COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK302508
Chemical Name: 3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]benzamide
Smiles: Cc1cc(Oc2cc(NC(=O)c3cccc(c3)Cn3nc(c(c3C)[N+](=O)[O-])C)cc(c2)[N+](=O)[O-])c(c(c1)C)C

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Molecular Weight: 529.55
Empirical Formula: C28H27N5O6

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 7.887
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 147
Number of rings: 4

     

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