COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK806060
Chemical Name: 5-[2-(ethylsulfanyl)propyl]-2-[1-(pyrrolidin-1-yl)butylidene]cyclohexane-1,3-dione
Smiles: CCSC(CC1CC(=O)/C(=C(\N2CCCC2)/CCC)/C(=O)C1)C

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Molecular Weight: 337.53
Empirical Formula: C19H31NO2S

Available Amount: 0 mg

Lipinsky:
logP: 3.582
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 62
Number of rings: 2

     

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