| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 29 | Yes |
Popular Name: [(2R)-2-hydroxy-3-[isobutyl-[(oxoBLAHyl)methyl]amino]propyl] [(2R)-2-hydroxy-3-[isobutyl-[(ox…
| 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) | 2.78 | 9.47 | -55.5 | 3 | 7 | 1 | 97 | 422.571 | 11 | ↓ |
| Hi High (pH 8-9.5) | 3.24 | 7 | -48.3 | 2 | 7 | 0 | 100 | 421.563 | 11 | ↓ |
| Hi High (pH 8-9.5) | 2.78 | 7.61 | -15.45 | 2 | 7 | 0 | 96 | 421.563 | 11 | ↓ |
