COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK751322
Chemical Name: N-(3-nitrophenyl)-2-[(6-{[(E)-(3-nitrophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Smiles: O=C(Nc1cccc(c1)[N+](=O)[O-])CSc1nc2c(s1)cc(cc2)/N=C/c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 493.52
Empirical Formula: C22H15N5O5S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.083
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 199
Number of rings: 4

     

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