COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL343916
Chemical Name: 2-methyl-2-[2-(4-nitrophenyl)-2-oxoethyl]-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-2-ium
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])C[N+]1(C)CCc2c(C1)c1ccccc1[nH]2

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Saltdata: Br-
Molecular Weight: 350.4
Empirical Formula: C20H20N3O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 0.063
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 78
Number of rings: 4

     

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