COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK590281
Chemical Name: 2-(benzylsulfanyl)-9-(3-nitrophenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: OC1=C2C(=Nc3n(C2c2cccc(c2)[N+](=O)[O-])nc(n3)SCc2ccccc2)CCC1

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Molecular Weight: 433.49
Empirical Formula: C22H19N5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.644
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 134
Number of rings: 5

     

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