COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK972667
Chemical Name: 2-methoxy-4-[(E)-2-phenylethenyl]phenyl2-chloro-4-nitrobenzoate
Smiles: COc1cc(ccc1OC(=O)c1ccc(cc1Cl)[N+](=O)[O-])/C=C/c1ccccc1

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Molecular Weight: 409.83
Empirical Formula: C22H16ClNO5

Available Amount: 0 mg

Lipinsky:
logP: 6.421
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 81
Number of rings: 3

     

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