UCSF

ZINC10474751

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2007 11 Yes

Popular Name: ethyl(2-phenylethyl)amine hydrochloride ethyl(2-phenylethyl)amine hydroc…

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CAS Numbers: 22002-68-2 , 61185-89-5

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) 1.93 6.05 -38.48 2 1 1 17 150.245 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 169 - 171 Enamine Building Blocks
MP 169...171 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
PUBCHEM_PATENT_ID US4579870; US4722940; US4906668 IBM Patent Data

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