UCSF

ZINC03831028

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2005 13 Yes

Popular Name: Meglumine Meglumine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 35564-86-4 , 6284-40-8 , 90191-92-7 , [6284-40-8]

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) -2.68 -8.8 -43.5 7 6 1 118 196.223 6 ↓
Hi High (pH 8-9.5) -2.68 -10.25 -8.6 6 6 0 113 195.215 6 ↓

Vendor Notes

Note Type Comments Provided By
Mp [°C] 128 - 132 Acros Organics
Melting_Point 128-131? Alfa-Aesar
Melting_Point 128-131° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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