Structure

InChI Key ASKZRYGFUPSJPN-UHFFFAOYSA-N
Smile Cc1cn2nc(-c3cc(=O)n4cc(N5CCNC6(CC6)C5)ccc4n3)cc(C)c2n1
InChI
InChI=1S/C22H23N7O/c1-14-9-18(26-29-11-15(2)24-21(14)29)17-10-20(30)28-12-16(3-4-19(28)25-17)27-8-7-23-22(13-27)5-6-22/h3-4,9-12,23H,5-8,13H2,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C22H23N7O
Molecular Weight 401.47
AlogP 1.96
Hydrogen Bond Acceptor 8.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 2.0
Polar Surface Area 79.83
Molecular species BASE
Aromatic Rings 4.0
Heavy Atoms 30.0

Pharmacology

Action Mechanism of Action Reference
POSITIVE MODULATOR SMN2 pre-mRNA positive modulator FDA

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Muscular Atrophy, Spinal 4 D009134 ClinicalTrials

Cross References

Resources Reference
CAS NUMBER 1825352-65-5
ChEMBL CHEMBL4297528
DrugBank DB15305
FDA SRS 76RS4S2ET1
Guide to Pharmacology 11170
PubChem 118513932
SureChEMBL SCHEMBL17260852