COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL375757
Chemical Name: 3-({2-chloro-6-methoxy-4-[(E)-2-nitroethenyl]phenoxy}methyl)benzoicacid
Smiles: COc1cc(/C=C/[N+](=O)[O-])cc(c1OCc1cccc(c1)C(=O)O)Cl

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Molecular Weight: 363.75
Empirical Formula: C17H14ClNO6

Physical State: Dry powder
Available Amount: 564 mg

Lipinsky:
logP: 4.09
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 101
Number of rings: 2

     

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