UCSF

ZINC01678159

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 14 No

Popular Name: Fosfosal Fosfosal

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CAS Number: 6064-83-1

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) 0.66 4.21 -247.25 0 6 -3 113 215.077 3 ↓
Lo Low (pH 4.5-6) 0.66 3.05 -123.69 1 6 -2 110 216.085 3 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 162-166? Alfa-Aesar
Melting_Point 162-166° Alfa-Aesar
Therapy analgesic, antiinflammatory SMDC Pharmakon

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.