| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 30 | No |
Popular Name: (5S)-3-hydroxy-1-(3-morpholinopropyl)-4-(pyridine-4-carbonyl)-5-(3-pyridyl)-5H-pyrrol-2-one (5S)-3-hydroxy-1-(3-morpholinopr…
| 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) | 0.00 | 3.67 | -60.28 | 0 | 8 | -1 | 99 | 407.45 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.45 | 4.91 | -60.14 | 2 | 8 | 1 | 97 | 409.466 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.58 | 5.92 | -59.32 | 1 | 8 | 1 | 94 | 409.466 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.00 | 6.01 | -72.49 | 1 | 8 | 0 | 100 | 408.458 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.45 | 5.2 | -130.65 | 3 | 8 | 2 | 98 | 410.474 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -0.58 | 6.21 | -128.47 | 2 | 8 | 2 | 95 | 410.474 | 7 | ↓ |
