General Information of the Compound
| Compound ID |
CP0426451
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| Compound Name |
2-(1-adamantyl)-N-(2-phenylquinolin-5-yl)acetamide
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| Structure |
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| Formula |
C27H28N2O
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| Molecular Weight |
396.534
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| Canonical SMILES |
O=C(CC12CC3CC(CC(C3)C1)C2)Nc1cccc2nc(ccc12)-c1ccccc1
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| InChI |
InChI=1S/C27H28N2O/c30-26(17-27-14-18-11-19(15-27)13-20(12-18)16-27)29-25-8-4-7-24-22(25)9-10-23(28-24)21-5-2-1-3-6-21/h1-10,18-20H,11-17H2,(H,29,30)
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| InChIKey |
CWJQVKZUACCBRW-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