General Information of the Compound
| Compound ID |
CP0396061
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| Compound Name |
2-[(4-tert-butylbenzoyl)amino]-N-(3-cyanophenyl)benzamide
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| Structure |
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| Formula |
C25H23N3O2
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| Molecular Weight |
397.478
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| Canonical SMILES |
CC(C)(C)c1ccc(cc1)C(=O)Nc1ccccc1C(=O)Nc1cccc(c1)C#N
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| InChI |
InChI=1S/C25H23N3O2/c1-25(2,3)19-13-11-18(12-14-19)23(29)28-22-10-5-4-9-21(22)24(30)27-20-8-6-7-17(15-20)16-26/h4-15H,1-3H3,(H,27,30)(H,28,29)
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| InChIKey |
LKUZQEKSMQEKAF-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