Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM76951
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM76951 |
| SMILES |
C#CC(=O)C(C)(C=O)C=O
|
| InChIKey |
JKPSVELKHKNDMW-UHFFFAOYSA-N
|
| MW [Da] |
138.12
Automatically obtained from RDkit software. |
| LogP |
-0.41
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM15509
Similarity: 0.7447
Similarity to MM15509
| Tanimoto metric | 0.7447 |
|---|---|
| Cosine metric | 0.8629 |
| Dice metric | 0.8537 |
| MW: | 124.1 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM242699
Similarity: 0.6949
Similarity to MM242699
| Tanimoto metric | 0.6949 |
|---|---|
| Cosine metric | 0.8215 |
| Dice metric | 0.82 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM16027
Similarity: 0.6596
Similarity to MM16027
| Tanimoto metric | 0.6596 |
|---|---|
| Cosine metric | 0.8121 |
| Dice metric | 0.7949 |
| MW: | 110.11 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+40 more
