5326870 -OEChem-10051721143D 43 46 0 0 0 0 0 0 0999 V2000 2.3854 -3.8762 -0.1817 F 0 0 0 0 0 0 0 0 0 0 0 0 6.6523 2.0187 0.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6329 1.0985 -0.7951 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3244 0.4961 0.0232 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5613 -0.8202 0.1968 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9100 0.5257 0.2224 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4271 1.4072 1.1714 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6050 0.0538 -0.5393 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3915 2.5413 0.8433 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5081 1.2596 -0.7748 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2010 -0.3324 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9251 0.2270 -0.1344 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3567 -1.7185 -0.0802 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8342 -0.6124 -0.2193 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2364 -2.5452 -0.1668 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9606 -1.9857 -0.2371 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7714 0.9646 -0.2363 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5255 -0.0166 -0.2965 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9275 -0.5354 0.2309 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6358 0.0110 0.3055 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3909 0.6849 -0.2739 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8135 -1.4686 0.7657 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1870 -1.2132 0.8133 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5709 2.0679 -0.6466 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8810 1.7683 -0.3515 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8006 0.8399 2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4588 1.8378 1.4482 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4622 -0.4685 -1.4926 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0924 -0.6298 0.1669 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9890 3.1943 0.0595 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5611 3.1563 1.7329 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5037 0.9258 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1133 1.9051 -1.5688 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8019 1.3066 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3334 -2.1889 -0.0135 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1222 -2.6656 -0.3433 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7633 1.4514 -0.7014 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3181 -1.7084 0.6261 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8762 -1.9403 1.2297 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4470 -2.4157 1.1561 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2262 2.9830 -1.1082 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7456 0.0537 0.5396 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7937 2.3282 -0.4987 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 2 9 1 0 0 0 0 2 10 1 0 0 0 0 3 18 2 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 11 1 0 0 0 0 5 18 1 0 0 0 0 5 19 1 0 0 0 0 5 38 1 0 0 0 0 6 20 1 0 0 0 0 6 25 1 0 0 0 0 6 42 1 0 0 0 0 7 9 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 14 2 0 0 0 0 12 34 1 0 0 0 0 13 15 1 0 0 0 0 13 35 1 0 0 0 0 14 16 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 16 36 1 0 0 0 0 17 20 2 0 0 0 0 17 21 1 0 0 0 0 17 24 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 23 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 43 1 0 0 0 0 M END > DB08092 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/VMLSXFMXUNVCSK-UHFFFAOYSA-N/SDF?record_type=3d > FC1=CC(=CC(=C1)C(=O)NC1=CC=C2NC=CC2=C1)N1CCOCC1 > InChI=1S/C19H18FN3O2/c20-15-9-14(11-17(12-15)23-5-7-25-8-6-23)19(24)22-16-1-2-18-13(10-16)3-4-21-18/h1-4,9-12,21H,5-8H2,(H,22,24) > VMLSXFMXUNVCSK-UHFFFAOYSA-N > C19H18FN3O2 > 339.3635 > 339.13830504 > 3 > 43 > -1.3811641049785653e-08 > 35.824421803260236 > 1 > 2 > 0 > 1 > 3-fluoro-N-(1H-indol-5-yl)-5-(morpholin-4-yl)benzamide > 3.14 > 3.1961379579999996 > -3.72 > 0 > 0 > 4 > 0 > 16.856071316859396 > 14.809413173219797 > -1.7323878648964766 > 57.36 > 96.3975 > 3 > 1 > 6.48e-02 g/l > tetrahydrofolic acid > 0 $$$$