| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 12th, 2010 | 18 | Yes |
Popular Name: 2-[4-(3-aminopropyl)piperazin-1-yl]pyridine-3-carbonitrile 2-[4-(3-aminopropyl)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) | -0.19 | 3.15 | -47.28 | 3 | 5 | 1 | 71 | 246.338 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.19 | 5.36 | -108 | 4 | 5 | 2 | 72 | 247.346 | 4 | ↓ |
