COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL052592
Chemical Name: N-[7-(4-chlorophenyl)-5-oxo-3,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-2-nitrobenzenesulfonamide
Smiles: Clc1ccc(cc1)C1CC(=O)N=c2n1nc([nH]2)NS(=O)(=O)c1ccccc1[N+](=O)[O-]

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Molecular Weight: 448.85
Empirical Formula: C17H13ClN6O5S

Physical State: Dry powder
Available Amount: 203 mg

Lipinsky:
logP: 0.705
Rotatable bonds: 1
H-donors: 2
H-acceptors: 5
PSA: 157
Number of rings: 4

     

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