| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2009 | 31 | Yes |
Popular Name: N-[6-[4-[(2-hydroxyphenyl)methyl]-1,4-diazepan-1-yl]-3-pyridyl]-3-methyl-benzamide N-[6-[4-[(2-hydroxyphenyl)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) | 4.13 | 10.83 | -40.42 | 3 | 6 | 1 | 70 | 417.533 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.13 | 11.58 | -33.59 | 2 | 6 | 0 | 73 | 416.525 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.13 | 11.15 | -96.36 | 4 | 6 | 2 | 71 | 418.541 | 5 | ↓ |
