UCSF

ZINC11593547

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 29th, 2008 18 Yes

Popular Name: 2-(Boc-amino)-3-phenylpropylamine 2-(Boc-amino)-3-phenylpropylamine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1222902-68-2 , 146552-72-9 , 179051-72-0 , [1222902-68-2]

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) 3.53 -2.3 -41.37 4 4 1 66 251.35 6 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0605667A1; WO1993022279A1 IBM Patent Data

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