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DocumentationIdentifier: MM267076
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM267076 |
| SMILES |
CC(=CCF)C=C(C)CF
|
| InChIKey |
DZCRVPITHNRWLB-UHFFFAOYSA-N
|
| MW [Da] |
146.18
Automatically obtained from RDkit software. |
| LogP |
2.82
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 | 0.9231 |
|---|---|
| Cosine metric | 0.9608 |
| Dice metric | 0.96 |
| MW: | 128.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| MW: | 146.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.82 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM267075
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Similarity to MM267075
| Tanimoto metric | 0.8182 |
|---|---|
| Cosine metric | 0.9003 |
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||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.26 |
||||
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