COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK435132
Chemical Name: 9-[3-(4-bromophenyl)-4H-pyrazol-4-yl]-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Smiles: Brc1ccc(cc1)C1=NN=CC1C1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(C)C

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Molecular Weight: 495.42
Empirical Formula: C26H27BrN2O3

Physical State: Dry powder
Available Amount: 143 mg

Lipinsky:
logP: 5.357
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 68
Number of rings: 5

     

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