COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK537828
Chemical Name: 4-(1H-benzotriazol-1-yl)-3,5-dinitrobenzoicacid
Smiles: [O-][N+](=O)c1cc(cc(c1n1nnc2c1cccc2)[N+](=O)[O-])C(=O)O

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Molecular Weight: 329.23
Empirical Formula: C13H7N5O6

Physical State: Dry powder
Available Amount: 229 mg

Lipinsky:
logP: 2.924
Rotatable bonds: 1
H-donors: 1
H-acceptors: 6
PSA: 159
Number of rings: 3

     

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