In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 19 | Yes |
Popular Name: 1-[(9aR)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl]-7-amino-heptan-1-one 1-[(9aR)-1,3,4,6,7,8,9,9a-octahy…
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) | 1.31 | 6.48 | -91.02 | 4 | 4 | 2 | 52 | 269.433 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.31 | 4.21 | -47.51 | 3 | 4 | 1 | 51 | 268.425 | 6 | ↓ |