COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL301120
Chemical Name: 5-[2-(3,5-di-tert-butyl-4-hydroxyphenyl)-2-oxoethyl]-7-phenyl-2-(pyrrolidin-1-yl)[1,3]thiazolo[4,5-d]pyridazin-4(5H)-one
Smiles: O=C(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)Cn1nc(c2ccccc2)c2c(c1=O)nc(s2)N1CCCC1

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Molecular Weight: 544.72
Empirical Formula: C31H36N4O3S

Available Amount: 0 mg

Lipinsky:
logP: 6.442
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 114
Number of rings: 5

     

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