COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK747061
Chemical Name: 9-(4-bromo-3-nitrophenyl)-2,2,7,7-tetramethyl-2,3,7,8-tetrahydro-1H-xanthene-4,5(6H,9H)-dione
Smiles: O=C1CC(C)(C)CC2=C1OC1=C(C2c2ccc(c(c2)[N+](=O)[O-])Br)CC(CC1=O)(C)C

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Molecular Weight: 474.35
Empirical Formula: C23H24BrNO5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.257
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 89
Number of rings: 4

     

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