In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2008 | 26 | Yes |
Popular Name: 3-(4-ethylphenyl)-N-[6-(4-methylpiperazin-1-yl)-3-pyridyl]propanamide 3-(4-ethylphenyl)-N-[6-(4-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) | 3.62 | 9.99 | -42.69 | 2 | 5 | 1 | 50 | 353.49 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.62 | 7.52 | -10.79 | 1 | 5 | 0 | 48 | 352.482 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.62 | 7.82 | -37.92 | 2 | 5 | 1 | 50 | 353.49 | 6 | ↓ |