| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2007 | 32 | No |
Popular Name: 3-hydroxy-4-(4-methoxy-2-methyl-benzoyl)-5-(p-tolyl)-1-(3-pyridylmethyl)-5H-pyrrol-2-one 3-hydroxy-4-(4-methoxy-2-methyl-…
| 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) | 3.42 | 10.86 | -41.71 | 0 | 6 | -1 | 83 | 427.48 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.87 | 9.67 | -25.52 | 1 | 6 | 0 | 80 | 428.488 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.84 | 10.9 | -18.89 | 0 | 6 | 0 | 77 | 428.488 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.84 | 11.18 | -59.39 | 1 | 6 | 1 | 78 | 429.496 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.87 | 9.95 | -63.53 | 2 | 6 | 1 | 81 | 429.496 | 5 | ↓ |
