COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK386876
Chemical Name: S-[1-(1H-indol-3-yl)-2-nitroethyl]ethanethioate
Smiles: [O-][N+](=O)CC(c1c[nH]c2c1cccc2)SC(=O)C

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Molecular Weight: 264.3
Empirical Formula: C12H12N2O3S

Physical State: Dry powder
Available Amount: 526 mg

Lipinsky:
logP: 2.798
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 103
Number of rings: 2

     

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