UCSF

ZINC54420183

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 3rd, 2010 19 Yes

Popular Name: (4-amino-1,2,5-oxadiazol-3-yl)-[(2R)-2-(3-pyridyl)pyrrolidin-1-yl]methanone (4-amino-1,2,5-oxadiazol-3-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) 0.43 3.67 -9.1 2 7 0 98 259.269 2 ↓
Lo Low (pH 4.5-6) 0.43 4.13 -36.49 3 7 1 99 260.277 2 ↓

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

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