| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 19 | No |
Popular Name: 2-(3-oxopiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbothioamide 2-(3-oxopiperazin-1-yl)-6,7-dihy…
| 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) | 1.24 | 3.52 | -15.92 | 3 | 5 | 0 | 71 | 276.365 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.24 | 3.94 | -40.34 | 4 | 5 | 1 | 72 | 277.373 | 2 | ↓ |
