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Chemical structure of Emivirine

GC64484

Emivirine

Also known as 6-benzyl-1-(ethoxymethyl)-5-propan-2-ylpyrimidine-2,4-dione

Emivirine (MKC-442) is a non-nucleoside reverse transcriptase inhibitors (NNRTIs) with Ki values of 0·20 and 0·01 μM for dTTP- and dGTP-dependent DNA or RNA polymerase activity, respectively

ChemicalCAS149950-60-7MW302.37FormulaC17H22N2O3
CAS number
149950-60-7
Molecular weight
302.37
Formula
C17H22N2O3
Solubility
DMSO ： 100 mg/mL (330·72 mM; Need ultrasonic)
InChIKey
MLILORUFDVLTSP-UHFFFAOYSA-N
Catalogue number
GC64484
Brand
GLPBIO
Computed properties PubChem CID 65013 · XLogP 2.6 · TPSA 58.6 Ų · H-bond donors 1
XLogP
2.6
TPSA
58.6 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
22

SMILES CCOCN1C(=C(C(=O)NC1=O)C(C)C)CC2=CC=CC=C2

Computed descriptors from PubChem (CID 65013), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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