COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK311498
Chemical Name: 2-{3-[(4-methylphenyl)sulfanyl]-5-nitrophenyl}hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Smiles: Cc1ccc(cc1)Sc1cc(cc(c1)[N+](=O)[O-])N1C(=O)C2C(C1=O)C1OC2CC1

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Molecular Weight: 410.45
Empirical Formula: C21H18N2O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.062
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 117
Number of rings: 5

     

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