UCSF

ZINC36874692

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2009 21 Yes

Popular Name: (1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(3S,5S)-3,5-dimethyl-1-piperidyl]ethanamine (1R)-1-(2,3-dihydro-1,4-benzodio…

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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) 0.59 6.7 -38.92 3 4 1 49 291.415 3 ↓
Mid Mid (pH 6-8) 0.59 7.05 -133.38 4 4 2 51 292.423 3 ↓

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