COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK925852
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-1-(5-chloro-2-methoxyphenyl)prop-2-en-1-one
Smiles: COc1ccc(cc1C(=O)/C=C/c1ccc2c(c1)OCO2)Cl

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Molecular Weight: 316.74
Empirical Formula: C17H13ClO4

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.752
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 44
Number of rings: 3

     

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