UCSF

ZINC54646281

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2010 36 No

Popular Name: (2S)-3-phenyl-N-[4-(1-piperidyl)phenyl]-2-[(1S,5R)-1,8,8-trimethyl-2,4-dioxo-3-azabicyclo[3.2.1]octa (2S)-3-phenyl-N-[4-(1-piperidyl)…

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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) 5.00 14.84 -14.89 1 6 0 70 487.644 6 ↓
Mid Mid (pH 6-8) 5.00 15.39 -38.99 2 6 1 71 488.652 6 ↓

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

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