UCSF

ZINC00948503

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2004 28 Yes

Popular Name: 1-({[4-(2-methoxyphenyl)piperazino]sulfonyl}methyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-one 1-({[4-(2-methoxyphenyl)piperazi…

Find On: PubMed — Wikipedia — Google

CAS Number: 315692-82-1

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) 2.62 8.79 -16.27 0 6 0 67 406.548 5 ↓

Activity (Go SEA)

Rings

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

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