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DocumentationIdentifier: MM304266
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM304266 |
| SMILES |
C=CC=CCC(C)C(=C)C
|
| InChIKey |
WXSVODKZGLOIMT-UHFFFAOYSA-N
|
| MW [Da] |
136.24
Automatically obtained from RDkit software. |
| LogP |
3.33
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162841
Similarity: 0.85
Similarity to MM162841
| Tanimoto metric | 0.85 |
|---|---|
| Cosine metric | 0.922 |
| Dice metric | 0.9189 |
| MW: | 124.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM304078
Similarity: 0.8333
Similarity to MM304078
| Tanimoto metric | 0.8333 |
|---|---|
| Cosine metric | 0.9098 |
| Dice metric | 0.9091 |
| MW: | 138.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM406401
Similarity: 0.7619
Similarity to MM406401
| Tanimoto metric | 0.7619 |
|---|---|
| Cosine metric | 0.8677 |
| Dice metric | 0.8649 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+181 more
