UCSF

ZINC23362752

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 30th, 2008 31 Yes

Popular Name: (2S,4R)-4-[(2,6-difluorophenyl)methylamino]-N-(2-methoxyethyl)-1-(1-propyl-4-piperidyl)pyrrolidine-2 (2S,4R)-4-[(2,6-difluorophenyl)m…

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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) 2.25 7.44 -92.28 4 6 2 63 440.579 10 ↓
Mid Mid (pH 6-8) 2.25 6.3 -40.05 3 6 1 58 439.571 10 ↓
Lo Low (pH 4.5-6) 2.25 8.16 -100.44 4 6 2 59 440.579 10 ↓

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