General Information of the Compound
| Compound ID |
CP0408842
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| Compound Name |
N-[2-(4-cyclohexyl-4-hydroxypiperidin-1-yl)-4-methylquinazolin-6-yl]-2-[4-(trifluoromethoxy)phenoxy]acetamide
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| Structure |
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| Formula |
C29H33F3N4O4
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| Molecular Weight |
558.601
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| Canonical SMILES |
Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(O)(CC1)C1CCCCC1
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| InChI |
InChI=1S/C29H33F3N4O4/c1-19-24-17-21(34-26(37)18-39-22-8-10-23(11-9-22)40-29(30,31)32)7-12-25(24)35-27(33-19)36-15-13-28(38,14-16-36)20-5-3-2-4-6-20/h7-12,17,20,38H,2-6,13-16,18H2,1H3,(H,34,37)
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| InChIKey |
UQFJSPHVWZDNLB-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound