General Information of the Compound
| Compound ID |
CP0379896
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[3-[3-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]-5-fluoro-2-methylindol-1-yl]acetic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H19FN2O3
|
||||||||||||||||||
| Molecular Weight |
378.403
|
||||||||||||||||||
| Canonical SMILES |
Cc1noc(C)c1-c1cccc(c1)-c1c(C)n(CC(O)=O)c2ccc(F)cc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H19FN2O3/c1-12-21(14(3)28-24-12)15-5-4-6-16(9-15)22-13(2)25(11-20(26)27)19-8-7-17(23)10-18(19)22/h4-10H,11H2,1-3H3,(H,26,27)
Show/Hide
|
||||||||||||||||||
| InChIKey |
NXYHLZIGZZCLOO-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