COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL147336
Chemical Name: 2-amino-3-(ethoxycarbonyl)-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium
Smiles: CCOC(=O)c1cc2[nH]c3c(c2[n+](c1N)c1ccc(cc1)[N+](=O)[O-])cccc3

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Saltdata: CF3COO-
Molecular Weight: 377.38
Empirical Formula: C20H17N4O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0
Rotatable bonds: 3
H-donors: 3
H-acceptors: 4
PSA: 117
Number of rings: 4

     

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