UCSF

ZINC00028446

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 17 Yes

Popular Name: methyl 2-amino-3,4,5-trimethoxybenzoate methyl 2-amino-3,4,5-trimethoxyb…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 5035-82-5 , [5035-82-5]

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) 1.53 2.56 -6.71 2 6 0 80 241.243 5 ↓

Vendor Notes

Note Type Comments Provided By
MP 44 - 45 Enamine Building Blocks
M.P 44-45 °C Indofine
MP 44...45 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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