UCSF

ZINC22658844

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 18th, 2008 35 Yes

Popular Name: (1R,4S)-4-[4-(2-benzhydryloxyethyl)piperazine-1-carbonyl]-1,7,7-trimethyl-5-oxabicyclo[2.2.1]heptan- (1R,4S)-4-[4-(2-benzhydryloxyeth…

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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) 2.99 12.54 -11.17 0 6 0 59 476.617 7 ↓
Mid Mid (pH 6-8) 2.99 14.76 -47.83 1 6 1 60 477.625 7 ↓

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

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