In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2008 | 26 | Yes |
Popular Name: 1-[4-[3-[(indan-2-ylamino)methyl]-2-pyridyl]piperazin-1-yl]ethanone 1-[4-[3-[(indan-2-ylamino)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) | 1.69 | 9.25 | -57.5 | 2 | 5 | 1 | 53 | 351.474 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.69 | 7.95 | -11.08 | 1 | 5 | 0 | 48 | 350.466 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.69 | 8.39 | -42.18 | 2 | 5 | 1 | 50 | 351.474 | 4 | ↓ |