COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL079599
Chemical Name: 2-{[2-(3,5-di-tert-butyl-4-hydroxyphenyl)-2-oxoethyl]sulfanyl}-5,6-dimethyl-3-(prop-2-en-1-yl)thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: C=CCn1c(SCC(=O)c2cc(c(c(c2)C(C)(C)C)O)C(C)(C)C)nc2c(c1=O)c(C)c(s2)C

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Molecular Weight: 498.71
Empirical Formula: C27H34N2O3S2

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 7.548
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 123
Number of rings: 3

     

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