| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 27 | Yes |
Popular Name: 2-(dimethylamino)-N-[4-(4-isopropylpiperazin-1-yl)phenyl]pyridine-3-carboxamide 2-(dimethylamino)-N-[4-(4-isopro…
| 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) | 2.65 | 10.29 | -42.97 | 2 | 6 | 1 | 53 | 368.505 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.65 | 7.92 | -11.17 | 1 | 6 | 0 | 52 | 367.497 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.65 | 10.79 | -76.75 | 3 | 6 | 2 | 54 | 369.513 | 5 | ↓ |
