COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK950758
Chemical Name: (4Z)-5-methyl-4-{[5-(4-methyl-2-nitrophenyl)furan-2-yl]methylidene}-2,4-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(c(c1)[N+](=O)[O-])c1ccc(o1)/C=C\1/C(=NNC1=O)C

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Molecular Weight: 311.3
Empirical Formula: C16H13N3O4

Physical State: Dry powder
Available Amount: 47 mg

Lipinsky:
logP: 3.215
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 100
Number of rings: 3

     

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