In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2010 | 19 | Yes |
Popular Name: (8aS)-N-(m-tolyl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide (8aS)-N-(m-tolyl)-3,4,6,7,8,8a-h…
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) | 2.40 | 7.87 | -42.46 | 2 | 4 | 1 | 37 | 260.361 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.40 | 5.63 | -8.13 | 1 | 4 | 0 | 36 | 259.353 | 1 | ↓ |