| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 9th, 2009 | 28 | Yes |
Popular Name: (2R)-2-[4-(4-ethylpiperazin-1-yl)-2-methyl-anilino]-N-(3-fluorophenyl)propanamide (2R)-2-[4-(4-ethylpiperazin-1-yl…
| 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) | 4.48 | 9.92 | -44.57 | 3 | 5 | 1 | 49 | 385.507 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.48 | 7.71 | -11.96 | 2 | 5 | 0 | 48 | 384.499 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.48 | 10.56 | -118.25 | 4 | 5 | 2 | 50 | 386.515 | 6 | ↓ |
