General Information of the Compound
| Compound ID |
CP0344271
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-((3-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)benzyl)(3-phenylpropyl)amino)acetic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C30H32N2O4
|
||||||||||||||||||
| Molecular Weight |
484.596
|
||||||||||||||||||
| Canonical SMILES |
Cc1oc(nc1CCOc1cccc(CN(CCCc2ccccc2)CC(O)=O)c1)-c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C30H32N2O4/c1-23-28(31-30(36-23)26-14-6-3-7-15-26)17-19-35-27-16-8-12-25(20-27)21-32(22-29(33)34)18-9-13-24-10-4-2-5-11-24/h2-8,10-12,14-16,20H,9,13,17-19,21-22H2,1H3,(H,33,34)
Show/Hide
|
||||||||||||||||||
| InChIKey |
OKAJTZNCNFNXOS-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