COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL320993
Chemical Name: 3-amino-2-(3-methoxyphenyl)-7-nitro-1-oxo-1,2-dihydroisoquinoline-4-carbonitrile
Smiles: COc1cccc(c1)n1c(N)c(C#N)c2c(c1=O)cc(cc2)[N+](=O)[O-]

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Molecular Weight: 336.31
Empirical Formula: C17H12N4O4

Available Amount: 0 mg

Lipinsky:
logP: 1.265
Rotatable bonds: 1
H-donors: 2
H-acceptors: 4
PSA: 125
Number of rings: 3

     

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