In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 30 | No |
Popular Name: 6,7-dimethoxy-4-[4-(thiomorpholine-4-carbonyl)-1-piperidyl]quinoline-3-carbonitrile 6,7-dimethoxy-4-[4-(thiomorpholi…
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 | 9.75 | -18.71 | 0 | 7 | 0 | 79 | 426.542 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.15 | 10.16 | -51.04 | 1 | 7 | 1 | 80 | 427.55 | 4 | ↓ |