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DocumentationIdentifier: MM172149
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM172149 |
| SMILES |
C=CC(C)C(C)CC=O
|
| InChIKey |
YXNLMIAWTBIGKS-UHFFFAOYSA-N
|
| MW [Da] |
126.2
Automatically obtained from RDkit software. |
| LogP |
2.03
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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||||
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| PI: | 2
Total passive interactions
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| LogP: | 2.2 |
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| AI: | 0
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| LogP: | 2.2 |
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