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DocumentationIdentifier: MM246777
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM246777 |
| SMILES |
C=C(C)C(=C)CC(=O)CC
|
| InChIKey |
KDKVKRPONWNGOH-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
2.49
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM269655
Similarity: 0.823
Similarity to MM269655
| Tanimoto metric | 0.823 |
|---|---|
| Cosine metric | 0.9036 |
| Dice metric | 0.9029 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM134005
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Similarity to MM134005
| Tanimoto metric | 0.8224 |
|---|---|
| Cosine metric | 0.9069 |
| Dice metric | 0.9026 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM263570
Similarity: 0.7778
Similarity to MM263570
| Tanimoto metric | 0.7778 |
|---|---|
| Cosine metric | 0.8808 |
| Dice metric | 0.875 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+191 more
