In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 8th, 2008 | 29 | No |
Popular Name: (2S)-2-(1,3-dioxoisoindolin-2-yl)-N-[6-(4-methylpiperazin-1-yl)-3-pyridyl]propanamide (2S)-2-(1,3-dioxoisoindolin-2-yl…
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) | 1.96 | 8.13 | -51.26 | 2 | 8 | 1 | 89 | 394.455 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.96 | 5.67 | -19.11 | 1 | 8 | 0 | 88 | 393.447 | 4 | ↓ |