UCSF

ZINC00153662

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 10 No

Popular Name: 4-Fluorobenzaldehyde oxime 4-Fluorobenzaldehyde oxime

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CAS Numbers: 459-23-4 , 588-95-4

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) 2.52 2.54 -6.12 1 2 0 33 139.129 1 ↓
Ref Reference (pH 7) 2.52 2.39 -5.08 1 2 0 33 139.129 1 ↓
Ref Reference (pH 7) 1.70 2.62 -3.33 0 2 0 29 139.129 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 82 - 85 Enamine Building Blocks
MP 82...85 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

Activity (Go SEA)

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

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