COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL055532
Chemical Name: 4-{[(E)-(5-bromothiophen-2-yl)methylidene]amino}-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Brc1ccc(s1)/C=N/n1c(S)nnc1c1[nH]nc2c1CCC2

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Molecular Weight: 395.31
Empirical Formula: C13H11BrN6S2

Physical State: Dry powder
Available Amount: 199 mg

Lipinsky:
logP: 4.502
Rotatable bonds: 4
H-donors: 1
H-acceptors: 0
PSA: 138
Number of rings: 4

     

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