UCSF

ZINC20119682

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2008 24 Yes

Popular Name: [(5S)-9-(2,2-dimethylpropyl)-2,9-diazaspiro[4.5]decan-2-yl]-(4-hydroxyphenyl)methanone [(5S)-9-(2,2-dimethylpropyl)-2,9…

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Download: MOL2 SDF SMILES Flexibase

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) 2.76 7.84 -44.77 2 4 1 45 331.48 3 ↓
Hi High (pH 8-9.5) 2.76 8.63 -70.96 1 4 0 48 330.472 3 ↓

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