7R9A5P7H32

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 2
Total Number of Articles : 7
PubChem 155903259
Molecular Formula

C23H32F3N5O4

SMILES

CC1([C@@H]2[C@H]1[C@H](N(C2)C(=O)[C@H](C(C)(C)C)NC(=O)C(F)(F)F)C(=O)N[C@@H](C[C@@H]3CCNC3=O)C#N)C

InChI

InChI=1S/C23H32F3N5O4/c1-21(2,3)16(30-20(35)23(24,25)26)19(34)31-10-13-14(22(13,4)5)15(31)18(33)29-12(9-27)8-11-6-7-28-17(11)32/h11-16H,6-8,10H2,1-5H3,(H,28,32)(H,29,33)(H,30,35)/t11-,12-,13-,14-,15-,16+/m0/s1

synonyms
  • 2628280-40-8
  • 7R9A5P7H32
  • Nirmatrelvir
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Properties
Property Value
MW 499.5 g/mol
HBD 3
HBA 8
Rotatable Bond Count 7
Exact Mass 499.24063901 g/mol
Monoisotopic Mass 499.24063901 g/mol
Heavy Atom Count 35
Isotope Atom Count 0
Atom Stereo Count 6
Covalent Unit Count 1
Complexity 964
xlogp 2.2
Topological Polar Surface Area 131