COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK097180
Chemical Name: (2E)-N-(4-chlorophenyl)-2-cyano-3-[3-iodo-5-methoxy-4-(prop-2-en-1-yloxy)phenyl]prop-2-enamide
Smiles: C=CCOc1c(I)cc(cc1OC)/C=C(/C(=O)Nc1ccc(cc1)Cl)\C#N

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Molecular Weight: 494.72
Empirical Formula: C20H16ClIN2O3

Physical State: Dry powder
Available Amount: 189 mg

Lipinsky:
logP: 5.933
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 71
Number of rings: 2

     

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