| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 19 | Yes |
Popular Name: 2-[5-[(4-isopropylpiperazin-1-yl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine 2-[5-[(4-isopropylpiperazin-1-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) | 0.59 | 1.09 | -88.14 | 4 | 6 | 2 | 74 | 269.393 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.59 | -1.12 | -42.07 | 3 | 6 | 1 | 73 | 268.385 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.59 | -1.37 | -6.42 | 2 | 6 | 0 | 71 | 267.377 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.59 | 1.15 | -98.69 | 4 | 6 | 2 | 74 | 269.393 | 4 | ↓ |
