UCSF

ZINC01666831

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 14 Yes

Popular Name: N-Butylbenzenesulfonamide N-Butylbenzenesulfonamide

Find On: PubMed — Wikipedia — Google

CAS Numbers: 3622-84-2 , [3622-84-2]

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) 2.44 3.05 -8.52 1 3 0 46 213.302 5 ↓

Vendor Notes

Note Type Comments Provided By
BP 184 / 0.8 TCI
Boiling_Point 314? Alfa-Aesar
ALOGPS_SOLUBILITY 4.60e-01 g/l DrugBank-experimental
Purity 95% Fluorochem

Activity (Go SEA)

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