UCSF

ZINC65531038

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 24 Yes

Popular Name: (2R)-2-methyl-2-morpholino-N-[[3-(3-pyridyl)-1H-pyrazol-4-yl]methyl]butan-1-amine (2R)-2-methyl-2-morpholino-N-[[3…

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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) 1.60 3.66 -43.77 3 6 1 71 330.456 7 ↓
Hi High (pH 8-9.5) 1.60 3.54 -7.71 2 6 0 66 329.448 7 ↓
Hi High (pH 8-9.5) 1.60 2.5 -5.87 2 6 0 66 329.448 7 ↓
Mid Mid (pH 6-8) 1.60 3.69 -41.21 3 6 1 71 330.456 7 ↓
Lo Low (pH 4.5-6) 1.60 5.58 -118.5 4 6 2 72 331.464 7 ↓
Lo Low (pH 4.5-6) 1.60 5.61 -113.42 4 6 2 72 331.464 7 ↓

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