In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2009 | 25 | Yes |
Popular Name: 3-(1,4-diazepan-1-ylmethyl)-2-(4-fluorophenyl)-5-methyl-imidazo[1,2-a]pyridine 3-(1,4-diazepan-1-ylmethyl)-2-(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) | 2.58 | 9.17 | -47.6 | 2 | 4 | 1 | 37 | 339.438 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.58 | 9.21 | -81.6 | 3 | 4 | 2 | 38 | 340.446 | 3 | ↓ |