COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK837174
Chemical Name: (5E)-1-methyl-3-phenyl-2-thioxo-5-(2,3,4-trimethoxybenzylidene)dihydropyrimidine-4,6(1H,5H)-dione
Smiles: COc1c(OC)ccc(c1OC)/C=C/1\C(=O)N(C)C(=S)N(C1=O)c1ccccc1

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Molecular Weight: 412.47
Empirical Formula: C21H20N2O5S

Physical State: Dry powder
Available Amount: 501 mg

Lipinsky:
logP: 2.638
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 100
Number of rings: 3

     

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