In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2009 | 28 | Yes |
Popular Name: 3-(1,4-diazepan-1-ylmethyl)-2-(2,5-dimethoxyphenyl)-8-methyl-imidazo[1,2-a]pyridine 3-(1,4-diazepan-1-ylmethyl)-2-(2…
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) | 3.03 | 7.4 | -48.25 | 2 | 6 | 1 | 56 | 381.5 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.03 | 8.01 | -76.66 | 3 | 6 | 2 | 57 | 382.508 | 5 | ↓ |