In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: [(9aS)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl]-(1H-indol-4-yl)methanone [(9aS)-1,3,4,6,7,8,9,9a-octahydr…
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) | 1.87 | 8 | -42.82 | 2 | 4 | 1 | 41 | 284.383 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.87 | 5.72 | -12.03 | 1 | 4 | 0 | 39 | 283.375 | 1 | ↓ |