UCSF

ZINC22357285

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 15th, 2008 27 Yes

Popular Name: [2-[methyl-[2-oxo-2-(p-tolylamino)ethyl]amino]-2-oxo-ethyl] [2-[methyl-[2-oxo-2-(p-tolylamin…

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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) 3.89 8.34 -25.45 2 7 0 96 435.274 7 ↓
Mid Mid (pH 6-8) 3.89 9.36 -57.46 1 7 -1 99 434.266 7 ↓

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Rings

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

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