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| Stem definition | Drug id | CAS RN |
|---|---|---|
| estrogens | 1063 | 3571-53-7 |
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| Property | Value | Reference |
|---|---|---|
| S (Water solubility) | 0.01 mg/mL | Bocci G, Oprea TI, Benet LZ |
| BA (Bioavailability) | 5 % |
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2A,ACVR2B,AKT2,AKT3,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK4,CDK5,CDK9,DDR1,DYRK1B,EGFR,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,GSK3B,IKBKB,ITK,JAK2,JAK3,MAP2K6,MAP3K7,MAPK10,MAPK7,MAPK9,MAPKAPK2,NTRK2,PDK1,PDK2,PDK4,PDPK1,PIK3CA,PIK3CB,PIK3CG,PIM2,PRKDC,SIK2,STK33,SYK,TEK,TGFBR1,TTK,ZAP70 | 49 | |||
| kinase-selectivity-class | AXL,EIF2AK3,GRK2,MAP2K6 | 4 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
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None
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| Source | Code | Description |
|---|---|---|
| FDA CS | M0447348 | Estradiol Congeners |
| FDA MoA | N0000000100 | Estrogen Receptor Agonists |
| MeSH PA | D004967 | Estrogens |
| MeSH PA | D006728 | Hormones |
| FDA EPC | N0000175825 | Estrogen |
| CHEBI has role | CHEBI:50114 | estrogen |
| CHEBI has role | CHEBI:77746 | human metabolite |
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None
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| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 11.13 | acidic |
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| ID | Source |
|---|---|
| D04065 | KEGG_DRUG |
| 4017609 | VANDF |
| 4021205 | VANDF |
| C0771510 | UMLSCUI |
| CHEBI:135719 | CHEBI |
| EST | PDB_CHEM_ID |
| CHEMBL1697794 | ChEMBL_ID |
| 2014 | INN_ID |
| H3N3A8MFJC | UNII |
| 19135 | PUBCHEM_CID |
| DB00783 | DRUGBANK_ID |
| 4083 | RXNORM |
| 4684 | MMSL |
| 6157 | MMSL |
| 73244 | MMSL |
| 8602 | MMSL |
| d00537 | MMSL |
| 001265 | NDDF |
| 005517 | NDDF |
| 126172005 | SNOMEDCT_US |
| 12839006 | SNOMEDCT_US |
| C0014912 | UMLSCUI |
| 5757 | PUBCHEM_CID |
| 406 | INN_ID |
| D004958 | MESH_DESCRIPTOR_UI |
| CHEBI:16469 | CHEBI |
| H3N3A8MFJC | INXIGHT DRUGS |
None