UCSF

ZINC48945490

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 21st, 2010 19 No

Popular Name: 2,3-dihydro-1,4-dioxin-5-yl-[(2R)-2-(2-pyridyl)pyrrolidin-1-yl]methanone 2,3-dihydro-1,4-dioxin-5-yl-[(2R…

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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) 0.60 4.88 -10.22 0 5 0 52 260.293 2 ↓
Lo Low (pH 4.5-6) 0.60 5.69 -31.89 1 5 1 53 261.301 2 ↓

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

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