COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK673012
Chemical Name: ethyl6-bromo-2-[({5-[(2E)-but-2-en-1-yl]-3-cyano-4,6-dimethylpyridin-2-yl}sulfanyl)methyl]-5-hydroxy-1-methyl-1H-indole-3-carboxylate
Smiles: C/C=C/Cc1c(C)nc(c(c1C)C#N)SCc1n(C)c2c(c1C(=O)OCC)cc(c(c2)Br)O

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Molecular Weight: 528.47
Empirical Formula: C25H26BrN3O3S

Physical State: Dry powder
Available Amount: 3 mg

Lipinsky:
logP: 6.325
Rotatable bonds: 9
H-donors: 1
H-acceptors: 3
PSA: 113
Number of rings: 3

     

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