COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK721362
Chemical Name: 3-(benzylsulfanyl)-11-(2-methylpropyl)-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CC(Cc1nc2sc3c(c2c2c1CCCC2)ncn1c3nnc1SCc1ccccc1)C

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Molecular Weight: 459.64
Empirical Formula: C25H25N5S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.972
Rotatable bonds: 4
H-donors: 0
H-acceptors: 0
PSA: 109
Number of rings: 6

     

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