COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK523925
Chemical Name: S-(1-{[3-(ethoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-1-oxobutan-2-yl)sulfurothioate
Smiles: CCOC(=O)c1c(NC(=O)C(SS(=O)(=O)[O-])CC)sc2c1CCCC2

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Saltdata: Na+
Molecular Weight: 406.52
Empirical Formula: C15H20NO6S3

Available Amount: 0 mg

Lipinsky:
logP: 4.782
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 174
Number of rings: 2

     

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