UCSF

ZINC05199833

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 25th, 2006 30 No

Popular Name: 2-benzylideneaminooxy-N-[2-oxo-1-(pyrrolidin-1-ylmethyl)indolin-3-ylidene]amino-acetamide 2-benzylideneaminooxy-N-[2-oxo-1…

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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) 2.53 8.47 -21.83 1 8 0 88 405.458 7 ↓
Mid Mid (pH 6-8) 2.53 8.61 -15.79 1 8 0 88 405.458 7 ↓
Mid Mid (pH 6-8) 2.53 10.93 -52.66 2 8 1 90 406.466 7 ↓
Mid Mid (pH 6-8) 2.53 11.06 -50.87 2 8 1 90 406.466 7 ↓

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

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