COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK674648
Chemical Name: methyl4-[({[6-({(E)-[4-(1,3-benzothiazol-2-ylsulfanyl)-3-nitrophenyl]methylidene}amino)-1,3-benzothiazol-2-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nc2c(s1)cc(cc2)/N=C/c1ccc(c(c1)[N+](=O)[O-])Sc1nc2c(s1)cccc2

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Molecular Weight: 671.8
Empirical Formula: C31H21N5O5S4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 8.936
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 246
Number of rings: 6

     

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