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DocumentationIdentifier: MM417460
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM417460 |
| SMILES |
C=CCC(=C)C(C=C)=CC
|
| InChIKey |
KTUXHFMSKGFWCV-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 |
Similar entries
MM174893
Similarity: 0.8163
Similarity to MM174893
| Tanimoto metric | 0.8163 |
|---|---|
| Cosine metric | 0.9035 |
| Dice metric | 0.8989 |
| MW: | 122.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM354917
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Similarity to MM354917
| Tanimoto metric | 0.7273 |
|---|---|
| Cosine metric | 0.8425 |
| Dice metric | 0.8421 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM417195
Similarity: 0.6957
Similarity to MM417195
| Tanimoto metric | 0.6957 |
|---|---|
| Cosine metric | 0.8205 |
| Dice metric | 0.8205 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+106 more
