In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 17 | No |
Popular Name: (3S)-1-ethyl-3-(3-pyridylmethylamino)pyrrolidine-2,5-dione (3S)-1-ethyl-3-(3-pyridylmethyla…
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) | -0.57 | 3.8 | -56.11 | 2 | 5 | 1 | 67 | 234.279 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.57 | 2.52 | -12.78 | 1 | 5 | 0 | 62 | 233.271 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.57 | 2.99 | -39.66 | 2 | 5 | 1 | 64 | 234.279 | 4 | ↓ |