| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 14 | Yes |
Popular Name: (2R,3S)-N2-ethyl-N2-isobutyl-3-methyl-pentane-1,2-diamine (2R,3S)-N2-ethyl-N2-isobutyl-3-m…
| 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) | 2.26 | 4.94 | -43.12 | 3 | 2 | 1 | 31 | 201.378 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.26 | 5.92 | -116.35 | 4 | 2 | 2 | 32 | 202.386 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.26 | 5.61 | -27.01 | 3 | 2 | 1 | 30 | 201.378 | 7 | ↓ |
