| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2010 | 17 | Yes |
Popular Name: (6S)-1-[(4-ethylcyclohexyl)methyl]-6-methyl-1,4-diazepane (6S)-1-[(4-ethylcyclohexyl)methy…
| 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) | 3.13 | 7.06 | -37.11 | 2 | 2 | 1 | 20 | 239.427 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.13 | 7.22 | -33.19 | 2 | 2 | 1 | 16 | 239.427 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.13 | 8.58 | -111.83 | 3 | 2 | 2 | 21 | 240.435 | 3 | ↓ |
