Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM174405
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM174405 |
| SMILES |
C=C(C=CC)C(C)C=O
|
| InChIKey |
FTIGWLIDBTXOAA-UHFFFAOYSA-N
|
| MW [Da] |
124.18
Automatically obtained from RDkit software. |
| LogP |
1.95
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM356874
Similarity: 0.8586
Similarity to MM356874
| Tanimoto metric | 0.8586 |
|---|---|
| Cosine metric | 0.9266 |
| Dice metric | 0.9239 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM112012
Similarity: 0.7529
Similarity to MM112012
| Tanimoto metric | 0.7529 |
|---|---|
| Cosine metric | 0.8677 |
| Dice metric | 0.8591 |
| MW: | 110.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM02403
Similarity: 0.6771
Similarity to MM02403
| Tanimoto metric | 0.6771 |
|---|---|
| Cosine metric | 0.8087 |
| Dice metric | 0.8075 |
| MW: | 124.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+557 more
