COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK553156
Chemical Name: 1,5-dimethyl-4-{[4-nitro-7-(piperidin-1-yl)-2,1,3-benzoxadiazol-5-yl]amino}-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: [O-][N+](=O)c1c(Nc2c(C)n(n(c2=O)c2ccccc2)C)cc(c2c1non2)N1CCCCC1

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Molecular Weight: 449.47
Empirical Formula: C22H23N7O4

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 2.573
Rotatable bonds: 0
H-donors: 1
H-acceptors: 4
PSA: 123
Number of rings: 5

     

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