COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL171609
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-1-(5-methylthiophen-2-yl)prop-2-en-1-one
Smiles: Cc1ccc(s1)C(=O)/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 272.32
Empirical Formula: C15H12O3S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.198
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 63
Number of rings: 3

     

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