COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK841933
Chemical Name: 4-chloro-2-[(2E)-3-(2-fluorophenyl)prop-2-enoyl]phenyl3-nitrobenzoate
Smiles: Clc1ccc(c(c1)C(=O)/C=C/c1ccccc1F)OC(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 425.8
Empirical Formula: C22H13ClFNO5

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.979
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 89
Number of rings: 3

     

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