General Information of the Compound
| Compound ID |
CP0538451
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| Compound Name |
5-[[(6R)-6-methyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]oxy]-N-[3-(trifluoromethyl)phenyl]indole-1-carboxamide
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| Structure |
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| Formula |
C24H20F3N5O2
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| Molecular Weight |
467.451
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| Canonical SMILES |
C[C@@H]1Cc2c(CN1)ncnc2Oc1ccc2n(ccc2c1)C(=O)Nc1cccc(c1)C(F)(F)F
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| InChI |
InChI=1S/C24H20F3N5O2/c1-14-9-19-20(12-28-14)29-13-30-22(19)34-18-5-6-21-15(10-18)7-8-32(21)23(33)31-17-4-2-3-16(11-17)24(25,26)27/h2-8,10-11,13-14,28H,9,12H2,1H3,(H,31,33)/t14-/m1/s1
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| InChIKey |
NSHMANQZSCXBCX-CQSZACIVSA-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