COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK672580
Chemical Name: 9-(2-hydroxy-3,5-dinitrophenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Smiles: O=C1CC(C)(C)CC2=C1C(C1=C(O2)CC(CC1=O)(C)C)c1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 456.45
Empirical Formula: C23H24N2O8

Available Amount: 0 mg

Lipinsky:
logP: 3.672
Rotatable bonds: 2
H-donors: 1
H-acceptors: 8
PSA: 155
Number of rings: 4

     

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