Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM298086
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM298086 |
| SMILES |
C=CC(C=C)C(C)C(C)=O
|
| InChIKey |
PTXLHBHINXDLQD-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
2.2
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM160209
Similarity: 0.8737
Similarity to MM160209
| Tanimoto metric | 0.8737 |
|---|---|
| Cosine metric | 0.9347 |
| Dice metric | 0.9326 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM297848
Similarity: 0.7155
Similarity to MM297848
| Tanimoto metric | 0.7155 |
|---|---|
| Cosine metric | 0.835 |
| Dice metric | 0.8342 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM150117
Similarity: 0.6947
Similarity to MM150117
| Tanimoto metric | 0.6947 |
|---|---|
| Cosine metric | 0.8335 |
| Dice metric | 0.8199 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+472 more
