COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK720084
Chemical Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)butanamide
Smiles: CCC(C(=O)Nc1sc2c(c1C#N)CCCC2)Sc1nnc2c(n1)[nH]c1c2cccc1

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Molecular Weight: 448.57
Empirical Formula: C22H20N6OS2

Physical State: Dry powder
Available Amount: 171 mg

Lipinsky:
logP: 4.772
Rotatable bonds: 4
H-donors: 2
H-acceptors: 1
PSA: 160
Number of rings: 5

     

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