COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528491
Chemical Name: 1-(3,5-dibromo-4-hydroxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carbolin-2-ium-3-carboxylate
Smiles: [O-]C(=O)C1Cc2c3ccccc3[nH]c2C([NH2+]1)c1cc(Br)c(c(c1)Br)O

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Molecular Weight: 466.13
Empirical Formula: C18H14Br2N2O3

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 3.354
Rotatable bonds: 1
H-donors: 4
H-acceptors: 3
PSA: 92
Number of rings: 4

     

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