| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 18 | Yes |
Popular Name: (1R,2R)-N1-isobutyl-N1-isopropyl-1-phenyl-propane-1,2-diamine (1R,2R)-N1-isobutyl-N1-isopropyl…
| 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) | 2.93 | 7.64 | -117.15 | 4 | 2 | 2 | 32 | 250.43 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.93 | 7.33 | -29.66 | 3 | 2 | 1 | 30 | 249.422 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.93 | 5.08 | -42.67 | 3 | 2 | 1 | 31 | 249.422 | 6 | ↓ |
