| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 21 | No |
Popular Name: (3R)-3-[[(S)-phenyl(4-pyridyl)methyl]amino]pyrrolidine-2,5-dione (3R)-3-[[(S)-phenyl(4-pyridyl)me…
| 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) | 0.53 | 3.14 | -12.35 | 2 | 5 | 0 | 71 | 281.315 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.53 | 3.63 | -46.66 | 3 | 5 | 1 | 72 | 282.323 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.53 | 4.13 | -54.22 | 3 | 5 | 1 | 76 | 282.323 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.72 | 1.59 | -42.64 | 2 | 5 | 0 | 82 | 281.315 | 4 | ↓ |
