In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 20 | Yes |
Popular Name: (9aR)-2-[(6-chloro-3-pyridyl)sulfonyl]-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine (9aR)-2-[(6-chloro-3-pyridyl)sul…
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) | 1.99 | 4.6 | -45.04 | 1 | 5 | 1 | 55 | 316.834 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.99 | 2.35 | -8.19 | 0 | 5 | 0 | 54 | 315.826 | 2 | ↓ |