In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 19th, 2009 | 30 | Yes |
Popular Name: 2-[4-[4-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]butyl]piperazin-1-yl]benzonitrile 2-[4-[4-[(2-oxo-3,4-dihydro-1H-q…
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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) | 3.53 | 10.52 | -53.85 | 2 | 6 | 1 | 70 | 405.522 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.53 | 8.21 | -14.13 | 1 | 6 | 0 | 69 | 404.514 | 7 | ↓ |