COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK973606
Chemical Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-[(3,4,5-trimethoxybenzyl)oxy]propan-2-ol
Smiles: COc1cc(COCC(CN2CCN(CC2)Cc2ccc3c(c2)OCO3)O)cc(c1OC)OC

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Saltdata: 2HCl
Molecular Weight: 474.55
Empirical Formula: C25H34N2O7

Available Amount: 0 mg

Lipinsky:
logP: 2.402
Rotatable bonds: 8
H-donors: 1
H-acceptors: 7
PSA: 82
Number of rings: 4

     

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