Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM139211
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM139211 |
| SMILES |
CNCC(C)(CO)CO
|
| InChIKey |
JPDWOAOVCHLDTO-UHFFFAOYSA-N
|
| MW [Da] |
133.19
Automatically obtained from RDkit software. |
| LogP |
-0.8
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM312351
Similarity: 0.9531
Similarity to MM312351
| Tanimoto metric | 0.9531 |
|---|---|
| Cosine metric | 0.9763 |
| Dice metric | 0.976 |
| MW: | 149.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.83 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM228994
Similarity: 0.8133
Similarity to MM228994
| Tanimoto metric | 0.8133 |
|---|---|
| Cosine metric | 0.9018 |
| Dice metric | 0.8971 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM102960
Similarity: 0.8033
Similarity to MM102960
| Tanimoto metric | 0.8033 |
|---|---|
| Cosine metric | 0.8963 |
| Dice metric | 0.8909 |
| MW: | 117.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+374 more
