UCSF

ZINC00389564

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 7th, 2005 16 Yes

Popular Name: 1,4-Naphthalenedicarboxylic acid 1,4-Naphthalenedicarboxylic acid

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CAS Numbers: 605-70-9 , [605-70-9]

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) 2.19 0.33 -100.55 0 4 -2 80 214.176 2 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 321-325? Alfa-Aesar
Melting_Point 321-325° Alfa-Aesar
Purity 98% Fluorochem

Activity (Go SEA)

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