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DocumentationIdentifier: MM167108
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM167108 |
| SMILES |
CC=CCCC(C)CF
|
| InChIKey |
UMZPCZBNXADRGE-UHFFFAOYSA-N
|
| MW [Da] |
130.21
Automatically obtained from RDkit software. |
| LogP |
2.95
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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MM367473
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| Tanimoto metric | 0.9661 |
|---|---|
| Cosine metric | 0.9829 |
| Dice metric | 0.9828 |
| MW: | 144.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM367475
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| Tanimoto metric | 0.8143 |
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| Cosine metric | 0.9024 |
| Dice metric | 0.8976 |
| MW: | 145.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 1.89 |
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| AI: | 0
Total active interactions
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MM367847
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Similarity to MM367847
| Tanimoto metric | 0.8028 |
|---|---|
| Cosine metric | 0.896 |
| Dice metric | 0.8906 |
| MW: | 141.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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