COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK210414
Chemical Name: 2-(benzylsulfanyl)-9-(3-hydroxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: Oc1cccc(c1)C1C2=C(CCCC2=O)Nc2n1nc(n2)SCc1ccccc1

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Molecular Weight: 404.49
Empirical Formula: C22H20N4O2S

Physical State: Dry powder
Available Amount: 92 mg

Lipinsky:
logP: 4.186
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 105
Number of rings: 5

     

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