UCSF

ZINC00155911

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2005 13 Yes

Popular Name: (-)-N-Methylephedrine, 98+% (-)-N-Methylephedrine, 98+%

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CAS Numbers: 14222-20-9 , 18760-80-0 , 42151-56-4 , 552-79-4

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) 1.49 4.51 -33.13 2 2 1 25 180.271 3 ↓
Hi High (pH 8-9.5) 1.49 2.61 -3.19 1 2 0 23 179.263 3 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 86?-88? Alfa-Aesar
Melting_Point 86°-88° Alfa-Aesar

Activity (Go SEA)

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