COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL187596
Chemical Name: 2-(4-benzylpiperazin-1-yl)-2-oxoethyl(2E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate
Smiles: COc1cc(/C=C/C(=O)OCC(=O)N2CCN(CC2)Cc2ccccc2)cc(c1OC)OC

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Molecular Weight: 454.52
Empirical Formula: C25H30N2O6

Physical State: Dry powder
Available Amount: 84 mg

Lipinsky:
logP: 2.845
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 77
Number of rings: 3

     

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