Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM393419
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM393419 |
| SMILES |
C=CC(CCC=O)C(=C)C
|
| InChIKey |
WQUYNFCEZAEZJF-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
2.34
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162242
Similarity: 0.8
Similarity to MM162242
| Tanimoto metric | 0.8 |
|---|---|
| Cosine metric | 0.8944 |
| Dice metric | 0.8889 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM245344
Similarity: 0.6606
Similarity to MM245344
| Tanimoto metric | 0.6606 |
|---|---|
| Cosine metric | 0.7956 |
| Dice metric | 0.7956 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM235214
Similarity: 0.6486
Similarity to MM235214
| Tanimoto metric | 0.6486 |
|---|---|
| Cosine metric | 0.787 |
| Dice metric | 0.7869 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+332 more
