COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK780718
Chemical Name: 1-(4-bromo-2-methylphenyl)-5-oxo-2-(1H-pyrrol-1-yl)-4-(thiophen-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cscc1)C(=O)CCC2)c1ccc(cc1C)Br

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Molecular Weight: 490.42
Empirical Formula: C25H20BrN3OS

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.325
Rotatable bonds: 1
H-donors: 0
H-acceptors: 1
PSA: 77
Number of rings: 5

     

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