COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528529
Chemical Name: 1-(3,5-di-tert-butyl-4-hydroxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carbolin-2-ium-3-carboxylate
Smiles: [O-]C(=O)C1Cc2c3ccccc3[nH]c2C([NH2+]1)c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C

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Molecular Weight: 420.55
Empirical Formula: C26H32N2O3

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 4.8
Rotatable bonds: 1
H-donors: 4
H-acceptors: 3
PSA: 92
Number of rings: 4

     

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