| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2009 | 30 | Yes |
Popular Name: 3-methoxy-N-[6-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]-3-pyridyl]benzamide 3-methoxy-N-[6-[4-(2-thienylmeth…
| 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) | 3.69 | 9.51 | -13.58 | 1 | 6 | 0 | 58 | 422.554 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.69 | 11.39 | -44.76 | 2 | 6 | 1 | 59 | 423.562 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.69 | 11.72 | -100.08 | 3 | 6 | 2 | 60 | 424.57 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.69 | 9.82 | -38.7 | 2 | 6 | 1 | 59 | 423.562 | 6 | ↓ |
