171 -OEChem-10051720133D 22 23 0 0 0 0 0 0 0999 V2000 0.2513 -2.3699 0.2706 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 2.1987 0.0085 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7617 1.1250 -0.1206 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7637 -1.2665 0.0242 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3532 -0.8966 -0.9217 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7559 -0.0338 -0.2289 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3025 -0.0322 0.1358 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6568 0.3633 0.2343 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 1.1183 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6853 1.7453 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8317 -0.5160 0.3939 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3723 -1.3215 0.1527 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3922 -0.1143 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5069 2.4476 0.1843 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 3.1666 -0.0757 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6229 -0.0028 0.9521 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5843 -1.4176 0.9627 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3042 1.9770 -0.2209 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6027 -0.0631 -1.4526 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6314 -1.3788 -1.4559 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3329 -0.8679 -0.2297 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2268 0.8592 -0.3249 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 9 1 0 0 0 0 2 10 1 0 0 0 0 2 15 1 0 0 0 0 3 9 1 0 0 0 0 3 13 1 0 0 0 0 3 18 1 0 0 0 0 4 12 1 0 0 0 0 4 13 2 0 0 0 0 5 11 1 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 6 13 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 7 12 1 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 10 14 1 0 0 0 0 11 16 1 0 0 0 0 11 17 1 0 0 0 0 M END > DB03304 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/MEYMBLGOKYDGLZ-UHFFFAOYSA-N/SDF?record_type=3d > NCC1=CNC2=C1C(=O)NC(N)=N2 > InChI=1S/C7H9N5O/c8-1-3-2-10-5-4(3)6(13)12-7(9)11-5/h2H,1,8H2,(H4,9,10,11,12,13) > MEYMBLGOKYDGLZ-UHFFFAOYSA-N > C7H9N5O > 179.1793 > 179.080709935 > 4 > 22 > 0.9668739435191946 > 17.45340895781716 > 1 > 4 > 0 > 0 > 2-amino-5-(aminomethyl)-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-4-one > -1.43 > -1.207994808333333 > -1.79 > 0 > 1 > 2 > 1 > 13.118544830459305 > 11.035487827151117 > 8.393132257443407 > 109.28999999999999 > 48.6742 > 1 > 1 > 2.93e+00 g/l > tetrahydrofolic acid > 0 $$$$