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DocumentationIdentifier: MM351178
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM351178 |
| SMILES |
O=CC(O)C(=O)C(F)CO
|
| InChIKey |
JWMLPPDNOQKZGF-UHFFFAOYSA-N
|
| MW [Da] |
150.11
Automatically obtained from RDkit software. |
| LogP |
-1.55
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM160790
Similarity: 0.7516
Similarity to MM160790
| Tanimoto metric | 0.7516 |
|---|---|
| Cosine metric | 0.8669 |
| Dice metric | 0.8582 |
| MW: | 136.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM350989
Similarity: 0.6387
Similarity to MM350989
| Tanimoto metric | 0.6387 |
|---|---|
| Cosine metric | 0.7799 |
| Dice metric | 0.7796 |
| MW: | 152.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM223881
Similarity: 0.604
Similarity to MM223881
| Tanimoto metric | 0.604 |
|---|---|
| Cosine metric | 0.7531 |
| Dice metric | 0.7531 |
| MW: | 150.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+30 more
