| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 20 | Yes |
Popular Name: 1-(azepan-1-yl)-2-[[(1R,3S)-1-(hydroxymethyl)-3-methyl-cyclohexyl]amino]ethanone 1-(azepan-1-yl)-2-[[(1R,3S)-1-(h…
| 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) | 2.21 | 4.9 | -36.01 | 3 | 4 | 1 | 57 | 283.436 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.21 | 3.71 | -8.88 | 2 | 4 | 0 | 53 | 282.428 | 4 | ↓ |
