COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK699260
Chemical Name: (5Z)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-3-(pyridin-3-ylmethyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C\c2cc3OCOc3cc2Br)/C(=O)N1Cc1cccnc1

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Molecular Weight: 435.32
Empirical Formula: C17H11BrN2O3S2

Physical State: Dry powder
Available Amount: 888 mg

Lipinsky:
logP: 3.233
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 109
Number of rings: 4

     

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