General Information of the Compound
| Compound ID |
CP0144258
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| Compound Name |
3-(3-(3-(2-methyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl)phenoxy)phenylsulfonyl)propan-1-ol
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| Structure |
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| Formula |
C24H21F3N2O4S
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| Molecular Weight |
490.503
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| Canonical SMILES |
Cc1nc2c(cccn2c1-c1cccc(Oc2cccc(c2)S(=O)(=O)CCCO)c1)C(F)(F)F
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| InChI |
InChI=1S/C24H21F3N2O4S/c1-16-22(29-11-4-10-21(23(29)28-16)24(25,26)27)17-6-2-7-18(14-17)33-19-8-3-9-20(15-19)34(31,32)13-5-12-30/h2-4,6-11,14-15,30H,5,12-13H2,1H3
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| InChIKey |
BEGFQLFGEWZPNM-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