COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK429035
Chemical Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl][6-bromo-2-(4-butylphenyl)quinolin-4-yl]methanone
Smiles: CCCCc1ccc(cc1)c1nc2ccc(cc2c(c1)C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2)Br

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Molecular Weight: 586.53
Empirical Formula: C32H32BrN3O3

Physical State: Dry powder
Available Amount: 879 mg

Lipinsky:
logP: 6.463
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 54
Number of rings: 6

     

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