In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2009 | 36 | Yes |
Popular Name: N-[3-(4-benzhydrylpiperazin-1-yl)-3-oxo-propyl]-N-isobutyl-pyrazine-2-carboxamide N-[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) | 3.72 | 13.09 | -10.52 | 0 | 7 | 0 | 70 | 485.632 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.72 | 14.73 | -49.94 | 1 | 7 | 1 | 71 | 486.64 | 9 | ↓ |