In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 27 | Yes |
Popular Name: N-(3-chloro-2-fluoro-phenyl)-2-ethyl-3,4-dihydro-1H-pyrido[4,3-b]quinoline-10-carboxamide N-(3-chloro-2-fluoro-phenyl)-2-e…
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) | 4.42 | 7.5 | -8.63 | 1 | 4 | 0 | 45 | 383.854 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.42 | 9.89 | -45.79 | 2 | 4 | 1 | 46 | 384.862 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.