UCSF

ZINC67946498

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 23 Yes

Popular Name: (2S,4R)-4-amino-1-[(2,2-difluoro-1,3-benzodioxol-4-yl)methyl]-N-ethyl-pyrrolidine-2-carboxamide (2S,4R)-4-amino-1-[(2,2-difluoro…

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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) 0.70 1.02 -52.1 4 6 1 78 328.339 4 ↓
Hi High (pH 8-9.5) 0.70 0.73 -9.63 3 6 0 77 327.331 4 ↓

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

No pre-computed analogs available. Try a structural similarity search.