COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL171121
Chemical Name: 2-{3-[(4-chlorophenoxy)methyl]-4-methoxyphenyl}-4,6-dinitro-1H-indole
Smiles: COc1ccc(cc1COc1ccc(cc1)Cl)c1cc2c([nH]1)cc(cc2[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 453.84
Empirical Formula: C22H16ClN3O6

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 6.146
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 125
Number of rings: 4

     

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