COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK051729
Chemical Name: S-[1-(1-acetyl-1H-indol-3-yl)-2-nitroethyl]ethanethioate
Smiles: CC(=O)SC(c1cn(c2c1cccc2)C(=O)C)C[N+](=O)[O-]

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Molecular Weight: 306.34
Empirical Formula: C14H14N2O4S

Physical State: Dry powder
Available Amount: 466 mg

Lipinsky:
logP: 2.838
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 110
Number of rings: 2

     

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