In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2005 | 29 | No |
Popular Name: 2-{3-[2-(diisobutylamino)ethoxy]phenyl}-4,5,6,7-tetrahydro-1H-isoindole-1,3(2H)-dione 2-{3-[2-(diisobutylamino)ethoxy]…
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) | 4.69 | 13.09 | -38.75 | 1 | 5 | 1 | 53 | 399.555 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.69 | 11.19 | -8.11 | 0 | 5 | 0 | 52 | 398.547 | 9 | ↓ |