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DocumentationIdentifier: MM257595
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM257595 |
| SMILES |
CC(N)COCC(F)CO
|
| InChIKey |
MWQKFDWSULVILF-UHFFFAOYSA-N
|
| MW [Da] |
151.18
Automatically obtained from RDkit software. |
| LogP |
-0.32
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM165604
Similarity: 0.7976
Similarity to MM165604
| Tanimoto metric | 0.7976 |
|---|---|
| Cosine metric | 0.8931 |
| Dice metric | 0.8874 |
| MW: | 137.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM363034
Similarity: 0.7053
Similarity to MM363034
| Tanimoto metric | 0.7053 |
|---|---|
| Cosine metric | 0.8277 |
| Dice metric | 0.8272 |
| MW: | 151.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM257599
Similarity: 0.6796
Similarity to MM257599
| Tanimoto metric | 0.6796 |
|---|---|
| Cosine metric | 0.8096 |
| Dice metric | 0.8092 |
| MW: | 149.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+533 more
