| Stem definition | Drug id | CAS RN |
|---|---|---|
| N-methylated xanthine derivatives | 1107 | 519-37-9 |
None
| Property | Value | Reference |
|---|---|---|
| BA (Bioavailability) | 80 % | Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H |
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| Source | Code | Description |
|---|---|---|
| MeSH PA | D018927 | Anti-Asthmatic Agents |
| MeSH PA | D001993 | Bronchodilator Agents |
| MeSH PA | D018373 | Peripheral Nervous System Agents |
| MeSH PA | D019141 | Respiratory System Agents |
None
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| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 13.55 | acidic |
| pKa2 | 1.64 | Basic |
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| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Adenosine receptor A2b | GPCR | Ki | 4.76 | CHEMBL |
| ID | Source |
|---|---|
| D07933 | KEGG_DRUG |
| C0059871 | UMLSCUI |
| CHEBI:94764 | CHEBI |
| CHEMBL699 | ChEMBL_ID |
| 1892 | PUBCHEM_CID |
| C008749 | MESH_SUPPLEMENTAL_RECORD_UI |
| 1667 | INN_ID |
| L164909TBI | UNII |
| 24611 | RXNORM |
| 005937 | NDDF |
| 712689006 | SNOMEDCT_US |
None