COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL006057
Chemical Name: (5Z)-5-[4-(azepan-1-yl)benzylidene]-1-hexyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCCCCCN1C(=S)NC(=O)/C(=C/c2ccc(cc2)N2CCCCCC2)/C1=O

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Molecular Weight: 413.58
Empirical Formula: C23H31N3O2S

Available Amount: 0 mg

Lipinsky:
logP: 5.884
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 84
Number of rings: 3

     

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