UCSF

ZINC23362566

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 30th, 2008 28 Yes

Popular Name: (2S,4R)-4-[(2,6-difluorophenyl)methylamino]-N-methyl-1-(1-propyl-4-piperidyl)pyrrolidine-2-carboxami (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) 2.27 7.58 -92.96 4 5 2 53 396.526 7 ↓
Mid Mid (pH 6-8) 2.27 6.37 -40.14 3 5 1 49 395.518 7 ↓
Lo Low (pH 4.5-6) 2.27 8.23 -99.75 4 5 2 50 396.526 7 ↓

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