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| Stem definition | Drug id | CAS RN |
|---|---|---|
| 4748 | 10447-39-9 |
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| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| azlogd74 | LogD at pH 7.4 | 1.114 | Moderate | 0.68 | |
| caco2-efflux | Caco-2 efflux ratio (BA/AB) | 3.926 | Moderate | 0.68 | |
| caco2-intrinsic-papp | Caco-2 intrinsic apparent permeability | 10.940 | 10^-6 cm/s | Moderate | 0.68 |
| dh-clint | Dog hepatocyte intrinsic clearance | 6.950 | uL/min/10^6 cells | Moderate | 0.68 |
| dppb | Dog plasma protein binding (% unbound) | 36.950 | % | Moderate | 0.68 |
| fcs-ppb | Fetal calf serum protein binding (% unbound) | 59.050 | % | Moderate | 0.68 |
| herg | hERG pIC50 | 5.173 | pIC50 | Moderate | 0.68 |
| hh-clint | Human hepatocyte intrinsic clearance | 2.698 | uL/min/10^6 cells | Moderate | 0.68 |
| hlm-clint | Human liver microsomal intrinsic clearance | 7.727 | uL/min/mg protein | Moderate | 0.68 |
| hppb | Human plasma protein binding (% unbound) | 49.020 | % | Moderate | 0.68 |
| kinase-safety-class | ACVR2A,ACVR2B,AKT2,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK4,CDK5,CDK9,DDR1,DYRK1B,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,ITK,JAK2,MAP3K7,MAPK12,MAPK7,MET,NTRK2,PDK2,PDK4,PIM2,PRKDC,SIK2,SIK3,TEK,TGFBR1 | 33 | |||
| kinase-selectivity-class | AXL,ERBB2,GRK2,PDK4,PIK3CD,SIK2 | 6 | |||
| mdck-mdr1-efflux | MDCK-MDR1 efflux ratio | 2.388 | Moderate | 0.68 | |
| mh-clint | Mouse hepatocyte intrinsic clearance | 58.210 | Moderate | 0.68 | |
| mppb | Mouse plasma protein binding (% unbound) | 39.890 | Moderate | 0.68 | |
| nih-mdck-mdr1-efflux | NIH MDCK-MDR1 efflux ratio | 6.699 | Moderate | 0.68 | |
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 | |||
| pppb | Pig plasma protein binding (% unbound) | 54.990 | % | Moderate | 0.68 |
| rh-clint | Rat hepatocyte intrinsic clearance | 90.573 | uL/min/10^6 cells | Moderate | 0.68 |
| rh-fuinc | Rat hepatocyte fraction unbound in incubation | 67.980 | % | Moderate | 0.68 |
| rppb | Rat plasma protein binding (% unbound) | 43.080 | % | Moderate | 0.68 |
| solubility-dd | Solubility at pH 7.4 in DMSO | 905.733 | uM | Moderate | 0.68 |
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| Source | Code | Description |
|---|---|---|
| ATC | R06AX31 | RESPIRATORY SYSTEM ANTIHISTAMINES FOR SYSTEMIC USE ANTIHISTAMINES FOR SYSTEMIC USE Other antihistamines for systemic use |
| MeSH PA | D006633 | Histamine Antagonists |
| MeSH PA | D018377 | Neurotransmitter Agents |
| MeSH PA | D018494 | Histamine Agents |
| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Allergic rhinitis | indication | 61582004 | |
| Sneezing | indication | 76067001 | |
| Seasonal allergic rhinitis | indication | 367498001 | |
| Allergic conjunctivitis | indication | 473460002 | DOID:11204 |
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| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 8.8 | Basic |
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| ID | Source |
|---|---|
| D10230 | KEGG_DRUG |
| CHEBI:134746 | CHEBI |
| CHEMBL1187694 | ChEMBL_ID |
| C014742 | MESH_SUPPLEMENTAL_RECORD_UI |
| 10447-38-8 | SECONDARY_CAS_RN |
| DB13713 | DRUGBANK_ID |
| W9A18RJ49B | UNII |
| C0243449 | UMLSCUI |
| 4714 | INN_ID |
| 65600 | PUBCHEM_CID |
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