| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 17th, 2004 | 29 | No |
Popular Name: (3S)-1-(4-methoxyphenyl)-3-[4-(4-pyridylmethyl)anilino]pyrrolidine-2,5-quinone (3S)-1-(4-methoxyphenyl)-3-[4-(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) | 3.22 | 8.95 | -15.49 | 1 | 6 | 0 | 72 | 387.439 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.22 | 9.4 | -42.18 | 2 | 6 | 1 | 73 | 388.447 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.22 | 9.41 | -44.39 | 2 | 6 | 1 | 73 | 388.447 | 6 | ↓ |
