COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK956924
Chemical Name: 3-amino-2-(4-nitrophenyl)-1,2,6,7,8,8a-hexahydronaphthalene-1,2,4-tricarbonitrile
Smiles: N#CC1(c2ccc(cc2)[N+](=O)[O-])C(C#N)C2CCCC=C2C(=C1N)C#N

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Molecular Weight: 345.36
Empirical Formula: C19H15N5O2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 2.869
Rotatable bonds: 0
H-donors: 2
H-acceptors: 2
PSA: 143
Number of rings: 3

     

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