COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK066919
Chemical Name: (5E)-1-(1,3-benzodioxol-5-yl)-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/c1ccc(o1)c1cccc(c1)[N+](=O)[O-])c1ccc2c(c1)OCO2

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Molecular Weight: 447.36
Empirical Formula: C22H13N3O8

Physical State: Dry powder
Available Amount: 75 mg

Lipinsky:
logP: 3.454
Rotatable bonds: 2
H-donors: 1
H-acceptors: 8
PSA: 143
Number of rings: 5

     

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