COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK335998
Chemical Name: 5-(3,5-di-tert-butyl-4-hydroxyphenyl)-8-(thiophen-2-yl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-2,4,6(1H,3H,7H)-trione
Smiles: O=c1[nH]c2NC3=C(C(c2c(=O)[nH]1)c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)C(=O)CC(C3)c1cccs1

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Molecular Weight: 519.66
Empirical Formula: C29H33N3O4S

Physical State: Dry powder
Available Amount: 370 mg

Lipinsky:
logP: 4.422
Rotatable bonds: 2
H-donors: 4
H-acceptors: 4
PSA: 135
Number of rings: 5

     

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