COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK761340
Chemical Name: N-[(E)-(4-bromophenyl)methylidene]-2-[(4-methoxy-3-nitrobenzyl)sulfanyl]-1,3-benzothiazol-6-amine
Smiles: COc1ccc(cc1[N+](=O)[O-])CSc1nc2c(s1)cc(cc2)/N=C/c1ccc(cc1)Br

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Molecular Weight: 514.42
Empirical Formula: C22H16BrN3O3S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 133
Number of rings: 4

     

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