COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK210420
Chemical Name: 2-(benzylsulfanyl)-9-(2,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: COc1cc(OC)c(cc1C1C2=C(CCCC2=O)Nc2n1nc(n2)SCc1ccccc1)OC

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Molecular Weight: 478.57
Empirical Formula: C25H26N4O4S

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 4.505
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 112
Number of rings: 5

     

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