General Information of the Compound
| Compound ID |
CP0566847
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[[1-[3-(3,5-dichlorophenyl)phenyl]cyclobutyl]-[4-(difluoromethoxy)phenyl]sulfonylamino]acetic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H21Cl2F2NO5S
|
||||||||||||||||||
| Molecular Weight |
556.414
|
||||||||||||||||||
| Canonical SMILES |
OC(=O)CN(C1(CCC1)c1cccc(c1)-c1cc(Cl)cc(Cl)c1)S(=O)(=O)c1ccc(OC(F)F)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H21Cl2F2NO5S/c26-19-12-17(13-20(27)14-19)16-3-1-4-18(11-16)25(9-2-10-25)30(15-23(31)32)36(33,34)22-7-5-21(6-8-22)35-24(28)29/h1,3-8,11-14,24H,2,9-10,15H2,(H,31,32)
Show/Hide
|
||||||||||||||||||
| InChIKey |
OWTNWQIYMJJSLO-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