COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK870289
Chemical Name: 5-[(2-carboxyethyl)sulfanyl]-4-methyl-2-(piperidin-1-yl)-1,3-dithiol-1-ium
Smiles: OC(=O)CCSc1[s+]c(sc1C)N1CCCCC1

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Saltdata: Br-
Molecular Weight: 304.48
Empirical Formula: C12H18NO2S3

Physical State: Dry powder
Available Amount: 69 mg

Lipinsky:
logP: 0
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 94
Number of rings: 2

     

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