compound 130 [PMID: 29157600] [2023]
compound 130 [PMID: 29157600]
| SMILES |
O=C(O)C[C@H](NC(=O)c1ccc(-c2ccc(F)cc2)o1)C(=O)O |
| InChIKey |
DXDJHKUZMNAXTM-JTQLQIEISA-N |
Chemical Properties
| Hydrogen bond acceptors |
4 |
| Hydrogen bond donors |
3 |
| Rotatable bonds |
6 |
| Log P |
1.743 |
| Molecular weight (Da) |
321.1 |
| Stereochemistry info |
unspecified |
Bioactivities
|
| Receptor |
Activity |
Source |
| Protein |
Gene |
Species |
Family |
Class |
Type |
Min |
Avg |
Max |
Database |
|
|
|
|
|
|
|
|
|
|
|
| Receptor |
Activity |
Source |
| Protein |
Gene |
Species |
Family |
Class |
Type |
Min |
Avg |
Max |
Database |
|
|
|
|
|
|
|
|
|
|
compound 130 [PMID: 29157600]
Drug properties
| Molecular type |
Small molecule |
| Physiological/Surrogate |
Surrogate |
| Approved drug |
No |
Distribution across phases (no. indications)
Phase I
0
Phase II
0
Phase III
0
Phase IV
0
Compound is not listed as a drug.