General Information of the Compound
| Compound ID |
CP0532772
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| Compound Name |
2-[5-[[5-methyl-4-(1-propan-2-ylpyrazol-4-yl)pyrimidin-2-yl]amino]-2,3-dihydroindol-1-yl]ethanol
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| Formula |
C21H26N6O
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| Molecular Weight |
378.48
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| Canonical SMILES |
CC(C)n1cc(cn1)-c1nc(Nc2ccc3N(CCO)CCc3c2)ncc1C
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| InChI |
InChI=1S/C21H26N6O/c1-14(2)27-13-17(12-23-27)20-15(3)11-22-21(25-20)24-18-4-5-19-16(10-18)6-7-26(19)8-9-28/h4-5,10-14,28H,6-9H2,1-3H3,(H,22,24,25)
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| InChIKey |
PHHFHRWXQDFKOB-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: PT01204, Receptor-type tyrosine-protein kinase FLT3
Protein ID: PT01214, Tyrosine-protein kinase JAK2
Protein ID: PT04886, Tyrosine-protein kinase JAK2