In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 24 | Yes |
Popular Name: 2-[(3R)-3-hydroxy-1-piperidyl]-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-acetamide 2-[(3R)-3-hydroxy-1-piperidyl]-N…
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) | 2.63 | 4.85 | -44.32 | 3 | 6 | 1 | 72 | 333.408 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.45 | 4.02 | -32.57 | 2 | 6 | 0 | 79 | 332.4 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.45 | 1.73 | -42.73 | 1 | 6 | -1 | 77 | 331.392 | 3 | ↓ |