UCSF

ZINC16886470

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2008 9 Yes

Popular Name: 5-Chloropyrimidine-4,6-diol 5-Chloropyrimidine-4,6-diol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1193-56-2 , 63447-41-6 , [1193-56-2]

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) 0.19 -1.48 -47.85 1 4 -1 69 145.525 0 ↓
Ref Reference (pH 7) 0.19 -1.55 -45.59 1 4 -1 69 145.525 0 ↓
Hi High (pH 8-9.5) 0.65 -2.71 -105.28 0 4 -2 72 144.517 0 ↓
Lo Low (pH 4.5-6) 0.19 -1.06 -42.12 2 4 0 70 146.533 0 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

Rings

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