group E 1682-2106 [PMID:16118363] [3815]
group E 1682-2106 [PMID:16118363]
| SMILES |
CC(C)C(C(=O)O)N1C(=O)/C(=C2/C(=O)N(C)c3ccccc32)SC1=S |
| InChIKey |
ICRQMQBVDGOOFY-QBFSEMIESA-N |
Chemical Properties
| Hydrogen bond acceptors |
5 |
| Hydrogen bond donors |
1 |
| Rotatable bonds |
3 |
| Log P |
2.344 |
| Molecular weight (Da) |
376.1 |
| 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 |
|
|
|
|
|
|
|
|
|
|
group E 1682-2106 [PMID:16118363]
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.