In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 25 | Yes |
Popular Name: (4aS,5R)-N-allyl-3-cyclopentyl-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinoline-5-carboxamide (4aS,5R)-N-allyl-3-cyclopentyl-1…
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) | 3.43 | 9.98 | -36.2 | 2 | 4 | 1 | 37 | 340.491 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.43 | 7.74 | -8.42 | 1 | 4 | 0 | 36 | 339.483 | 4 | ↓ |