COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK832737
Chemical Name: (2E)-1-[4-(2-hydroxy-3-phenoxypropyl)piperazin-1-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
Smiles: COc1cc(/C=C/C(=O)N2CCN(CC2)CC(COc2ccccc2)O)cc(c1OC)OC

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Saltdata: HCl
Molecular Weight: 456.54
Empirical Formula: C25H32N2O6

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 2.982
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 80
Number of rings: 3

     

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