General Information of the Compound
| Compound ID |
CP0516573
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| Compound Name |
3-[[6-chloro-1-(4-hydroxybutyl)indol-2-yl]methyl]-1-cyclopropylimidazo[4,5-c]pyridin-2-one
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| Structure |
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| Formula |
C22H23ClN4O2
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| Molecular Weight |
410.905
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| Canonical SMILES |
OCCCCn1c(Cn2c3cnccc3n(C3CC3)c2=O)cc2ccc(Cl)cc12
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| InChI |
InChI=1S/C22H23ClN4O2/c23-16-4-3-15-11-18(25(20(15)12-16)9-1-2-10-28)14-26-21-13-24-8-7-19(21)27(22(26)29)17-5-6-17/h3-4,7-8,11-13,17,28H,1-2,5-6,9-10,14H2
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| InChIKey |
WITHOBURGRKGEF-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