COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK137083
Chemical Name: 3-[(2E)-1-(1,1-dioxido-1,2-benzothiazol-3-yl)-2-(3-nitrobenzylidene)hydrazinyl]propanenitrile
Smiles: N#CCCN(C1=NS(=O)(=O)c2c1cccc2)/N=C/c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 383.39
Empirical Formula: C17H13N5O4S

Physical State: Dry powder
Available Amount: 262 mg

Lipinsky:
logP: 2.022
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 132
Number of rings: 3

     

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