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DocumentationIdentifier: MM408474
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM408474 |
| SMILES |
C=CC(CC)C(=C)CCC
|
| InChIKey |
BBILYSGDEUQUQE-UHFFFAOYSA-N
|
| MW [Da] |
138.25
Automatically obtained from RDkit software. |
| LogP |
3.55
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM350736
Similarity: 0.7912
Similarity to MM350736
| Tanimoto metric | 0.7912 |
|---|---|
| Cosine metric | 0.8848 |
| Dice metric | 0.8834 |
| MW: | 138.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM173223
Similarity: 0.7907
Similarity to MM173223
| Tanimoto metric | 0.7907 |
|---|---|
| Cosine metric | 0.8892 |
| Dice metric | 0.8831 |
| MW: | 124.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM292917
Similarity: 0.7826
Similarity to MM292917
| Tanimoto metric | 0.7826 |
|---|---|
| Cosine metric | 0.8791 |
| Dice metric | 0.878 |
| MW: | 138.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+391 more
