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| Stem definition | Drug id | CAS RN |
|---|---|---|
| 37 | 2627-69-2 |
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| Property | Value | Reference |
|---|---|---|
| BA (Bioavailability) | 5 % | Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H |
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2B,AXL,BRAF,CAMK2D,CDK5,CDK9,DYRK1B,EIF2AK3,ERBB2,GRK2,ITK,MAP2K6,MAP3K21,MAPK7,NTRK1,NTRK2,PDK1,PDK2,PRKDC,TEK | 20 | |||
| kinase-selectivity-class | MAP2K6,MAP3K21 | 2 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
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| Source | Code | Description |
|---|---|---|
| ATC | C01EB13 | CARDIOVASCULAR SYSTEM CARDIAC THERAPY OTHER CARDIAC PREPARATIONS Other cardiac preparations |
| CHEBI has role | CHEBI:35610 | antineoplastic agent |
| CHEBI has role | CHEBI:50427 | platelet aggregation inhibitor |
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| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 11.55 | acidic |
| pKa2 | 11.83 | acidic |
| pKa3 | 12.51 | acidic |
| pKa4 | 13.19 | acidic |
| pKa5 | 4.67 | Basic |
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| ID | Source |
|---|---|
| D02742 | KEGG_DRUG |
| C0051027 | UMLSCUI |
| CHEBI:28498 | CHEBI |
| CHEMBL1551724 | ChEMBL_ID |
| DB04944 | DRUGBANK_ID |
| C011651 | MESH_SUPPLEMENTAL_RECORD_UI |
| 17513 | PUBCHEM_CID |
| 5133 | IUPHAR_LIGAND_ID |
| 6758 | INN_ID |
| 53IEF47846 | UNII |
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