General Information of the Compound
| Compound ID |
CP0409540
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| Compound Name |
N-[3-[4-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxyphenyl]propanamide
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| Structure |
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| Formula |
C17H18N6O2
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| Molecular Weight |
338.371
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| Canonical SMILES |
CCC(=O)Nc1cccc(Oc2nccc(Nc3cc(C)[nH]n3)n2)c1
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| InChI |
InChI=1S/C17H18N6O2/c1-3-16(24)19-12-5-4-6-13(10-12)25-17-18-8-7-14(21-17)20-15-9-11(2)22-23-15/h4-10H,3H2,1-2H3,(H,19,24)(H2,18,20,21,22,23)
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| InChIKey |
QSZZYXSIXKCFOR-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