COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK976068
Chemical Name: 2-[(2E)-2-(benzylimino)-1,3-thiazolidin-3-yl]-1-(3-nitrophenyl)ethanone
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])CN1CCS/C/1=N/Cc1ccccc1

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Saltdata: HBr
Molecular Weight: 355.42
Empirical Formula: C18H17N3O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.575
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 103
Number of rings: 3

     

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