General Information of the Compound
| Compound ID |
CP0889539
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| Compound Name |
rac-Methyl 4-(Biphenyl-4-yl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
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| Structure |
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| Formula |
C25H25NO3
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| Molecular Weight |
387.479
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| Canonical SMILES |
COC(=O)C1=C(C)NC2=C(C(=O)CC(C)C2)C1c1ccc(-c2ccccc2)cc1
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| InChI |
InChI=1S/C25H25NO3/c1-15-13-20-24(21(27)14-15)23(22(16(2)26-20)25(28)29-3)19-11-9-18(10-12-19)17-7-5-4-6-8-17/h4-12,15,23,26H,13-14H2,1-3H3
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| InChIKey |
QRCOYVBKPOHMKC-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