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| Stem definition | Drug id | CAS RN |
|---|---|---|
| spasmolytics with a papaverine-like action | 877 | 80387-96-8 |
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| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2A,ACVR2B,AKT2,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK5,CDK9,DDR1,DYRK1B,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,ITK,JAK2,JAK3,MAP3K21,MAP3K7,MAPK7,NTRK2,PDK2,PDK4,PIK3CB,PIM2,PRKDC,SIK2,SIK3,TEK | 32 | |||
| kinase-selectivity-class | AXL,EPHB4,ERBB2,GRK2,PDK4,SIK2,SIK3,TEK | 8 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
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| Source | Code | Description |
|---|---|---|
| ATC | A03AA09 | ALIMENTARY TRACT AND METABOLISM DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS Synthetic anticholinergics, esters with tertiary amino group |
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| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 13.84 | acidic |
| pKa2 | 7.9 | Basic |
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| ID | Source |
|---|---|
| D07079 | KEGG_DRUG |
| 70280-88-5 | SECONDARY_CAS_RN |
| 163406 | RXNORM |
| C0612470 | UMLSCUI |
| CHEBI:135397 | CHEBI |
| CHEMBL3304486 | ChEMBL_ID |
| CHEMBL3301670 | ChEMBL_ID |
| DB13380 | DRUGBANK_ID |
| C028777 | MESH_SUPPLEMENTAL_RECORD_UI |
| 165124 | PUBCHEM_CID |
| 2174 | INN_ID |
| 843C4UPZ2F | UNII |
| 005404 | NDDF |
| 005405 | NDDF |
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