| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 25th, 2010 | 27 | Yes |
Popular Name: 4-isopropyl-N-[[6-(4-methyl-1,4-diazepan-1-yl)-3-pyridyl]methyl]benzamide 4-isopropyl-N-[[6-(4-methyl-1,4-…
| 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) | 3.41 | 11.41 | -45 | 2 | 5 | 1 | 50 | 367.517 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.41 | 9.4 | -8.88 | 1 | 5 | 0 | 48 | 366.509 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.41 | 11.69 | -103.03 | 3 | 5 | 2 | 51 | 368.525 | 5 | ↓ |
