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- 2 of 3 defined stereocentres
1-[4-({trans-4-[(3-Amino-1-piperidinyl)methyl]cyclohexyl}amino)-6-(3-chloro-5-fluoro-4-hydroxyphenyl)-3-quinolinyl]ethanone
CC(=O)c1c(c2c(nc1)ccc(c2)c3cc(c(c(c3)F)O)Cl)N[C@H]4CC[C@@H](CC4)CN5CC(CCC5)N
InChI=1S/C29H34ClFN4O2/c1-17(36)24-14-33-27-9-6-19(20-12-25(30)29(37)26(31)13-20)11-23(27)28(24)34-22-7-4-18(5-8-22)15-35-10-2-3-21(32)16-35/h6,9,11-14,18,21-22,37H,2-5,7-8,10,15-16,32H2,1H3,(H,33,34)/t18-,21?,22-
ISXSHIWBHAEAOG-NULPYHFVSA-N
CSID:58908138, http://www.chemspider.com/Chemical-Structure.58908138.html (accessed 21:20, Jul 1, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
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