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DocumentationIdentifier: MM375201
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM375201 |
| SMILES |
C#CC(=O)OC=CC#CC
|
| InChIKey |
NMHGYAGOUAIVKM-UHFFFAOYSA-N
|
| MW [Da] |
134.13
Automatically obtained from RDkit software. |
| LogP |
0.7
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM168914
Similarity: 0.8636
Similarity to MM168914
| Tanimoto metric | 0.8636 |
|---|---|
| Cosine metric | 0.9293 |
| Dice metric | 0.9268 |
| MW: | 120.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM280911
Similarity: 0.7843
Similarity to MM280911
| Tanimoto metric | 0.7843 |
|---|---|
| Cosine metric | 0.8796 |
| Dice metric | 0.8791 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM288997
Similarity: 0.7742
Similarity to MM288997
| Tanimoto metric | 0.7742 |
|---|---|
| Cosine metric | 0.8747 |
| Dice metric | 0.8727 |
| MW: | 136.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+189 more
