General Information of the Compound
| Compound ID |
CP0559963
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| Compound Name |
3-chloro-N-[[3-(3-methoxypropyl)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]-2-propan-2-ylpyrazolo[1,5-a]pyridine-7-carboxamide
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| Structure |
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| Formula |
C21H29ClN4O2
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| Molecular Weight |
404.942
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| Canonical SMILES |
COCCCN1CC2C(CNC(=O)c3cccc4c(Cl)c(nn34)C(C)C)C2C1
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| InChI |
InChI=1S/C21H29ClN4O2/c1-13(2)20-19(22)17-6-4-7-18(26(17)24-20)21(27)23-10-14-15-11-25(12-16(14)15)8-5-9-28-3/h4,6-7,13-16H,5,8-12H2,1-3H3,(H,23,27)
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| InChIKey |
KLECHXMLPPZMLD-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