General Information of the Compound
| Compound ID |
CP0528616
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| Compound Name |
5-cyclohexyl-1-(2,4-dichlorophenyl)-3-methyl-2-phenyl-6,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4(5H)-one
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| Structure |
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| Formula |
C26H26Cl2N2O
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| Molecular Weight |
453.413
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| Canonical SMILES |
Cc1c2c(CCN(C3CCCCC3)C2=O)n(c1-c1ccccc1)-c1ccc(Cl)cc1Cl
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| InChI |
InChI=1S/C26H26Cl2N2O/c1-17-24-23(14-15-29(26(24)31)20-10-6-3-7-11-20)30(22-13-12-19(27)16-21(22)28)25(17)18-8-4-2-5-9-18/h2,4-5,8-9,12-13,16,20H,3,6-7,10-11,14-15H2,1H3
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| InChIKey |
FNJBHNSWEFHVHN-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