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| Stem definition | Drug id | CAS RN |
|---|---|---|
| diuretics, chlorothiazide derivatives | 761 | 2259-96-3 |
| Dose | Unit | Route |
|---|---|---|
| 5 | mg | O |
| 5 | mg | O |
| Property | Value | Reference |
|---|---|---|
| S (Water solubility) | 0.28 mg/mL | Bocci G, Oprea TI, Benet LZ |
| BDDCS (Biopharmaceutical Drug Disposition Classification System) | 3 | Bocci G, Oprea TI, Benet LZ |
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2A,ACVR2B,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK5,CDK9,DYRK1B,EGFR,EIF2AK3,EPHB4,ERBB2,GRK2,ITK,JAK2,JAK3,MAP2K6,MAP3K7,MAPK10,MAPK14,MAPK7,MAPK9,MAPKAPK2,MET,NTRK2,PDK1,PDK2,PDK4,PDPK1,PIK3CA,PIK3CB,PIK3CD,PIK3CG,PIM2,PRKDC,SIK2,SIK3,STK33,SYK,TEK,TGFBR1,ZAP70 | 45 | |||
| kinase-selectivity-class | GRK2,MAP2K6,PDK1,PDK2,TEK,ZAP70 | 6 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
| Date | Agency | Company | Orphan |
|---|---|---|---|
| June 8, 1982 | FDA | PHARMACIA AND UPJOHN |
None
None
None
None
| Source | Code | Description |
|---|---|---|
| ATC | C03AA09 | CARDIOVASCULAR SYSTEM DIURETICS LOW-CEILING DIURETICS, THIAZIDES Thiazides, plain |
| ATC | C03AB09 | CARDIOVASCULAR SYSTEM DIURETICS LOW-CEILING DIURETICS, THIAZIDES Thiazides and potassium in combination |
| MeSH PA | D000959 | Antihypertensive Agents |
| MeSH PA | D002317 | Cardiovascular Agents |
| MeSH PA | D004232 | Diuretics |
| CHEBI has role | CHEBI:35498 | diuretic |
| CHEBI has role | CHEBI:35554 | cardiovascular drug |
| CHEBI has role | CHEBI:35674 | antihypertensive agent |
None
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 8.89 | acidic |
| pKa2 | 11.0 | acidic |
| pKa3 | 1.34 | Basic |
None
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| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Solute carrier family 12 member 3 | Transporter | INHIBITOR | CHEMBL | CHEMBL | |||||
| Glutamate receptor 1 | Ion channel | EC50 | 5.70 | CHEMBL | |||||
| Glutamate receptor 2 | Ion channel | EC50 | 5.65 | CHEMBL | |||||
| Glutamate receptor 4 | Ion channel | ALLOSTERIC MODULATOR | EC50 | 5.41 | IUPHAR | ||||
| Glutamate receptor 3 | Ion channel | ALLOSTERIC MODULATOR | EC50 | 4.86 | IUPHAR | ||||
| Glutamate receptor ionotropic, AMPA | Ion channel | IC50 | 5.21 | CHEMBL |
| ID | Source |
|---|---|
| 4017504 | VUID |
| N0000145889 | NUI |
| D01256 | KEGG_DRUG |
| 22033 | RXNORM |
| C0056831 | UMLSCUI |
| CHEBI:31448 | CHEBI |
| CYZ | PDB_CHEM_ID |
| CHEMBL61593 | ChEMBL_ID |
| DB00606 | DRUGBANK_ID |
| C004639 | MESH_SUPPLEMENTAL_RECORD_UI |
| 2910 | PUBCHEM_CID |
| 4167 | IUPHAR_LIGAND_ID |
| 1138 | INN_ID |
| P71U09G5BW | UNII |
| 002304 | NDDF |
| 37006008 | SNOMEDCT_US |
| 4017504 | VANDF |
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