COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL046362
Chemical Name: 3-(ethoxycarbonyl)-1,2-dimethyl-4-[(4-methylpiperazin-1-ium-1-yl)methyl]-1H-indol-5-olate
Smiles: CCOC(=O)c1c(C)n(c2c1c(C[NH+]1CCN(CC1)C)c([O-])cc2)C

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Molecular Weight: 345.44
Empirical Formula: C19H27N3O3

Physical State: Dry powder
Available Amount: 318 mg

Lipinsky:
logP: 1.477
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 61
Number of rings: 3

     

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