COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL051145
Chemical Name: 4-{[(1E,2Z)-2-bromo-3-phenylprop-2-en-1-ylidene]amino}-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Br/C(=C\c1ccccc1)/C=N/n1c(S)nnc1c1[nH]nc2c1CCC2

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Molecular Weight: 415.32
Empirical Formula: C17H15BrN6S

Physical State: Dry powder
Available Amount: 247 mg

Lipinsky:
logP: 5.15
Rotatable bonds: 4
H-donors: 1
H-acceptors: 0
PSA: 110
Number of rings: 4

     

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