COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL454223
Chemical Name: 5-[({1-[(3,3-diphenylpropyl)(methyl)amino]-2-methylpropan-2-yl}oxy)carbonyl]-2,6-dimethyl-4-(3-nitrophenyl)pyridinium-3-carboxylate
Smiles: CN(CC(OC(=O)c1c(C)[nH+]c(c(c1c1cccc(c1)[N+](=O)[O-])C(=O)[O-])C)(C)C)CCC(c1ccccc1)c1ccccc1

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Molecular Weight: 595.7
Empirical Formula: C35H37N3O6

Available Amount: 0 mg

Lipinsky:
logP: 6.426
Rotatable bonds: 9
H-donors: 1
H-acceptors: 6
PSA: 129
Number of rings: 4

     

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