COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK066048
Chemical Name: N-{[5-(acetyloxy)-6-bromo-3-(ethoxycarbonyl)-1-methyl-1H-indol-2-yl]methyl}-2-hydroxy-N,N-dimethylethanaminium
Smiles: CCOC(=O)c1c2cc(OC(=O)C)c(cc2n(c1C[N+](CCO)(C)C)C)Br

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Saltdata: I-
Molecular Weight: 442.33
Empirical Formula: C19H26BrN2O5

Physical State: Dry powder
Available Amount: 294 mg

Lipinsky:
logP: -1.732
Rotatable bonds: 10
H-donors: 1
H-acceptors: 5
PSA: 77
Number of rings: 2

     

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