COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL383467
Chemical Name: 3-{[(2E)-3-(3-bromo-4,5-dimethoxyphenyl)-2-cyanoprop-2-enoyl]amino}benzoicacid
Smiles: N#C/C(=C\c1cc(Br)c(c(c1)OC)OC)/C(=O)Nc1cccc(c1)C(=O)O

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Molecular Weight: 431.24
Empirical Formula: C19H15BrN2O5

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 3.991
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 108
Number of rings: 2

     

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