| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2009 | 30 | Yes |
Popular Name: 3-(1,4-diazepan-1-ylmethyl)-5-methyl-2-(4-phenylphenyl)imidazo[1,2-a]pyridine 3-(1,4-diazepan-1-ylmethyl)-5-me…
| 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) | 4.21 | 12.52 | -48.34 | 2 | 4 | 1 | 37 | 397.546 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.21 | 11.45 | -9.9 | 1 | 4 | 0 | 33 | 396.538 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.21 | 12.56 | -81.14 | 3 | 4 | 2 | 38 | 398.554 | 4 | ↓ |
