COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK562221
Chemical Name: (5E)-3-(3-chloro-4-methylphenyl)-6-hydroxy-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: OC1=NC(=O)N(C(=O)/C/1=C/c1ccc(o1)c1cccc(c1)[N+](=O)[O-])c1ccc(c(c1)Cl)C

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Molecular Weight: 451.82
Empirical Formula: C22H14ClN3O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.658
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 128
Number of rings: 4

     

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