COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL173008
Chemical Name: 2-amino-1-(3-bromophenyl)-4-(2,6-dichlorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2cccc(c2)Br)C2=C(C1c1c(Cl)cccc1Cl)C(=O)CCC2

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Molecular Weight: 489.2
Empirical Formula: C22H16BrCl2N3O

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.496
Rotatable bonds: 0
H-donors: 2
H-acceptors: 1
PSA: 70
Number of rings: 4

     

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