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DocumentationIdentifier: MM334534
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM334534 |
| SMILES |
O=C(O)CNC(=O)C=CF
|
| InChIKey |
APWLRCUWRQDTBZ-UHFFFAOYSA-N
|
| MW [Da] |
147.11
Automatically obtained from RDkit software. |
| LogP |
-0.33
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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MM43919
Similarity: 0.7931
Similarity to MM43919
| Tanimoto metric | 0.7931 |
|---|---|
| Cosine metric | 0.8906 |
| Dice metric | 0.8846 |
| MW: | 129.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM157324
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| Tanimoto metric | 0.6983 |
|---|---|
| Cosine metric | 0.8356 |
| Dice metric | 0.8223 |
| MW: | 131.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM238173
Similarity: 0.6183
Similarity to MM238173
| Tanimoto metric | 0.6183 |
|---|---|
| Cosine metric | 0.7676 |
| Dice metric | 0.7642 |
| MW: | 149.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+92 more
