COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK170738
Chemical Name: (5E)-1-(4-bromophenyl)-5-{[5-(2-methoxy-5-nitrophenyl)furan-2-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1c1ccc(o1)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br)[N+](=O)[O-]

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Molecular Weight: 512.27
Empirical Formula: C22H14BrN3O7

Physical State: Dry powder
Available Amount: 357 mg

Lipinsky:
logP: 4.196
Rotatable bonds: 3
H-donors: 1
H-acceptors: 7
PSA: 134
Number of rings: 4

     

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