In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 20 | Yes |
Popular Name: (4S)-1-methyl-4-[[(2R)-tetrahydropyran-2-yl]methylamino]-3,4-dihydroquinolin-2-one (4S)-1-methyl-4-[[(2R)-tetrahydr…
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) | 0.49 | 6.58 | -45.52 | 2 | 4 | 1 | 46 | 275.372 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.49 | 5.21 | -6.27 | 1 | 4 | 0 | 42 | 274.364 | 3 | ↓ |