General Information of the Compound
| Compound ID |
CP0571925
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| Compound Name |
3-[[5-chloro-1-(4,4,4-trifluorobutyl)indol-2-yl]methyl]-1-cyclopropylimidazo[4,5-c]pyridin-2-one
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| Structure |
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| Formula |
C22H20ClF3N4O
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| Molecular Weight |
448.876
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| Canonical SMILES |
FC(F)(F)CCCn1c(Cn2c3cnccc3n(C3CC3)c2=O)cc2cc(Cl)ccc12
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| InChI |
InChI=1S/C22H20ClF3N4O/c23-15-2-5-18-14(10-15)11-17(28(18)9-1-7-22(24,25)26)13-29-20-12-27-8-6-19(20)30(21(29)31)16-3-4-16/h2,5-6,8,10-12,16H,1,3-4,7,9,13H2
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| InChIKey |
ZFWYIKMSNVRTJB-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