COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK683326
Chemical Name: (3Z)-3-(4-bromobenzylidene)-1-[(4-methylphenyl)sulfonyl]-4,6-dinitro-2,3-dihydro-1H-indole
Smiles: Cc1ccc(cc1)S(=O)(=O)N1C/C(=C\c2ccc(cc2)Br)/c2c1cc(cc2[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 530.36
Empirical Formula: C22H16BrN3O6S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.289
Rotatable bonds: 0
H-donors: 0
H-acceptors: 6
PSA: 137
Number of rings: 4

     

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