COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK052477
Chemical Name: 3-[(2E)-2-[(6-chloro-1,3-benzodioxol-5-yl)methylidene]-1-(1,1-dioxido-1,2-benzothiazol-3-yl)hydrazinyl]-N-cyclohexylpropanamide
Smiles: O=C(NC1CCCCC1)CCN(C1=NS(=O)(=O)c2c1cccc2)/N=C/c1cc2OCOc2cc1Cl

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Molecular Weight: 517.01
Empirical Formula: C24H25ClN4O5S

Physical State: Dry powder
Available Amount: 1215 mg

Lipinsky:
logP: 3.802
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 110
Number of rings: 5

     

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