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DocumentationIdentifier: MM273541
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM273541 |
| SMILES |
C=C(C)CC(=CCC)CC
|
| InChIKey |
LMOJMZDAPWOIAJ-UHFFFAOYSA-N
|
| MW [Da] |
138.25
Automatically obtained from RDkit software. |
| LogP |
3.7
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM265793
Similarity: 0.881
Similarity to MM265793
| Tanimoto metric | 0.881 |
|---|---|
| Cosine metric | 0.9368 |
| Dice metric | 0.9367 |
| MW: | 138.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM150334
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| Tanimoto metric | 0.85 |
|---|---|
| Cosine metric | 0.922 |
| Dice metric | 0.9189 |
| MW: | 124.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM333024
Similarity: 0.8372
Similarity to MM333024
| Tanimoto metric | 0.8372 |
|---|---|
| Cosine metric | 0.9115 |
| Dice metric | 0.9114 |
| MW: | 138.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+577 more
