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DocumentationIdentifier: MM354090
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM354090 |
| SMILES |
C=CC(=C)C(=C)CC=CC
|
| InChIKey |
DZRUJUOWYQYTMR-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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| Tanimoto metric | 0.8571 |
|---|---|
| Cosine metric | 0.9243 |
| Dice metric | 0.9231 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.08 |
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MM295089
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Similarity to MM295089
| Tanimoto metric | 0.8261 |
|---|---|
| Cosine metric | 0.905 |
| Dice metric | 0.9048 |
| MW: | 134.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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