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| Stem definition | Drug id | CAS RN |
|---|---|---|
| vasopressin analogues | 4679 | 3397-23-7 |
| Dose | Unit | Route |
|---|---|---|
| 5 | U | P |
None
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2B,BRAF,CAMK2D,CDK5,EIF2AK3,GRK2,ITK,PDK1,PDK2,PDK4,PRKDC | 11 | |||
| kinase-selectivity-class | GRK2 | 1 | |||
| mdck-mdr1-bcrp-efflux | MDCK-MDR1-BCRP efflux ratio | 1.589 | Moderate | 0.78 | |
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
None
None
None
None
None
| Source | Code | Description |
|---|---|---|
| ATC | H01BA05 | SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES POSTERIOR PITUITARY LOBE HORMONES Vasopressin and analogues |
| MeSH PA | D002317 | Cardiovascular Agents |
| MeSH PA | D003029 | Coagulants |
| MeSH PA | D006401 | Hematologic Agents |
| MeSH PA | D006490 | Hemostatics |
| MeSH PA | D014662 | Vasoconstrictor Agents |
None
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 9.47 | acidic |
| pKa2 | 12.33 | acidic |
| pKa3 | 12.66 | acidic |
| pKa4 | 12.81 | acidic |
| pKa5 | 13.19 | acidic |
| pKa6 | 13.28 | acidic |
| pKa7 | 13.55 | acidic |
| pKa8 | 13.68 | acidic |
| pKa9 | 10.12 | Basic |
| pKa10 | 6.4 | Basic |
None
None
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| ID | Source |
|---|---|
| D07227 | KEGG_DRUG |
| N0000170338 | NUI |
| CHEMBL1819440 | ChEMBL_ID |
| 2544 | INN_ID |
| DB13464 | DRUGBANK_ID |
| 1KTH6N080W | UNII |
| 7703 | RXNORM |
| 006913 | NDDF |
| 703839000 | SNOMEDCT_US |
| C0029276 | UMLSCUI |
| D009951 | MESH_DESCRIPTOR_UI |
| CHEBI:136020 | CHEBI |
| 14257660 | PUBCHEM_CID |
| 1KTH6N080W | INXIGHT DRUGS |
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