In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 21st, 2011 | 25 | Yes |
Popular Name: 2-(6,7-dihydro-5H-cyclopenta[f]benzofuran-3-yl)-1-(4-isobutylpiperazin-1-yl)ethanone 2-(6,7-dihydro-5H-cyclopenta[f]b…
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) | 3.13 | 11.65 | -49.45 | 1 | 4 | 1 | 38 | 341.475 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.13 | 9.73 | -12.28 | 0 | 4 | 0 | 37 | 340.467 | 4 | ↓ |