| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 29th, 2009 | 22 | Yes |
Popular Name: 3-(4-fluorophenyl)-1-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]urea 3-(4-fluorophenyl)-1-[2-methyl-2…
| 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) | 2.34 | 5.13 | -47.44 | 3 | 5 | 1 | 49 | 309.409 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.34 | 2.66 | -10.37 | 2 | 5 | 0 | 48 | 308.401 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.34 | 4.79 | -47.27 | 3 | 5 | 1 | 49 | 309.409 | 4 | ↓ |
