UCSF

ZINC67640794

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 12th, 2011 12 Yes

Popular Name: (8-methyl-6,10-dioxaspiro[4.5]dec-8-yl)amine (8-methyl-6,10-dioxaspiro[4.5]de…

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CAS Number:

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) 1.44 1.57 -44.56 3 3 1 46 172.248 0 ↓
Hi High (pH 8-9.5) 1.44 1.33 -2.84 2 3 0 44 171.24 0 ↓

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

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