UCSF

ZINC53432003

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2010 26 Yes

Popular Name: 2-[4-[(1S)-2-[(2S,6S)-2,6-dimethyl-1-piperidyl]-1-methyl-2-oxo-ethyl]piperazin-1-yl]-N,N-diethyl-ace 2-[4-[(1S)-2-[(2S,6S)-2,6-dimeth…

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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) 1.59 5.86 -10.21 0 6 0 47 366.55 6 ↓
Lo Low (pH 4.5-6) 1.59 8.06 -35.85 1 6 1 48 367.558 6 ↓
Lo Low (pH 4.5-6) 1.59 8.34 -37.01 1 6 1 48 367.558 6 ↓

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

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