COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK568962
Chemical Name: N-[(2Z)-5-(4-bromophenyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3,4,5-triethoxybenzamide
Smiles: CCOc1cc(cc(c1OCC)OCC)C(=O)/N=c\1/[nH]nc(s1)c1ccc(cc1)Br

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Molecular Weight: 492.39
Empirical Formula: C21H22BrN3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.404
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 106
Number of rings: 3

     

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