COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK822058
Chemical Name: (2E)-3-[5-(4-bromophenyl)furan-2-yl]-2-[(4-methylpiperazin-1-yl)carbonyl]prop-2-enenitrile
Smiles: CN1CCN(CC1)C(=O)/C(=C/c1ccc(o1)c1ccc(cc1)Br)/C#N

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Saltdata: HCl
Molecular Weight: 400.27
Empirical Formula: C19H18BrN3O2

Physical State: Dry powder
Available Amount: 71 mg

Lipinsky:
logP: 3.593
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 60
Number of rings: 3

     

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