COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL000028
Chemical Name: 1- (5- nitrothiophen- 2- yl)ethanone
Smiles: CC(=O)c1ccc(s1)[N+](=O)[O-]

Download SD file Download MOL file View 3D-structure Show MSDS

Molecular Weight: 171.18
Empirical Formula: C6H5NO3S

Physical State: Dry powder
Available Amount: 1640 mg

Lipinsky:
logP: 1.098
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 91
Number of rings: 1

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