COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK665254
Chemical Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}acetamide
Smiles: COc1cc(NC(=O)CSc2nc3c(s2)cccc3)c(cc1OC)Cc1nccc2c1cc(OC)c(c2)OC

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Molecular Weight: 561.68
Empirical Formula: C29H27N3O5S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.978
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 145
Number of rings: 5

     

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