COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL091340
Chemical Name: ethyl4-({[5-methyl-7-(3-nitrophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]carbonyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)C1=C(C)Nc2n(C1c1cccc(c1)[N+](=O)[O-])ncn2

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Molecular Weight: 448.44
Empirical Formula: C22H20N6O5

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 4.299
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 143
Number of rings: 4

     

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