COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK472859
Chemical Name: (2E)-3-{5-[(4-bromophenoxy)methyl]furan-2-yl}-2-cyano-N-(3-cyanothiophen-2-yl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(o1)COc1ccc(cc1)Br)/C(=O)Nc1sccc1C#N

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Molecular Weight: 454.3
Empirical Formula: C20H12BrN3O3S

Physical State: Dry powder
Available Amount: 178 mg

Lipinsky:
logP: 5.532
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 127
Number of rings: 3

     

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