In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2011 | 20 | Yes |
Popular Name: 2-(1,2-benzoxazol-3-yl)-1-(4-ethylpiperazin-1-yl)ethanone 2-(1,2-benzoxazol-3-yl)-1-(4-eth…
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) | 1.77 | 7.28 | -53.89 | 1 | 5 | 1 | 51 | 274.344 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.77 | 5.06 | -16.1 | 0 | 5 | 0 | 50 | 273.336 | 3 | ↓ |