In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 24th, 2008 | 20 | Yes |
Popular Name: (1R)-1-(2,4-dimethoxyphenyl)-2-(4-methylpiperazin-1-yl)ethanamine (1R)-1-(2,4-dimethoxyphenyl)-2-(…
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) | -0.61 | 3.47 | -103.69 | 4 | 5 | 2 | 54 | 281.4 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.61 | 0.17 | -5.81 | 2 | 5 | 0 | 51 | 279.384 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.61 | 2.58 | -33.02 | 3 | 5 | 1 | 52 | 280.392 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.61 | 1 | -46.72 | 3 | 5 | 1 | 53 | 280.392 | 5 | ↓ |