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DocumentationIdentifier: MM275057
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM275057 |
| SMILES |
CC(=O)NC(CF)C(C)C
|
| InChIKey |
CUXAYHXAEPAOJY-UHFFFAOYSA-N
|
| MW [Da] |
147.19
Automatically obtained from RDkit software. |
| LogP |
1.12
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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| Tanimoto metric | 0.7886 |
|---|---|
| Cosine metric | 0.888 |
| Dice metric | 0.8818 |
| MW: | 133.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM328665
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| Tanimoto metric | 0.6736 |
|---|---|
| Cosine metric | 0.8052 |
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| MW: | 147.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.26 |
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|---|---|---|---|---|---|
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Total active interactions
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MM221532
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| Tanimoto metric | 0.673 |
|---|---|
| Cosine metric | 0.8068 |
| Dice metric | 0.8045 |
| MW: | 147.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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+249 more
