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DocumentationIdentifier: MM224821
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM224821 |
| SMILES |
O=C(CO)CCC(F)(F)F
|
| InChIKey |
BNRKUUWCPJEYNE-UHFFFAOYSA-N
|
| MW [Da] |
156.1
Automatically obtained from RDkit software. |
| LogP |
0.89
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM130406
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Similarity to MM130406
| Tanimoto metric | 0.7176 |
|---|---|
| Cosine metric | 0.8471 |
| Dice metric | 0.8356 |
| MW: | 140.1 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM36292
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| Tanimoto metric | 0.6824 |
|---|---|
| Cosine metric | 0.826 |
| Dice metric | 0.8112 |
| MW: | 120.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM224820
Similarity: 0.6289
Similarity to MM224820
| Tanimoto metric | 0.6289 |
|---|---|
| Cosine metric | 0.7744 |
| Dice metric | 0.7722 |
| MW: | 154.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+311 more
