In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 20 | No |
Popular Name: 2-[(4-ethylpiperazin-1-yl)methyl]isoindoline-1,3-dione 2-[(4-ethylpiperazin-1-yl)methyl…
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) | 1.81 | 5.7 | -36.16 | 1 | 5 | 1 | 47 | 274.344 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.81 | 3.43 | -8.54 | 0 | 5 | 0 | 46 | 273.336 | 3 | ↓ |