UCSF

ZINC20446131

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2008 10 Yes

Popular Name: (6-methoxypyridin-2-yl)methanamine (6-methoxypyridin-2-yl)methanamine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 101962-27-0 , 194658-13-4 , 95851-89-1 , [194658-13-4] , [95851-89-1]

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) 0.35 -0.87 -46.16 3 3 1 50 139.178 2 ↓
Hi High (pH 8-9.5) 0.35 -1.25 -6.67 2 3 0 48 138.17 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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

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