UCSF

ZINC69779203

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2011 29 Yes

Popular Name: 5-[(2S)-6-(4-fluorophenyl)sulfonyl-6-azaspiro[2.5]octan-2-yl]-3-(3-pyridyl)-1,2,4-oxadiazole 5-[(2S)-6-(4-fluorophenyl)sulfon…

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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) 2.64 6.14 -16.15 0 7 0 89 414.462 4 ↓
Lo Low (pH 4.5-6) 2.64 6.6 -45.08 1 7 1 90 415.47 4 ↓

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

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