COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK128249
Chemical Name: 1-[(1E)-3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(3,4-dimethoxyphenyl)-3-oxoprop-1-en-2-yl]pyridin-2(1H)-one
Smiles: COc1cc(ccc1OC)/C=C(/n1ccccc1=O)\C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 503.55
Empirical Formula: C28H29N3O6

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 2.391
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 80
Number of rings: 5

     

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