COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL020970
Chemical Name: (2Z)-3-[5-(2-chloro-4-nitrophenyl)furan-2-yl]-2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)prop-2-enamide
Smiles: N#C/C(=C/c1ccc(o1)c1ccc(cc1Cl)[N+](=O)[O-])/C(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C

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Molecular Weight: 503.9
Empirical Formula: C25H18ClN5O5

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 3.158
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 135
Number of rings: 4

     

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