COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL504985
Chemical Name: (2E)-3-[5-(2-chloro-4-nitrophenyl)furan-2-yl]-2-cyano-N-cyclohexylprop-2-enamide
Smiles: N#C/C(=C\c1ccc(o1)c1ccc(cc1Cl)[N+](=O)[O-])/C(=O)NC1CCCCC1

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Molecular Weight: 399.83
Empirical Formula: C20H18ClN3O4

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 4.76
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 111
Number of rings: 3

     

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