COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK922362
Chemical Name: (2E)-1-(1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)prop-2-en-1-one
Smiles: Clc1ccc(cc1)/C=C/C(=O)c1ccc2c(c1)OCO2

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Molecular Weight: 286.71
Empirical Formula: C16H11ClO3

Physical State: Dry powder
Available Amount: 117 mg

Lipinsky:
logP: 3.95
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 35
Number of rings: 3

     

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