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| Stem definition | Drug id | CAS RN |
|---|---|---|
| antibiotics, produced by Streptomyces strains | 3526 | 25546-65-0 |
| Dose | Unit | Route |
|---|---|---|
| 1 | g | P |
| Property | Value | Reference |
|---|---|---|
| Vd (Volume of distribution) | 0.25 L/kg | Lombardo F, Berellini G, Obach RS |
| CL (Clearance) | 1.50 mL/min/kg | Lombardo F, Berellini G, Obach RS |
| t_half (Half-life) | 2.50 hours | Lombardo F, Berellini G, Obach RS |
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2B,AXL,BRAF,CAMK2D,CDK4,CDK5,DYRK1B,EIF2AK3,ERBB2,GRK2,ITK,MAP2K6,MAP3K21,MAPK10,MAPK7,NTRK1,NTRK2,PDK2,PDK4,PRKDC,TEK | 21 | |||
| kinase-selectivity-class | CHUK,MAP2K6,PDK1 | 3 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
None
None
None
None
None
| Source | Code | Description |
|---|---|---|
| ATC | J01GB10 | ANTIINFECTIVES FOR SYSTEMIC USE ANTIBACTERIALS FOR SYSTEMIC USE AMINOGLYCOSIDE ANTIBACTERIALS Other aminoglycosides |
| MeSH PA | D000890 | Anti-Infective Agents |
| MeSH PA | D000900 | Anti-Bacterial Agents |
| CHEBI has role | CHEBI:33281 | antimicrobial agent |
| CHEBI has role | CHEBI:33282 | antibacterial agent |
| CHEBI has role | CHEBI:36047 | antibacterial drug |
| CHEBI has role | CHEBI:25212 | metabolite |
None
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 12.57 | acidic |
| pKa2 | 13.56 | acidic |
| pKa3 | 13.9 | acidic |
| pKa4 | 8.21 | Basic |
| pKa5 | 7.69 | Basic |
| pKa6 | 6.31 | Basic |
| pKa7 | 5.7 | Basic |
None
None
None
| ID | Source |
|---|---|
| D02209 | KEGG_DRUG |
| 53797-35-6 | SECONDARY_CAS_RN |
| C0035554 | UMLSCUI |
| CHEBI:45257 | CHEBI |
| RIO | PDB_CHEM_ID |
| CHEMBL221572 | ChEMBL_ID |
| D012271 | MESH_DESCRIPTOR_UI |
| DB03615 | DRUGBANK_ID |
| 12161 | IUPHAR_LIGAND_ID |
| 3197 | INN_ID |
| 2Q5JOU7T53 | UNII |
| 33042 | PUBCHEM_CID |
| 010978 | NDDF |
| 010979 | NDDF |
| 2Q5JOU7T53 | INXIGHT DRUGS |
None