COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK513029
Chemical Name: 1-{1-(3,4-dichlorophenyl)-5-(2-methoxyphenyl)-4-[4-(piperidin-1-yl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}ethanone
Smiles: COc1ccccc1C1N(c2ccc(cc2)N2CCCCC2)C(=NN1c1ccc(c(c1)Cl)Cl)C(=O)C

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Molecular Weight: 523.46
Empirical Formula: C28H28Cl2N4O2

Physical State: Dry powder
Available Amount: 217 mg

Lipinsky:
logP: 5.399
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 48
Number of rings: 5

     

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