In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | Yes |
Popular Name: 2-(2-piperazin-1-ylethylamino)-5,6,7,8-tetrahydroquinoline-3-carbonitrile 2-(2-piperazin-1-ylethylamino)-5…
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) | 1.32 | 4.87 | -41.24 | 3 | 5 | 1 | 69 | 286.403 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.32 | 7.12 | -117.46 | 4 | 5 | 2 | 70 | 287.411 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.32 | 5.78 | -36.45 | 3 | 5 | 1 | 65 | 286.403 | 4 | ↓ |