COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK184746
Chemical Name: 2-(4-nitrophenyl)-2-oxoethyl(4-oxo-4,6,7,8-tetrahydro-3H-pyrrolo[2,1-f]purin-3-yl)acetate
Smiles: O=C(Cn1cnc2c(c1=O)n1CCCc1n2)OCC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 397.35
Empirical Formula: C18H15N5O6

Physical State: Dry powder
Available Amount: 40 mg

Lipinsky:
logP: -0.175
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 139
Number of rings: 4

     

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