smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCc1ccc2oc(C3=CC[N@H+](Cc4cccc(F)c4)CC3)nc2c1 ZINC000216785403 535833424 /nfs/dbraw/zinc/83/34/24/535833424.db2.gz CVVXBFQITBNXGV-UHFFFAOYSA-N 1 0 336.410 4.819 40 70 EJIBRO CCc1ccc2oc(C3=CC[N@H+](Cc4ccc(F)cc4)CC3)nc2c1 ZINC000216784930 535833036 /nfs/dbraw/zinc/83/30/36/535833036.db2.gz BVGCUGHZGCWQIH-UHFFFAOYSA-N 1 0 336.410 4.819 40 70 EJIBRO Cc1cc2nc(C3=CC[N@H+](Cc4cccc(F)c4)CC3)oc2cc1C ZINC000216785473 241211059 /nfs/dbraw/zinc/21/10/59/241211059.db2.gz FDVUWDVPVWUNLK-UHFFFAOYSA-N 1 0 336.410 4.873 40 70 EJIBRO Cc1cc2nc(C3=CC[N@H+](Cc4cccc(F)c4)CC3)oc2c(C)c1 ZINC000216785545 241210798 /nfs/dbraw/zinc/21/07/98/241210798.db2.gz SPSOVSFZRKFCJX-UHFFFAOYSA-N 1 0 336.410 4.873 40 70 EJIBRO Cc1cc2nc(C3=CC[N@H+](Cc4ccc(F)cc4)CC3)oc2cc1C ZINC000216784994 241210348 /nfs/dbraw/zinc/21/03/48/241210348.db2.gz ISIGCPRHSMHVNB-UHFFFAOYSA-N 1 0 336.410 4.873 40 70 EJIBRO Cc1cc2nc(C3=CC[N@H+](Cc4ccc(F)cc4)CC3)oc2c(C)c1 ZINC000216785067 241210236 /nfs/dbraw/zinc/21/02/36/241210236.db2.gz QUWDOGRCTOODAU-UHFFFAOYSA-N 1 0 336.410 4.873 40 70 EJIBRO