UCSF

ZINC04899532

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 11th, 2006 16 No

Popular Name: BOC-PYR-OH BOC-PYR-OH

Find On: PubMed — Wikipedia — Google

CAS Numbers: 160347-90-0 , 4677-75-2 , 53100-44-0 , [53100-44-0]

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) -1.12 1.97 -52.61 0 6 -1 86 228.224 3 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 118-123? Alfa-Aesar

Activity (Go SEA)

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