COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK426051
Chemical Name: [6-bromo-2-(4-tert-butylphenyl)quinolin-4-yl][4-(5-chloro-2-methylphenyl)piperazin-1-yl]methanone
Smiles: Brc1ccc2c(c1)c(cc(n2)c1ccc(cc1)C(C)(C)C)C(=O)N1CCN(CC1)c1cc(Cl)ccc1C

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Molecular Weight: 576.96
Empirical Formula: C31H31BrClN3O

Physical State: Dry powder
Available Amount: 609 mg

Lipinsky:
logP: 7.399
Rotatable bonds: 1
H-donors: 0
H-acceptors: 1
PSA: 36
Number of rings: 5

     

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