| Stem definition | Drug id | CAS RN |
|---|---|---|
| 98 | 56287-74-2 |
| Molecule | Description |
|---|---|
|
Synonyms:
|
|
None
None
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2A,ACVR2B,ACVRL1,AKT2,AKT3,ALK,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK5,CDK9,CSF1R,DDR1,DYRK1B,EGFR,EIF2AK3,EPHA2,EPHB4,ERBB2,FLT3,FYN,GRK1,GRK2,GRK3,GSK3B,ITK,JAK1,JAK2,KIT,LYN,MAP2K6,MAP3K1,MAP3K21,MAP3K7,MAP4K1,MAP4K3,MAPK1,MAPK10,MAPK11,MAPK12,MAPK14,MAPK7,MAPK9,MAPKAPK2,MAPKAPK5,MARK4,MELK,MET,MTOR,NTRK2,PDK1,PDK2,PDK4,PDPK1,PIK3CB,PIK3CD,PIM2,PRKCD,PRKDC,SIK2,SIK3,SRC,STK33,SYK,TEK,TTK,ULK1 | 70 | |||
| kinase-selectivity-class | ACVR2A,AXL,BRAF,CDK9,DDR1,GRK2,MAP2K6,MAPK14,MAPK7,PDK4,PIK3CD,SIK2,SIK3,STK33 | 14 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
None
None
None
None
None
| Source | Code | Description |
|---|---|---|
| MeSH PA | D002491 | Central Nervous System Agents |
| MeSH PA | D003879 | Dermatologic Agents |
| MeSH PA | D009125 | Muscle Relaxants, Central |
| MeSH PA | D009465 | Neuromuscular Agents |
| MeSH PA | D011838 | Radiation-Sensitizing Agents |
| MeSH PA | D017319 | Photosensitizing Agents |
| MeSH PA | D018373 | Peripheral Nervous System Agents |
None
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 3.77 | Basic |
| pKa2 | 3.08 | Basic |
None
None
None
| ID | Source |
|---|---|
| D01638 | KEGG_DRUG |
| C0050939 | UMLSCUI |
| CHEBI:31177 | CHEBI |
| CHEMBL2105918 | ChEMBL_ID |
| C033541 | MESH_SUPPLEMENTAL_RECORD_UI |
| 2040 | PUBCHEM_CID |
| 4831 | INN_ID |
| CO4U2C8ORZ | UNII |
| 010869 | NDDF |
None