UCSF

ZINC01713157

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 14 Yes

Popular Name: 2-(3,4-DiMethoxyphenyl)-N-MethylethylaMine 2-(3,4-DiMethoxyphenyl)-N-Methyl…

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CAS Numbers: 13078-76-7 , 3490-06-0 , [3490-06-0]

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) 1.55 4.38 -46.23 2 3 1 35 196.27 5 ↓

Vendor Notes

Note Type Comments Provided By
BP 100 / 0.1 TCI

Activity (Go SEA)

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