COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK044340
Chemical Name: (7Z)-3-(1,3-benzodioxol-5-yl)-7-(5-ethoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Smiles: CCOc1ccc2c(c1)/C(=c\1/sc3=NCN(Cn3c1=O)c1ccc3c(c1)OCO3)/C(=O)N2

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Molecular Weight: 450.47
Empirical Formula: C22H18N4O5S

Physical State: Dry powder
Available Amount: 590 mg

Lipinsky:
logP: 0.33
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 118
Number of rings: 6

     

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