COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK757128
Chemical Name: 9-[5-(2,3-dimethyl-4-nitrophenyl)furan-2-yl]-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(c1ccc(o1)c1ccc(c(c1C)C)[N+](=O)[O-])C1=C(O2)CC(CC1=O)(C)C

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Molecular Weight: 489.57
Empirical Formula: C29H31NO6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.641
Rotatable bonds: 2
H-donors: 0
H-acceptors: 6
PSA: 102
Number of rings: 5

     

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