UCSF

ZINC62954085

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2011 21 Yes

Popular Name: (1R,2S)-2-(8-azaspiro[4.5]decane-8-carbonyl)cyclohexanecarboxylic (1R,2S)-2-(8-azaspiro[4.5]decane…

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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) 2.95 9.49 -57.85 0 4 -1 60 292.399 2 ↓
Lo Low (pH 4.5-6) 2.95 7.74 -10.47 1 4 0 58 293.407 2 ↓

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

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