ELSULFAVIRINE SODIUM

Search structure
Synonyms:
Status: Phase 1
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: HKK2U3V1DT

Structure
InChI Key UJFARQSHFFWJHD-UHFFFAOYSA-M
Smile CCC(=O)[N-]S(=O)(=O)c1ccc(NC(=O)Cc2ccc(Br)c(Oc3cc(Cl)cc(C#N)c3)c2F)c(Cl)c1.[Na+]
InChI
InChI=1S/C24H17BrCl2FN3O5S.Na/c1-2-21(32)31-37(34,35)17-4-6-20(19(27)11-17)30-22(33)9-14-3-5-18(25)24(23(14)28)36-16-8-13(12-29)7-15(26)10-16;/h3-8,10-11H,2,9H2,1H3,(H2,30,31,32,33);/q;+1/p-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H16BrCl2FN3NaO5S
Molecular Weight 651.27
AlogP 5.96
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 8.0
Polar Surface Area 125.36
Molecular species ACID
Aromatic Rings 3.0
Heavy Atoms 37.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
HIV Infections 1 D015658 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL4297377
FDA SRS HKK2U3V1DT
PubChem 46175184
CONTENTS