COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL357750
Chemical Name: 2-butyl-5-(1H-indol-3-ylmethylidene)-2-methyl-1,3-dioxane-4,6-dione
Smiles: CCCCC1(C)OC(=O)/C(=C/c2c[nH]c3c2cccc3)/C(=O)O1

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Molecular Weight: 313.35
Empirical Formula: C18H19NO4

Physical State: Dry powder
Available Amount: 93 mg

Lipinsky:
logP: 2.384
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 68
Number of rings: 3

     

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