COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL304967
Chemical Name: 2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-(2-nitrophenyl)quinazolin-4(3H)-one
Smiles: O=c1c2ccccc2nc(n1c1ccccc1[N+](=O)[O-])/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 413.39
Empirical Formula: C23H15N3O5

Physical State: Dry powder
Available Amount: 63 mg

Lipinsky:
logP: 4.812
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 96
Number of rings: 5

     

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