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DocumentationIdentifier: MM352338
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM352338 |
| SMILES |
C=CCCC(=C)C(=C)C=C
|
| InChIKey |
OLGQKLDPYMXPBH-UHFFFAOYSA-N
|
| MW [Da] |
134.22
Automatically obtained from RDkit software. |
| LogP |
3.25
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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MM162676
Similarity: 0.8333
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| Tanimoto metric | 0.8333 |
|---|---|
| Cosine metric | 0.9129 |
| Dice metric | 0.9091 |
| MW: | 122.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM173791
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| Cosine metric | 0.9129 |
| Dice metric | 0.9091 |
| MW: | 122.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.08 |
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|---|---|---|---|---|---|
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Total active interactions
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MM352217
Similarity: 0.7595
Similarity to MM352217
| Tanimoto metric | 0.7595 |
|---|---|
| Cosine metric | 0.8639 |
| Dice metric | 0.8633 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.48 |
||||
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| AI: | 0
Total active interactions
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