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Chemical structure of YH-53

GC63262

YH-53

Also known as N-[(2S)-1-[[(2S)-1-(1,3-benzothiazol-2-yl)-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]-4-methoxy-1H-indole-2-carboxamide

YH-53 is a potent 3CLpro inhibitor with Ki values of 6·3 nM, 34·7 nM for SARS-CoV-1 3CLpro and SARS-CoV-2 3CLpro, respectively

ChemicalCAS1471484-62-4MW575.68FormulaC30H33N5O5S
CAS number
1471484-62-4
Molecular weight
575.68
Formula
C30H33N5O5S
Solubility
DMSO : 50 mg/mL (86·85 mM; Need ultrasonic)
InChIKey
JBLLRCOZJMVOAE-HSQYWUDLSA-N
Catalogue number
GC63262
Brand
GLPBIO
Computed properties PubChem CID 72708377 · XLogP 4.7 · TPSA 171 Ų · H-bond donors 4
XLogP
4.7
TPSA
171 Ų
H-bond donors
4
H-bond acceptors
7
Rotatable bonds
11
Heavy atoms
41

SMILES CC(C)C[C@@H](C(=O)N[C@@H](C[C@@H]1CCNC1=O)C(=O)C2=NC3=CC=CC=C3S2)NC(=O)C4=CC5=C(N4)C=CC=C5OC

Computed descriptors from PubChem (CID 72708377), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Universities, hospitals and biotech companies across Israel. Research use only — not for diagnostic or therapeutic use.