COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK291583
Chemical Name: (5E)-5-(1,3-benzodioxol-5-ylmethylidene)-2-(4-methylpiperazin-1-yl)-1,3-thiazol-4(5H)-one
Smiles: CN1CCN(CC1)C1=NC(=O)/C(=C\c2ccc3c(c2)OCO3)/S1

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Molecular Weight: 331.4
Empirical Formula: C16H17N3O3S

Physical State: Dry powder
Available Amount: 72 mg

Lipinsky:
logP: 1.96
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 79
Number of rings: 4

     

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