COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK772884
Chemical Name: 9-bromo-2-[(4-methylphenyl)sulfonyl]-4-nitro-2,11-dihydro[1]benzoxepino[4,3,2-cd]indole
Smiles: Cc1ccc(cc1)S(=O)(=O)n1cc2c3c1cc(cc3Oc1c(C2)cc(Br)cc1)[N+](=O)[O-]

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Molecular Weight: 499.34
Empirical Formula: C22H15BrN2O5S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 6.92
Rotatable bonds: 0
H-donors: 0
H-acceptors: 5
PSA: 102
Number of rings: 5

     

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