UCSF

ZINC36103589

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 26 Yes

Popular Name: 4-[[1-(3,4-dimethoxyphenyl)sulfonyl-4-piperidyl]methyl]morpholine 4-[[1-(3,4-dimethoxyphenyl)sulfo…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 1.55 3.11 -12.38 0 7 0 68 384.498 6 ↓
Mid Mid (pH 6-8) 1.55 5.11 -49.7 1 7 1 70 385.506 6 ↓

Activity (Go SEA)

Rings

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

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