UCSF

ZINC65575782

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 21st, 2011 25 No

Popular Name: [(5R)-3-phenyl-4,5-dihydroisoxazol-5-yl]-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)-1-piperidyl]methanone [(5R)-3-phenyl-4,5-dihydroisoxaz…

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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) 0.56 4.9 -25.96 1 7 0 84 358.423 3 ↓
Mid Mid (pH 6-8) 1.29 4.23 -51.68 0 7 -1 81 357.415 3 ↓

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Rings

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

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