COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK096744
Chemical Name: (2E)-1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
Smiles: COc1cc(/C=C/C(=O)N2CCN(CC2)c2ccc(cc2)F)cc(c1OC)OC

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Molecular Weight: 400.45
Empirical Formula: C22H25FN2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.614
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 51
Number of rings: 3

     

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