UCSF

ZINC04521662

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 7th, 2005 11 Yes

Popular Name: 3-Methoxybenzamide 3-Methoxybenzamide

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CAS Number: 5813-86-5

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) 0.79 0.57 -11.36 2 3 0 52 151.165 2 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 131-135? Alfa-Aesar
Melting_Point 131-135° Alfa-Aesar
M.P 132.5-135.5 °C Indofine
ALOGPS_SOLUBILITY 4.58e+00 g/l DrugBank-experimental

Activity (Go SEA)

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