UCSF

ZINC62994302

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 21st, 2011 16 Yes

Popular Name: cyclopentyl(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanimine cyclopentyl(6,8-dihydro-5H-imida…

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) 1.23 6.94 -89.09 3 4 2 48 220.32 2 ↓
Mid Mid (pH 6-8) 1.23 6.47 -36.66 2 4 1 47 219.312 2 ↓

Activity (Go SEA)

Rings

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

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