COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK180022
Chemical Name: N-tert-butyl-3-[(2E)-2-(2,3-dihydroxybenzylidene)-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/c1cccc(c1O)O

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Molecular Weight: 444.51
Empirical Formula: C21H24N4O5S

Physical State: Dry powder
Available Amount: 462 mg

Lipinsky:
logP: 2.45
Rotatable bonds: 7
H-donors: 3
H-acceptors: 5
PSA: 132
Number of rings: 3

     

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