UCSF

ZINC22114002

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2008 17 Yes

Popular Name: 1-Boc-2-Butylpiperazine hydrochloride 1-Boc-2-Butylpiperazine hydrochl…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1027511-69-8 , 1179359-55-7 , 1212133-43-1 , 1217463-36-9 , 169447-76-1 , [1179359-55-7]

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) 2.60 5.65 -48.81 2 4 1 46 243.371 5 ↓
Hi High (pH 8-9.5) 1.81 10.87 -19.03 1 10 0 105 446.515 3 ↓
Mid Mid (pH 6-8) 2.60 4.29 -4.81 1 4 0 42 242.363 5 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

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