COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK674214
Chemical Name: 2-[(4-bromobenzyl)sulfanyl]-N-[(E)-{4-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-3-nitrophenyl}methylidene]-1,3-benzothiazol-6-amine
Smiles: Brc1ccc(cc1)CSc1nc2c(s1)cc(cc2)/N=C/c1ccc(c(c1)[N+](=O)[O-])Sc1nccn1C

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Molecular Weight: 596.55
Empirical Formula: C25H18BrN5O2S3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 7.408
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 167
Number of rings: 5

     

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