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DocumentationIdentifier: MM239256
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM239256 |
| SMILES |
CCOCCC(C)(O)CF
|
| InChIKey |
IPTMCZQLLFRAOI-UHFFFAOYSA-N
|
| MW [Da] |
150.19
Automatically obtained from RDkit software. |
| LogP |
1.13
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM41801
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Similarity to MM41801
| Tanimoto metric | 0.8646 |
|---|---|
| Cosine metric | 0.9298 |
| Dice metric | 0.9274 |
| MW: | 136.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM362911
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| Tanimoto metric | 0.6408 |
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| Cosine metric | 0.7884 |
| Dice metric | 0.7811 |
| MW: | 154.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.69 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM131465
Similarity: 0.6354
Similarity to MM131465
| Tanimoto metric | 0.6354 |
|---|---|
| Cosine metric | 0.7971 |
| Dice metric | 0.7771 |
| MW: | 132.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+385 more
