5430 -OEChem-10051719223D 21 23 0 0 0 0 0 0 0999 V2000 4.4521 -0.7710 0.0006 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2155 1.0932 -0.0005 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1725 -1.1290 -0.0004 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7409 1.1666 -0.0001 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5298 0.7016 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4764 -0.6895 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5562 -0.0352 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0303 -0.0181 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7243 1.4228 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6761 -1.4210 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9087 0.6788 0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8872 -0.7179 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7847 -1.1728 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0263 0.8915 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1195 2.0476 -0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7384 2.5067 0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6701 -2.5063 -0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8638 1.1983 0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8244 -1.2685 0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4593 -2.2040 0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7803 1.6666 0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 5 1 0 0 0 0 2 7 1 0 0 0 0 2 15 1 0 0 0 0 3 6 1 0 0 0 0 3 7 2 0 0 0 0 4 8 1 0 0 0 0 4 14 2 0 0 0 0 5 6 1 0 0 0 0 5 9 2 0 0 0 0 6 10 2 0 0 0 0 7 8 1 0 0 0 0 8 13 2 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 18 1 0 0 0 0 12 19 1 0 0 0 0 13 20 1 0 0 0 0 14 21 1 0 0 0 0 M END > DB00730 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/WJCNZQLZVWNLKY-UHFFFAOYSA-N/SDF?record_type=3d > N1C2=CC=CC=C2N=C1C1=CSC=N1 > InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13) > WJCNZQLZVWNLKY-UHFFFAOYSA-N > C10H7N3S > 201.248 > 201.036067929 > 2 > 21 > 0.0006590868694429774 > 21.02122404273875 > 1 > 1 > 0 > 1 > 2-(1,3-thiazol-4-yl)-1H-1,3-benzodiazole > 2.47 > 2.328917354333333 > -3.16 > 0 > 0 > 3 > 0 > 10.276095741722969 > 4.075780780042961 > 41.57 > 64.90650000000001 > 1 > 1 > 1.38e-01 g/l > tetrahydrofolic acid > 0 $$$$