COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK741606
Chemical Name: 9-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Smiles: OC1=C(C(=O)CC(C1)(C)C)C1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(C)C

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Molecular Weight: 412.53
Empirical Formula: C25H32O5

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 3.303
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 80
Number of rings: 4

     

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