In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 32 | Yes |
Popular Name: N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]-3-(2-thienylsulfonylamino)naphthalene-2-carboxamide N-[1-(2-amino-2-oxo-ethyl)-4-pip…
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) | 2.11 | 4.65 | -80.39 | 4 | 8 | 0 | 125 | 472.592 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.11 | 2.45 | -64.5 | 3 | 8 | -1 | 124 | 471.584 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.11 | 4.65 | -56.01 | 5 | 8 | 1 | 123 | 473.6 | 7 | ↓ |