General Information of the Compound
| Compound ID |
CP0385949
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| Compound Name |
N-[2-phenyl-6-(1H-pyrazol-5-ylamino)pyrimidin-4-yl]prop-2-enamide
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| Structure |
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| Formula |
C16H14N6O
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| Molecular Weight |
306.329
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| Canonical SMILES |
C=CC(=O)Nc1cc(Nc2cc[nH]n2)nc(n1)-c1ccccc1
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| InChI |
InChI=1S/C16H14N6O/c1-2-15(23)19-14-10-13(18-12-8-9-17-22-12)20-16(21-14)11-6-4-3-5-7-11/h2-10H,1H2,(H3,17,18,19,20,21,22,23)
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| InChIKey |
YLMKDUHUYYITGE-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