COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK553104
Chemical Name: N-(2-chlorophenyl)-2-[(11-propyl-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl)sulfanyl]acetamide
Smiles: CCCc1nc2sc3c(c2c2c1CCCC2)ncn1c3nnc1SCC(=O)Nc1ccccc1Cl

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Molecular Weight: 523.08
Empirical Formula: C25H23ClN6OS2

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 6.051
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 138
Number of rings: 6

     

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