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DocumentationIdentifier: MM64827
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM64827 |
| SMILES |
CC(CF)CC(=O)CCO
|
| InChIKey |
ADDDVVLOMCWMFB-UHFFFAOYSA-N
|
| MW [Da] |
148.18
Automatically obtained from RDkit software. |
| LogP |
0.93
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM45828
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Similarity to MM45828
| Tanimoto metric | 0.7158 |
|---|---|
| Cosine metric | 0.846 |
| Dice metric | 0.8344 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM328420
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Similarity to MM328420
| Tanimoto metric | 0.6923 |
|---|---|
| Cosine metric | 0.8208 |
| Dice metric | 0.8182 |
| MW: | 150.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM262404
Similarity: 0.6857
Similarity to MM262404
| Tanimoto metric | 0.6857 |
|---|---|
| Cosine metric | 0.8158 |
| Dice metric | 0.8136 |
| MW: | 150.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+365 more
