General Information of the Compound
| Compound ID |
CP0500639
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| Compound Name |
2-chloro-5-(5-fluoropyrimidin-2-yl)-N-((1-hydroxycyclohexyl)methyl)benzamide
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| Structure |
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| Formula |
C18H19ClFN3O2
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| Molecular Weight |
363.82
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| Canonical SMILES |
OC1(CNC(=O)c2cc(ccc2Cl)-c2ncc(F)cn2)CCCCC1
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| InChI |
InChI=1S/C18H19ClFN3O2/c19-15-5-4-12(16-21-9-13(20)10-22-16)8-14(15)17(24)23-11-18(25)6-2-1-3-7-18/h4-5,8-10,25H,1-3,6-7,11H2,(H,23,24)
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| InChIKey |
NPKWTUPLJQXKEA-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