In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2011 | 25 | Yes |
Popular Name: [4-[(5-chloro-2-thienyl)methyl]piperazin-1-yl]-(7-methylimidazo[1,2-a]pyridin-2-yl)methanone [4-[(5-chloro-2-thienyl)methyl]p…
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) | 3.37 | 9.46 | -10.61 | 0 | 5 | 0 | 41 | 374.897 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.37 | 11.67 | -44.3 | 1 | 5 | 1 | 42 | 375.905 | 3 | ↓ |