Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM242360
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM242360 |
| SMILES |
C=CCC(=O)C(C)(C)C=O
|
| InChIKey |
DZJAXNSUKMDKCU-UHFFFAOYSA-N
|
| MW [Da] |
140.18
Automatically obtained from RDkit software. |
| LogP |
1.36
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM173401
Similarity: 0.7835
Similarity to MM173401
| Tanimoto metric | 0.7835 |
|---|---|
| Cosine metric | 0.8852 |
| Dice metric | 0.8786 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM137887
Similarity: 0.732
Similarity to MM137887
| Tanimoto metric | 0.732 |
|---|---|
| Cosine metric | 0.8555 |
| Dice metric | 0.8452 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM132120
Similarity: 0.6598
Similarity to MM132120
| Tanimoto metric | 0.6598 |
|---|---|
| Cosine metric | 0.8123 |
| Dice metric | 0.795 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+297 more
