COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK332470
Chemical Name: ethyl(2E)-2-cyano-3-(4-{[(2,4-dinitrophenyl)carbonyl]amino}phenyl)-3-hydroxyprop-2-enoate
Smiles: CCOC(=O)/C(=C(\c1ccc(cc1)NC(=O)c1ccc(cc1N(=O)=O)N(=O)=O)/O)/C#N

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Molecular Weight: 426.34
Empirical Formula: C19H14N4O8

Physical State: Dry powder
Available Amount: 54 mg

Lipinsky:
logP: 2.084
Rotatable bonds: 5
H-donors: 2
H-acceptors: 8
PSA: 191
Number of rings: 2

     

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