finerenone   Click here for help

GtoPdb Ligand ID: 8678

Synonyms: BAY 94-8862 | Kerendia®
Approved drug
finerenone is an approved drug (FDA (2021), EMA (2022))
Compound class: Synthetic organic
Comment: Finerenone (BAY 94-8862) is a next generation (first-in-class) oral, non-steroidal mineralocorticoid receptor antagonist which blocks the deleterious effects of aldosterone [2].
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 110.26
Molecular weight 378.17
XLogP 2.84
No. Lipinski's rules broken 0
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Canonical SMILES CCOc1ncc(c2c1C(C(=C(N2)C)C(=O)N)c1ccc(cc1OC)C#N)C
Isomeric SMILES CCOc1ncc(c2c1[C@@H](C(=C(N2)C)C(=O)N)c1ccc(cc1OC)C#N)C
InChI InChI=1S/C21H22N4O3/c1-5-28-21-18-17(14-7-6-13(9-22)8-15(14)27-4)16(20(23)26)12(3)25-19(18)11(2)10-24-21/h6-8,10,17,25H,5H2,1-4H3,(H2,23,26)/t17-/m1/s1
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (2021), EMA (2022))
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
9634 finerenone
Synonyms Click here for help
BAY 94-8862 | Kerendia®
Database Links Click here for help
CAS Registry No. 1050477-31-0 (source: WHO INN record)
GtoPdb PubChem SID 252166878
PubChem CID 60150535
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UniChem Compound Search for chemical match using the InChIKey BTBHLEZXCOBLCY-QGZVFWFLSA-N
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