COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053413
Chemical Name: 4-chloro-3-nitro-N-(5-oxo-7-phenyl-3,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)benzamide
Smiles: O=C1CC(c2ccccc2)n2c(=N1)[nH]c(n2)NC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl

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Molecular Weight: 412.79
Empirical Formula: C18H13ClN6O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.786
Rotatable bonds: 1
H-donors: 2
H-acceptors: 4
PSA: 131
Number of rings: 4

     

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