UCSF

ZINC67966828

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2011 22 Yes

Popular Name: 2-(3-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)acetamide 2-(3-methyl-2,4-dioxo-1H-pyrimid…

Find On: PubMed — Wikipedia — Google

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) -1.00 5.1 -42.32 3 8 1 103 304.33 3 ↓
Hi High (pH 8-9.5) -0.54 2.81 -54.16 1 8 -1 105 302.314 3 ↓
Mid Mid (pH 6-8) -1.00 4.64 -27.46 2 8 0 102 303.322 3 ↓

Activity (Go SEA)

Rings

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

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