DAROTROPIUM BROMIDE

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Synonyms
Status
Molecule Category Salt-form
UNII 2W2V1U785A

Structure

InChI Key CWRNUVNMUYSOFQ-ABHLOGGPSA-M
Smiles C[N+]1(C)[C@@H]2CC[C@H]1C[C@H](CC(C#N)(c1ccccc1)c1ccccc1)C2.[Br-]
InChI
InChI=1S/C24H29N2.BrH/c1-26(2)22-13-14-23(26)16-19(15-22)17-24(18-25,20-9-5-3-6-10-20)21-11-7-4-8-12-21;/h3-12,19,22-23H,13-17H2,1-2H3;1H/q+1;/p-1/t19-,22-,23+;

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H29BrN2
Molecular Weight 425.41
AlogP 4.9
Hydrogen Bond Acceptor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 23.79
Heavy Atoms 26.0

Pharmacology

Mechanism of Action Action Reference
Muscarinic acetylcholine receptor antagonist ANTAGONIST PubMed

Target Conservation

Protein: Muscarinic acetylcholine receptor
Description: Muscarinic acetylcholine receptor M2
Organism : Homo sapiens
P08172 ENSG00000181072
Protein: Muscarinic acetylcholine receptor
Description: Muscarinic acetylcholine receptor M4
Organism : Homo sapiens
P08173 ENSG00000180720
Protein: Muscarinic acetylcholine receptor
Description: Muscarinic acetylcholine receptor M5
Organism : Homo sapiens
P08912 ENSG00000184984
Protein: Muscarinic acetylcholine receptor
Description: Muscarinic acetylcholine receptor M1
Organism : Homo sapiens
P11229 ENSG00000168539
Protein: Muscarinic acetylcholine receptor
Description: Muscarinic acetylcholine receptor M3
Organism : Homo sapiens
P20309 ENSG00000133019

Cross References

Resources Reference
ChEMBL CHEMBL2308782
FDA SRS 2W2V1U785A
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