COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK017736
Chemical Name: ethyl6-bromo-2-{[(4,5-dichloro-3,6-dioxocyclohexa-1,4-dien-1-yl)sulfanyl]methyl}-5-methoxy-1-methyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c2cc(OC)c(cc2n(c1CSC1=CC(=O)C(=C(C1=O)Cl)Cl)C)Br

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Molecular Weight: 533.23
Empirical Formula: C20H16BrCl2NO5S

Physical State: Dry powder
Available Amount: 19 mg

Lipinsky:
logP: 4.611
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 99
Number of rings: 3

     

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