UCSF

ZINC65528396

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 19 No

Popular Name: (5R)-5-[(2S)-1-(2H-imidazol-2-ylmethyl)pyrrolidin-2-yl]-3-isopropyl-4,5-dihydro-1,2,4-oxadiazole (5R)-5-[(2S)-1-(2H-imidazol-2-yl…

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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) 0.85 4.22 -37.71 3 6 1 67 264.353 4 ↓
Hi High (pH 8-9.5) 0.85 2.13 -15.03 2 6 0 66 263.345 4 ↓
Hi High (pH 8-9.5) 0.85 2.84 -30.42 3 6 1 67 264.353 4 ↓

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

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