In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 29 | Yes |
Popular Name: N-[(4-fluorophenyl)methyl]-N-[4-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]phenyl]propanamide N-[(4-fluorophenyl)methyl]-N-[4-…
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) | 2.55 | 10.29 | -11.83 | 0 | 5 | 0 | 44 | 397.494 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.55 | 12.64 | -51.55 | 1 | 5 | 1 | 45 | 398.502 | 6 | ↓ |