COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK120174
Chemical Name: 1-{3-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]propyl}-1,3-dihydro-2H-benzimidazol-2-one
Smiles: CCn1c2ccccc2c2c1nc(SCCCn1c(=O)[nH]c3c1cccc3)nn2

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Molecular Weight: 404.5
Empirical Formula: C21H20N6OS

Physical State: Dry powder
Available Amount: 4 mg

Lipinsky:
logP: 3.863
Rotatable bonds: 6
H-donors: 1
H-acceptors: 1
PSA: 101
Number of rings: 5

     

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