General Information of the Compound
| Compound ID |
CP0572731
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| Compound Name |
1-cyclopropyl-3-[[1-(3-methylsulfonylpropyl)-5-(trifluoromethyl)indol-2-yl]methyl]imidazo[4,5-c]pyridin-2-one
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| Structure |
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| Formula |
C23H23F3N4O3S
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| Molecular Weight |
492.523
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| Canonical SMILES |
CS(=O)(=O)CCCn1c(Cn2c3cnccc3n(C3CC3)c2=O)cc2cc(ccc12)C(F)(F)F
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| InChI |
InChI=1S/C23H23F3N4O3S/c1-34(32,33)10-2-9-28-18(12-15-11-16(23(24,25)26)3-6-19(15)28)14-29-21-13-27-8-7-20(21)30(22(29)31)17-4-5-17/h3,6-8,11-13,17H,2,4-5,9-10,14H2,1H3
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| InChIKey |
QOFPFKWRHUGDOL-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