General Information of the Compound
| Compound ID |
CP0570831
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| Compound Name |
3-[[5-chloro-1-(4-hydroxybutyl)imidazo[4,5-b]pyridin-2-yl]methyl]-1-cyclopropylimidazo[4,5-c]pyridin-2-one
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| Structure |
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| Formula |
C20H21ClN6O2
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| Molecular Weight |
412.881
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| Canonical SMILES |
OCCCCn1c(Cn2c3cnccc3n(C3CC3)c2=O)nc2nc(Cl)ccc12
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| InChI |
InChI=1S/C20H21ClN6O2/c21-17-6-5-15-19(23-17)24-18(25(15)9-1-2-10-28)12-26-16-11-22-8-7-14(16)27(20(26)29)13-3-4-13/h5-8,11,13,28H,1-4,9-10,12H2
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| InChIKey |
MCKPYGHZROZIEX-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