In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2008 | 19 | Yes |
Popular Name: (1S)-1-(benzofuran-2-yl)-2-(4-methylpiperazin-1-yl)ethanamine (1S)-1-(benzofuran-2-yl)-2-(4-me…
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) | -0.09 | 5.23 | -103.05 | 4 | 4 | 2 | 48 | 261.369 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.09 | 2.77 | -44.13 | 3 | 4 | 1 | 47 | 260.361 | 3 | ↓ |