Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM392624
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM392624 |
| SMILES |
CC(C)C(C=O)CCC=O
|
| InChIKey |
CZQWCLPFVSPOKD-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
1.44
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM406795
Similarity: 0.8696
Similarity to MM406795
| Tanimoto metric | 0.8696 |
|---|---|
| Cosine metric | 0.9305 |
| Dice metric | 0.9302 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM172046
Similarity: 0.8182
Similarity to MM172046
| Tanimoto metric | 0.8182 |
|---|---|
| Cosine metric | 0.9045 |
| Dice metric | 0.9 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM179686
Similarity: 0.8182
Similarity to MM179686
| Tanimoto metric | 0.8182 |
|---|---|
| Cosine metric | 0.9045 |
| Dice metric | 0.9 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+263 more
