COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL164052
Chemical Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]ethanone
Smiles: COCCn1c(C)cc(c1C)C(=O)CSc1nc2c(s1)cccc2

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Molecular Weight: 360.5
Empirical Formula: C18H20N2O2S2

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 4.346
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 97
Number of rings: 3

     

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