General Information of the Compound
| Compound ID |
CP0538708
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| Compound Name |
N-(1-acetyl-2,2,4-trimethyl-4-phenyl-3H-quinolin-6-yl)-4-propylbenzamide
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| Structure |
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| Formula |
C30H34N2O2
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| Molecular Weight |
454.614
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| Canonical SMILES |
CCCc1ccc(cc1)C(=O)Nc1ccc2N(C(C)=O)C(C)(C)CC(C)(c3ccccc3)c2c1
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| InChI |
InChI=1S/C30H34N2O2/c1-6-10-22-13-15-23(16-14-22)28(34)31-25-17-18-27-26(19-25)30(5,24-11-8-7-9-12-24)20-29(3,4)32(27)21(2)33/h7-9,11-19H,6,10,20H2,1-5H3,(H,31,34)
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| InChIKey |
GUHHQHLOTUGFKQ-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