In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 15 | No |
Popular Name: 1-[(8aR)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]butane-1,3-dione 1-[(8aR)-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) | -0.24 | 6.77 | -50.57 | 1 | 4 | 1 | 42 | 211.285 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.24 | 4.65 | -16.23 | 0 | 4 | 0 | 41 | 210.277 | 2 | ↓ |