COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL357608
Chemical Name: (3E)-5-(4-chlorophenyl)-3-(2,4-dimethoxy-5-nitrobenzylidene)furan-2(3H)-one
Smiles: COc1cc(OC)c(cc1/C=C/1\C=C(OC1=O)c1ccc(cc1)Cl)[N+](=O)[O-]

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Molecular Weight: 387.78
Empirical Formula: C19H14ClNO6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.632
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 90
Number of rings: 3

     

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