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DocumentationIdentifier: MM264457
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM264457 |
| SMILES |
C=C(CO)NC(=O)C=CF
|
| InChIKey |
SNVDUAMSJPXRPK-UHFFFAOYSA-N
|
| MW [Da] |
145.13
Automatically obtained from RDkit software. |
| LogP |
0.09
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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MM142715
Similarity: 0.7863
Similarity to MM142715
| Tanimoto metric | 0.7863 |
|---|---|
| Cosine metric | 0.8867 |
| Dice metric | 0.8803 |
| MW: | 127.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| Tanimoto metric | 0.7481 |
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| Cosine metric | 0.8649 |
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| MW: | 129.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.12 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM333841
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| Tanimoto metric | 0.7063 |
|---|---|
| Cosine metric | 0.8285 |
| Dice metric | 0.8278 |
| MW: | 145.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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