UCSF

ZINC20357751

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2008 11 Yes

Popular Name: 6-(Hydroxymethyl)picolinic acid 6-(Hydroxymethyl)picolinic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1197-10-0 , 26893-73-2 , [1197-10-0]

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) -0.25 -0.28 -55.09 1 4 -1 73 152.129 2 ↓
Hi High (pH 8-9.5) 3.27 4.36 -9.46 1 6 0 66 346.464 11 ↓
Lo Low (pH 4.5-6) -0.25 0.12 -33.54 2 4 0 74 153.137 2 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 130-134? Alfa-Aesar
Melting_Point 130-134° Alfa-Aesar
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

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