| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 18 | Yes |
Popular Name: N'-isopropyl-N'-methyl-N-[(1R)-1-(3-pyridyl)ethyl]butane-1,4-diamine N'-isopropyl-N'-methyl-N-[(1R)-1…
| 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) | 2.06 | 8.11 | -97.24 | 3 | 3 | 2 | 34 | 251.418 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.06 | 7.02 | -34.65 | 2 | 3 | 1 | 29 | 250.41 | 8 | ↓ |
