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331261-50-8

331261-50-8 structural image
Product Name: HIV-1 inhibitor 18A
Formula: C14H11N5O2S
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COMPUTED DESCRIPTORS

Molecular Weight 313.34 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 3
Exact Mass 313.06334578 g/mol
Monoisotopic Mass 313.06334578 g/mol
Topological Polar Surface Area 128 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 414
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes