| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2011 | 21 | Yes |
Popular Name: (2S)-6-(N-butylanilino)-2-methyl-2-(methylamino)hexan-1-ol (2S)-6-(N-butylanilino)-2-methyl…
| 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) | 4.11 | 7.44 | -35.1 | 3 | 3 | 1 | 40 | 293.475 | 11 | ↓ |
| Hi High (pH 8-9.5) | 4.11 | 6.34 | -4.62 | 2 | 3 | 0 | 35 | 292.467 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 4.11 | 7.49 | -89.3 | 4 | 3 | 0 | 41 | 294.483 | 11 | ↓ |
