UCSF

ZINC11946123

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 20th, 2008 12 Yes

Popular Name: 2-(2-Chloro-phenoxy)-propylamine 2-(2-Chloro-phenoxy)-propylamine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1021871-58-8 , 886763-29-7 , [886763-29-7]

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) 1.79 3.34 -42.32 3 2 1 37 186.662 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 175 - 177 Enamine Building Blocks
MP 175...177 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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

No pre-computed analogs available. Try a structural similarity search.