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DocumentationIdentifier: MM242308
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM242308 |
| SMILES |
C=CC(C)(C)C(=O)CCO
|
| InChIKey |
IQMUWAXCOZMYNF-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
1.15
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 | 0.7778 |
|---|---|
| Cosine metric | 0.8819 |
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||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.76 |
||||
|---|---|---|---|---|---|
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Total passive interactions
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| LogP: | 2.18 |
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||||
|---|---|---|---|---|---|
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Total passive interactions
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+310 more
