COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK563963
Chemical Name: 2-(9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-1-ium-2-yl)phenolate
Smiles: [O-]c1ccccc1c1[nH+]c2n(n1)cnc1c2c2CCCCCc2s1

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Molecular Weight: 336.42
Empirical Formula: C18H16N4OS

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 6.681
Rotatable bonds: 1
H-donors: 1
H-acceptors: 1
PSA: 95
Number of rings: 5

     

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