| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 32 | No |
Popular Name: (5S)-4-benzoyl-3-hydroxy-5-(1-naphthyl)-1-(3-pyridylmethyl)-5H-pyrrol-2-one (5S)-4-benzoyl-3-hydroxy-5-(1-na…
| 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) | 3.70 | 12.53 | -41.77 | 0 | 5 | -1 | 73 | 419.46 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.14 | 11.07 | -27.04 | 1 | 5 | 0 | 71 | 420.468 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.12 | 12.03 | -15 | 0 | 5 | 0 | 67 | 420.468 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.14 | 11.35 | -56.92 | 2 | 5 | 1 | 72 | 421.476 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.12 | 12.31 | -52.29 | 1 | 5 | 1 | 69 | 421.476 | 5 | ↓ |
