UCSF

ZINC03872945

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2005 25 Yes

Popular Name: Isoconazole nitrate Isoconazole nitrate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 24168-96-5 , 27523-40-6 , [24168-96-5]

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) 5.70 13.97 -31.1 1 3 1 28 417.143 6 ↓
Mid Mid (pH 6-8) 5.70 13.46 -6.17 0 3 0 27 416.135 6 ↓

Vendor Notes

Note Type Comments Provided By
Target Antifection Selleck Chemicals
Indications antifungal KeyOrganics Bioactives
Target Others Selleck Chemicals

Activity (Go SEA)

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