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DocumentationIdentifier: MM292680
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM292680 |
| SMILES |
CNCC(F)C(C)OC=O
|
| InChIKey |
RIPGYHSISIFQHR-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
MM171996
Similarity: 0.791
Similarity to MM171996
| Tanimoto metric | 0.791 |
|---|---|
| Cosine metric | 0.8894 |
| Dice metric | 0.8833 |
| MW: | 135.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM376000
Similarity: 0.6524
Similarity to MM376000
| Tanimoto metric | 0.6524 |
|---|---|
| Cosine metric | 0.7897 |
| Dice metric | 0.7897 |
| MW: | 149.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM92820
Similarity: 0.6267
Similarity to MM92820
| Tanimoto metric | 0.6267 |
|---|---|
| Cosine metric | 0.7742 |
| Dice metric | 0.7705 |
| MW: | 149.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+93 more
