| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 14 | Yes |
Popular Name: 3-[(2-hydroxy-2-methyl-propyl)-isobutyl-amino]propanenitrile 3-[(2-hydroxy-2-methyl-propyl)-i…
| 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) | 1.10 | 4.94 | -43.22 | 2 | 3 | 1 | 48 | 199.318 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.10 | 2.9 | -6.63 | 1 | 3 | 0 | 47 | 198.31 | 6 | ↓ |
