COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK673682
Chemical Name: 3,3,6,6-tetramethyl-9-(6-nitro-1,3-benzodioxol-5-yl)-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)c1cc2OCOc2cc1[N+](=O)[O-]

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Molecular Weight: 439.47
Empirical Formula: C24H25NO7

Physical State: Dry powder
Available Amount: 15 mg

Lipinsky:
logP: 4.156
Rotatable bonds: 1
H-donors: 0
H-acceptors: 7
PSA: 107
Number of rings: 5

     

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