COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL019653
Chemical Name: 2-({1-[2-(3,4-dimethoxyphenyl)ethyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoicacid
Smiles: COc1ccc(cc1OC)CCN1C(=O)CC(C1=O)Sc1ccccc1C(=O)O

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Molecular Weight: 415.47
Empirical Formula: C21H21NO6S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 2.967
Rotatable bonds: 9
H-donors: 1
H-acceptors: 6
PSA: 118
Number of rings: 3

     

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