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DocumentationIdentifier: MM293245
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM293245 |
| SMILES |
CC(C)C(=O)C=COC=O
|
| InChIKey |
LVKPJIAQQFJDEM-UHFFFAOYSA-N
|
| MW [Da] |
142.15
Automatically obtained from RDkit software. |
| LogP |
0.9
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM169907
Similarity: 0.8242
Similarity to MM169907
| Tanimoto metric | 0.8242 |
|---|---|
| Cosine metric | 0.9078 |
| Dice metric | 0.9036 |
| MW: | 128.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM293243
Similarity: 0.7549
Similarity to MM293243
| Tanimoto metric | 0.7549 |
|---|---|
| Cosine metric | 0.8605 |
| Dice metric | 0.8603 |
| MW: | 140.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM281950
Similarity: 0.7212
Similarity to MM281950
| Tanimoto metric | 0.7212 |
|---|---|
| Cosine metric | 0.8381 |
| Dice metric | 0.838 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+186 more
