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| Stem definition | Drug id | CAS RN |
|---|---|---|
| antibiotics, cefalosporanic acid derivatives | 4159 | 135889-00-8 |
| Molecule | Description |
|---|---|
|
Synonyms:
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| Dose | Unit | Route |
|---|---|---|
| 0.45 | g | O |
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| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| azlogd74 | LogD at pH 7.4 | -1.482 | Moderate | 0.65 | |
| caco2-efflux | Caco-2 efflux ratio (BA/AB) | 1.230 | Moderate | 0.65 | |
| caco2-intrinsic-papp | Caco-2 intrinsic apparent permeability | 0.519 | 10^-6 cm/s | Moderate | 0.65 |
| dh-clint | Dog hepatocyte intrinsic clearance | 1.820 | uL/min/10^6 cells | Moderate | 0.65 |
| dppb | Dog plasma protein binding (% unbound) | 55.110 | % | Moderate | 0.65 |
| fcs-ppb | Fetal calf serum protein binding (% unbound) | 42.520 | % | Moderate | 0.65 |
| herg | hERG pIC50 | 4.212 | pIC50 | Moderate | 0.65 |
| hh-clint | Human hepatocyte intrinsic clearance | 2.218 | uL/min/10^6 cells | Moderate | 0.65 |
| hlm-clint | Human liver microsomal intrinsic clearance | 3.990 | uL/min/mg protein | Moderate | 0.65 |
| hppb | Human plasma protein binding (% unbound) | 37.490 | % | Moderate | 0.65 |
| kinase-safety-class | ACVR2A,ACVR2B,ACVRL1,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK5,CDK9,DDR1,DYRK1B,EGFR,EIF2AK3,ERBB2,FLT3,GRK2,GRK3,GSK3B,IKBKB,ITK,JAK1,JAK2,KIT,MAP2K6,MAP3K14,MAP3K21,MAP3K7,MAPK10,MAPK7,MAPKAPK2,MARK4,MTOR,NTRK2,PDK1,PDK2,PIK3CA,PIK3CB,PIK3CD,PIK3CG,PIM2,PRKDC,SIK2,STK33,SYK,TEK,TGFBR1,TTK | 49 | |||
| kinase-selectivity-class | ACVR2B,AXL,CDK9,DYRK1B,EIF2AK3,EPHB4,GRK2,JAK2,MAP2K6,MAP3K14,MAPK12,MAPK7,PRKDC,STK33,TEK,TGFBR1,TTK | 17 | |||
| mdck-mdr1-efflux | MDCK-MDR1 efflux ratio | 0.989 | Moderate | 0.65 | |
| mh-clint | Mouse hepatocyte intrinsic clearance | 4.699 | Moderate | 0.65 | |
| mppb | Mouse plasma protein binding (% unbound) | 51.670 | Moderate | 0.65 | |
| nih-mdck-mdr1-efflux | NIH MDCK-MDR1 efflux ratio | 1.253 | Moderate | 0.65 | |
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 | |||
| pppb | Pig plasma protein binding (% unbound) | 35.200 | % | Moderate | 0.65 |
| rh-clint | Rat hepatocyte intrinsic clearance | 1.563 | uL/min/10^6 cells | Moderate | 0.65 |
| rh-fuinc | Rat hepatocyte fraction unbound in incubation | 88.470 | % | Moderate | 0.65 |
| rppb | Rat plasma protein binding (% unbound) | 38.030 | % | Moderate | 0.65 |
| solubility-dd | Solubility at pH 7.4 in DMSO | 972.747 | uM | Moderate | 0.65 |
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| Source | Code | Description |
|---|---|---|
| ATC | J01DD17 | ANTIINFECTIVES FOR SYSTEMIC USE ANTIBACTERIALS FOR SYSTEMIC USE OTHER BETA-LACTAM ANTIBACTERIALS Third-generation cephalosporins |
| CHEBI has role | CHEBI:36047 | antibacterial drug |
None
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| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 2.32 | acidic |
| pKa2 | 13.88 | acidic |
| pKa3 | 3.58 | Basic |
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| ID | Source |
|---|---|
| D07638 | KEGG_DRUG |
| C2699134 | UMLSCUI |
| CHEBI:131729 | CHEBI |
| CHEMBL582912 | ChEMBL_ID |
| DB13461 | DRUGBANK_ID |
| 12053 | IUPHAR_LIGAND_ID |
| 7006 | INN_ID |
| 4D5D3422MW | UNII |
| 6436055 | PUBCHEM_CID |
| 4D5D3422MW | INXIGHT DRUGS |
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