COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK388546
Chemical Name: 2-(3,4-dimethylphenyl)-2-oxoethyl4-(2-chloro-6-nitrophenoxy)benzoate
Smiles: O=C(c1ccc(cc1)Oc1c(Cl)cccc1[N+](=O)[O-])OCC(=O)c1ccc(c(c1)C)C

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Molecular Weight: 439.85
Empirical Formula: C23H18ClNO6

Physical State: Dry powder
Available Amount: 162 mg

Lipinsky:
logP: 6.714
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 98
Number of rings: 3

     

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