COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK197396
Chemical Name: (3E)-5-(4-bromophenyl)-3-(4-methoxy-3-nitrobenzylidene)furan-2(3H)-one
Smiles: COc1ccc(cc1[N+](=O)[O-])/C=C/1\C=C(OC1=O)c1ccc(cc1)Br

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Molecular Weight: 402.2
Empirical Formula: C18H12BrNO5

Physical State: Dry powder
Available Amount: 156 mg

Lipinsky:
logP: 4.753
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 81
Number of rings: 3

     

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