COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK233638
Chemical Name: prop-2-en-1-yl2-[(2-methoxy-2-oxoethyl)sulfanyl]-5-methyl-7-(2-nitrophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Smiles: C=CCOC(=O)C1=C(C)Nc2n(C1c1ccccc1[N+](=O)[O-])nc(n2)SCC(=O)OC

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Molecular Weight: 445.46
Empirical Formula: C19H19N5O6S

Physical State: Dry powder
Available Amount: 116 mg

Lipinsky:
logP: 3.938
Rotatable bonds: 9
H-donors: 1
H-acceptors: 6
PSA: 166
Number of rings: 3

     

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