General Information of the Compound
| Compound ID |
CP0455757
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| Compound Name |
2-methyl-6-[5-morpholin-4-yl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-7-[[(1R)-1-(1,3-oxazol-4-yl)ethyl]amino]-4H-pyrazolo[4,3-b]pyridin-5-one
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| Structure |
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| Formula |
C24H23F3N8O3
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| Molecular Weight |
528.495
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| Canonical SMILES |
C[C@@H](Nc1c(-c2nc3cc(c(cc3[nH]2)N2CCOCC2)C(F)(F)F)c(=O)[nH]c2cn(C)nc12)c1cocn1
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| InChI |
InChI=1S/C24H23F3N8O3/c1-12(17-10-38-11-28-17)29-21-19(23(36)32-16-9-34(2)33-20(16)21)22-30-14-7-13(24(25,26)27)18(8-15(14)31-22)35-3-5-37-6-4-35/h7-12,29H,3-6H2,1-2H3,(H,30,31)(H,32,36)/t12-/m1/s1
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| InChIKey |
FGKBTJYIPUBPBL-GFCCVEGCSA-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: PT01411, Fibroblast growth factor receptor 3
Cell Viability or Cytotoxicity Assay
| Cell Line ID | Cell Line Name | Cell Line Organism | |
| CL000035 | NIH 3T3 | Mus musculus (Mouse) | 1 |
| 1 |
IC50 = 27886 nM
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