COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK536686
Chemical Name: methyl2-({(E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-4,5-dimethoxybenzoate
Smiles: N#C/C(=C\Nc1cc(OC)c(cc1C(=O)OC)OC)/c1scc(n1)c1cccc(c1)Br

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Molecular Weight: 500.37
Empirical Formula: C22H18BrN3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.373
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 3

     

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