COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK426335
Chemical Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]{6-bromo-2-[4-(propan-2-yl)phenyl]quinolin-4-yl}methanone
Smiles: Brc1ccc2c(c1)c(cc(n2)c1ccc(cc1)C(C)C)C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 572.5
Empirical Formula: C31H30BrN3O3

Physical State: Dry powder
Available Amount: 1390 mg

Lipinsky:
logP: 5.748
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 54
Number of rings: 6

     

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