UCSF

ZINC13508087

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2008 6 No

Popular Name: Isobutyraldehyde oxime Isobutyraldehyde oxime

Find On: PubMed — Wikipedia — Google

CAS Numbers: 151-00-8 , 543713-09-3; > ; MFCD09265486; > ; AS51248MG500; > ; $149,04; > ; 500; > ; mg; > ; AS51248G1; > ; $273,24; > ; 1; > ; g , [151-00-8]

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) 0.98 0.61 -3.97 1 2 0 33 87.122 1 ↓
Ref Reference (pH 7) 0.98 0.64 -4.39 1 2 0 33 87.122 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

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