COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK513027
Chemical Name: 1-{5-(5-bromo-2-methoxyphenyl)-1-(4-methylphenyl)-4-[4-(piperidin-1-yl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}ethanone
Smiles: COc1ccc(cc1C1N(c2ccc(cc2)N2CCCCC2)C(=NN1c1ccc(cc1)C)C(=O)C)Br

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Molecular Weight: 547.49
Empirical Formula: C29H31BrN4O2

Physical State: Dry powder
Available Amount: 229 mg

Lipinsky:
logP: 5.826
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 48
Number of rings: 5

     

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