COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK773419
Chemical Name: 2-[(4-methylphenyl)sulfonyl]-4-nitro-7-(prop-2-en-1-yl)-1,2-dihydro[1]benzoxepino[4,3,2-cd]indole
Smiles: C=CCc1cccc2c1Oc1cc(cc3c1C(=C2)CN3S(=O)(=O)c1ccc(cc1)C)[N+](=O)[O-]

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Molecular Weight: 460.51
Empirical Formula: C25H20N2O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.176
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 100
Number of rings: 5

     

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