In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 39 | Yes |
Popular Name: 1-(4-benzhydrylpiperazin-1-yl)-4-[(2S)-2-(2-pyridyl)-2H-indol-3-yl]butan-1-one 1-(4-benzhydrylpiperazin-1-yl)-4…
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) | 6.00 | 16.73 | -14.84 | 1 | 5 | 0 | 52 | 514.673 | 8 | ↓ |
Lo Low (pH 4.5-6) | 6.00 | 18.3 | -49.11 | 2 | 5 | 1 | 53 | 515.681 | 8 | ↓ |