UCSF

ZINC01510377

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 20th, 2004 16 Yes

Popular Name: [(1S)-1-phenylethyl]-(p-tolyl)amine [(1S)-1-phenylethyl]-(p-tolyl)amine

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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) 4.20 0.83 -3.04 1 1 0 12 211.308 3 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0676398A2; EP0676398A3; EP0745600A1; EP1022274A1; US5624935; US5739345; US5834501; US5886014; US5977365; US6117893 IBM Patent Data

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