COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK385711
Chemical Name: (6Z)-5-imino-2-methyl-6-{3-[(4-nitrobenzyl)oxy]benzylidene}-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Cc1nn2c(=NC(=O)/C(=C\c3cccc(c3)OCc3ccc(cc3)[N+](=O)[O-])/C2=N)s1

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Molecular Weight: 421.44
Empirical Formula: C20H15N5O4S

Physical State: Dry powder
Available Amount: 200 mg

Lipinsky:
logP: 2.205
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 149
Number of rings: 4

     

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