COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL191510
Chemical Name: 7-(diethylamino)-3-[5-(4-nitrophenyl)-4H-1,2,4-triazol-3-yl]-2H-chromen-2-one
Smiles: CCN(c1ccc2c(c1)oc(=O)c(c2)c1nnc([nH]1)c1ccc(cc1)[N+](=O)[O-])CC

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Molecular Weight: 405.41
Empirical Formula: C21H19N5O4

Physical State: Dry powder
Available Amount: 79 mg

Lipinsky:
logP: 5.331
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 116
Number of rings: 4

     

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