General Information of the Compound
| Compound ID |
CP0486151
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| Compound Name |
2-[4-[(N-benzoylanilino)methyl]phenyl]benzoic acid
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| Formula |
C27H21NO3
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| Molecular Weight |
407.469
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| Canonical SMILES |
OC(=O)c1ccccc1-c1ccc(CN(C(=O)c2ccccc2)c2ccccc2)cc1
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| InChI |
InChI=1S/C27H21NO3/c29-26(22-9-3-1-4-10-22)28(23-11-5-2-6-12-23)19-20-15-17-21(18-16-20)24-13-7-8-14-25(24)27(30)31/h1-18H,19H2,(H,30,31)
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| InChIKey |
BAFVLFNRDQYHGA-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