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DocumentationIdentifier: MM272284
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM272284 |
| SMILES |
CNCC(CF)OC(C)=O
|
| InChIKey |
FJSGPCFKRLQTDC-UHFFFAOYSA-N
|
| MW [Da] |
149.17
Automatically obtained from RDkit software. |
| LogP |
0.11
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM149960
Similarity: 0.7769
Similarity to MM149960
| Tanimoto metric | 0.7769 |
|---|---|
| Cosine metric | 0.8814 |
| Dice metric | 0.8745 |
| MW: | 135.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM67245
Similarity: 0.6939
Similarity to MM67245
| Tanimoto metric | 0.6939 |
|---|---|
| Cosine metric | 0.8201 |
| Dice metric | 0.8193 |
| MW: | 149.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM135242
Similarity: 0.6923
Similarity to MM135242
| Tanimoto metric | 0.6923 |
|---|---|
| Cosine metric | 0.8321 |
| Dice metric | 0.8182 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+101 more
