5326978 -OEChem-10051720403D 24 26 0 0 0 0 0 0 0999 V2000 0.7788 -3.2603 -0.0112 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.5391 3.3469 -0.0150 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.8827 -1.9620 0.0535 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.2778 1.3523 0.0418 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.3525 -0.6705 -0.0505 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3097 0.3531 -0.0752 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1154 1.5259 -0.0519 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2714 -1.7898 -0.0404 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6308 -1.0681 0.0888 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9763 0.5388 -0.0656 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0149 -0.5030 -0.0265 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1214 0.8923 -0.0303 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2673 1.3973 0.1614 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -1.3802 -0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4123 1.4479 -0.0104 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3432 -0.8036 0.0189 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 0.5832 0.0139 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0661 -2.4320 0.8188 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 -2.3262 -0.9882 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3368 -1.4099 -0.6752 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 -1.2507 1.0769 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9912 2.3161 -0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3384 1.6200 1.2311 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2594 1.0974 -0.1918 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 2 15 1 0 0 0 0 3 16 1 0 0 0 0 4 17 1 0 0 0 0 5 8 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 6 13 1 0 0 0 0 7 10 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 15 1 0 0 0 0 13 22 1 0 0 0 0 13 23 1 0 0 0 0 13 24 1 0 0 0 0 14 16 2 0 0 0 0 15 17 2 0 0 0 0 16 17 1 0 0 0 0 M END > DB04721 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/QHCZROILDUNGRT-UHFFFAOYSA-N/SDF?record_type=3d > CN1CCN2C1=NC1=C(Br)C(Br)=C(Br)C(Br)=C21 > InChI=1S/C10H7Br4N3/c1-16-2-3-17-9-7(14)5(12)4(11)6(13)8(9)15-10(16)17/h2-3H2,1H3 > QHCZROILDUNGRT-UHFFFAOYSA-N > C10H7Br4N3 > 488.799 > 484.737347827 > 2 > 24 > 0.0032174066726898477 > 32.848156299915345 > 1 > 0 > 0 > 0 > 9,10,11,12-tetrabromo-5-methyl-2,5,7-triazatricyclo[6.4.0.0^{2,6}]dodeca-1(12),6,8,10-tetraene > 4.45 > 5.1789594863333335 > -4.02 > 0 > 0 > 3 > 0 > 4.508905536254597 > 21.060000000000002 > 82.28930000000003 > 0 > 0 > 4.64e-02 g/l > tetrahydrofolic acid > 1 $$$$