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DocumentationIdentifier: MM281353
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM281353 |
| SMILES |
CC#CC(=O)CC#CCC
|
| InChIKey |
SCBBHEIYLATHGC-UHFFFAOYSA-N
|
| MW [Da] |
134.18
Automatically obtained from RDkit software. |
| LogP |
1.38
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM282933
Similarity: 0.9286
Similarity to MM282933
| Tanimoto metric | 0.9286 |
|---|---|
| Cosine metric | 0.9632 |
| Dice metric | 0.963 |
| MW: | 134.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM359263
Similarity: 0.9265
Similarity to MM359263
| Tanimoto metric | 0.9265 |
|---|---|
| Cosine metric | 0.9619 |
| Dice metric | 0.9618 |
| MW: | 134.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM158613
Similarity: 0.8971
Similarity to MM158613
| Tanimoto metric | 0.8971 |
|---|---|
| Cosine metric | 0.946 |
| Dice metric | 0.9457 |
| MW: | 120.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+534 more
