COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK958507
Chemical Name: 2-{4-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-3-methoxyphenyl}-4,6-dinitro-1H-indole
Smiles: COc1cc(ccc1Cn1nc(c(c1C)Br)C)c1cc2c([nH]1)cc(cc2[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 500.31
Empirical Formula: C21H18BrN5O5

Physical State: Dry powder
Available Amount: 58 mg

Lipinsky:
logP: 5.444
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 134
Number of rings: 4

     

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