| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 6th, 2008 | 16 | No |
Popular Name: (3S)-1-methyl-3-(3-pyridylmethylamino)pyrrolidine-2,5-dione (3S)-1-methyl-3-(3-pyridylmethyl…
| 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) | -0.95 | 1.53 | -9.68 | 1 | 5 | 0 | 62 | 219.244 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.95 | 2.79 | -57.35 | 2 | 5 | 1 | 67 | 220.252 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.95 | 3.05 | -120.06 | 3 | 5 | 2 | 68 | 221.26 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.95 | 2 | -40.51 | 2 | 5 | 1 | 64 | 220.252 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.95 | 2 | -40.03 | 2 | 5 | 1 | 64 | 220.252 | 3 | ↓ |
