COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK535459
Chemical Name: 3-amino-2-benzyl-7-nitro-1-oxo-1,2-dihydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(N)n(Cc2ccccc2)c(=O)c2c1ccc(c2)[N+](=O)[O-]

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Molecular Weight: 320.31
Empirical Formula: C17H12N4O3

Physical State: Dry powder
Available Amount: 230 mg

Lipinsky:
logP: 1.54
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 115
Number of rings: 3

     

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