COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL036443
Chemical Name: 1-(3-{1-[(2-aminoethyl)sulfanyl]-2-nitroethyl}-1H-indol-1-yl)ethanone
Smiles: NCCSC(c1cn(c2c1cccc2)C(=O)C)C[N+](=O)[O-]

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Saltdata: CI-
Molecular Weight: 307.37
Empirical Formula: C14H17N3O3S

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 2.088
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 119
Number of rings: 2

     

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