COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK761058
Chemical Name: 2-amino-1-(4-bromo-2-fluorophenyl)-7,7-dimethyl-4-[4-(methylsulfanyl)phenyl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: CSc1ccc(cc1)C1C(=C(N)N(C2=C1C(=O)CC(C2)(C)C)c1ccc(cc1F)Br)C#N

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Molecular Weight: 512.45
Empirical Formula: C25H23BrFN3OS

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.854
Rotatable bonds: 0
H-donors: 2
H-acceptors: 1
PSA: 95
Number of rings: 4

     

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