UCSF

ZINC00154040

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 20 Yes

Popular Name: 1-Benzenesulfonyl-piperidine-4-carboxylic acid ethyl ester 1-Benzenesulfonyl-piperidine-4-c…

Find On: PubMed — Wikipedia — Google

CAS Numbers: , 111627-26-0 , [111627-26-0]

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) 2.26 6.04 -13.01 0 5 0 64 297.376 5 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 88 - 90 KeyOrganics
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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