UCSF

ZINC03684405

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 16 Yes

Popular Name: (2S,4S)-2-methyl-1-[(1S)-1-phenylethyl]piperidin-1-ium-4-ol (2S,4S)-2-methyl-1-[(1S)-1-pheny…

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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) 2.02 -0.63 -32.82 2 2 1 24 220.336 2 ↓

Activity (Go SEA)

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