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DocumentationIdentifier: MM440021
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM440021 |
| SMILES |
C=CCCC1CN1CCN
|
| InChIKey |
FNDAZIOEWIZJKC-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
0.6
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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MM194644
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| Tanimoto metric | 0.8195 |
|---|---|
| Cosine metric | 0.9053 |
| Dice metric | 0.9008 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM440076
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| Tanimoto metric | 0.7051 |
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| Cosine metric | 0.8271 |
| Dice metric | 0.8271 |
| MW: | 138.21 |
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|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.04 |
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Total active interactions
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MM433894
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| Tanimoto metric | 0.6728 |
|---|---|
| Cosine metric | 0.8046 |
| Dice metric | 0.8044 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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+232 more
