General Information of the Compound
| Compound ID |
CP0228422
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| Compound Name |
N'-(4-chloro-3-fluorophenyl)-N-(1-cyclohexylpyrrolidin-3-yl)oxamide
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| Structure |
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| Formula |
C18H23ClFN3O2
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| Molecular Weight |
367.852
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| Canonical SMILES |
Fc1cc(NC(=O)C(=O)NC2CCN(C2)C2CCCCC2)ccc1Cl
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| InChI |
InChI=1S/C18H23ClFN3O2/c19-15-7-6-12(10-16(15)20)21-17(24)18(25)22-13-8-9-23(11-13)14-4-2-1-3-5-14/h6-7,10,13-14H,1-5,8-9,11H2,(H,21,24)(H,22,25)
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| InChIKey |
SLMIKXBCOQUWAI-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