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DocumentationIdentifier: MM268534
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM268534 |
| SMILES |
CC(=O)OC(C)C(F)CN
|
| InChIKey |
CGEPGVQDHDFJJC-UHFFFAOYSA-N
|
| MW [Da] |
149.17
Automatically obtained from RDkit software. |
| LogP |
0.23
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM171996
Similarity: 0.7361
Similarity to MM171996
| Tanimoto metric | 0.7361 |
|---|---|
| Cosine metric | 0.858 |
| Dice metric | 0.848 |
| MW: | 135.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM144344
Similarity: 0.6319
Similarity to MM144344
| Tanimoto metric | 0.6319 |
|---|---|
| Cosine metric | 0.7949 |
| Dice metric | 0.7745 |
| MW: | 135.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM245009
Similarity: 0.6303
Similarity to MM245009
| Tanimoto metric | 0.6303 |
|---|---|
| Cosine metric | 0.7752 |
| Dice metric | 0.7732 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+177 more
