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DocumentationIdentifier: MM283330
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM283330 |
| SMILES |
CC#CC#CC(=O)C#CC
|
| InChIKey |
BWUOBCYJICZUFI-UHFFFAOYSA-N
|
| MW [Da] |
130.15
Automatically obtained from RDkit software. |
| LogP |
0.61
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM170890
Similarity: 0.9667
Similarity to MM170890
| Tanimoto metric | 0.9667 |
|---|---|
| Cosine metric | 0.9832 |
| Dice metric | 0.9831 |
| MW: | 116.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM369494
Similarity: 0.9063
Similarity to MM369494
| Tanimoto metric | 0.9063 |
|---|---|
| Cosine metric | 0.9509 |
| Dice metric | 0.9508 |
| MW: | 130.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM369480
Similarity: 0.9063
Similarity to MM369480
| Tanimoto metric | 0.9063 |
|---|---|
| Cosine metric | 0.9509 |
| Dice metric | 0.9508 |
| MW: | 130.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+207 more
