| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 7th, 2007 | 30 | No |
Popular Name: 5-(4-methoxyphenyl)-2-phenyl-4-[1-(3-pyridylmethylamino)ethylidene]pyrazol-3-one 5-(4-methoxyphenyl)-2-phenyl-4-[…
| 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) | 3.15 | 9.4 | -20.98 | 1 | 6 | 0 | 69 | 398.466 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.63 | -1.1 | -42.57 | 1 | 6 | 1 | 68 | 399.474 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.63 | -0.99 | -97.66 | 2 | 6 | 2 | 70 | 400.482 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.15 | 10.16 | -59.64 | 2 | 6 | 1 | 70 | 399.474 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.15 | 9.87 | -51.88 | 2 | 6 | 1 | 70 | 399.474 | 6 | ↓ |
