TECALCET HYDROCHLORIDE

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Synonyms
Status
Molecule Category Salt-form
UNII 3HP28R98LC
EPA CompTox DTXSID10170263

Structure

InChI Key YJXUXANREVNZLH-PFEQFJNWSA-N
Smiles COc1cccc([C@@H](C)NCCCc2ccccc2Cl)c1.Cl
InChI
InChI=1S/C18H22ClNO.ClH/c1-14(16-8-5-10-17(13-16)21-2)20-12-6-9-15-7-3-4-11-18(15)19;/h3-5,7-8,10-11,13-14,20H,6,9,12H2,1-2H3;1H/t14-;/m1./s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H23Cl2NO
Molecular Weight 340.29
AlogP 4.63
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 7.0
Polar Surface Area 21.26
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 21.0

Pharmacology

Mechanism of Action Action Reference
Calcium sensing receptor modulator MODULATOR PubMed PubMed PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Membrane receptor Family C G protein-coupled receptor Ion receptor (family C GPCR) Calcium sensing receptor Calcium sensing receptor
80 - - - -
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Homo sapiens
80 - - - -

Target Conservation

Protein: Calcium sensing receptor
Description: Extracellular calcium-sensing receptor
Organism : Homo sapiens
P41180 ENSG00000036828

Cross References

Resources Reference
ChEMBL CHEMBL2107572
FDA SRS 3HP28R98LC
PubChem 158796
SureChEMBL SCHEMBL1178446
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