COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374882
Chemical Name: (5E)-1-(4-ethoxyphenyl)-5-[4-(propan-2-yl)benzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCOc1ccc(cc1)N1C(=S)NC(=O)/C(=C\c2ccc(cc2)C(C)C)/C1=O

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Molecular Weight: 394.49
Empirical Formula: C22H22N2O3S

Physical State: Dry powder
Available Amount: 409 mg

Lipinsky:
logP: 5.042
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 90
Number of rings: 3

     

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