| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 2nd, 2009 | 20 | Yes |
Popular Name: [4-(3-pyridylmethyl)piperazin-1-yl]-[(2S)-pyrrolidin-2-yl]methanone [4-(3-pyridylmethyl)piperazin-1-…
| 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) | -0.11 | 3.18 | -39.78 | 2 | 5 | 1 | 53 | 275.376 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.11 | 1.88 | -10.52 | 1 | 5 | 0 | 48 | 274.368 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.11 | 5.46 | -99.67 | 3 | 5 | 2 | 54 | 276.384 | 3 | ↓ |
