| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 31st, 2011 | 30 | Yes |
Popular Name: 2-benzyl-N-[[6-(4-methyl-1,4-diazepan-1-yl)-3-pyridyl]methyl]thiazole-4-carboxamide 2-benzyl-N-[[6-(4-methyl-1,4-dia…
| 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) | 2.76 | 10.88 | -42.03 | 2 | 6 | 1 | 63 | 422.578 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.76 | 8.86 | -11.09 | 1 | 6 | 0 | 61 | 421.57 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.76 | 11.2 | -98.32 | 3 | 6 | 2 | 64 | 423.586 | 6 | ↓ |
