COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK959243
Chemical Name: 2-amino-4-(1,3-benzodioxol-5-yl)-1-(2-chloro-4-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2ccc(cc2Cl)[N+](=O)[O-])C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2

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Molecular Weight: 464.86
Empirical Formula: C23H17ClN4O5

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 2.643
Rotatable bonds: 1
H-donors: 2
H-acceptors: 5
PSA: 134
Number of rings: 5

     

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