UCSF

ZINC36875311

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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-[(2S,6S)-2,6-dimethylmorpholin-4-yl]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) -0.46 3.31 -50.11 3 5 1 59 293.387 3 ↓
Hi High (pH 8-9.5) -0.46 2.53 -6.3 2 5 0 57 292.379 3 ↓
Lo Low (pH 4.5-6) -0.46 4.89 -138.2 4 5 2 60 294.395 3 ↓

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