COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK137814
Chemical Name: methyl4-{(E)-[2-(1,1-dioxido-1,2-benzothiazol-3-yl)-2-(2-hydroxyethyl)hydrazinylidene]methyl}-3-hydroxynaphthalene-2-carboxylate
Smiles: OCCN(C1=NS(=O)(=O)c2c1cccc2)/N=C/c1c(O)c(cc2c1cccc2)C(=O)OC

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Molecular Weight: 453.48
Empirical Formula: C22H19N3O6S

Physical State: Dry powder
Available Amount: 418 mg

Lipinsky:
logP: 4.071
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 129
Number of rings: 4

     

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