General Information of the Compound
| Compound ID |
CP0409875
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| Compound Name |
5-methyl-N-[6-[(3-methylimidazol-4-yl)methoxy]pyridin-3-yl]-6-(trifluoromethyl)-2,3-dihydroindole-1-carboxamide
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| Structure |
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| Formula |
C21H20F3N5O2
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| Molecular Weight |
431.418
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| Canonical SMILES |
Cc1cc2CCN(C(=O)Nc3ccc(OCc4cncn4C)nc3)c2cc1C(F)(F)F
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| InChI |
InChI=1S/C21H20F3N5O2/c1-13-7-14-5-6-29(18(14)8-17(13)21(22,23)24)20(30)27-15-3-4-19(26-9-15)31-11-16-10-25-12-28(16)2/h3-4,7-10,12H,5-6,11H2,1-2H3,(H,27,30)
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| InChIKey |
LBADZHVGVVXFCB-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