| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 21 | Yes |
Popular Name: 3-[4-(2-quinolylmethyl)piperazin-1-yl]propan-1-amine 3-[4-(2-quinolylmethyl)piperazin…
| 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) | 0.78 | 4.91 | -93.42 | 4 | 4 | 2 | 48 | 286.423 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.78 | 2.28 | -7.38 | 2 | 4 | 0 | 45 | 284.407 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.78 | 3.04 | -78.05 | 4 | 4 | 2 | 48 | 286.423 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.78 | 4.92 | -110.53 | 4 | 4 | 2 | 48 | 286.423 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.78 | 2.65 | -47.67 | 3 | 4 | 1 | 47 | 285.415 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.78 | 5.31 | -165.44 | 5 | 4 | 3 | 49 | 287.431 | 5 | ↓ |
