UCSF

ZINC69075232

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 18th, 2011 17 Yes

Popular Name: (1S)-1-cyclopropyl-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethyl-ethanamine (1S)-1-cyclopropyl-2-(6,8-dihydr…

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) 0.78 8.07 -87.17 3 4 2 39 236.363 5 ↓
Hi High (pH 8-9.5) 0.78 7.6 -39.92 2 4 1 38 235.355 5 ↓

Activity (Go SEA)

Rings

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

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