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| Stem definition | Drug id | CAS RN |
|---|---|---|
| 1788 | 31112-62-6 |
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| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2A,ACVR2B,ACVRL1,AKT3,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK4,CDK5,CDK9,DDR1,DYRK1B,EGFR,EIF2AK3,EPHB4,ERBB2,GRK2,GSK3B,ITK,JAK2,JAK3,KDR,MAP2K6,MAP3K14,MAP3K21,MAP3K7,MAPK10,MAPK7,MAPK9,MAPKAPK2,MTOR,NTRK2,PDK1,PDK2,PDK4,PIK3CA,PIK3CB,PIK3CD,PIK3CG,PIM2,PRKDC,SIK2,SIK3,STK33,SYK,TEK,TGFBR1,TTK,ZAP70 | 52 | |||
| kinase-selectivity-class | AXL,BRAF,CDK1,CDK16,CDK2,CDK3,CDK4,CDK6,CDK7,CDK9,CHUK,CLK4,DYRK1A,EIF2AK3,EPHB4,GRK2,INSR,MAP2K6,MAP3K14,MAP3K21,MAPK7,PDK1,PIK3CD,PRKDC,STK33,SYK,TEK,TGFBR1,ZAP70 | 29 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
| Date | Agency | Company | Orphan |
|---|---|---|---|
| Aug. 23, 1978 | FDA |
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| Source | Code | Description |
|---|---|---|
| ATC | V08AB01 | VARIOUS CONTRAST MEDIA X-RAY CONTRAST MEDIA, IODINATED Watersoluble, nephrotropic, low osmolar X-ray contrast media |
| MeSH PA | D003287 | Contrast Media |
| MeSH PA | D064907 | Diagnostic Uses of Chemicals |
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| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 11.26 | acidic |
| pKa2 | 11.87 | acidic |
| pKa3 | 12.83 | acidic |
| pKa4 | 13.76 | acidic |
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| ID | Source |
|---|---|
| 4018226 | VUID |
| N0000146557 | NUI |
| D01311 | KEGG_DRUG |
| 4018226 | VANDF |
| C0025869 | UMLSCUI |
| CHEBI:31841 | CHEBI |
| CHEMBL462394 | ChEMBL_ID |
| D008793 | MESH_DESCRIPTOR_UI |
| DB01578 | DRUGBANK_ID |
| C002587 | MESH_SUPPLEMENTAL_RECORD_UI |
| 3116 | INN_ID |
| RHH3W8F1CO | UNII |
| 443944 | PUBCHEM_CID |
| 6920 | RXNORM |
| 464 | MMSL |
| 5104 | MMSL |
| d01472 | MMSL |
| 002350 | NDDF |
| 414693007 | SNOMEDCT_US |
| 90733003 | SNOMEDCT_US |
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