COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK777248
Chemical Name: ethyl3-(3-nitrophenyl)-3-{[(2-oxo-2,3-dihydro-1,3-benzothiazol-6-yl)sulfonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1cccc(c1)[N+](=O)[O-])NS(=O)(=O)c1ccc2c(c1)sc(=O)[nH]2

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Saltdata: HCl
Molecular Weight: 451.48
Empirical Formula: C18H17N3O7S2

Physical State: Dry powder
Available Amount: 65 mg

Lipinsky:
logP: 2.795
Rotatable bonds: 7
H-donors: 2
H-acceptors: 7
PSA: 181
Number of rings: 3

     

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