UCSF

ZINC64539064

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2011 35 No

Popular Name: (2S,4R,6S,8S)-2,4,6,8-tetraphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one (2S,4R,6S,8S)-2,4,6,8-tetrapheny…

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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) 6.29 12.06 -34.55 4 4 1 61 460.601 4 ↓
Mid Mid (pH 6-8) 6.29 11.3 -5.85 3 4 0 57 459.593 4 ↓
Mid Mid (pH 6-8) 6.29 12.21 -22.76 4 4 0 61 460.601 4 ↓

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Rings

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

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