General Information of the Compound
| Compound ID |
CP0379745
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-Chloro-3'-((2-isopropyl-1-oxoisoindolin-5-yloxy)methyl)biphenyl-3-carboxylic Acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H22ClNO4
|
||||||||||||||||||
| Molecular Weight |
435.907
|
||||||||||||||||||
| Canonical SMILES |
CC(C)N1Cc2cc(OCc3cccc(c3)-c3ccc(Cl)c(c3)C(O)=O)ccc2C1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H22ClNO4/c1-15(2)27-13-19-11-20(7-8-21(19)24(27)28)31-14-16-4-3-5-17(10-16)18-6-9-23(26)22(12-18)25(29)30/h3-12,15H,13-14H2,1-2H3,(H,29,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
IPHOWNGWSDCVGP-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