COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK429304
Chemical Name: (2E)-N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-N-methyl-3-(4-nitrophenyl)prop-2-enamide
Smiles: CCn1nc(c(c1)CN(C(=O)/C=C/c1ccc(cc1)[N+](=O)[O-])C)C

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Molecular Weight: 328.37
Empirical Formula: C17H20N4O3

Physical State: Dry powder
Available Amount: 964 mg

Lipinsky:
logP: 2.036
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 83
Number of rings: 2

     

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