In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2011 | 16 | Yes |
Popular Name: 1-[(8aS)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-3-(ethylamino)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) | 0.03 | 5.4 | -93.74 | 3 | 4 | 2 | 41 | 227.352 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.03 | 3.17 | -43.24 | 2 | 4 | 1 | 40 | 226.344 | 4 | ↓ |