ELSULFAVIRINE

Search structure
Synonyms:
Status: Phase 1
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: ZC4CGO0RUG

Structure
InChI Key ULTDEARCBRNRGR-UHFFFAOYSA-N
Smile CCC(=O)NS(=O)(=O)c1ccc(NC(=O)Cc2ccc(Br)c(Oc3cc(Cl)cc(C#N)c3)c2F)c(Cl)c1
InChI
InChI=1S/C24H17BrCl2FN3O5S/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,(H,30,33)(H,31,32)

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H17BrCl2FN3O5S
Molecular Weight 629.29
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 CHEMBL4301163
DrugBank DB14929
FDA SRS ZC4CGO0RUG
PubChem 11527519
SureChEMBL SCHEMBL1341521
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