UCSF

ZINC23362286

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 30th, 2008 32 Yes

Popular Name: (2S,4S)-N-isopropyl-1-(1-propyl-4-piperidyl)-4-[[4-(trifluoromethyl)phenyl]methylamino]pyrrolidine-2 (2S,4S)-N-isopropyl-1-(1-propyl-…

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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) 3.60 9.85 -109.06 4 5 2 53 456.597 9 ↓
Mid Mid (pH 6-8) 3.60 8.67 -39.48 3 5 1 49 455.589 9 ↓
Lo Low (pH 4.5-6) 3.61 10.64 -107.37 4 5 2 50 456.597 9 ↓

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