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DocumentationIdentifier: MM363424
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM363424 |
| SMILES |
C=CC(O)C=CCCCO
|
| InChIKey |
VVCRBVFKYUBORZ-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.86
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: 0.8507
Similarity to MM169596
| Tanimoto metric | 0.8507 |
|---|---|
| Cosine metric | 0.9224 |
| Dice metric | 0.9194 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM363667
Similarity: 0.8286
Similarity to MM363667
| Tanimoto metric | 0.8286 |
|---|---|
| Cosine metric | 0.9072 |
| Dice metric | 0.9063 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM363420
Similarity: 0.8082
Similarity to MM363420
| Tanimoto metric | 0.8082 |
|---|---|
| Cosine metric | 0.894 |
| Dice metric | 0.8939 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+689 more
