In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2011 | 21 | Yes |
Popular Name: 2-[(2S)-2-ethylmorpholin-4-yl]quinoline-4-carboxamide 2-[(2S)-2-ethylmorpholin-4-yl]qu…
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) | 2.15 | 4.48 | -12.01 | 2 | 5 | 0 | 68 | 285.347 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.15 | 4.77 | -34.18 | 3 | 5 | 1 | 70 | 286.355 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.