General Information of the Compound
| Compound ID |
CP0562527
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| Compound Name |
1-(4,6-dichloro-1H-imidazo[4,5-c]pyridin-2-yl)-3-[(1,3-dimethyl-4-propan-2-ylpyrazolo[3,4-b]pyridin-6-yl)amino]urea
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| Structure |
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| Formula |
C18H19Cl2N9O
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| Molecular Weight |
448.318
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| Canonical SMILES |
CC(C)c1cc(NNC(=O)Nc2nc3c(Cl)nc(Cl)cc3[nH]2)nc2n(C)nc(C)c12
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| InChI |
InChI=1S/C18H19Cl2N9O/c1-7(2)9-5-12(23-16-13(9)8(3)28-29(16)4)26-27-18(30)25-17-21-10-6-11(19)22-15(20)14(10)24-17/h5-7H,1-4H3,(H,23,26)(H3,21,24,25,27,30)
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| InChIKey |
SSSBXZCHUNWTLJ-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