COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK528886
Chemical Name: benzyl3-(benzylsulfanyl)-3-(1H-indol-3-yl)-2-nitropropanoate
Smiles: [O-][N+](=O)C(C(c1c[nH]c2c1cccc2)SCc1ccccc1)C(=O)OCc1ccccc1

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Molecular Weight: 446.53
Empirical Formula: C25H22N2O4S

Physical State: Dry powder
Available Amount: 268 mg

Lipinsky:
logP: 7.682
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 113
Number of rings: 4

     

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