General Information of the Compound
| Compound ID |
CP0318103
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| Compound Name |
N-[2-[[5-methyl-2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]amino]phenyl]prop-2-enamide
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| Structure |
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| Formula |
C18H19N7O
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| Molecular Weight |
349.398
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| Canonical SMILES |
Cc1cnc(Nc2ccnn2C)nc1Nc1ccccc1NC(=O)C=C
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| InChI |
InChI=1S/C18H19N7O/c1-4-16(26)21-13-7-5-6-8-14(13)22-17-12(2)11-19-18(24-17)23-15-9-10-20-25(15)3/h4-11H,1H2,2-3H3,(H,21,26)(H2,19,22,23,24)
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| InChIKey |
KEEFYWUVYWZFPQ-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