UCSF

ZINC69458617

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2011 24 Yes

Popular Name: (3R)-3-[[1-[(2S)-2-hydroxy-2-phenyl-ethyl]-4-piperidyl]methyl-methyl-amino]tetrahydrofuran-2-one (3R)-3-[[1-[(2S)-2-hydroxy-2-phe…

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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) 0.79 8.94 -103.65 3 5 2 55 334.46 6 ↓
Hi High (pH 8-9.5) 0.79 4.65 -11.17 1 5 0 53 332.444 6 ↓
Mid Mid (pH 6-8) 0.79 6.97 -40.39 2 5 1 54 333.452 6 ↓

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

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