General Information of the Compound
| Compound ID |
CP0540067
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| Compound Name |
3-chloro-N-[5-[1-[(4-fluorophenyl)carbamoyl]cyclobutyl]pyridin-2-yl]benzamide
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| Structure |
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| Formula |
C23H19ClFN3O2
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| Molecular Weight |
423.875
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| Canonical SMILES |
Fc1ccc(NC(=O)C2(CCC2)c2ccc(NC(=O)c3cccc(Cl)c3)nc2)cc1
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| InChI |
InChI=1S/C23H19ClFN3O2/c24-17-4-1-3-15(13-17)21(29)28-20-10-5-16(14-26-20)23(11-2-12-23)22(30)27-19-8-6-18(25)7-9-19/h1,3-10,13-14H,2,11-12H2,(H,27,30)(H,26,28,29)
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| InChIKey |
SJLTZLFAIZMGBS-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