ANDOLAST

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Synonyms
Status
Molecule Category Free-form
UNII 6513M33209
EPA CompTox DTXSID80157682

Structure

InChI Key VXEBMQZDPONDFB-UHFFFAOYSA-N
Smiles O=C(Nc1ccc(-c2nnn[nH]2)cc1)c1ccc(-c2nnn[nH]2)cc1
InChI
InChI=1S/C15H11N9O/c25-15(11-3-1-9(2-4-11)13-17-21-22-18-13)16-12-7-5-10(6-8-12)14-19-23-24-20-14/h1-8H,(H,16,25)(H,17,18,21,22)(H,19,20,23,24)

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H11N9O
Molecular Weight 333.32
AlogP 1.3
Hydrogen Bond Acceptor 7.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 4.0
Polar Surface Area 138.02
Molecular species ACID
Aromatic Rings 4.0
Heavy Atoms 25.0

Pharmacology

Mechanism of Action Action Reference
Calcium-activated potassium channel subunit alpha-1 activator ACTIVATOR Other PubMed

Target Conservation

Protein: Calcium-activated potassium channel subunit alpha-1
Description: Calcium-activated potassium channel subunit alpha-1
Organism : Homo sapiens
Q12791 ENSG00000156113

Cross References

Resources Reference
ChEMBL CHEMBL119549
FDA SRS 6513M33209
PubChem 65970
SureChEMBL SCHEMBL166170
ZINC ZINC000000004680
CONTENTS