| Stem definition | Drug id | CAS RN |
|---|---|---|
| beta-adrenoreceptor antagonists | 637 | 94651-09-9 |
None
| Property | Value | Reference |
|---|---|---|
| BA (Bioavailability) | 99 % | Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H |
None
None
None
None
None
None
None
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 9.19 | Basic |
None
None
| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Beta-1 adrenergic receptor | GPCR | Ki | 8 | WOMBAT-PK | |||||
| Beta-2 adrenergic receptor | GPCR | Ki | 6.20 | WOMBAT-PK |
| ID | Source |
|---|---|
| D03490 | KEGG_DRUG |
| C0055713 | UMLSCUI |
| CHEBI:135377 | CHEBI |
| CHEMBL255015 | ChEMBL_ID |
| CHEMBL2110772 | ChEMBL_ID |
| CHEMBL399938 | ChEMBL_ID |
| C053708 | MESH_SUPPLEMENTAL_RECORD_UI |
| 146294 | PUBCHEM_CID |
| 552 | IUPHAR_LIGAND_ID |
| 5250 | INN_ID |
| 63686-79-3 | SECONDARY_CAS_RN |
| 1K2ACH4U3R | UNII |
| CHEMBL2105976 | ChEMBL_ID |
| 63659-12-1 | SECONDARY_CAS_RN |
None