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DocumentationIdentifier: MM138092
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM138092 |
| SMILES |
CCCCC(C)(F)CC
|
| InChIKey |
YODDXUQXIQMBSB-UHFFFAOYSA-N
|
| MW [Da] |
132.22
Automatically obtained from RDkit software. |
| LogP |
3.31
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM307693
Similarity: 0.9104
Similarity to MM307693
| Tanimoto metric | 0.9104 |
|---|---|
| Cosine metric | 0.9542 |
| Dice metric | 0.9531 |
| MW: | 146.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM239198
Similarity: 0.8971
Similarity to MM239198
| Tanimoto metric | 0.8971 |
|---|---|
| Cosine metric | 0.9471 |
| Dice metric | 0.9457 |
| MW: | 146.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM227756
Similarity: 0.8841
Similarity to MM227756
| Tanimoto metric | 0.8841 |
|---|---|
| Cosine metric | 0.9402 |
| Dice metric | 0.9385 |
| MW: | 146.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+588 more
