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| Stem definition | Drug id | CAS RN |
|---|---|---|
| 95 | 63547-13-7 |
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| Property | Value | Reference |
|---|---|---|
| BA (Bioavailability) | 80 % |
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2A,ACVR2B,AKT2,AKT3,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK5,CDK9,DDR1,DYRK1B,EIF2AK3,EPHB4,ERBB2,GRK2,GSK3B,IGF1R,ITK,JAK2,JAK3,MAP2K6,MAP3K21,MAP3K7,MAPK10,MAPK7,MAPK9,MAPKAPK2,MARK4,MET,MTOR,NTRK2,PDK1,PDK2,PDK4,PDPK1,PIK3CB,PIK3CD,PIM2,PRKCD,PRKDC,SIK2,SIK3,STK33,SYK,TEK,TTK,ZAP70 | 50 | |||
| kinase-selectivity-class | AXL,ERBB2,GRK2,MAP2K6,PDK4,TEK | 6 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 | |||
| pld-class | Phospholipidosis risk class (1 = positive, 0 = negative) | 0 | Moderate | 0.72 |
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| Source | Code | Description |
|---|---|---|
| ATC | N06BX17 | NERVOUS SYSTEM PSYCHOANALEPTICS PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS Other psychostimulants and nootropics |
| MeSH PA | D000316 | Adrenergic alpha-Agonists |
| MeSH PA | D000322 | Adrenergic Agonists |
| MeSH PA | D018377 | Neurotransmitter Agents |
| MeSH PA | D018663 | Adrenergic Agents |
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| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 7.28 | acidic |
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| ID | Source |
|---|---|
| D07348 | KEGG_DRUG |
| 45938 | RXNORM |
| C0101700 | UMLSCUI |
| RNW | PDB_CHEM_ID |
| CHEMBL93077 | ChEMBL_ID |
| DB08925 | DRUGBANK_ID |
| C022116 | MESH_SUPPLEMENTAL_RECORD_UI |
| 3033226 | PUBCHEM_CID |
| 5110 | INN_ID |
| BI81Z4542G | UNII |
| CHEBI:135200 | CHEBI |
| 005222 | NDDF |
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