In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 16 | No |
Popular Name: (3S)-1-methyl-3-[[(2R)-tetrahydropyran-2-yl]methylamino]pyrrolidine-2,5-dione (3S)-1-methyl-3-[[(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) | -0.23 | 2.78 | -46.68 | 2 | 5 | 1 | 63 | 227.284 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.23 | 1.52 | -8.04 | 1 | 5 | 0 | 59 | 226.276 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.23 | 1.52 | -8.46 | 1 | 5 | 0 | 59 | 226.276 | 3 | ↓ |