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Vesatolimod (GS-9620)

CAT: 1568-C12532-5mgSize: 5 mgDry Ice: YesHazardous: No
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CAT#:1568-C12532-5mgSize:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1228585-88-3
Target
TLR
Applications
Immunology & Inflammation
Smiles
CCCCOC1=NC (=C2C (=N1) N (CC (=O) N2) CC3=CC=CC (=C3) CN4CCCC4) N
Molecular Formula
C22H30N6O2
Additionnal Information
Vesatolimod (GS-9620) is a potent and selective orally active small molecule agonist of Toll-like receptor 7.
Storage Conditions
2 years -80 in solvent

Chemical Information

Vesatolimod

Vesatolimod is aninvestigational drug that is being studied to treat HIV. Vesatolimod belongs to a group of HIV drugs called immune modulators. Immune modulators (also called immunomodulators) are substances that help to activate, boost, or restore normal immune function.

CAS Number1228585-88-3
PubChem CID46241268
IUPAC Name4-amino-2-butoxy-8-[[3-(pyrrolidin-1-ylmethyl)phenyl]methyl]-5,7-dihydropteridin-6-one
Molecular FormulaC22H30N6O2
Molecular Weight410.5
XLogP2.7
Topological Polar Surface Area96.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Heavy Atom Count30
Formal Charge0
Complexity558
SMILES
CCCCOC1=NC(=C2C(=N1)N(CC(=O)N2)CC3=CC=CC(=C3)CN4CCCC4)N
InChI
InChI=1S/C22H30N6O2/c1-2-3-11-30-22-25-20(23)19-21(26-22)28(15-18(29)24-19)14-17-8-6-7-16(12-17)13-27-9-4-5-10-27/h6-8,12H,2-5,9-11,13-15H2,1H3,(H,24,29)(H2,23,25,26)
InChIKey
VFOKSTCIRGDTBR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Vesatolimod
CAS: 1228585-88-3
CID: 46241268
Formula: C22H30N6O2
MW: 410.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight410.5
XLogP32.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Exact Mass410.24302422
Monoisotopic Mass410.24302422
Topological Polar Surface Area96.6 Ų
Heavy Atom Count30
Formal Charge0
Complexity558
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
S7221-01Vesatolimod (GS-9620)
A3444-5.1GS-9620
FG146405-01GS 9620
A13251-100GS-9620 100mg
A13251-10GS-9620 10mg
A13251-25GS-9620 25mg
A13251-50GS-9620 50mg
A13251-5GS-9620 5mg
HY-15601-01Vesatolimod
HY-15601R-01Vesatolimod (Standard)

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