DIMETHYLGRISABINE [346826]
DIMETHYLGRISABINE
| SMILES |
COc1cc2c(cc1OC)[C@@H](Cc1ccc(Oc3cc(C[C@H]4c5cc(OC)c(OC)cc5CCN4C)ccc3OC)cc1)N(C)CC2 |
| InChIKey |
UHYCXSGUNAWVBW-SAIUNTKASA-N |
Chemical Properties
| Hydrogen bond acceptors |
8 |
| Hydrogen bond donors |
0 |
| Rotatable bonds |
11 |
| Log P |
7.065 |
| Molecular weight (Da) |
638.3 |
| Stereochemistry info |
full |
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 |
|
|
|
|
|
|
|
|
|
|
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.