COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK185274
Chemical Name: (2E)-3-[4-(benzyloxy)-3-bromo-5-iodophenyl]-2-cyano-N-(4-methoxybenzyl)prop-2-enamide
Smiles: COc1ccc(cc1)CNC(=O)/C(=C/c1cc(Br)c(c(c1)I)OCc1ccccc1)/C#N

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Molecular Weight: 603.25
Empirical Formula: C25H20BrIN2O3

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 6.397
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 71
Number of rings: 3

     

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