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| Stem definition | Drug id | CAS RN |
|---|---|---|
| analogues of penicillanic acid antibiotics modified in the five-membered ring | 1131 | 106560-14-9 |
| Dose | Unit | Route |
|---|---|---|
| 0.75 | g | O |
| Property | Value | Reference |
|---|---|---|
| Vd (Volume of distribution) | 0.18 L/kg | Lombardo F, Berellini G, Obach RS |
| CL (Clearance) | 2.23 mL/min/kg | Lombardo F, Berellini G, Obach RS |
| t_half (Half-life) | 1.40 hours | Lombardo F, Berellini G, Obach RS |
| BA (Bioavailability) | 25 % |
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2B,CAMK2D,CDK5,EIF2AK3,ERBB2,GRK2,ITK,MAP2K6,MAPK7,NTRK2,PDK1,PDK2,PRKDC,TEK | 14 | |||
| kinase-selectivity-class | AXL,EIF2AK3,GRK2,MAP2K6,MAP3K14,PRKDC,TEK,TGFBR1 | 8 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
None
None
None
None
None
| Source | Code | Description |
|---|---|---|
| ATC | J01DI03 | ANTIINFECTIVES FOR SYSTEMIC USE ANTIBACTERIALS FOR SYSTEMIC USE OTHER BETA-LACTAM ANTIBACTERIALS Other cephalosporins and penems |
| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Bacterial infection of skin | indication | 128936008 | |
| Respiratory tract infection | indication | 275498002 |
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 3.21 | acidic |
None
None
None
| ID | Source |
|---|---|
| 122547-49-3 | SECONDARY_CAS_RN |
| CHEBI:51257 | CHEBI |
| FPM | PDB_CHEM_ID |
| D01839 | KEGG_DRUG |
| CHEMBL556262 | ChEMBL_ID |
| CHEMBL431753 | ChEMBL_ID |
| C107057 | MESH_SUPPLEMENTAL_RECORD_UI |
| 10808 | IUPHAR_LIGAND_ID |
| DB12190 | DRUGBANK_ID |
| F52Y83BGH3 | UNII |
| 020030 | NDDF |
| 020031 | NDDF |
| 1162766006 | SNOMEDCT_US |
| 1162884001 | SNOMEDCT_US |
| 1162886004 | SNOMEDCT_US |
| C0541153 | UMLSCUI |
| 7086 | INN_ID |
| 65894 | PUBCHEM_CID |
None