UCSF

ZINC42534329

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 30th, 2010 27 Yes

Popular Name: (2S)-2-[4-[2-[(3S,5S)-3,5-dimethyl-1-piperidyl]-2-oxo-ethyl]piperazin-1-yl]-N-pentyl-propanamide (2S)-2-[4-[2-[(3S,5S)-3,5-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) 2.59 5.8 -11.15 1 6 0 56 380.577 8 ↓
Lo Low (pH 4.5-6) 2.59 8 -38.64 2 6 1 57 381.585 8 ↓
Lo Low (pH 4.5-6) 2.59 7.99 -38.88 2 6 1 57 381.585 8 ↓

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