In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 35 | Yes |
Popular Name: 1-[(1S)-2-(4-benzhydrylpiperazin-1-yl)-1-methyl-2-oxo-ethyl]-3-(4-methoxyphenyl)urea 1-[(1S)-2-(4-benzhydrylpiperazin…
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) | 4.25 | 9.73 | -11.14 | 2 | 7 | 0 | 74 | 472.589 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.25 | 11.38 | -47.02 | 3 | 7 | 1 | 75 | 473.597 | 7 | ↓ |