UCSF

ZINC00241160

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 16th, 2005 19 Yes

Popular Name: 4,4'-oxydibenzoic acid 4,4'-oxydibenzoic acid

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CAS Numbers: 2215-89-6 , [2215-89-6]

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) 3.51 1.03 -98.7 0 5 -2 89 256.213 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 105 - 108 Enamine Building Blocks
MP 105...108 Enamine Building Blocks
MP 329-330° Fluorochem
Melting_Point 329-332? Alfa-Aesar
Melting_Point 329-332° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 98% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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