General Information of the Compound
| Compound ID |
CP0508383
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-chloro-2-fluoro-4-[[5-(4-fluorophenyl)-1,2,3,6-tetrahydropyridin-6-yl]methoxy]-N-(5-fluoropyrimidin-2-yl)benzenesulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H18ClF3N4O3S
|
||||||||||||||||||
| Molecular Weight |
510.925
|
||||||||||||||||||
| Canonical SMILES |
Fc1ccc(cc1)C1=CCCNC1COc1cc(F)c(cc1Cl)S(=O)(=O)Nc1ncc(F)cn1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H18ClF3N4O3S/c23-17-8-21(34(31,32)30-22-28-10-15(25)11-29-22)18(26)9-20(17)33-12-19-16(2-1-7-27-19)13-3-5-14(24)6-4-13/h2-6,8-11,19,27H,1,7,12H2,(H,28,29,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
WOTXCZXHFXVBTE-UHFFFAOYSA-N
|
||||||||||||||||||
| 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
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
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 |
|
|---|
Table of Molecular Bioactivities Related to the Compound