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DocumentationIdentifier: MM268664
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM268664 |
| SMILES |
CC(O)CC(F)C(=O)CO
|
| InChIKey |
KPCGACKAFGCOIZ-UHFFFAOYSA-N
|
| MW [Da] |
150.15
Automatically obtained from RDkit software. |
| LogP |
-0.34
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM268663
Similarity: 0.7397
Similarity to MM268663
| Tanimoto metric | 0.7397 |
|---|---|
| Cosine metric | 0.8506 |
| Dice metric | 0.8504 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM245207
Similarity: 0.6623
Similarity to MM245207
| Tanimoto metric | 0.6623 |
|---|---|
| Cosine metric | 0.797 |
| Dice metric | 0.7969 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM245208
Similarity: 0.6415
Similarity to MM245208
| Tanimoto metric | 0.6415 |
|---|---|
| Cosine metric | 0.7816 |
| Dice metric | 0.7816 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+216 more
