General Information of the Compound
| Compound ID |
CP0420472
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| Compound Name |
5-[(7-ethyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl)oxy]-N-[3-(trifluoromethyl)phenyl]indole-1-carboxamide
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| Structure |
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| Formula |
C25H22F3N5O2
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| Molecular Weight |
481.478
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| Canonical SMILES |
CCN1CCc2c(C1)ncnc2Oc1ccc2n(ccc2c1)C(=O)Nc1cccc(c1)C(F)(F)F
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| InChI |
InChI=1S/C25H22F3N5O2/c1-2-32-10-9-20-21(14-32)29-15-30-23(20)35-19-6-7-22-16(12-19)8-11-33(22)24(34)31-18-5-3-4-17(13-18)25(26,27)28/h3-8,11-13,15H,2,9-10,14H2,1H3,(H,31,34)
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| InChIKey |
KDTHRSNAQKQRGJ-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