COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK112335
Chemical Name: 2-[(2-chloro-6-nitrobenzyl)sulfanyl]-6-ethoxy-1,3-benzothiazole
Smiles: CCOc1ccc2c(c1)sc(n2)SCc1c(Cl)cccc1[N+](=O)[O-]

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Molecular Weight: 380.88
Empirical Formula: C16H13ClN2O3S2

Physical State: Dry powder
Available Amount: 355 mg

Lipinsky:
logP: 5.743
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 121
Number of rings: 3

     

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