COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK673581
Chemical Name: N-butyl-2-[(6-{[(E)-(2-hydroxy-5-nitrophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Smiles: CCCCNC(=O)CSc1nc2c(s1)cc(cc2)/N=C/c1cc(ccc1O)[N+](=O)[O-]

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Molecular Weight: 444.54
Empirical Formula: C20H20N4O4S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.71
Rotatable bonds: 8
H-donors: 2
H-acceptors: 4
PSA: 173
Number of rings: 3

     

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