| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 32 | No |
Popular Name: (5S)-4-(2,4-dimethoxybenzoyl)-3-hydroxy-5-phenyl-1-(3-pyridylmethyl)-5H-pyrrol-2-one (5S)-4-(2,4-dimethoxybenzoyl)-3-…
| 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) | 2.58 | 9.59 | -67.72 | 0 | 7 | -1 | 92 | 429.452 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.03 | 8.35 | -31.85 | 1 | 7 | 0 | 89 | 430.46 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.00 | 9.56 | -25.35 | 0 | 7 | 0 | 86 | 430.46 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.03 | 8.63 | -56.71 | 2 | 7 | 1 | 90 | 431.468 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.00 | 9.84 | -59.66 | 1 | 7 | 1 | 87 | 431.468 | 7 | ↓ |
