Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM328318
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM328318 |
| SMILES |
C#CC(C#C)CC(C)C=O
|
| InChIKey |
UURHVGAJMMPQCJ-UHFFFAOYSA-N
|
| MW [Da] |
134.18
Automatically obtained from RDkit software. |
| LogP |
1.09
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM141870
Similarity: 0.8955
Similarity to MM141870
| Tanimoto metric | 0.8955 |
|---|---|
| Cosine metric | 0.9463 |
| Dice metric | 0.9449 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM199399
Similarity: 0.791
Similarity to MM199399
| Tanimoto metric | 0.791 |
|---|---|
| Cosine metric | 0.8894 |
| Dice metric | 0.8833 |
| MW: | 120.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.85 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM328211
Similarity: 0.7595
Similarity to MM328211
| Tanimoto metric | 0.7595 |
|---|---|
| Cosine metric | 0.8639 |
| Dice metric | 0.8633 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+355 more
