In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2009 | 28 | Yes |
Popular Name: 3-(1,4-diazepan-1-ylmethyl)-2-[4-(2-methylallyloxy)phenyl]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) | 3.83 | 11.43 | -51.12 | 2 | 5 | 1 | 46 | 377.512 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.83 | 11.45 | -83.82 | 3 | 5 | 2 | 48 | 378.52 | 6 | ↓ |