In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 21 | Yes |
Popular Name: 2-[methyl-[[(2R)-tetrahydrofuran-2-yl]methyl]amino]quinoline-4-carboxylic 2-[methyl-[[(2R)-tetrahydrofuran…
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) | 2.56 | 8.64 | -38.32 | 1 | 5 | 0 | 67 | 286.331 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 8.32 | -50.69 | 0 | 5 | -1 | 65 | 285.323 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.