COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK786193
Chemical Name: 1-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)ethanone
Smiles: O=C(n1nc(c(c1C)[N+](=O)[O-])C)Cn1nc(c(c1C)I)C

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Molecular Weight: 403.18
Empirical Formula: C12H14IN5O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.577
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 98
Number of rings: 2

     

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