NESOLICAFTOR

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: T2U4ZA62U4

Structure
InChI Key XPEHHUISIBFLHX-RAIGVLPGSA-N
Smile C[C@@H](O)c1nnc([C@H]2C[C@H](NC(=O)c3cc(-c4ccccc4)no3)C2)o1
InChI
InChI=1S/C18H18N4O4/c1-10(23)17-20-21-18(25-17)12-7-13(8-12)19-16(24)15-9-14(22-26-15)11-5-3-2-4-6-11/h2-6,9-10,12-13,23H,7-8H2,1H3,(H,19,24)/t10-,12-,13-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H18N4O4
Molecular Weight 354.37
AlogP 2.45
Hydrogen Bond Acceptor 7.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 5.0
Polar Surface Area 114.28
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 26.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Cystic Fibrosis 2 D003550 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL4297479
DrugBank DB15239
FDA SRS T2U4ZA62U4
SureChEMBL SCHEMBL17874059
CONTENTS