In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2009 | 28 | Yes |
Popular Name: 3-amino-2-phenyl-N-[(1R)-1-(4-pyridyl)ethyl]quinoline-4-carboxamide 3-amino-2-phenyl-N-[(1R)-1-(4-py…
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) | 3.34 | 7.56 | -12.01 | 3 | 5 | 0 | 81 | 368.44 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.34 | 8.02 | -44.97 | 4 | 5 | 1 | 82 | 369.448 | 4 | ↓ |