COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL338472
Chemical Name: 4-chloro-N-[7-(4-chlorophenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-3-nitrobenzamide
Smiles: Clc1ccc(cc1)C1C=C(Nc2n1nc(n2)NC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl)c1ccccc1

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Saltdata: HCl
Molecular Weight: 507.34
Empirical Formula: C24H16Cl2N6O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.14
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 117
Number of rings: 5

     

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