UCSF

ZINC00597112

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2005 26 Yes

Popular Name: Enrofloxacin Enrofloxacin

Find On: PubMed — Wikipedia — Google

CAS Numbers: 112732-17-9 , 93106-60-6 , [112732-17-9] , [93106-60-6]

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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) 0.27 11.97 -102.25 1 6 0 70 359.401 4 ↓
Mid Mid (pH 6-8) 0.27 9.76 -64.7 0 6 -1 69 358.393 4 ↓
Mid Mid (pH 6-8) -2.47 9.98 -82.44 2 6 1 73 360.409 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 225 TCI
Therapy antibacterial SMDC Pharmakon
Indications antibiotic KeyOrganics Bioactives
Target Antifection Selleck Chemicals
mechanism DNA gyrase and topoisomerase IV inhibitor IBScreen Bioactives
Patent Database Links EP1902706; GB2321455; US2001006962; US2003105066; US2003153544; US2004063677; US2007196398; US2007196466; US2007197469; US2007197501; US2007203097; US2007265275; WO2007086884; WO2007097888; WO2007097889; WO2007117102 ChEBI
PUBCHEM_SUBSTANCE_COMMENT NCC_SAMPLE_SUPPLIER : Sigma Chemical Company; NCC_SUPPLIER_STRUCTURE_ID : 17849 NIH Clinical Collection via PubChem
Target Others Selleck Chemicals
PUBCHEM_SUBSTANCE_COMMENT SAMPLE_SUPPLIER: Sigma Chemical Company; SUPPLIER_STRUCTURE_ID: 17849 NIH Clinical Collection via PubChem
biological_use Veterinary antibacterial agent ZereneX Building Blocks
biological_use Veterinary antibacterial agent IBScreen Bioactives

Activity (Go SEA)

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