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DocumentationIdentifier: MM228320
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM228320 |
| SMILES |
CNC(C)(C)C=CC(C)O
|
| InChIKey |
VTRQMGDNNAMOSU-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
0.92
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 | 0.757 |
|---|---|
| Cosine metric | 0.8701 |
| Dice metric | 0.8617 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
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| LogP: | 0.53 |
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| AI: | 0
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