UCSF

ZINC25757055

Substance Information

In ZINC since Heavy atoms Benign functionality
February 1st, 2009 34 No

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) 4.74 12.5 -42.52 2 5 1 68 494.762 10
Hi High (pH 8-9.5) 4.74 10.18 -11.99 1 5 0 67 493.754 10

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0203382A2; EP0203382B1; EP0210513A1; EP0213692A2; EP0221493A2; EP0221493B1; EP0313846A2; EP0316163A2; EP0316163B1; EP0335704A2; EP0335704B1; EP0348947A2; EP0348947B1; EP0399545B1; EP0585514B1; EP0597167A1; EP0597167B1; EP0597852A1; EP0597852B1; EP064930 IBM Patent Data
Indications veterinary antibiotic KeyOrganics Bioactives

Activity (Go SEA)

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

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