COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK542340
Chemical Name: 2-[(2E)-3-(2-methoxyphenyl)prop-2-enoyl]-4-methylphenyl4-nitrobenzoate
Smiles: COc1ccccc1/C=C/C(=O)c1cc(C)ccc1OC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 417.42
Empirical Formula: C24H19NO6

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.626
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 98
Number of rings: 3

     

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