UCSF

ZINC66895882

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 2nd, 2011 25 Yes

Popular Name: (2S)-2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-N-[(4-methoxyphenyl)methyl]-N,3-dimethyl-butanamide (2S)-2-[(2S,6S)-2,6-dimethylmorp…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

    None

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) 2.83 6.82 -10.8 0 5 0 42 348.487 6 ↓
Lo Low (pH 4.5-6) 2.83 8.99 -35.05 1 5 1 43 349.495 6 ↓

Activity (Go SEA)

Rings

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

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