COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK687388
Chemical Name: 7,9-diiodo-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(I)cc1I)[N+](=O)[O-]

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Molecular Weight: 672.24
Empirical Formula: C22H14I2N2O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 7.825
Rotatable bonds: 0
H-donors: 0
H-acceptors: 5
PSA: 102
Number of rings: 5

     

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