Structure

InChI Key WQVZLXWQESQGIF-WJKBNZMCSA-N
Smile C[C@H](CCc1ccccc1)NC[C@H](O)c1ccc(O)c(C(N)=O)c1.Cl
InChI
InChI=1S/C19H24N2O3.ClH/c1-13(7-8-14-5-3-2-4-6-14)21-12-18(23)15-9-10-17(22)16(11-15)19(20)24;/h2-6,9-11,13,18,21-23H,7-8,12H2,1H3,(H2,20,24);1H/t13-,18+;/m1./s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H25ClN2O3
Molecular Weight 364.87
AlogP 2.14
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 8.0
Polar Surface Area 95.58
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 24.0

Pharmacology

Action Mechanism of Action Reference
ANTAGONIST Adrenergic receptor beta antagonist PubMed PubMed PubMed PubMed PubMed

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL1204165
EPA CompTox DTXSID7020477
FDA SRS O5OBT75D2C
PubChem 636407
SureChEMBL SCHEMBL588720