UCSF

ZINC00029134

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 15 Yes

Popular Name: 1-[(4-methylphenyl)sulfonyl]pyrrolidine 1-[(4-methylphenyl)sulfonyl]pyrr…

Find On: PubMed — Wikipedia — Google

CAS Numbers: , 6435-78-5 , [6435-78-5]

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) 2.10 4.31 -8.85 0 3 0 37 225.313 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US5977062; WO2000059528A1 IBM Patent Data
PUBCHEM_PATENT_ID WO1999006437A1 IBM Patent Data

Activity (Go SEA)

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