In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2009 | 38 | Yes |
Popular Name: 1-[3-(4-benzhydrylpiperazin-1-yl)-3-oxo-propyl]-3-(2-fluorophenyl)-1-isobutyl-urea 1-[3-(4-benzhydrylpiperazin-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) | 5.62 | 15.34 | -13.07 | 1 | 6 | 0 | 56 | 516.661 | 9 | ↓ |
Lo Low (pH 4.5-6) | 5.62 | 16.95 | -48.83 | 2 | 6 | 1 | 57 | 517.669 | 9 | ↓ |