COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL051902
Chemical Name: 4-{[(E)-(5-bromo-2-methoxyphenyl)methylidene]amino}-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1/C=N/n1c(S)nnc1c1[nH]nc2c1CCC2)Br

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Molecular Weight: 419.3
Empirical Formula: C16H15BrN6OS

Physical State: Dry powder
Available Amount: 234 mg

Lipinsky:
logP: 4.809
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 119
Number of rings: 4

     

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