COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK775684
Chemical Name: (3Z)-1-[(4-methylphenyl)sulfonyl]-4,6-dinitro-3-(pyridin-3-ylmethylidene)-2,3-dihydro-1H-indole
Smiles: Cc1ccc(cc1)S(=O)(=O)N1C/C(=C\c2cccnc2)/c2c1cc(cc2[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 452.45
Empirical Formula: C21H16N4O6S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.156
Rotatable bonds: 1
H-donors: 0
H-acceptors: 6
PSA: 150
Number of rings: 4

     

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