COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL040004
Chemical Name: 2-(9-benzyl-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ium-2-yl)naphthalen-1-olate
Smiles: [O-]c1c(ccc2c1cccc2)c1nc2n(n1)cnc1c2c2CC[NH+](Cc2s1)Cc1ccccc1

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Molecular Weight: 463.56
Empirical Formula: C27H21N5OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.942
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 98
Number of rings: 7

     

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