General Information of the Compound
| Compound ID |
CP0431635
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| Compound Name |
5-methoxy-N-[4-methyl-6-(2-methylpyridin-3-yl)oxypyridin-3-yl]-6-(trifluoromethyl)-2,3-dihydroindole-1-carboxamide
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| Structure |
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| Formula |
C23H21F3N4O3
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| Molecular Weight |
458.44
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| Canonical SMILES |
COc1cc2CCN(C(=O)Nc3cnc(Oc4cccnc4C)cc3C)c2cc1C(F)(F)F
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| InChI |
InChI=1S/C23H21F3N4O3/c1-13-9-21(33-19-5-4-7-27-14(19)2)28-12-17(13)29-22(31)30-8-6-15-10-20(32-3)16(11-18(15)30)23(24,25)26/h4-5,7,9-12H,6,8H2,1-3H3,(H,29,31)
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| InChIKey |
LGELKLOINROYEG-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
Protein ID: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT01019, 5-hydroxytryptamine receptor 2B
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C