General Information of the Compound
| Compound ID |
CP0234122
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| Compound Name |
3-[3-(3-methylsulfonylphenoxy)phenyl]-2-(piperidin-1-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine
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| Structure |
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| Formula |
C27H26F3N3O3S
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| Molecular Weight |
529.584
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| Canonical SMILES |
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(CN3CCCCC3)nc3c(cccn23)C(F)(F)F)c1
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| InChI |
InChI=1S/C27H26F3N3O3S/c1-37(34,35)22-11-6-10-21(17-22)36-20-9-5-8-19(16-20)25-24(18-32-13-3-2-4-14-32)31-26-23(27(28,29)30)12-7-15-33(25)26/h5-12,15-17H,2-4,13-14,18H2,1H3
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| InChIKey |
BSNQJTLXVANSQQ-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