| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2009 | 29 | No |
Popular Name: (E)-N-[6-[4-[(2S)-2-hydroxybutyl]-1,4-diazepan-1-yl]-3-pyridyl]-3-phenyl-prop-2-enamide (E)-N-[6-[4-[(2S)-2-hydroxybutyl…
| 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) | 3.24 | 9.59 | -42.28 | 3 | 6 | 1 | 70 | 395.527 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.24 | 9.93 | -96.2 | 4 | 6 | 2 | 71 | 396.535 | 7 | ↓ |
