COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL553203
Chemical Name: 3-carboxy-1-(4-nitrophenyl)-2,3,4,9-tetrahydro-1H-beta-carbolin-2-ium
Smiles: OC(=O)C1Cc2c3ccccc3[nH]c2C([NH2+]1)c1ccc(cc1)[N+](=O)[O-]

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Saltdata: CH3COO-
Molecular Weight: 338.34
Empirical Formula: C18H16N3O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.89
Rotatable bonds: 2
H-donors: 4
H-acceptors: 4
PSA: 115
Number of rings: 4

     

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