COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK553798
Chemical Name: 4-{[(2E)-2-{[(4-chlorophenyl)carbonyl]amino}-3-(3,4-diethoxyphenyl)prop-2-enoyl]amino}benzoicacid
Smiles: CCOc1cc(ccc1OCC)/C=C(\C(=O)Nc1ccc(cc1)C(=O)O)/NC(=O)c1ccc(cc1)Cl

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Molecular Weight: 508.96
Empirical Formula: C27H25ClN2O6

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 5.759
Rotatable bonds: 7
H-donors: 3
H-acceptors: 6
PSA: 113
Number of rings: 3

     

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