| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2009 | 29 | Yes |
Popular Name: N-[6-[4-[(3-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-pyridyl]-3-methyl-but-2-enamide N-[6-[4-[(3-methoxyphenyl)methyl…
| 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) | 3.76 | 11.23 | -41.52 | 2 | 6 | 1 | 59 | 395.527 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.76 | 9.35 | -9.95 | 1 | 6 | 0 | 58 | 394.519 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.76 | 11.47 | -96.13 | 3 | 6 | 2 | 60 | 396.535 | 6 | ↓ |
