UCSF

ZINC38193760

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 11th, 2010 13 Yes

Popular Name: 1-(piperidin-2-ylmethyl)piperidine 1-(piperidin-2-ylmethyl)piperidine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1177293-32-1 , 81310-54-5 , 81310-55-6 , N/A , [81310-55-6]

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) 1.93 6.61 -109.72 3 2 2 21 184.327 2 ↓
Hi High (pH 8-9.5) 1.93 4.83 -31.34 2 2 1 20 183.319 2 ↓
Mid Mid (pH 6-8) 1.93 5.36 -30.75 2 2 1 16 183.319 2 ↓

Vendor Notes

Note Type Comments Provided By
BP 104-106°/5 Torr Matrix Scientific
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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