General Information of the Compound
| Compound ID |
CP0263118
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[3-[2-[[cyclopropanecarbonyl(ethyl)amino]methyl]-4-(trifluoromethyl)phenyl]-4-methoxyindazol-1-yl]acetic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H24F3N3O4
|
||||||||||||||||||
| Molecular Weight |
475.467
|
||||||||||||||||||
| Canonical SMILES |
CCN(Cc1cc(ccc1-c1nn(CC(O)=O)c2cccc(OC)c12)C(F)(F)F)C(=O)C1CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H24F3N3O4/c1-3-29(23(33)14-7-8-14)12-15-11-16(24(25,26)27)9-10-17(15)22-21-18(5-4-6-19(21)34-2)30(28-22)13-20(31)32/h4-6,9-11,14H,3,7-8,12-13H2,1-2H3,(H,31,32)
Show/Hide
|
||||||||||||||||||
| InChIKey |
CCTWRXSUSUIJSL-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