UCSF

ZINC58343351

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2011 20 Yes

Popular Name: N'-(pyrazolo[1,5-a]pyrimidin-6-ylmethyl)-N-pyrimidin-2-yl-ethane-1,2-diamine N'-(pyrazolo[1,5-a]pyrimidin-6-y…

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) 0.19 5.84 -61.49 3 7 1 85 270.32 6 ↓
Mid Mid (pH 6-8) 0.19 4.48 -13.89 2 7 0 80 269.312 6 ↓

Activity (Go SEA)

Rings

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

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