UCSF

ZINC36977469

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2009 21 Yes

Popular Name: (3R)-3-[[3-(3-methoxyphenyl)cyclobutyl]amino]azepan-2-one (3R)-3-[[3-(3-methoxyphenyl)cycl…

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) 2.59 6.06 -46.88 3 4 1 55 289.399 4 ↓
Hi High (pH 8-9.5) 2.59 5.81 -9.07 2 4 0 50 288.391 4 ↓

Activity (Go SEA)

Rings

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