COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK764486
Chemical Name: 2-(1,3-benzodioxol-5-yl)-3-{[(E)-1,3-benzodioxol-5-ylmethylidene]amino}-7-nitro-2,3-dihydroquinazolin-4(1H)-one
Smiles: O=C1N(/N=C/c2ccc3c(c2)OCO3)C(Nc2c1ccc(c2)[N+](=O)[O-])c1ccc2c(c1)OCO2

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Molecular Weight: 460.4
Empirical Formula: C23H16N4O7

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.412
Rotatable bonds: 3
H-donors: 1
H-acceptors: 7
PSA: 127
Number of rings: 6

     

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