COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL019700
Chemical Name: (2E)-4-{[4-chloro-3-(ethoxycarbonyl)phenyl]amino}-4-oxobut-2-enoicacid
Smiles: CCOC(=O)c1cc(ccc1Cl)NC(=O)/C=C/C(=O)O

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Molecular Weight: 297.69
Empirical Formula: C13H12ClNO5

Available Amount: 0 mg

Lipinsky:
logP: 2.851
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 92
Number of rings: 1

     

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