| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 13 | Yes |
Popular Name: (2S,3R)-N2-methyl-N2-[(1S)-1-methylbutyl]pentane-2,3-diamine (2S,3R)-N2-methyl-N2-[(1S)-1-met…
| 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) | 2.18 | 5.13 | -106.27 | 4 | 2 | 2 | 32 | 188.359 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.18 | 3.52 | -39.21 | 3 | 2 | 1 | 31 | 187.351 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.18 | 4.84 | -29.11 | 3 | 2 | 1 | 30 | 187.351 | 6 | ↓ |
