Molecular Identity
Ambroxol
4-[(2-amino-3,5-dibromophenyl)methylamino]cyclohexan-1-ol
PubChem CID: 2132
Ambroxol is an aromatic amine.
2D Structure
Properties
C13H18Br2N2O
Molecular Formula
378.10
Molecular Weight
g/mol
377.9765
Exact Mass
Da
2.6
XLogP
Drug-like (Lipinski: < 5)
58.3
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
3
H-Bond Acceptors
259
Complexity
SMILES
Canonical SMILES
SMILES: C1CC(CCC1NCC2=C(C(=CC(=C2)Br)Br)N)OIsomeric SMILES
SMILES: C1CC(CCC1NCC2=C(C(=CC(=C2)Br)Br)N)OSynonyms(20)
ambroxol18683-91-5107814-37-9rac-cis-AmbroxolAmbroxol EP Impurity D36557-04-74-((2-amino-3,5-dibromobenzyl)amino)cyclohexan-1-olrac-cis-Ambroxol-d5Bisolvon metabolite VIIIcis-4-((2-Amino-3,5-dibromobenzyl)amino)cyclohexanol4-[(2-Amino-3,5-dibromobenzyl)amino]cyclohexanolBromhexine-metabolite VIIINA-872trans-4-((2-Amino-3,5-dibromobenzyl)amino)cyclohexanolC13H18Br2N2O
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Ambroxol
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