COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK565376
Chemical Name: 3-(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)naphthalen-2-olate
Smiles: [O-]c1cc2ccccc2cc1c1[nH+]c2n(n1)cnc1c2c2CCCCCc2s1

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Molecular Weight: 386.48
Empirical Formula: C22H18N4OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.912
Rotatable bonds: 1
H-donors: 1
H-acceptors: 1
PSA: 95
Number of rings: 6

     

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