COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK381673
Chemical Name: (6Z)-2-butyl-5-imino-6-{3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]benzylidene}-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCCCc1sc2=NC(=O)/C(=C\c3ccc(c(c3)OC)OCCOc3ccc(cc3)[N+](=O)[O-])/C(=N)n2n1

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Molecular Weight: 523.57
Empirical Formula: C25H25N5O6S

Physical State: Dry powder
Available Amount: 209 mg

Lipinsky:
logP: 3.838
Rotatable bonds: 9
H-donors: 1
H-acceptors: 6
PSA: 167
Number of rings: 4

     

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