UCSF

ZINC26506947

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 13 Yes

Popular Name: Ethyl 5-amino-2-methylnicotinate Ethyl 5-amino-2-methylnicotinate

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CAS Numbers: 60390-42-3 , [60390-42-3]

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) 0.93 2.66 -8.35 2 4 0 65 180.207 3 ↓
Lo Low (pH 4.5-6) 0.93 3.06 -34.56 3 4 1 66 181.215 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

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