COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK949899
Chemical Name: butyl4-{[(2E)-3-(5-bromo-2-hydroxyphenyl)-2-cyanoprop-2-enoyl]amino}benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)NC(=O)/C(=C/c1cc(Br)ccc1O)/C#N

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Molecular Weight: 443.3
Empirical Formula: C21H19BrN2O4

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 6.475
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 99
Number of rings: 2

     

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