COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK952785
Chemical Name: (2E)-2-cyano-N-methyl-3-[5-(4-methyl-2-nitrophenyl)furan-2-yl]prop-2-enamide
Smiles: CNC(=O)/C(=C/c1ccc(o1)c1ccc(cc1[N+](=O)[O-])C)/C#N

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Molecular Weight: 311.3
Empirical Formula: C16H13N3O4

Physical State: Dry powder
Available Amount: 360 mg

Lipinsky:
logP: 2.519
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 111
Number of rings: 2

     

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