967 -OEChem-10051719523D 15 15 0 0 0 0 0 0 0999 V2000 -1.8663 2.3530 -0.0001 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0522 -2.2662 0.0008 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6578 1.1786 0.0005 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8716 -1.0983 0.0001 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0891 1.1379 0.0001 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9829 0.0473 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7273 -0.0727 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -1.2365 -0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2931 1.2632 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4123 -1.2186 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1899 -0.0879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6551 1.9815 0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5587 -2.2043 -0.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9978 0.0954 0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6384 1.2092 0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 2 0 0 0 0 2 10 2 0 0 0 0 3 11 1 0 0 0 0 3 15 1 0 0 0 0 4 11 2 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 5 12 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 6 14 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 M END > DB02262 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/PXQPEWDEAKTCGB-UHFFFAOYSA-N/SDF?record_type=3d > OC(=O)C1=CC(=O)NC(=O)N1 > InChI=1S/C5H4N2O4/c8-3-1-2(4(9)10)6-5(11)7-3/h1H,(H,9,10)(H2,6,7,8,11) > PXQPEWDEAKTCGB-UHFFFAOYSA-N > C5H4N2O4 > 156.0963 > 156.017106626 > 4 > 15 > -1.0162239275427307 > 12.461507679606417 > 1 > 3 > 0 > 0 > 2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid > -0.89 > -1.227664501 > -1.54 > 0 > -1 > 1 > -1 > 8.781577636043496 > 2.6352223431108714 > -6.031557163303447 > 95.5 > 33.27460000000001 > 1 > 1 > 4.51e+00 g/l > biotin > 0 $$$$