DWN-12088

Search structure
Synonyms:
Status: Phase 1
Entry Type: Small molecule
Molecule Category: UNKNOWN

Structure
InChI Key VXCNMWNXDDMFSX-YPMHNXCESA-N
Smile O[C@H]1CCCN[C@@H]1CCCn1cnc2c(Cl)c(Cl)ccc21
InChI
InChI=1S/C15H19Cl2N3O/c16-10-5-6-12-15(14(10)17)19-9-20(12)8-2-3-11-13(21)4-1-7-18-11/h5-6,9,11,13,18,21H,1-4,7-8H2/t11-,13+/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H19Cl2N3O
Molecular Weight 328.24
AlogP 3.24
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 4.0
Polar Surface Area 50.08
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 21.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Idiopathic Pulmonary Fibrosis 1 D054990 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL4802138
CONTENTS