COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK852529
Chemical Name: 3,4,5-triethoxy-N-[(2E)-6-nitro-1,3-benzothiazol-2(3H)-ylidene]benzamide
Smiles: CCOc1cc(cc(c1OCC)OCC)C(=O)/N=c\1/sc2c([nH]1)ccc(c2)[N+](=O)[O-]

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Molecular Weight: 431.47
Empirical Formula: C20H21N3O6S

Physical State: Dry powder
Available Amount: 210 mg

Lipinsky:
logP: 5.246
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 140
Number of rings: 3

     

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