General Information of the Compound
| Compound ID |
CP0532546
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| Compound Name |
N-cyclohexyl-3-[(3,5-difluorophenoxy)methyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide
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| Structure |
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| Formula |
C21H26F2N4O2
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| Molecular Weight |
404.461
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| Canonical SMILES |
Cn1nc(COc2cc(F)cc(F)c2)c2CN(CCc12)C(=O)NC1CCCCC1
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| InChI |
InChI=1S/C21H26F2N4O2/c1-26-20-7-8-27(21(28)24-16-5-3-2-4-6-16)12-18(20)19(25-26)13-29-17-10-14(22)9-15(23)11-17/h9-11,16H,2-8,12-13H2,1H3,(H,24,28)
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| InChIKey |
VADTWBSDMRYZSG-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