smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cc2[nH]c3c(c2cc1C)c(C)nc1ccccc31 ZINC000006533766 170211327 /nfs/dbraw/zinc/21/13/27/170211327.db2.gz DISDWAOVQQELPK-UHFFFAOYSA-N 0 1 260.340 4.795 50 5 CJBAMN Cc1oc2c(cc3c4ccccc4/c(=N\O)oc3c2C)c1C ZINC000013689921 567867171 /nfs/dbraw/zinc/86/71/71/567867171.db2.gz IAIMEVOITJVKBG-VHEBQXMUSA-N 0 1 293.322 4.547 50 5 CJBAMN CN(C)c1c2sc3ccccc3c2nc2ccccc21 ZINC000034510288 566914532 /nfs/dbraw/zinc/91/45/32/566914532.db2.gz KKPFCCXFGNPMHZ-UHFFFAOYSA-N 0 1 278.380 4.669 50 5 CJBAMN Cc1cccc(N=c2c3ccccc3c3ccccc3n2C)c1 ZINC000334157343 206121124 /nfs/dbraw/zinc/12/11/24/206121124.db2.gz GJNGKVRKPCPSGY-UHFFFAOYSA-N 0 1 298.389 4.872 50 5 CJBAMN