In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 28th, 2008 | 25 | Yes |
Popular Name: 2-[4-[(2-hydroxy-1-naphthyl)methyl]piperazin-1-yl]-N-isopropyl-acetamide 2-[4-[(2-hydroxy-1-naphthyl)meth…
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) | 3.01 | 5.3 | -37.49 | 3 | 5 | 1 | 57 | 342.463 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.01 | 5.41 | -37.2 | 3 | 5 | 1 | 57 | 342.463 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.01 | 3.1 | -10.37 | 2 | 5 | 0 | 56 | 341.455 | 5 | ↓ |