UCSF

ZINC19370337

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2008 17 Yes

Popular Name: 1-(4-tert-butylbenzyl)piperazine 1-(4-tert-butylbenzyl)piperazine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 119162-51-5 , 956-61-6 , [956-61-6]

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) 2.74 5.77 -39.18 2 2 1 20 233.379 3 ↓
Hi High (pH 8-9.5) 2.74 4.36 -2.3 1 2 0 15 232.371 3 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 52-55? Alfa-Aesar
Purity 95% Fluorochem

Activity (Go SEA)

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