COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK156688
Chemical Name: 5-(3-nitrophenoxy)-2-{4-[(4-nitrophenyl)sulfanyl]phenyl}-1H-isoindole-1,3(2H)-dione
Smiles: O=C1c2cc(ccc2C(=O)N1c1ccc(cc1)Sc1ccc(cc1)[N+](=O)[O-])Oc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 513.49
Empirical Formula: C26H15N3O7S

Physical State: Dry powder
Available Amount: 91 mg

Lipinsky:
logP: 6.33
Rotatable bonds: 2
H-donors: 0
H-acceptors: 7
PSA: 163
Number of rings: 5

     

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