COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK139086
Chemical Name: 3-[(2E)-1-(1,1-dioxido-1,2-benzothiazol-3-yl)-2-(pyridin-3-ylmethylidene)hydrazinyl]propanenitrile
Smiles: N#CCCN(C1=NS(=O)(=O)c2c1cccc2)/N=C/c1cccnc1

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Molecular Weight: 339.38
Empirical Formula: C16H13N5O2S

Physical State: Dry powder
Available Amount: 555 mg

Lipinsky:
logP: 1.04
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 99
Number of rings: 3

     

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