General Information of the Compound
| Compound ID |
CP0191257
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| Compound Name |
3-[[2,6-difluoro-4-(2-methylindazol-4-yl)phenyl]methyl]pyrido[3,4-d]pyrimidin-4-one
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| Structure |
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| Formula |
C22H15F2N5O
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| Molecular Weight |
403.392
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| Canonical SMILES |
Cn1cc2c(cccc2n1)-c1cc(F)c(Cn2cnc3cnccc3c2=O)c(F)c1
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| InChI |
InChI=1S/C22H15F2N5O/c1-28-10-16-14(3-2-4-20(16)27-28)13-7-18(23)17(19(24)8-13)11-29-12-26-21-9-25-6-5-15(21)22(29)30/h2-10,12H,11H2,1H3
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| InChIKey |
YEKADQKRALXHSB-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