COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK378101
Chemical Name: 4-[(7-chloro-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: [O-][N+](=O)c1c(Nc2c(C)n(n(c2=O)c2ccccc2)C)cc(c2c1non2)Cl

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Molecular Weight: 400.78
Empirical Formula: C17H13ClN6O4

Physical State: Dry powder
Available Amount: 428 mg

Lipinsky:
logP: 2.178
Rotatable bonds: 0
H-donors: 1
H-acceptors: 4
PSA: 120
Number of rings: 4

     

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