UCSF

ZINC60023894

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2011 35 No

Popular Name: 4-[6-[4-(bis-p-tolylmethyl)-1-piperidyl]hexyl]morpholine-3,5-dione 4-[6-[4-(bis-p-tolylmethyl)-1-pi…

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) 5.27 15.76 -43.79 1 5 1 51 477.669 10 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US4123538; US4203991 IBM Patent Data

Activity (Go SEA)

Rings

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

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