In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2011 | 24 | Yes |
Popular Name: 2-chloro-7-fluoro-N-[3-(3-pyridyl)propyl]quinoline-3-carboxamide 2-chloro-7-fluoro-N-[3-(3-pyridy…
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) | 3.31 | 7.29 | -16.85 | 1 | 4 | 0 | 55 | 343.789 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.31 | 7.76 | -50.38 | 2 | 4 | 1 | 56 | 344.797 | 5 | ↓ |