COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK133236
Chemical Name: {4-[4-(methylsulfanyl)benzyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone
Smiles: CSc1ccc(cc1)CN1CCN(CC1)C(=O)c1cc(OC)c(c(c1)OC)OC

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Saltdata: HCl
Molecular Weight: 416.54
Empirical Formula: C22H28N2O4S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 3.723
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 76
Number of rings: 3

     

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