COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK841245
Chemical Name: 2-[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]-5-methoxyphenyl3-nitrobenzoate
Smiles: COc1ccc(c(c1)OC(=O)c1cccc(c1)[N+](=O)[O-])C(=O)/C=C/c1ccc(c(c1)OC)OC

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Molecular Weight: 463.44
Empirical Formula: C25H21NO8

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.487
Rotatable bonds: 9
H-donors: 0
H-acceptors: 8
PSA: 116
Number of rings: 3

     

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