COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK053565
Chemical Name: ethyl6-bromo-4-[(dimethylamino)methyl]-2-{[(4-ethoxyphenyl)sulfanyl]methyl}-5-hydroxy-1-methyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c(CSc2ccc(cc2)OCC)n(c2c1c(CN(C)C)c(O)c(c2)Br)C

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Saltdata: HCI
Molecular Weight: 521.48
Empirical Formula: C24H29BrN2O4S

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 5.549
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 89
Number of rings: 3

     

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