UCSF

ZINC67935183

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 27 Yes

Popular Name: 6-(diethylaminomethyl)-N-(2,4,6-trimethyl-3-pyridyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide 6-(diethylaminomethyl)-N-(2,4,6-…

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) 1.89 8.98 -56.13 2 7 1 77 367.477 6 ↓
Mid Mid (pH 6-8) 1.89 6.92 -16.3 1 7 0 75 366.469 6 ↓
Lo Low (pH 4.5-6) 1.89 9.37 -85.49 3 7 2 78 368.485 6 ↓

Activity (Go SEA)

Rings

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

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