COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL570133
Chemical Name: (3a'R,5'R,5a'S,8a'S,8b'R)-5'-({[4-(3-methylbutoxy)benzyl]oxy}methyl)tetrahydro-3a'H-dispiro[cyclohexane-1,2'-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-7',1''-cyclohexane](non-preferredname)
Smiles: CC(CCOc1ccc(cc1)COC[C@H]1O[C@@H]2OC3(O[C@@H]2[C@@H]2[C@H]1OC1(O2)CCCCC1)CCCCC3)C

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Molecular Weight: 516.68
Empirical Formula: C30H44O7

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 9.258
Rotatable bonds: 5
H-donors: 0
H-acceptors: 7
PSA: 64
Number of rings: 6

     

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