COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL045269
Chemical Name: 4-benzyl-1-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-6-ethyl-6-methyl-6,7-dihydrobenzo[h][1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Smiles: CCC1(C)Cc2ccccc2c2c1c(=O)n(Cc1ccccc1)c1n2c(SCC(=O)c2ccc(cc2)Br)nn1

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Molecular Weight: 599.55
Empirical Formula: C31H27BrN4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 9.008
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 93
Number of rings: 6

     

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