Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 9U35A31JAI

Structure

InChI Key VLULRUCCHYVXOH-UHFFFAOYSA-N
Smile Cc1ccccc1CN1C(=O)C2=C(CCN(Cc3ccccc3)C2)N2CCN=C12
InChI
InChI=1S/C24H26N4O/c1-18-7-5-6-10-20(18)16-28-23(29)21-17-26(15-19-8-3-2-4-9-19)13-11-22(21)27-14-12-25-24(27)28/h2-10H,11-17H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H26N4O
Molecular Weight 386.5
AlogP 3.17
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 4.0
Polar Surface Area 39.15
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 29.0

Cross References

Resources Reference
ChEMBL CHEMBL4297310
DrugBank DB14844
FDA SRS 9U35A31JAI
Guide to Pharmacology 9978
SureChEMBL SCHEMBL16227974
ZINC ZINC000169620396