UCSF

ZINC41544582

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 32 No

Popular Name: (2S)-3-(1,3-benzodioxole-5-carbonyl)-2-(2-fluorophenyl)-4-hydroxy-1-(2-pyrrolidin-1-ylethyl)-2H-pyrr (2S)-3-(1,3-benzodioxole-5-carbo…

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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) 2.82 8.76 -63.7 1 7 0 83 438.455 6 ↓
Lo Low (pH 4.5-6) 2.82 8 -44.09 2 7 1 81 439.463 6 ↓

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