General Information of the Compound
| Compound ID |
CP0428704
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| Compound Name |
5-cyclohexyl-1-(2,4-dichlorophenyl)-2-(furan-2-yl)-3-methyl-6,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4(5H)-one
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| Structure |
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| Formula |
C24H24Cl2N2O2
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| Molecular Weight |
443.374
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| Canonical SMILES |
Cc1c2c(CCN(C3CCCCC3)C2=O)n(c1-c1ccco1)-c1ccc(Cl)cc1Cl
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| InChI |
InChI=1S/C24H24Cl2N2O2/c1-15-22-20(11-12-27(24(22)29)17-6-3-2-4-7-17)28(23(15)21-8-5-13-30-21)19-10-9-16(25)14-18(19)26/h5,8-10,13-14,17H,2-4,6-7,11-12H2,1H3
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| InChIKey |
UTGGHWRFKOFSKZ-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