25223 -OEChem-10051719373D 26 26 0 0 0 0 0 0 0999 V2000 -0.3941 -2.5512 -0.2078 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.4230 0.1387 -0.5878 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1195 0.1842 0.0977 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0116 0.0805 -0.9834 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0591 1.5096 0.8692 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0849 -0.9925 1.0826 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4152 0.1595 -0.4908 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1096 -0.9828 -0.1244 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0044 1.4131 -0.4179 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4249 -0.8698 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3198 1.5259 0.0324 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0301 0.3847 0.4042 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1548 0.8910 -1.7149 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1533 -0.8272 -1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1602 1.5719 1.4918 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9165 1.6196 1.5447 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0626 2.3707 0.1909 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -1.0038 1.6765 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9094 -0.9179 1.8037 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2072 -1.9536 0.5732 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1785 0.2280 0.0909 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5114 0.9363 -1.2168 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4652 2.3108 -0.7066 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9921 -1.7494 0.6198 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7912 2.5025 0.0929 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0542 0.4728 0.7548 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 4 7 1 0 0 0 0 4 13 1 0 0 0 0 4 14 1 0 0 0 0 5 15 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 18 1 0 0 0 0 6 19 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 10 2 0 0 0 0 9 11 1 0 0 0 0 9 23 1 0 0 0 0 10 12 1 0 0 0 0 10 24 1 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 12 26 1 0 0 0 0 M END > DB01527 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/HXCXASJHZQXCKK-UHFFFAOYSA-N/SDF?record_type=3d > CC(C)(N)CC1=CC=CC=C1Cl > InChI=1S/C10H14ClN/c1-10(2,12)7-8-5-3-4-6-9(8)11/h3-6H,7,12H2,1-2H3 > HXCXASJHZQXCKK-UHFFFAOYSA-N > C10H14ClN > 183.678 > 183.08147716 > 1 > 26 > 0.9993158848089432 > 19.860647881343763 > 1 > 1 > 0 > 1 > 1-(2-chlorophenyl)-2-methylpropan-2-amine > 2.67 > 2.688871826333333 > -3.24 > 0 > 1 > 1 > 1 > 10.16457355665561 > 26.02 > 53.14820000000002 > 2 > 1 > 1.05e-01 g/l > biotin > 1 $$$$