COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL171800
Chemical Name: 2-amino-1-(3-bromophenyl)-7,7-dimethyl-4-(2-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2cccc(c2)Br)C2=C(C1c1ccccc1C)C(=O)CC(C2)(C)C

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Molecular Weight: 462.39
Empirical Formula: C25H24BrN3O

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.786
Rotatable bonds: 1
H-donors: 2
H-acceptors: 1
PSA: 70
Number of rings: 4

     

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