COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK335014
Chemical Name: 6-(3,4-dimethoxyphenyl)-9-(3-nitrophenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: COc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1n(C2c2cccc(c2)[N+](=O)[O-])ncn1

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Molecular Weight: 447.45
Empirical Formula: C23H21N5O5

Physical State: Dry powder
Available Amount: 448 mg

Lipinsky:
logP: 2.992
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 124
Number of rings: 5

     

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