COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK295635
Chemical Name: 5-nitro-2-{4-[(4-nitrophenyl)sulfanyl]phenyl}-1H-isoindole-1,3(2H)-dione
Smiles: O=C1c2cc(ccc2C(=O)N1c1ccc(cc1)Sc1ccc(cc1)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 421.39
Empirical Formula: C20H11N3O6S

Physical State: Dry powder
Available Amount: 52 mg

Lipinsky:
logP: 3.93
Rotatable bonds: 0
H-donors: 0
H-acceptors: 6
PSA: 154
Number of rings: 4

     

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