In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 21 | Yes |
Popular Name: 3-[[[(1R)-1-(2-pyridyl)ethyl]amino]methyl]quinolin-2-ol 3-[[[(1R)-1-(2-pyridyl)ethyl]ami…
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) | 1.44 | 5.48 | -37.67 | 3 | 4 | 1 | 62 | 280.351 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.44 | 4.15 | -15.16 | 2 | 4 | 0 | 58 | 279.343 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.