COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK487903
Chemical Name: 1-{4-[(2,5-dimethoxyphenyl)sulfonyl]piperazin-1-yl}-2-ethylbutan-1-one
Smiles: CCC(C(=O)N1CCN(CC1)S(=O)(=O)c1cc(OC)ccc1OC)CC

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Molecular Weight: 384.5
Empirical Formula: C18H28N2O5S

Physical State: Dry powder
Available Amount: 91 mg

Lipinsky:
logP: 3.168
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 84
Number of rings: 2

     

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