COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK130774
Chemical Name: 2-{2-methoxy-4-[(4-methylpiperidin-1-yl)carbonothioyl]phenoxy}-1-(pyrrolidin-1-yl)ethanone
Smiles: COc1cc(ccc1OCC(=O)N1CCCC1)C(=S)N1CCC(CC1)C

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Molecular Weight: 376.52
Empirical Formula: C20H28N2O3S

Physical State: Dry powder
Available Amount: 258 mg

Lipinsky:
logP: 2.467
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 74
Number of rings: 3

     

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