COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK172066
Chemical Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[(4-methylbenzyl)sulfanyl]ethanone
Smiles: Cc1ccc(cc1)CSCC(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 398.53
Empirical Formula: C22H26N2O3S

Physical State: Dry powder
Available Amount: 145 mg

Lipinsky:
logP: 3.966
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 67
Number of rings: 4

     

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