UCSF

ZINC11535851

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 16th, 2008 13 Yes

Popular Name: 2,3-dihydro-1H-pyrrolo[3,4-b]quinoline 2,3-dihydro-1H-pyrrolo[3,4-b]qui…

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) 1.52 -2.17 -48.71 2 2 1 29 171.223 0 ↓
Lo Low (pH 4.5-6) 1.52 -2.13 -104.87 3 2 2 31 172.231 0 ↓

Activity (Go SEA)

Rings

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