COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK818231
Chemical Name: (3Z)-1-heptyl-3-[2-(3-methylphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1,3-dihydro-2H-indol-2-one
Smiles: CCCCCCCN1c2ccccc2/C(=c\2/sc3n(c2=O)nc(n3)c2cccc(c2)C)/C1=O

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Molecular Weight: 458.58
Empirical Formula: C26H26N4O2S

Physical State: Dry powder
Available Amount: 402 mg

Lipinsky:
logP: 6.839
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 93
Number of rings: 5

     

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