UCSF

ZINC19890801

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2008 18 Yes

Popular Name: N-(2-chlorobenzyl)-1-phenylpropan-2-amine hydrochloride N-(2-chlorobenzyl)-1-phenylpropa…

Find On: PubMed — Wikipedia — Google

CAS Numbers: , 13364-32-4 , 5843-53-8

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) 4.26 8.78 -3.1 1 1 0 12 259.78 5 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0308317A1; EP0720744A1; EP0906315A1; EP0911039A2; EP0912579A1; EP0929554A1; EP0977572A1; EP0989987A1; EP0991622A1; EP1021204A2; EP1028957A1; US5446070; US5502080; US5656286; US5658955; US5719197; US5980882; US5985874; US6024976; US6046195; US6071927; US IBM Patent Data

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