In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 36 | Yes |
Popular Name: N-benzyl-N-[3-[2-oxo-2-(4-pyridylmethylamino)ethyl]phenyl]-1,3-benzodioxole-5-carboxamide N-benzyl-N-[3-[2-oxo-2-(4-pyridy…
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) | 3.73 | 11.04 | -20.53 | 1 | 7 | 0 | 81 | 479.536 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.73 | 11.49 | -53.22 | 2 | 7 | 1 | 82 | 480.544 | 8 | ↓ |