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DocumentationIdentifier: MM306164
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM306164 |
| SMILES |
CCC=C(CC=O)C(C)O
|
| InChIKey |
STOPPEHUYUCREJ-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
1.29
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM75910
Similarity: 0.7721
Similarity to MM75910
| Tanimoto metric | 0.7721 |
|---|---|
| Cosine metric | 0.8714 |
| Dice metric | 0.8714 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM307770
Similarity: 0.7163
Similarity to MM307770
| Tanimoto metric | 0.7163 |
|---|---|
| Cosine metric | 0.8347 |
| Dice metric | 0.8347 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM380923
Similarity: 0.702
Similarity to MM380923
| Tanimoto metric | 0.702 |
|---|---|
| Cosine metric | 0.8263 |
| Dice metric | 0.8249 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+476 more
