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DocumentationIdentifier: MM287770
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM287770 |
| SMILES |
C#CC=COCOC(C)=O
|
| InChIKey |
RXKCTIZXCCSODL-UHFFFAOYSA-N
|
| MW [Da] |
140.14
Automatically obtained from RDkit software. |
| LogP |
0.67
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM153035
Similarity: 0.8313
Similarity to MM153035
| Tanimoto metric | 0.8313 |
|---|---|
| Cosine metric | 0.9118 |
| Dice metric | 0.9079 |
| MW: | 130.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM287656
Similarity: 0.734
Similarity to MM287656
| Tanimoto metric | 0.734 |
|---|---|
| Cosine metric | 0.8468 |
| Dice metric | 0.8466 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM287658
Similarity: 0.7292
Similarity to MM287658
| Tanimoto metric | 0.7292 |
|---|---|
| Cosine metric | 0.8434 |
| Dice metric | 0.8434 |
| MW: | 148.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+130 more
