COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK563213
Chemical Name: 4-{[(E)-(5-bromothiophen-2-yl)methylidene]amino}-5-(3,4-dimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(ccc1OC)c1n[nH]c(=S)n1/N=C/c1ccc(s1)Br

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Molecular Weight: 425.33
Empirical Formula: C15H13BrN4O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.053
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 118
Number of rings: 3

     

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