COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK761763
Chemical Name: 2-amino-4-(4-fluorophenyl)-1-(2-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1c1ccc(cc1)F)C(=O)CCC2)c1ccccc1[N+](=O)[O-]

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Molecular Weight: 404.4
Empirical Formula: C22H17FN4O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.303
Rotatable bonds: 0
H-donors: 2
H-acceptors: 3
PSA: 115
Number of rings: 4

     

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