COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL192221
Chemical Name: octyl5-methyl-7-(3-nitrophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Smiles: CCCCCCCCOC(=O)C1=C(C)Nc2n(C1c1cccc(c1)[N+](=O)[O-])ncn2

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Molecular Weight: 413.48
Empirical Formula: C21H27N5O4

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 5.52
Rotatable bonds: 10
H-donors: 1
H-acceptors: 4
PSA: 114
Number of rings: 3

     

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