General Information of the Compound
| Compound ID |
CP0516575
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| Compound Name |
3-[[5-chloro-1-(3-methylsulfonylpropyl)indol-2-yl]methyl]-1H-imidazo[4,5-c]pyridin-2-one
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| Structure |
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| Formula |
C19H19ClN4O3S
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| Molecular Weight |
418.906
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| Canonical SMILES |
CS(=O)(=O)CCCn1c(Cn2c3cnccc3[nH]c2=O)cc2cc(Cl)ccc12
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| InChI |
InChI=1S/C19H19ClN4O3S/c1-28(26,27)8-2-7-23-15(10-13-9-14(20)3-4-17(13)23)12-24-18-11-21-6-5-16(18)22-19(24)25/h3-6,9-11H,2,7-8,12H2,1H3,(H,22,25)
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| InChIKey |
YHYFBQUIUGXQSQ-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