COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK020828
Chemical Name: 4-amino-7,7-dimethyl-2-(3-nitrophenyl)-5-oxo-5,6,7,8-tetrahydro-2H-chromene-3-carbonitrile
Smiles: N#CC1=C(N)C2=C(OC1c1cccc(c1)[N+](=O)[O-])CC(CC2=O)(C)C

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Molecular Weight: 339.35
Empirical Formula: C18H17N3O4

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 2.665
Rotatable bonds: 1
H-donors: 2
H-acceptors: 4
PSA: 121
Number of rings: 3

     

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