General Information of the Compound
| Compound ID |
CP0408617
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| Compound Name |
N-[1-acetyl-2,2,4-trimethyl-4-(4-methylphenyl)-3H-quinolin-6-yl]-4-phenylbenzamide
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| Structure |
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| Formula |
C34H34N2O2
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| Molecular Weight |
502.658
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| Canonical SMILES |
CC(=O)N1c2ccc(NC(=O)c3ccc(cc3)-c3ccccc3)cc2C(C)(CC1(C)C)c1ccc(C)cc1
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| InChI |
InChI=1S/C34H34N2O2/c1-23-11-17-28(18-12-23)34(5)22-33(3,4)36(24(2)37)31-20-19-29(21-30(31)34)35-32(38)27-15-13-26(14-16-27)25-9-7-6-8-10-25/h6-21H,22H2,1-5H3,(H,35,38)
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| InChIKey |
QMOJIASAZQBYMM-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