COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL512414
Chemical Name: (2E)-1-(2-hydroxy-5-methylphenyl)-3-(2,3,4,5-tetrahydro-1,6-benzodioxocin-8-yl)prop-2-en-1-one
Smiles: Cc1ccc(c(c1)C(=O)/C=C/c1ccc2c(c1)OCCCCO2)O

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Molecular Weight: 324.38
Empirical Formula: C20H20O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.12
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 55
Number of rings: 3

     

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