COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL488146
Chemical Name: methyl(2E)-3-[1-(2-cyanoethyl)-3-(4-methoxy-3-nitrophenyl)-1H-pyrazol-4-yl]prop-2-enoate
Smiles: N#CCCn1nc(c(c1)/C=C/C(=O)OC)c1ccc(c(c1)[N+](=O)[O-])OC

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Molecular Weight: 356.34
Empirical Formula: C17H16N4O5

Available Amount: 0 mg

Lipinsky:
logP: 0.889
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 122
Number of rings: 2

     

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