| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 20 | Yes |
Popular Name: (3S)-3-[4-[(1S)-1-methylpropyl]piperazin-1-yl]-1,2,3,4-tetrahydroquinoline (3S)-3-[4-[(1S)-1-methylpropyl]p…
| 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) | 2.90 | 6.48 | -34.2 | 2 | 3 | 1 | 20 | 274.432 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.90 | 4.58 | -2.13 | 1 | 3 | 0 | 19 | 273.424 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.90 | 7.19 | -89.4 | 3 | 3 | 2 | 24 | 275.44 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
