In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: (1S)-1-(benzofuran-2-yl)-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]ethanamine (1S)-1-(benzofuran-2-yl)-N-[(3,5…
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) | 2.77 | 6.82 | -44.95 | 3 | 4 | 1 | 58 | 270.356 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.77 | 5.6 | -10.13 | 2 | 4 | 0 | 54 | 269.348 | 4 | ↓ |