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DocumentationIdentifier: MM334228
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM334228 |
| SMILES |
C=CC(=CC(O)C=C)CC
|
| InChIKey |
ORLLUDDHLIVBRZ-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
2.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM342509
Similarity: 0.8252
Similarity to MM342509
| Tanimoto metric | 0.8252 |
|---|---|
| Cosine metric | 0.9084 |
| Dice metric | 0.9043 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM333909
Similarity: 0.775
Similarity to MM333909
| Tanimoto metric | 0.775 |
|---|---|
| Cosine metric | 0.8737 |
| Dice metric | 0.8732 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM372822
Similarity: 0.7563
Similarity to MM372822
| Tanimoto metric | 0.7563 |
|---|---|
| Cosine metric | 0.8613 |
| Dice metric | 0.8612 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+571 more
