Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM197103
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM197103 |
| SMILES |
C=CC(C=C)C(C)C=O
|
| InChIKey |
KOYPFYVMIBFSJV-UHFFFAOYSA-N
|
| MW [Da] |
124.18
Automatically obtained from RDkit software. |
| LogP |
1.81
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM400859
Similarity: 0.8571
Similarity to MM400859
| Tanimoto metric | 0.8571 |
|---|---|
| Cosine metric | 0.9258 |
| Dice metric | 0.9231 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM35422
Similarity: 0.8333
Similarity to MM35422
| Tanimoto metric | 0.8333 |
|---|---|
| Cosine metric | 0.9129 |
| Dice metric | 0.9091 |
| MW: | 112.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM197104
Similarity: 0.7714
Similarity to MM197104
| Tanimoto metric | 0.7714 |
|---|---|
| Cosine metric | 0.8714 |
| Dice metric | 0.871 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+607 more
