UCSF

ZINC23362968

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Substance Information

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

Popular Name: (2S,4R)-N-ethyl-4-[(2-fluorophenyl)methylamino]-1-(1-propyl-4-piperidyl)pyrrolidine-2-carboxamide (2S,4R)-N-ethyl-4-[(2-fluorophen…

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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) 2.53 8.32 -94.81 4 5 2 53 392.563 8 ↓
Mid Mid (pH 6-8) 2.53 7.18 -38.22 3 5 1 49 391.555 8 ↓
Lo Low (pH 4.5-6) 2.53 9.07 -102 4 5 2 50 392.563 8 ↓

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