COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK335388
Chemical Name: 9-(2,5-dimethoxyphenyl)-2-[(pyridin-2-ylmethyl)sulfanyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: COc1ccc(c(c1)C1C2=C(CCCC2=O)Nc2n1nc(n2)SCc1ccccn1)OC

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Molecular Weight: 449.53
Empirical Formula: C23H23N5O3S

Physical State: Dry powder
Available Amount: 449 mg

Lipinsky:
logP: 3.311
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 116
Number of rings: 5

     

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