In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 18 | Yes |
Popular Name: 2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]aniline 2-methyl-4-[2-(4-methylpiperazin…
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) | 1.78 | 4.35 | -36.6 | 3 | 4 | 1 | 43 | 250.366 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 4.28 | -33.82 | 3 | 4 | 1 | 43 | 250.366 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 1.89 | -6.38 | 2 | 4 | 0 | 42 | 249.358 | 4 | ↓ |