General Information of the Compound
| Compound ID |
CP0420859
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| Compound Name |
CHEMBL4457644
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| Formula |
C14H7ClN4O
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| Molecular Weight |
282.69
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| Canonical SMILES |
O\N=C1\c2ccccc2-c2nc3ncc(Cl)cc3nc12
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| InChI |
InChI=1S/C14H7ClN4O/c15-7-5-10-14(16-6-7)18-11-8-3-1-2-4-9(8)12(19-20)13(11)17-10/h1-6,20H/b19-12-
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| InChIKey |
XOSPTXXKPUNNKX-UNOMPAQXSA-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: PT00998, Mitogen-activated protein kinase 10
Protein ID: PT00863, Mitogen-activated protein kinase 8
Protein ID: PT00872, Mitogen-activated protein kinase 9