UCSF

ZINC61360967

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 2011 21 Yes

Popular Name: (1R)-1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[(1R)-1-(3-thienyl)ethyl]ethanamine (1R)-1-(2,7-dimethylpyrazolo[1,5…

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) 2.66 8.16 -51.25 2 4 1 47 301.439 4 ↓
Mid Mid (pH 6-8) 2.66 7.19 -9.5 1 4 0 42 300.431 4 ↓

Activity (Go SEA)

Rings

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

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