COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK308540
Chemical Name: 3-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-N-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethyl]benzamide
Smiles: O=C(c1cccc(c1)Cn1cc(c(n1)[N+](=O)[O-])Br)NCCn1nc(cc1C)[N+](=O)[O-]

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Molecular Weight: 478.26
Empirical Formula: C17H16BrN7O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.863
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 156
Number of rings: 3

     

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