General Information of the Compound
| Compound ID |
CP0525641
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| Compound Name |
4-[(4-benzyl-5-methylpyrimidin-2-yl)amino]-N-(2,6-dimethylphenyl)benzamide
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| Structure |
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| Formula |
C27H26N4O
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| Molecular Weight |
422.532
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| Canonical SMILES |
Cc1cnc(Nc2ccc(cc2)C(=O)Nc2c(C)cccc2C)nc1Cc1ccccc1
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| InChI |
InChI=1S/C27H26N4O/c1-18-8-7-9-19(2)25(18)31-26(32)22-12-14-23(15-13-22)29-27-28-17-20(3)24(30-27)16-21-10-5-4-6-11-21/h4-15,17H,16H2,1-3H3,(H,31,32)(H,28,29,30)
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| InChIKey |
FTQAJUPQIMHTNT-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