COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK961424
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-1-(1H-pyrrol-2-yl)prop-2-en-1-one
Smiles: O=C(c1ccc[nH]1)/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 241.25
Empirical Formula: C14H11NO3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.297
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 51
Number of rings: 3

     

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