76726 -OEChem-10051720233D 16 16 0 0 0 0 0 0 0999 V2000 0.9826 2.3495 0.0005 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9364 -0.0533 0.0006 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9286 -1.1656 0.0001 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9848 1.1633 -0.0009 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0779 -2.4118 -0.0001 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5053 0.0911 0.0002 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4517 -1.1911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1434 -0.0286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3942 1.2699 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7052 -0.0233 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3997 -2.0656 0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5175 2.0285 -0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0872 -2.4758 -0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5141 -3.2523 0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9294 1.0105 0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0918 -0.7331 0.0002 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 7 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 12 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 6 8 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 M END > DB03826 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/BBTNLADSUVOPPN-UHFFFAOYSA-N/SDF?record_type=3d > NC1=C(N)C(=O)NC(=O)N1 > InChI=1S/C4H6N4O2/c5-1-2(6)7-4(10)8-3(1)9/h5H2,(H4,6,7,8,9,10) > BBTNLADSUVOPPN-UHFFFAOYSA-N > C4H6N4O2 > 142.116 > 142.049075456 > 4 > 16 > -0.03216795604385663 > 12.080658166337203 > 1 > 4 > 0 > 0 > 5,6-diamino-1,2,3,4-tetrahydropyrimidine-2,4-dione > -1.52 > -2.240495602666666 > -1.01 > 0 > 0 > 1 > 0 > 13.075279225818099 > 8.478388447772474 > -4.074199305707405 > 110.24000000000001 > 42.530199999999994 > 0 > 1 > 1.38e+01 g/l > biotin > 0 $$$$