| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 18 | Yes |
Popular Name: 3-[(2S)-2-hydroxy-3-[[(1R,2R)-2-methylcyclopropyl]amino]propoxy]benzonitrile 3-[(2S)-2-hydroxy-3-[[(1R,2R)-2-…
| 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) | 1.84 | 4.41 | -47.1 | 3 | 4 | 1 | 70 | 247.318 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.84 | 3.12 | -8.98 | 2 | 4 | 0 | 65 | 246.31 | 6 | ↓ |
