COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK779889
Chemical Name: ethyl3-(3-nitrophenyl)-3-{[(2-oxo-1,3-benzothiazol-3(2H)-yl)acetyl]amino}propanoate
Smiles: CCOC(=O)CC(c1cccc(c1)[N+](=O)[O-])NC(=O)Cn1c(=O)sc2c1cccc2

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Saltdata: HCl
Molecular Weight: 429.45
Empirical Formula: C20H19N3O6S

Physical State: Dry powder
Available Amount: 48 mg

Lipinsky:
logP: 3.245
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 146
Number of rings: 3

     

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