In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 19 | Yes |
Popular Name: 1-butyl-N-[(1S)-1-(4-pyridyl)ethyl]piperidin-4-amine 1-butyl-N-[(1S)-1-(4-pyridyl)eth…
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) | 2.62 | 7.6 | -38.05 | 2 | 3 | 1 | 29 | 262.421 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.62 | 6.25 | -42.23 | 2 | 3 | 1 | 33 | 262.421 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.62 | 8.06 | -77.79 | 3 | 3 | 2 | 31 | 263.429 | 6 | ↓ |