UCSF

ZINC12648704

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2008 21 Yes

Popular Name: 1-Boc-3-N-(Pyridin-4-ylmethyl)-amino-piperidine 1-Boc-3-N-(Pyridin-4-ylmethyl)-a…

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CAS Numbers: 1217722-00-3 , 886364-97-2

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) 1.66 6.62 -48.54 2 5 1 59 292.403 5 ↓
Lo Low (pH 4.5-6) 1.66 6.9 -105.62 3 5 2 60 293.411 5 ↓

Vendor Notes

Note Type Comments Provided By
Purity 97% Fluorochem

Activity (Go SEA)

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