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| Stem definition | Drug id | CAS RN |
|---|---|---|
| 415 | 362-74-3 |
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| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2B,AURKA,AURKB,AXL,BRAF,CAMK2D,CDK5,CDK9,DDR1,DYRK1B,EIF2AK3,ERBB2,FLT3,GRK2,ITK,MAP2K6,MAP3K21,MAPK7,NTRK2,PDK1,PDK2,PIK3CD,PRKDC,SIK2,STK33,TEK | 26 | |||
| kinase-selectivity-class | AXL,CDK9,GRK2,MAP2K6 | 4 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
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| Source | Code | Description |
|---|---|---|
| ATC | C01CE04 | CARDIOVASCULAR SYSTEM CARDIAC THERAPY CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES Phosphodiesterase inhibitors |
| CHEBI has role | CHEBI:35620 | vasodilator agent |
| CHEBI has role | CHEBI:38147 | cardiotonic drug |
| CHEBI has role | CHEBI:48705 | agonist |
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| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 1.21 | acidic |
| pKa2 | 12.91 | acidic |
| pKa3 | 2.16 | Basic |
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| ID | Source |
|---|---|
| D01238 | KEGG_DRUG |
| C0012054 | UMLSCUI |
| CHEBI:50095 | CHEBI |
| CHEMBL485980 | ChEMBL_ID |
| D003994 | MESH_DESCRIPTOR_UI |
| DB13242 | DRUGBANK_ID |
| 5485 | IUPHAR_LIGAND_ID |
| 5288 | INN_ID |
| 16980-89-5 | SECONDARY_CAS_RN |
| 63X7MBT2LQ | UNII |
| 9687 | PUBCHEM_CID |
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