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DocumentationIdentifier: MM427441
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM427441 |
| SMILES |
C=CC1(OCCCC)CC1
|
| InChIKey |
AYNQITXSGHKHPH-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
2.52
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM203087
Similarity: 0.9237
Similarity to MM203087
| Tanimoto metric | 0.9237 |
|---|---|
| Cosine metric | 0.9611 |
| Dice metric | 0.9604 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM428090
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Similarity to MM428090
| Tanimoto metric | 0.881 |
|---|---|
| Cosine metric | 0.9367 |
| Dice metric | 0.9367 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM341365
Similarity: 0.8516
Similarity to MM341365
| Tanimoto metric | 0.8516 |
|---|---|
| Cosine metric | 0.9198 |
| Dice metric | 0.9198 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+77 more
