCCCCCCCCCCCC(N)=[NH+]OC ZINC000038882457 183012293 /nfs/dbraw/zinc/01/22/93/183012293.db2.gz DKXHWNCXDWVYLV-UHFFFAOYSA-N 2 0 314.474 3.714 1 30 DHEFRP CCCCCCCCNC1=[NH+]C(C)(C)[NH+]=C(NCCCCC)N1 ZINC000049867615 183761169 /nfs/dbraw/zinc/76/11/69/183761169.db2.gz UEWJLJRBUORLPM-UHFFFAOYSA-N 2 0 323.529 3.768 1 30 DHEFRP