COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK195720
Chemical Name: (2E)-3-[4-(butan-2-yloxy)-3-chloro-5-methoxyphenyl]-2-(4-nitrophenyl)prop-2-enenitrile
Smiles: CCC(Oc1c(Cl)cc(cc1OC)/C=C(\c1ccc(cc1)[N+](=O)[O-])/C#N)C

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Molecular Weight: 386.83
Empirical Formula: C20H19ClN2O4

Physical State: Dry powder
Available Amount: 283 mg

Lipinsky:
logP: 6.287
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 88
Number of rings: 2

     

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