In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 29 | Yes |
Popular Name: (4aS,5S)-N-benzyl-3-cyclopentyl-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinoline-5-carboxamide (4aS,5S)-N-benzyl-3-cyclopentyl-…
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) | 4.19 | 12.23 | -42.14 | 2 | 4 | 1 | 37 | 390.551 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.19 | 10.07 | -9.39 | 1 | 4 | 0 | 36 | 389.543 | 4 | ↓ |