COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL290924
Chemical Name: [3-(dimethylamino)-5,5-dioxido[1,2,4]triazolo[4,3-b][1,2]benzothiazol-2(3H)-yl](3-nitrophenyl)methanone
Smiles: CN(C1N(N=C2N1S(=O)(=O)c1c2cccc1)C(=O)c1cccc(c1)[N+](=O)[O-])C

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Molecular Weight: 401.4
Empirical Formula: C17H15N5O5S

Physical State: Dry powder
Available Amount: 480 mg

Lipinsky:
logP: 1.478
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 127
Number of rings: 4

     

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