ACORAMIDIS

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Synonyms
Status
Molecule Category Free-form
UNII T12B44A1OE

Structure

InChI Key WBFUHHBPNXWNCC-UHFFFAOYSA-N
Smiles Cc1n[nH]c(C)c1CCCOc1cc(C(=O)O)ccc1F
InChI
InChI=1S/C15H17FN2O3/c1-9-12(10(2)18-17-9)4-3-7-21-14-8-11(15(19)20)5-6-13(14)16/h5-6,8H,3-4,7H2,1-2H3,(H,17,18)(H,19,20)

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H17FN2O3
Molecular Weight 292.31
AlogP 2.88
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 6.0
Polar Surface Area 75.21
Molecular species ACID
Aromatic Rings 2.0
Heavy Atoms 21.0

Pharmacology

Mechanism of Action Action Reference
Transthyretin stabiliser STABILISER PubMed PubMed PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Secreted protein
- 160 4.8-314 - -
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Homo sapiens
- 160-512 4.8-314 - -

Target Conservation

Protein: Transthyretin
Description: Transthyretin
Organism : Homo sapiens
P02766 ENSG00000118271

Cross References

Resources Reference
ChEMBL CHEMBL3940890
FDA SRS T12B44A1OE
PDB 16V
SureChEMBL SCHEMBL15816954
ZINC ZINC000098207925
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