COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK856421
Chemical Name: (2Z)-6-[(3-methylbut-2-en-1-yl)oxy]-2-(thiophen-2-ylmethylidene)-1-benzofuran-3(2H)-one
Smiles: CC(=CCOc1ccc2c(c1)O/C(=C\c1cccs1)/C2=O)C

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Molecular Weight: 312.39
Empirical Formula: C18H16O3S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.139
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 63
Number of rings: 3

     

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