COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK822789
Chemical Name: (2E)-3-[5-(4-bromophenyl)furan-2-yl]-2-[(4-methylpiperidin-1-yl)carbonyl]prop-2-enenitrile
Smiles: CC1CCN(CC1)C(=O)/C(=C/c1ccc(o1)c1ccc(cc1)Br)/C#N

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Molecular Weight: 399.29
Empirical Formula: C20H19BrN2O2

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 5.198
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 57
Number of rings: 3

     

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