UCSF

ZINC65588530

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 21st, 2011 20 Yes

Popular Name: (3S)-N-[(2S)-2-(dimethylamino)-2-(3-thienyl)ethyl]-6-oxo-piperidine-3-carboxamide (3S)-N-[(2S)-2-(dimethylamino)-2…

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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) 0.50 3.72 -50.59 3 5 1 63 296.416 5 ↓
Hi High (pH 8-9.5) 0.50 1.31 -11.56 2 5 0 61 295.408 5 ↓

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

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