COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK706598
Chemical Name: (3Z)-3-[2-(4-butoxyphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1-heptyl-1,3-dihydro-2H-indol-2-one
Smiles: CCCCCCCN1C(=O)/C(=c/2\sc3n(c2=O)nc(n3)c2ccc(cc2)OCCCC)/c2c1cccc2

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Molecular Weight: 516.66
Empirical Formula: C29H32N4O3S

Physical State: Dry powder
Available Amount: 399 mg

Lipinsky:
logP: 8.139
Rotatable bonds: 9
H-donors: 0
H-acceptors: 3
PSA: 102
Number of rings: 5

     

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