General Information of the Compound
| Compound ID |
CP0535718
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-methoxy-5-[4-(2-methylphenoxy)-3-[(4-methylphenyl)carbamoylamino]phenyl]benzoic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C29H26N2O5
|
||||||||||||||||||
| Molecular Weight |
482.536
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(cc1C(O)=O)-c1ccc(Oc2ccccc2C)c(NC(=O)Nc2ccc(C)cc2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C29H26N2O5/c1-18-8-12-22(13-9-18)30-29(34)31-24-17-21(20-10-14-26(35-3)23(16-20)28(32)33)11-15-27(24)36-25-7-5-4-6-19(25)2/h4-17H,1-3H3,(H,32,33)(H2,30,31,34)
Show/Hide
|
||||||||||||||||||
| InChIKey |
JEPXNUFFZSVTLA-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