COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK330690
Chemical Name: (5Z)-5-[3-bromo-4-(dimethylamino)benzylidene]-2-[(4-ethoxyphenyl)amino]-1,3-thiazol-4(5H)-one
Smiles: CCOc1ccc(cc1)NC1=NC(=O)/C(=C/c2ccc(c(c2)Br)N(C)C)/S1

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Molecular Weight: 446.37
Empirical Formula: C20H20BrN3O2S

Physical State: Dry powder
Available Amount: 45 mg

Lipinsky:
logP: 6.231
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 79
Number of rings: 3

     

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