COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK554930
Chemical Name: 12-benzyl-9-(benzylsulfanyl)-6,6-dimethyl-6,12-dihydrobenzo[h][1,2,4]triazolo[3,4-b]quinazolin-7(5H)-one
Smiles: O=c1n2c(SCc3ccccc3)nnc2n(c2c1C(C)(C)Cc1c2cccc1)Cc1ccccc1

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Molecular Weight: 478.62
Empirical Formula: C29H26N4OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.044
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 76
Number of rings: 6

     

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