COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK180051
Chemical Name: 2-[(4-chlorophenyl)(1,1-dioxido-1,2-benzothiazol-3-yl)amino]ethylpyridine-3-carboxylate
Smiles: Clc1ccc(cc1)N(C1=NS(=O)(=O)c2c1cccc2)CCOC(=O)c1cccnc1

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Molecular Weight: 441.89
Empirical Formula: C21H16ClN3O4S

Physical State: Dry powder
Available Amount: 791 mg

Lipinsky:
logP: 3.938
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 89
Number of rings: 4

     

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