UCSF

ZINC69852943

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2011 11 Yes

Popular Name: 2,6-dioxaspiro[4.5]decan-9-ol 2,6-dioxaspiro[4.5]decan-9-ol

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CAS Number: 1342244-16-9

Other Names:

MFCD19651087

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.23 -0.99 -5.23 1 3 0 39 158.197 0 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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Rings

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.