2726820 -OEChem-10051721163D 23 24 0 0 0 0 0 0 0999 V2000 -3.1672 -0.4058 0.4231 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9137 1.4408 0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0188 -0.6916 -0.0133 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2547 1.2978 0.0438 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4033 -0.5772 0.0029 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4864 1.7204 0.0893 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2875 0.8108 0.0223 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6934 -1.3381 -0.0612 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7782 1.1283 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8014 -1.2705 -0.0266 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8264 -2.7643 -0.0923 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0011 0.6492 0.0239 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6253 2.0233 1.1354 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2639 2.6354 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8476 -1.7026 -1.0827 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6650 -2.2037 0.6074 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6030 1.8339 -0.3165 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6991 0.9183 -1.5293 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2622 -3.1285 -0.9565 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8531 -3.1328 -0.1973 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4165 -3.1983 0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2916 2.3074 0.0725 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1006 0.7451 0.0298 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 9 1 0 0 0 0 2 7 2 0 0 0 0 2 12 1 0 0 0 0 3 10 1 0 0 0 0 3 12 2 0 0 0 0 4 12 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 10 2 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 13 1 0 0 0 0 6 14 1 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 11 19 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 M END > DB08194 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/ONZWAEXRMZGFAN-UHFFFAOYSA-N/SDF?record_type=3d > CC1=NC(N)=NC2=C1CSCC2 > InChI=1S/C8H11N3S/c1-5-6-4-12-3-2-7(6)11-8(9)10-5/h2-4H2,1H3,(H2,9,10,11) > ONZWAEXRMZGFAN-UHFFFAOYSA-N > C8H11N3S > 181.258 > 181.067368057 > 3 > 23 > 0.07330779178719572 > 19.28268253919817 > 1 > 1 > 0 > 1 > 4-methyl-5H,7H,8H-thiopyrano[4,3-d]pyrimidin-2-amine > 1.04 > 0.8679284953333334 > -1.61 > 0 > 0 > 2 > 0 > 16.920636630402733 > 4.898214202648362 > 51.8 > 52.2367 > 0 > 1 > 4.41e+00 g/l > tetrahydrofolic acid > 0 $$$$