COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK597872
Chemical Name: (5Z)-5-[4-(azepan-1-yl)benzylidene]-1-(4-ethoxyphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCOc1ccc(cc1)N1C(=S)NC(=O)/C(=C/c2ccc(cc2)N2CCCCCC2)/C1=O

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Molecular Weight: 449.57
Empirical Formula: C25H27N3O3S

Physical State: Dry powder
Available Amount: 140 mg

Lipinsky:
logP: 5.426
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 93
Number of rings: 4

     

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