In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2008 | 30 | Yes |
Popular Name: N-[(2R)-2-(1,3-benzodioxol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]-4-ethoxy-benzamide N-[(2R)-2-(1,3-benzodioxol-5-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) | 2.96 | 7.22 | -46.29 | 2 | 7 | 1 | 64 | 412.51 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.96 | 6.7 | -46.83 | 2 | 7 | 1 | 64 | 412.51 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.96 | 4.84 | -10.48 | 1 | 7 | 0 | 63 | 411.502 | 7 | ↓ |