General Information of the Compound
| Compound ID |
CP0467360
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| Compound Name |
3-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy-4-(2-methoxyethoxy)phenyl]-N-(3-methoxypropylsulfonyl)propanamide
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| Structure |
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| Formula |
C22H26ClF3N2O7S
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| Molecular Weight |
554.971
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| Canonical SMILES |
COCCCS(=O)(=O)NC(=O)CCc1ccc(OCCOC)cc1Oc1ncc(cc1Cl)C(F)(F)F
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| InChI |
InChI=1S/C22H26ClF3N2O7S/c1-32-8-3-11-36(30,31)28-20(29)7-5-15-4-6-17(34-10-9-33-2)13-19(15)35-21-18(23)12-16(14-27-21)22(24,25)26/h4,6,12-14H,3,5,7-11H2,1-2H3,(H,28,29)
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| InChIKey |
VVYWWDYJVGLJJS-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