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Mozenavir

CAT: 0013-GTR19257798-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19257798-02Size:50 mg
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Description
Mozenavir (DMP 450) is an orally active and highly selective inhibitor of HIV-1 protease with a Ki of 0.3 nM. It disrupts the cleavage and processing of viral polyproteins, thereby inhibiting the replication and maturation of HIV-1. Mozenavir shows potential for research into HIV infections.
CAS Number
174391-92-5
Field of Research
Infectious Disease & Virology, Protein Biochemistry
Smiles
C (N1[C@H] (CC2=CC=CC=C2) [C@H] (O) [C@@H] (O) [C@@H] (CC3=CC=CC=C3) N (CC4=CC (N) =CC=C4) C1=O) C5=CC (N) =CC=C5
Molecular Formula
C33H36N4O3
Molecular Weight
536.66
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Mozenavir

Mozenavir is a non-peptidomimetic, water soluble, cyclic urea that is a selective inhibitor of HIV-1 protease.

CAS Number174391-92-5
PubChem CID154044
IUPAC Name(4R,5S,6S,7R)-1,3-bis[(3-aminophenyl)methyl]-4,7-dibenzyl-5,6-dihydroxy-1,3-diazepan-2-one
Molecular FormulaC33H36N4O3
Molecular Weight536.7
XLogP3.9
Topological Polar Surface Area116
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count40
Formal Charge0
Complexity724
SMILES
C1=CC=C(C=C1)C[C@@H]2[C@@H]([C@H]([C@H](N(C(=O)N2CC3=CC(=CC=C3)N)CC4=CC(=CC=C4)N)CC5=CC=CC=C5)O)O
InChI
InChI=1S/C33H36N4O3/c34-27-15-7-13-25(17-27)21-36-29(19-23-9-3-1-4-10-23)31(38)32(39)30(20-24-11-5-2-6-12-24)37(33(36)40)22-26-14-8-16-28(35)18-26/h1-18,29-32,38-39H,19-22,34-35H2/t29-,30-,31+,32+/m1/s1
InChIKey
KYRSNWPSSXSNEP-ZRTHHSRSSA-N
Chemical Structure
2D Structure
2D structure of Mozenavir
CAS: 174391-92-5
CID: 154044
Formula: C33H36N4O3
MW: 536.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight536.7
XLogP33.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass536.27874102
Monoisotopic Mass536.27874102
Topological Polar Surface Area116 Ų
Heavy Atom Count40
Formal Charge0
Complexity724
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
T207393-01Mozenavir

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