In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 14 | No |
Popular Name: 1-[(8aS)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-3-chloro-propan-1-one 1-[(8aS)-3,4,6,7,8,8a-hexahydro-…
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) | 0.82 | 5.96 | -40.4 | 1 | 3 | 1 | 25 | 217.72 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.82 | 3.73 | -5.96 | 0 | 3 | 0 | 24 | 216.712 | 2 | ↓ |