UCSF

ZINC35907975

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 15th, 2009 35 Yes

Popular Name: (4aS,5R)-3-cyclohexyl-N-(2-morpholinoethyl)-8-(trifluoromethyl)-1,2,4,4a,5,6-hexahydropyrazino[1,2-a (4aS,5R)-3-cyclohexyl-N-(2-morph…

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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) 4.04 9.38 -43.96 2 6 1 49 495.61 6 ↓
Hi High (pH 8-9.5) 4.04 6.95 -9.83 1 6 0 48 494.602 6 ↓
Mid Mid (pH 6-8) 4.04 11.65 -95.58 3 6 2 50 496.618 6 ↓

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