In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 26 | Yes |
Popular Name: 2-(4-benzyl-1-piperidyl)-1-(5-bromo-1H-indol-3-yl)ethanone 2-(4-benzyl-1-piperidyl)-1-(5-br…
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 | 13.27 | -49.19 | 2 | 3 | 1 | 37 | 412.351 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.00 | 11.08 | -15.08 | 1 | 3 | 0 | 36 | 411.343 | 5 | ↓ |