UCSF

ZINC49560919

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 14 Yes

Popular Name: (1S,2R,3S,4R,5S)-5-methyl-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic (1S,2R,3S,4R,5S)-5-methyl-7-oxab…

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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) 0.24 4.58 -138.45 0 5 -2 89 198.174 2 ↓
Lo Low (pH 4.5-6) 0.24 2.8 -50.7 1 5 -1 87 199.182 2 ↓
Lo Low (pH 4.5-6) 0.24 2.68 -51.33 1 5 -1 87 199.182 2 ↓

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