Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM379061
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM379061 |
| SMILES |
CC#CC#CC(=O)C1CN1
|
| InChIKey |
RGFHPOMAISWWCW-UHFFFAOYSA-N
|
| MW [Da] |
133.15
Automatically obtained from RDkit software. |
| LogP |
-0.45
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM378663
Similarity: 0.9286
Similarity to MM378663
| Tanimoto metric | 0.9286 |
|---|---|
| Cosine metric | 0.9636 |
| Dice metric | 0.963 |
| MW: | 119.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM400448
Similarity: 0.7792
Similarity to MM400448
| Tanimoto metric | 0.7792 |
|---|---|
| Cosine metric | 0.8827 |
| Dice metric | 0.8759 |
| MW: | 109.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM400398
Similarity: 0.7241
Similarity to MM400398
| Tanimoto metric | 0.7241 |
|---|---|
| Cosine metric | 0.8403 |
| Dice metric | 0.84 |
| MW: | 133.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+46 more
