In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 12th, 2008 | 23 | No |
Popular Name: (3S)-3-[2-(oxazinan-2-yl)-2-oxo-ethyl]-4-(3-pyridylmethyl)piperazin-2-one (3S)-3-[2-(oxazinan-2-yl)-2-oxo-…
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) | 0.67 | -2.31 | -41.38 | 2 | 7 | 1 | 76 | 319.385 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.67 | -2.2 | -106.92 | 3 | 7 | 2 | 77 | 320.393 | 4 | ↓ |