COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK723352
Chemical Name: methyl(4-{3-[tert-butyl(4-nitrobenzyl)amino]-2-hydroxypropoxy}-1H-indol-3-yl)acetate
Smiles: COC(=O)Cc1c[nH]c2c1c(OCC(CN(C(C)(C)C)Cc1ccc(cc1)[N+](=O)[O-])O)ccc2

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Saltdata: CI-
Molecular Weight: 469.54
Empirical Formula: C25H31N3O6

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 4.136
Rotatable bonds: 10
H-donors: 2
H-acceptors: 6
PSA: 120
Number of rings: 3

     

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