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DocumentationIdentifier: MM294685
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM294685 |
| SMILES |
C=C(C#CC#CC)C(C)O
|
| InChIKey |
KTQVSDLZHHLRFY-UHFFFAOYSA-N
|
| MW [Da] |
134.18
Automatically obtained from RDkit software. |
| LogP |
0.95
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM163704
Similarity: 0.8952
Similarity to MM163704
| Tanimoto metric | 0.8952 |
|---|---|
| Cosine metric | 0.9462 |
| Dice metric | 0.9447 |
| MW: | 120.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM359204
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Similarity to MM359204
| Tanimoto metric | 0.7344 |
|---|---|
| Cosine metric | 0.8481 |
| Dice metric | 0.8468 |
| MW: | 130.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM108765
Similarity: 0.7143
Similarity to MM108765
| Tanimoto metric | 0.7143 |
|---|---|
| Cosine metric | 0.8452 |
| Dice metric | 0.8333 |
| MW: | 110.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+426 more
