COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK524691
Chemical Name: 6-amino-2-methyl-8-(4-nitrophenyl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: N#CC1=C(N)C(C(C2C1=CCN(C2)C)c1ccc(cc1)[N+](=O)[O-])(C#N)C#N

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Molecular Weight: 360.38
Empirical Formula: C19H16N6O2

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 2.083
Rotatable bonds: 0
H-donors: 2
H-acceptors: 2
PSA: 146
Number of rings: 3

     

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