COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK145273
Chemical Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[4-(methylsulfanyl)benzyl]piperazine
Smiles: CSc1ccc(cc1)CN1CCN(CC1)Cc1ccc2c(c1)OCO2

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Saltdata: C2H2O4
Molecular Weight: 356.49
Empirical Formula: C20H24N2O2S

Physical State: Dry powder
Available Amount: 125 mg

Lipinsky:
logP: 2.8
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 50
Number of rings: 4

     

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