UCSF

ZINC11570828

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 27th, 2008 10 Yes

Popular Name: 1-Methyl-2-pyridin-2-yl-ethylamine 1-Methyl-2-pyridin-2-yl-ethylamine

Find On: PubMed — Wikipedia — Google

CAS Number: 51038-40-5

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) 0.15 2.15 -37.24 3 2 1 41 137.206 2 ↓
Lo Low (pH 4.5-6) 0.15 2.4 -99.44 4 2 2 42 138.214 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95+% Fluorochem
PUBCHEM_PATENT_ID EP0404267A1 IBM Patent Data
Warnings IRRITANT Matrix Scientific

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