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DocumentationIdentifier: MM149960
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM149960 |
| SMILES |
CC(=O)OC(CN)CF
|
| InChIKey |
KGJBITRUPFPSAR-UHFFFAOYSA-N
|
| MW [Da] |
135.14
Automatically obtained from RDkit software. |
| LogP |
-0.15
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM272284
Similarity: 0.7769
Similarity to MM272284
| Tanimoto metric | 0.7769 |
|---|---|
| Cosine metric | 0.8814 |
| Dice metric | 0.8745 |
| MW: | 149.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM142081
Similarity: 0.6667
Similarity to MM142081
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8005 |
| Dice metric | 0.8 |
| MW: | 135.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM104322
Similarity: 0.6535
Similarity to MM104322
| Tanimoto metric | 0.6535 |
|---|---|
| Cosine metric | 0.8084 |
| Dice metric | 0.7904 |
| MW: | 120.12 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+325 more
