COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK873201
Chemical Name: N-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamothioyl]-3-nitrobenzamide
Smiles: S=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)NC(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 411.44
Empirical Formula: C19H17N5O4S

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 1.342
Rotatable bonds: 1
H-donors: 2
H-acceptors: 4
PSA: 142
Number of rings: 3

     

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