| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 2nd, 2009 | 21 | No |
Popular Name: (3S)-1-(4-hydroxyphenyl)-3-(4-methylpiperazin-1-yl)pyrrolidine-2,5-dione (3S)-1-(4-hydroxyphenyl)-3-(4-me…
| 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) | -0.22 | 2.57 | -43.75 | 2 | 6 | 1 | 65 | 290.343 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.22 | 0.23 | -11.86 | 1 | 6 | 0 | 64 | 289.335 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.22 | 2.65 | -48.72 | 2 | 6 | 1 | 65 | 290.343 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.22 | 0.19 | -11.85 | 1 | 6 | 0 | 64 | 289.335 | 2 | ↓ |
