General Information of the Compound
| Compound ID |
CP0489470
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| Compound Name |
2-chloro-N-((1-hydroxycycloheptyl)methyl)-5-(pyridin-2-yl)benzamide
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| Structure |
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| Formula |
C20H23ClN2O2
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| Molecular Weight |
358.869
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| Canonical SMILES |
OC1(CNC(=O)c2cc(ccc2Cl)-c2ccccn2)CCCCCC1
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| InChI |
InChI=1S/C20H23ClN2O2/c21-17-9-8-15(18-7-3-6-12-22-18)13-16(17)19(24)23-14-20(25)10-4-1-2-5-11-20/h3,6-9,12-13,25H,1-2,4-5,10-11,14H2,(H,23,24)
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| InChIKey |
GKCWCLHXKQQJNL-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