UCSF

ZINC21527788

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2008 33 Yes

Popular Name: (3R)-N-[3-[4-(1-piperidyl)-1-piperidyl]propyl]-1-(1-piperidylsulfonyl)piperidine-3-carboxamide (3R)-N-[3-[4-(1-piperidyl)-1-pip…

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) 2.14 7.34 -45.6 2 8 1 77 484.731 8 ↓
Lo Low (pH 4.5-6) 2.14 9.62 -120.75 3 8 2 79 485.739 8 ↓
Lo Low (pH 4.5-6) 2.14 7.4 -52.71 2 8 1 77 484.731 8 ↓

Activity (Go SEA)

Rings

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

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