UCSF

ZINC34800308

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 25th, 2009 15 No

Popular Name: ETHYL 4-HYDROXY-3-NITROBENZOATE ETHYL 4-HYDROXY-3-NITROBENZOATE

Find On: PubMed — Wikipedia — Google

CAS Numbers: 19013-10-6 , [19013-10-6]

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) 2.15 4.85 -11.46 1 6 0 92 211.173 4 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 69-71? Alfa-Aesar
Melting_Point 69-71° Alfa-Aesar
M.P 69-71°C Indofine

Activity (Go SEA)

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