COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL416009
Chemical Name: methyl(2E)-3-[2-(benzyloxy)-5-bromophenyl]-2-cyanoprop-2-enoate
Smiles: N#C/C(=C\c1cc(Br)ccc1OCc1ccccc1)/C(=O)OC

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Molecular Weight: 372.22
Empirical Formula: C18H14BrNO3

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 4.582
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 59
Number of rings: 2

     

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