COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK760990
Chemical Name: 9-(6-hydroxy-2,6-dimethylheptyl)-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Smiles: CC(CC1C2=C(CCCC2=O)OC2=C1C(=O)CCC2)CCCC(O)(C)C

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Molecular Weight: 360.49
Empirical Formula: C22H32O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.317
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 63
Number of rings: 3

     

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