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DocumentationIdentifier: MM363667
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM363667 |
| SMILES |
C=CCCC=CC(O)C=C
|
| InChIKey |
UQHTUUJTIGNMHP-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
MM169596
Similarity: 0.9344
Similarity to MM169596
| Tanimoto metric | 0.9344 |
|---|---|
| Cosine metric | 0.9667 |
| Dice metric | 0.9661 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM324722
Similarity: 0.8507
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| Tanimoto metric | 0.8507 |
|---|---|
| Cosine metric | 0.9195 |
| Dice metric | 0.9194 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM363424
Similarity: 0.8286
Similarity to MM363424
| Tanimoto metric | 0.8286 |
|---|---|
| Cosine metric | 0.9072 |
| Dice metric | 0.9063 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.86 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+601 more
