In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 32 | Yes |
Popular Name: N-[6-[4-[(2R)-2-hydroxy-2-phenyl-ethyl]piperazin-1-yl]-3-pyridyl]-4-methoxy-benzamide N-[6-[4-[(2R)-2-hydroxy-2-phenyl…
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) | 2.96 | 6.67 | -12.57 | 2 | 7 | 0 | 78 | 432.524 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.96 | 6.99 | -38.43 | 3 | 7 | 1 | 79 | 433.532 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.96 | 8.94 | -48.32 | 3 | 7 | 1 | 79 | 433.532 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.96 | 9.25 | -107.93 | 4 | 7 | 2 | 80 | 434.54 | 7 | ↓ |