In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2010 | 39 | No |
Popular Name: 3-[(1-acetonyl-4-piperidyl)methyl]-2-phenyl-N-[(1S)-1-phenylpropyl]quinoline-4-carboxamide 3-[(1-acetonyl-4-piperidyl)methy…
None
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) | 5.27 | 17.12 | -44.69 | 2 | 5 | 1 | 63 | 520.697 | 9 | ↓ |
Hi High (pH 8-9.5) | 5.27 | 14.91 | -13.98 | 1 | 5 | 0 | 62 | 519.689 | 9 | ↓ |