COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK217464
Chemical Name: 2-(benzylsulfanyl)-9-(2,3,4-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: COc1c(OC)c(OC)ccc1C1C2=C(CCCC2=O)Nc2n1nc(n2)SCc1ccccc1

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Molecular Weight: 478.57
Empirical Formula: C25H26N4O4S

Physical State: Dry powder
Available Amount: 94 mg

Lipinsky:
logP: 4.361
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 112
Number of rings: 5

     

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