| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 21 | Yes |
Popular Name: 4-[(1S)-1-hydroxy-2-[4-[isopropyl(methyl)amino]butylamino]ethyl]benzonitrile 4-[(1S)-1-hydroxy-2-[4-[isopropy…
| 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) | 1.56 | 7.33 | -107.74 | 4 | 4 | 2 | 65 | 291.439 | 9 | ↓ |
| Hi High (pH 8-9.5) | 1.56 | 5.94 | -38.24 | 3 | 4 | 1 | 60 | 290.431 | 9 | ↓ |
