COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL291116
Chemical Name: N-tert-butyl-3-[(2E)-2-[(6-chloro-1,3-benzodioxol-5-yl)methylidene]-1-(1,1-dioxido-1,2-benzothiazol-3-yl)hydrazinyl]propanamide
Smiles: O=C(NC(C)(C)C)CCN(C1=NS(=O)(=O)c2c1cccc2)/N=C/c1cc2OCOc2cc1Cl

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Molecular Weight: 490.97
Empirical Formula: C22H23ClN4O5S

Physical State: Dry powder
Available Amount: 369 mg

Lipinsky:
logP: 2.97
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 110
Number of rings: 4

     

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