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| Stem definition | Drug id | CAS RN |
|---|---|---|
| prednisone and prednisolone derivatives | 1352 | 50629-82-8 |
| Molecule | Description |
|---|---|
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Synonyms:
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| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| azlogd74 | LogD at pH 7.4 | 2.083 | Moderate | 0.65 | |
| caco2-efflux | Caco-2 efflux ratio (BA/AB) | 2.084 | Moderate | 0.65 | |
| caco2-intrinsic-papp | Caco-2 intrinsic apparent permeability | 31.550 | 10^-6 cm/s | Moderate | 0.65 |
| dh-clint | Dog hepatocyte intrinsic clearance | 6.397 | uL/min/10^6 cells | Moderate | 0.65 |
| dppb | Dog plasma protein binding (% unbound) | 19.930 | % | Moderate | 0.65 |
| fcs-ppb | Fetal calf serum protein binding (% unbound) | 27.730 | % | Moderate | 0.65 |
| herg | hERG pIC50 | 4.552 | pIC50 | Moderate | 0.65 |
| hh-clint | Human hepatocyte intrinsic clearance | 2.999 | uL/min/10^6 cells | Moderate | 0.65 |
| hlm-clint | Human liver microsomal intrinsic clearance | 9.705 | uL/min/mg protein | Moderate | 0.65 |
| hppb | Human plasma protein binding (% unbound) | 14.260 | % | Moderate | 0.65 |
| kinase-safety-class | ACVR2B,CAMK2D,CDK5,EIF2AK3,GRK2,ITK,MAPK10,PDK1,PDK2,PDK4,PRKDC | 11 | |||
| kinase-selectivity-class | EIF2AK3,GRK2,MAP2K6,PDK1 | 4 | |||
| mdck-mdr1-efflux | MDCK-MDR1 efflux ratio | 5.902 | Moderate | 0.65 | |
| mh-clint | Mouse hepatocyte intrinsic clearance | 25.882 | Moderate | 0.65 | |
| mppb | Mouse plasma protein binding (% unbound) | 17.150 | Moderate | 0.65 | |
| nih-mdck-mdr1-efflux | NIH MDCK-MDR1 efflux ratio | 14.125 | Moderate | 0.65 | |
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 | |||
| pppb | Pig plasma protein binding (% unbound) | 22.220 | % | Moderate | 0.65 |
| rh-clint | Rat hepatocyte intrinsic clearance | 40.458 | uL/min/10^6 cells | Moderate | 0.65 |
| rh-fuinc | Rat hepatocyte fraction unbound in incubation | 68.680 | % | Moderate | 0.65 |
| rppb | Rat plasma protein binding (% unbound) | 13.200 | % | Moderate | 0.65 |
| solubility-dd | Solubility at pH 7.4 in DMSO | 378.443 | uM | Moderate | 0.65 |
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| Source | Code | Description |
|---|---|---|
| ATC | D07AC12 | DERMATOLOGICALS CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS CORTICOSTEROIDS, PLAIN Corticosteroids, potent (group III) |
| MeSH PA | D000893 | Anti-Inflammatory Agents |
| MeSH PA | D003879 | Dermatologic Agents |
| MeSH PA | D005938 | Glucocorticoids |
| MeSH PA | D006728 | Hormones |
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| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 11.78 | acidic |
| pKa2 | 12.45 | acidic |
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| ID | Source |
|---|---|
| D07202 | KEGG_DRUG |
| C0062097 | UMLSCUI |
| CHEBI:135724 | CHEBI |
| CHEMBL1587228 | ChEMBL_ID |
| DB13728 | DRUGBANK_ID |
| C036518 | MESH_SUPPLEMENTAL_RECORD_UI |
| 4647 | INN_ID |
| J69Z9UU41Z | UNII |
| 9846332 | PUBCHEM_CID |
| 26416 | RXNORM |
| 006912 | NDDF |
| 704673003 | SNOMEDCT_US |
| 715413003 | SNOMEDCT_US |
| J69Z9UU41Z | INXIGHT DRUGS |
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