COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK414919
Chemical Name: (2E)-3-(3,4-dimethoxyphenyl)-1-[4-(pyrimidin-2-yl)piperazin-1-yl]prop-2-en-1-one
Smiles: COc1cc(/C=C/C(=O)N2CCN(CC2)c2ncccn2)ccc1OC

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Molecular Weight: 354.41
Empirical Formula: C19H22N4O3

Physical State: Dry powder
Available Amount: 343 mg

Lipinsky:
logP: 2.203
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 67
Number of rings: 3

     

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