COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK627691
Chemical Name: 3-(4-bromobenzyl)-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d][1,2,3]triazin-4-one
Smiles: CC1(C)OCc2c(C1)c1c(s2)nnn(c1=O)Cc1ccc(cc1)Br

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Molecular Weight: 406.3
Empirical Formula: C17H16BrN3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.941
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 82
Number of rings: 4

     

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