In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 18 | Yes |
Popular Name: 1-propyl-N-[(1R)-1-(2-pyridyl)ethyl]piperidin-4-amine 1-propyl-N-[(1R)-1-(2-pyridyl)et…
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) | 2.18 | 6.83 | -34.56 | 2 | 3 | 1 | 29 | 248.394 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.18 | 5.6 | -33.14 | 2 | 3 | 1 | 33 | 248.394 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.18 | 7.19 | -78.99 | 3 | 3 | 2 | 31 | 249.402 | 5 | ↓ |