In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 38 | Yes |
Popular Name: 1-[(1S)-2-[4-[(4-allyloxyphenyl)methyl]piperazin-1-yl]-1-benzyl-2-oxo-ethyl]-3-(m-tolyl)urea 1-[(1S)-2-[4-[(4-allyloxyphenyl)…
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) | 5.00 | 10.92 | -11.8 | 2 | 7 | 0 | 74 | 512.654 | 10 | ↓ |
Mid Mid (pH 6-8) | 5.00 | 13.13 | -55.46 | 3 | 7 | 1 | 75 | 513.662 | 10 | ↓ |