COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK303736
Chemical Name: (5Z)-5-{4-methoxy-3-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]benzylidene}-3-(3-methoxypropyl)-2-thioxoimidazolidin-4-one
Smiles: COCCCN1C(=S)N/C(=C\c2ccc(c(c2)Cn2cnc(n2)[N+](=O)[O-])OC)/C1=O

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Molecular Weight: 432.46
Empirical Formula: C18H20N6O5S

Physical State: Dry powder
Available Amount: 51 mg

Lipinsky:
logP: 1.033
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 159
Number of rings: 3

     

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