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Documentation1-Methylxanthine
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM00015 |
| SMILES |
Cn1c(=O)[nH]c2nc[nH]c2c1=O
|
| InChIKey |
MVOYJPOZRLFTCP-UHFFFAOYSA-N
|
| MW [Da] |
166.14
Automatically obtained from RDkit software. |
| LogP |
-1.05
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
80220
|
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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+6 more
