UCSF

ZINC19726970

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2008 19 Yes

Popular Name: 3-ethyl-7-piperazin-1-yl-1H-quinolin-2-one 3-ethyl-7-piperazin-1-yl-1H-quin…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 1.38 3.8 -54.91 3 4 1 53 258.345 2 ↓
Hi High (pH 8-9.5) 1.38 2.39 -10.12 2 4 0 48 257.337 2 ↓

Activity (Go SEA)

Rings

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

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