COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK020018
Chemical Name: (5E)-1-(4-chlorophenyl)-5-{[5-(2-methyl-4-nitrophenyl)furan-2-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Clc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2ccc(o2)c2ccc(cc2C)[N+](=O)[O-])/C1=O

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Molecular Weight: 451.82
Empirical Formula: C22H14ClN3O6

Physical State: Dry powder
Available Amount: 197 mg

Lipinsky:
logP: 4.734
Rotatable bonds: 2
H-donors: 1
H-acceptors: 6
PSA: 125
Number of rings: 4

     

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