In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 14 | Yes |
Popular Name: 1-[(8aR)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-3-amino-propan-1-one 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) | -0.98 | 2.73 | -98.43 | 4 | 4 | 2 | 52 | 199.298 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.98 | 0.61 | -49.34 | 3 | 4 | 1 | 51 | 198.29 | 2 | ↓ |