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DocumentationIdentifier: MM260718
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM260718 |
| SMILES |
C=C(C=CC=C(C)C)CC
|
| InChIKey |
VJFUCFGDUZKWQT-UHFFFAOYSA-N
|
| MW [Da] |
136.24
Automatically obtained from RDkit software. |
| LogP |
3.48
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM170184
Similarity: 0.8615
Similarity to MM170184
| Tanimoto metric | 0.8615 |
|---|---|
| Cosine metric | 0.9282 |
| Dice metric | 0.9256 |
| MW: | 122.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM366096
Similarity: 0.8358
Similarity to MM366096
| Tanimoto metric | 0.8358 |
|---|---|
| Cosine metric | 0.912 |
| Dice metric | 0.9106 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM282160
Similarity: 0.7467
Similarity to MM282160
| Tanimoto metric | 0.7467 |
|---|---|
| Cosine metric | 0.855 |
| Dice metric | 0.855 |
| MW: | 134.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+451 more
