DEXBROMPHENIRAMINE MALEATE

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Trade Names:
Synonyms:
Status: Approved (1963)
Entry Type: Small molecule
Molecule Category: Parent
UNII: BPA9UT29BS

Structure
InChI Key SRGKFVAASLQVBO-DASCVMRKSA-N
Smile CN(C)CC[C@@H](c1ccc(Br)cc1)c1ccccn1.O=C(O)/C=C\C(=O)O
InChI
InChI=1S/C16H19BrN2.C4H4O4/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13;5-3(6)1-2-4(7)8/h3-9,11,15H,10,12H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t15-;/m0./s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C20H23BrN2O4
Molecular Weight 435.32
AlogP 3.93
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 5.0
Polar Surface Area 16.13
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 19.0

Pharmacology

Action Mechanism of Action Reference
ANTAGONIST Histamine H1 receptor antagonist PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

MCS

Scaffolds

Mixture
Mixture

Cross References

Resources Reference
ChEBI 59273
ChEMBL CHEMBL1200638
EPA CompTox DTXSID6047818
FDA SRS BPA9UT29BS
PubChem 6433334
SureChEMBL SCHEMBL217770
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