4644 -OEChem-01272015303D 15 16 0 0 0 0 0 0 0999 V2000 -0.3211 -2.6932 -0.0091 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9108 1.1329 0.0138 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7703 1.5076 -0.0227 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6714 0.5140 0.0207 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6213 -0.7521 -0.0023 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6483 1.4661 -0.0055 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7039 -0.5661 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5225 0.9178 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0382 -0.7042 0.0098 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -1.4756 -0.0039 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7749 0.6528 0.0032 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6252 -1.6083 -0.0073 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9991 2.4903 0.0444 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 0.6230 -0.2424 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4798 -1.2962 -0.0024 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 11 2 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 13 1 0 0 0 0 4 9 1 0 0 0 0 4 14 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 15 1 0 0 0 0 6 8 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 9 12 1 0 0 0 0 M END > DB05262 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/HXNFUBHNUDHIGC-UHFFFAOYSA-N/SDF?record_type=3d > O=C1NC2=C(C=NN2)C(=O)N1 > InChI=1S/C5H4N4O2/c10-4-2-1-6-9-3(2)7-5(11)8-4/h1H,(H3,6,7,8,9,10,11) > HXNFUBHNUDHIGC-UHFFFAOYSA-N > C5H4N4O2 > 152.1109 > 152.033425392 > 5 > 15 > 0.14332084445824855 > 12.5988072093842 > 1 > 3 > 0 > 0 > 1H,2H,4H,5H,6H-pyrazolo[3,4-d]pyrimidine-4,6-dione > -0.65 > -1.6700113939999999 > -1.52 > 0 > -1 > 2 > -1 > 9.441897981914021 > 6.252258890490276 > 2.091486474289734 > 82.59 > 55.3527 > 0 > 1 > 4.58e+00 g/l > prinomastat > 0 $$$$